A0A087XG14_POEFO Loading...

Calcium-transporting ATPase

Catalyzes the hydrolysis of ATP coupled with the transport of calcium.

AlphaFold DB , UniProt , Accession A0A087XG14, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 936 aa.

						>A0A087XG14_POEFO|A0A087XG14
MFRFPFPALWQKKENQEIMVQPLELSQNQPCSEDETMVPVLTSRKASELPVNEVACVLQADLQAGLTQEEVTRRRVYHGWNEFDISEDEPLWRKYISQFKDPLILLLLASAVISVVMHQLDDAISITVAIIIVVTVAFVQEYRSEKSLEELGKLVPPECHCIRDGQLEHLLARDLVPGDTVCLSVGERVPADLRLYEASDLSIDESSLTGETHPSSKSTTPQPPASNGNIASRSNIAFMGTLVRCGKAKGIVIGTGENSEFGEVFKMMQAEEAPKTPLQKSMDLLGKQLSLYSFGIIGVIMLVGWLQGKRILDMFTIGVSLAVAAIPEGLPIVVTVTLALGVMRMVKKRAIVKKLPIVETLSCCNVICSDKTGTLTKNEMTVTQVFTSDGLHAEVTGVGYNGTGEVLLDGEVVHGLACPSISKVVEVGCVCNDSVIRNQNLLGRPTEGALIALAMKMGLESVQQEFIRLEEHPFTSEQKWMAVRCVHRTQQDKSGVYFMKGAYEQVIRFCSCYNSRGSNLPLTHQQRELYQQQISYMGTSGLRVLAFASGSQMGSLTFLGLVGIIDPPREGVKEAIATLLNSGVAIKMITGDSQETAVSIANRLGLYSKGCQCLSGEEVDHLDLQELSNIVSRVGVFYRASPRHKLKIVKSLQNLGAVVAMTGDGVNDAVALKAADIGVAMGQTGTDVCKEAADMILVDDDFQTIMSAIEEGKGIYNNIKNFVRFQLSTSIAALTLISLATLMNFPNPLNAMQILWINIIMDGPPAQSLGVEPVDRDVIRKPPRNVKDTILTRSLLVKVLVSAFIIVCGTLFVFWRELQDNVITPRDTTMTFTCFVFFDMFNALSSRSQTRMVHEMGLCSNRTFCYAVLASIMGQLLVIYFPPLQSVFLTESLSILDLLFLLSLTSSVCVVSEVIKKVERCRGAERRPPSDCSLEV
					

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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	Very low	31.6	Very low	232 Å²	232	167.8 Å²	167.8	100%	1.143	82%	0.816	S	S	*	*				0	110.6	0	-129.6	167	-167.6	0	0	106.2
2	F	28.7	Very low	31.1	Very low	185 Å²	185	169.1 Å²	169.1	81%	0.811	82%	0.815	S	S	*	*			trans	45	100.2	171.4	-64.7	-83.9	0	0	0	119.5
3	R	26.4	Very low	30.7	Very low	232 Å²	232	171.4 Å²	171.4	88%	0.875	82%	0.818	S	S	*	*				79.6	107.9	66.8	-86	-170.2	172.9	174.7	-1.6	115.4
4	F	33.4	Very low	30.7	Very low	191 Å²	191	171.9 Å²	171.9	84%	0.838	82%	0.819	S	S	*	*			trans	-32.1	160.3	144.8	-86.5	-81.2	0	0	0	114.7
5	P	47.4	Very low	30.3	Very low	121 Å²	121	171.5 Å²	171.5	79%	0.786	82%	0.824	S	S	*	*				-160.5	173.9	62	41.3	-17.6	0	0	0	120.5
6	F	32.7	Very low	30.3	Very low	182 Å²	182	172.1 Å²	172.1	80%	0.798	83%	0.825	S	S	*	*			trans	-56.5	161.9	154.3	-100.3	-89.1	0	0	0	112.6
7	P	40.1	Very low	29.9	Very low	127 Å²	127	173.6 Å²	173.6	83%	0.825	83%	0.831	S	S	*	*				-154.1	168.1	92.3	36.7	-15	0	0	0	118.1
8	A	29.8	Very low	30.1	Very low	82 Å²	82	172.3 Å²	172.3	68%	0.678	83%	0.828	S	S	*	*			trans	-83.2	165.2	178.7	0	0	0	0	0	115.3
9	L	25.2	Very low	29.8	Very low	160 Å²	160	173.5 Å²	173.5	84%	0.838	84%	0.835	S	S	*	*			trans	168.6	146.3	151	-89.5	136.9	0	0	0	108.2
10	W	26.8	Very low	29.8	Very low	196 Å²	196	170.5 Å²	170.5	74%	0.742	83%	0.827	S	S	*	*			cis	-175.5	152.5	-17.9	-125.9	91.8	0	0	0	106.9
11	Q	24.1	Very low	29.5	Very low	138 Å²	138	170.9 Å²	170.9	65%	0.645	83%	0.828	S	S	*	*			trans	81.9	110.5	139.7	-126.9	151.8	5.3	0	0	125.2
12	K	25.4	Very low	29.3	Very low	183 Å²	183	165.3 Å²	165.3	80%	0.796	81%	0.809	S	S	*	*				36.6	133.3	128.9	-73.7	-177.6	165.3	-178	0	121.2
13	K	25.4	Very low	29.7	Very low	199 Å²	199	164.5 Å²	164.5	87%	0.865	81%	0.812	S	S	*	*				-176.8	145.8	93.1	-108.3	-178.2	177.6	179	0	113.4
14	E	30.7	Very low	29.6	Very low	178 Å²	178	162.4 Å²	162.4	83%	0.832	81%	0.812	S	S	*	*			trans	-59.6	151.7	168.3	-68.6	154.6	131.8	0	0	113.1
15	N	25.3	Very low	29.9	Very low	166 Å²	166	161.5 Å²	161.5	89%	0.888	82%	0.816	S	S	*	*				-159	129.9	123.8	-106.3	-2.6	0	0	0	111.4
16	Q	29.5	Very low	28.8	Very low	181 Å²	181	161.4 Å²	161.4	85%	0.846	82%	0.817	S	S	*	*			trans	-70.5	145.1	167.4	-71.3	172	-44.4	0	0	110.2
17	E	25	Very low	28.7	Very low	198 Å²	198	161.5 Å²	161.5	93%	0.925	82%	0.821	S	S	*	*			trans	-157.7	130.9	136.2	-114.3	171.8	-163	0	0	110.4
18	I	33.4	Very low	28.5	Very low	150 Å²	150	163.1 Å²	163.1	77%	0.769	82%	0.822	S	S	*	*			trans	-98.3	126.6	178.4	-65	167.3	0	0	0	107.1
19	M	24.5	Very low	28.3	Very low	196 Å²	196	168.1 Å²	168.1	97%	0.966	83%	0.832	S	S	*	*			trans	-160.1	154.9	148.2	-110.5	-162.1	-69.6	0	0	112.1
20	V	28.2	Very low	28.5	Very low	113 Å²	113	166.6 Å²	166.6	69%	0.685	83%	0.831	S	S	*	*			trans	-111.4	145.4	-152.7	165.6	0	0	0	0	112
21	Q	23.5	Very low	28.6	Very low	178 Å²	178	161.8 Å²	161.8	83%	0.832	83%	0.827	S	S	*	*			trans	77	157.9	159.4	-82.5	169.3	8.3	0	0	120.8
22	P	29.8	Very low	28.8	Very low	116 Å²	116	160.1 Å²	160.1	75%	0.753	83%	0.83	S	S	*	*			cis	-130.3	-177	-25.6	34.7	-14.2	0	0	0	113.8
23	L	37	Very low	29.1	Very low	168 Å²	168	160.6 Å²	160.6	88%	0.88	84%	0.835	S	S	*	*			trans	-45.3	138.5	177.5	-79.4	84	0	0	0	115
24	E	25	Very low	29.6	Very low	187 Å²	187	158.2 Å²	158.2	87%	0.874	83%	0.832	S	S	*	*				-172.3	152.6	126.6	-105.1	173.6	-165.5	0	0	112.8
25	L	38.8	Very low	30.1	Very low	173 Å²	173	156.2 Å²	156.2	91%	0.906	82%	0.822	S	S	*	*			trans	-49.3	134.4	-165.7	-72.7	80.7	0	0	0	115.7
26	S	24.8	Very low	31.1	Very low	118 Å²	118	153 Å²	153	83%	0.825	81%	0.809	S	S	*	*			trans	-129.7	119.1	158.4	71	0	0	0	0	111.9
27	Q	30.6	Very low	32.4	Very low	185 Å²	185	151.3 Å²	151.3	86%	0.864	80%	0.803	S	S	*	*			trans	-56.7	143.9	173.8	-68.7	165.2	-37.1	0	0	113
28	N	35.1	Very low	34.5	Very low	160 Å²	160	142.6 Å²	142.6	86%	0.856	76%	0.763	S	S	*	*			trans	37.8	105.3	151.6	-69.8	-1.2	0	0	0	118.9
29	Q	25.8	Very low	36.3	Very low	188 Å²	188	138.7 Å²	138.7	88%	0.879	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-95.3	136.9	144.5	-82.3	178.9	-27.9	0	0	109	C31	Q29-C31 PolarHBondContact O-N 3.45Å
30	P	30.4	Very low	38.6	Very low	127 Å²	127	131.8 Å²	131.8	83%	0.825	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-73.9	124.5	176.1	29.7	-29.4	0	0	0	109.4
31	C	27.7	Very low	41.2	Very low	96 Å²	96	127 Å²	127	65%	0.649	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-67.4	137.6	172.1	-96	0	0	0	0	110.2	Q29	Q29-C31 PolarHBondContact O-N 3.45Å
32	S	29.2	Very low	44.1	Very low	103 Å²	103	122.5 Å²	122.5	72%	0.72	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-71.9	122.5	-179.4	49.2	0	0	0	0	112.8	D34	S32-D34 VanDerWaalsContact C-N 3.29Å; S32-D34 PolarHBondContact O-N 2.76Å
33	E	32.4	Very low	46.8	Very low	193 Å²	193	117.1 Å²	117.1	90%	0.902	64%	0.637	S	S	*	*	S	Bend	trans	35.4	6.4	145.2	-66.4	-173.1	159.8	0	0	123.7
34	D	35.1	Very low	49.1	Very low	149 Å²	149	115.4 Å²	115.4	80%	0.797	62%	0.619	S	S	*	*			trans	-111.1	20.8	169.5	-87.5	-28.1	0	0	0	112.9	S32 T36	S32-D34 VanDerWaalsContact C-N 3.29Å; S32-D34 PolarHBondContact O-N 2.76Å; D34-T36 PolarHBondContact O-N 3.37Å; D34-T36 VanDerWaalsContact O-N 3.09Å
35	E	40.4	Very low	52	Low	135 Å²	135	112.8 Å²	112.8	63%	0.631	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	2.4	-172.8	-74.5	-169	157.2	0	0	116
36	T	48.1	Very low	54.3	Low	100 Å²	100	104.5 Å²	104.5	61%	0.613	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-3.5	-170.4	44.5	0	0	0	0	116.6	D34	D34-T36 PolarHBondContact O-N 3.37Å; D34-T36 VanDerWaalsContact O-N 3.09Å
37	M	56.7	Low	57.3	Low	145 Å²	145	98.9 Å²	98.9	71%	0.714	52%	0.522	S	S	*	.			trans	-119.2	108.6	177.4	-72.8	-171.6	-122.7	0	0	111.1	P39	M37-P39 VanDerWaalsContact O-CD 3.3Å; M37-P39 WeakPolarHBondContact O-CD 3.47Å
38	V	67.6	Low	60.1	Low	15 Å²	15	93.1 Å²	93.1	9%	0.091	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-68.4	116.4	171.4	-177.5	0	0	0	0	108.2	L58 H78	V38-L58 HydrophobicContact CG1-CD2 4.17Å; V38-H78 PolarHBondContact O-NE2 3.04Å
39	P	71.3	Confident	62.7	Low	67 Å²	67	87.7 Å²	87.7	44%	0.435	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-73.8	143.9	-174.6	29.5	-33.9	0	0	0	111.4	M37 V57	M37-P39 VanDerWaalsContact O-CD 3.3Å; M37-P39 WeakPolarHBondContact O-CD 3.47Å; P39-V57 HydrophobicContact CG-CG1 3.77Å
40	V	72.8	Confident	65.7	Low	52 Å²	52	81.2 Å²	81.2	32%	0.315	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-74.5	127.3	167.7	-172	0	0	0	0	108.7	H78 I253 N258	V40-H78 VanDerWaalsContact CG2-CE1 3.46Å; V40-H78 WeakPolarHBondContact CG2-CE1 3.35Å; V40-I253 WeakPolarHBondContact CG1-O 3.34Å; V40-N258 HydrophobicContact CG1-CB 3.89Å
41	L	83.7	Confident	68.5	Low	13 Å²	13	76.3 Å²	76.3	7%	0.068	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-93.5	121.1	178.9	-92.5	150.2	0	0	0	109.5	K45 A46 L49 V54 V57 L58 I253	L41-K45 HydrophobicContact CD2-CB 3.96Å; L41-A46 HydrophobicContact CB-CB 4.45Å; L41-L49 HydrophobicContact CD2-CD1 4.19Å; L41-V54 HydrophobicContact CD1-CG1 4.23Å; L41-V57 HydrophobicContact CD1-CB 3.97Å; L41-V57 HydrophobicContact CD1-CG1 3.55Å; L41-V57 HydrophobicContact CG-CG1 4.12Å; L41-L58 HydrophobicContact CD1-CD1 4.25Å; L41-L58 HydrophobicContact CD1-CD2 3.96Å; L41-L58 HydrophobicContact CD1-CG 3.8Å; L41-I253 HydrophobicContact CB-CB 4.43Å; L41-I253 PolarHBondContact N-O 3.38Å
42	T	84.9	Confident	71.3	Confident	83 Å²	83	77.7 Å²	77.7	51%	0.509	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-62.5	145.3	171.4	58.3	0	0	0	0	110	R44 K45 A46	T42-R44 PolarHBondContact O-N 3.21Å; T42-R44 VanDerWaalsContact O-N 3.1Å; T42-K45 PolarHBondContact O-N 3.09Å; T42-A46 PolarHBondContact O-N 3.28Å
43	S	84.9	Confident	74.1	Confident	3 Å²	3	77.7 Å²	77.7	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-59.6	-30.1	-176.1	77.6	0	0	0	0	112.6	A46 S47 R233 E260	S43-A46 PolarHBondContact O-N 3.14Å; S43-S47 WeakPolarHBondContact O-CB 3.32Å; S43-S47 PolarHBondContact O-N 3.43Å; S43-S47 PolarHBondContact O-OG 3.44Å; S43-R233 PolarHBondContact OG-NH1 3.26Å; S43-E260 WeakPolarHBondContact CB-OE1 3.49Å; S43-E260 WeakPolarHBondContact OG-CG 3.45Å; S43-E260 PolarHBondContact OG-OE1 3.46Å
44	R	85.8	Confident	76.7	Confident	132 Å²	132	68.5 Å²	68.5	50%	0.498	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-46.3	173.2	-171	-177.2	177.5	168.1	3.5	113	T42 S47 E48 N227	T42-R44 PolarHBondContact O-N 3.21Å; T42-R44 VanDerWaalsContact O-N 3.1Å; R44-S47 PolarHBondContact O-OG 3.25Å; R44-E48 IonicContact NE-OE1 3.65Å; R44-E48 PolarHBondContact O-N 3.37Å; R44-N227 WeakPolarHBondContact CG-ND2 3.46Å; R44-N227 PolarHBondContact O-ND2 2.86Å
45	K	86.5	Confident	79.2	Confident	131 Å²	131	61.9 Å²	61.9	57%	0.57	32%	0.32	S	S	*	.	H	α-helix	trans	-69.5	-42.4	176.7	-91.1	-176	173.6	-179.9	0	110.7	L41 T42 S47 E48 L49	L41-K45 HydrophobicContact CD2-CB 3.96Å; T42-K45 PolarHBondContact O-N 3.09Å; K45-S47 VanDerWaalsContact C-N 3.27Å; K45-S47 PolarHBondContact O-N 2.98Å; K45-E48 PolarHBondContact O-N 2.88Å; K45-L49 WeakPolarHBondContact O-CG 3.44Å; K45-L49 PolarHBondContact O-N 3.2Å
46	A	86.4	Confident	81.4	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-32.5	179	0	0	0	0	0	112.9	L41 T42 S43 R194 I236 I253	L41-A46 HydrophobicContact CB-CB 4.45Å; T42-A46 PolarHBondContact O-N 3.28Å; S43-A46 PolarHBondContact O-N 3.14Å; A46-R194 VanDerWaalsContact O-CD 3.24Å; A46-R194 WeakPolarHBondContact O-CD 3.34Å; A46-R194 PolarHBondContact O-NE 2.99Å; A46-I236 HydrophobicContact CB-CD1 4.02Å; A46-I253 HydrophobicContact CB-CB 4.49Å; A46-I253 HydrophobicContact CB-CD1 3.84Å; A46-I253 HydrophobicContact CB-CG2 3.94Å
47	S	88.4	Confident	83.3	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-73	-29	177.9	67.2	0	0	0	0	113.4	S43 R44 K45 Q222 N227 N235	S43-S47 WeakPolarHBondContact O-CB 3.32Å; S43-S47 PolarHBondContact O-N 3.43Å; S43-S47 PolarHBondContact O-OG 3.44Å; R44-S47 PolarHBondContact O-OG 3.25Å; K45-S47 VanDerWaalsContact C-N 3.27Å; K45-S47 PolarHBondContact O-N 2.98Å; S47-Q222 PolarHBondContact O-N 2.92Å; S47-N227 VanDerWaalsContact OG-CG 3.25Å; S47-N227 PolarHBondContact OG-ND2 3.02Å; S47-N227 PolarHBondContact OG-OD1 2.98Å; S47-N235 WeakPolarHBondContact CA-OD1 3.48Å; S47-N235 WeakPolarHBondContact CB-OD1 3.18Å; S47-N235 PolarHBondContact O-ND2 3.42Å
48	E	89.6	Confident	84.7	Confident	63 Å²	63	51.1 Å²	51.1	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-78.3	-33.6	178.8	-74.1	166.1	-167	0	0	112.3	R44 K45 P221 N227	R44-E48 IonicContact NE-OE1 3.65Å; R44-E48 PolarHBondContact O-N 3.37Å; K45-E48 PolarHBondContact O-N 2.88Å; E48-P221 WeakPolarHBondContact O-CB 3.46Å; E48-N227 VanDerWaalsContact CG-ND2 3.3Å; E48-N227 WeakPolarHBondContact CG-ND2 3.39Å; E48-N227 PolarHBondContact OE1-ND2 2.89Å
49	L	88.4	Confident	85.6	Confident	47 Å²	47	55.7 Å²	55.7	25%	0.246	29%	0.294	C	S	.	.	S	Bend	trans	-81.2	146.8	-174.7	-63.5	171.1	0	0	0	112.7	L41 K45 E53 V54 R194	L41-L49 HydrophobicContact CD2-CD1 4.19Å; K45-L49 WeakPolarHBondContact O-CG 3.44Å; K45-L49 PolarHBondContact O-N 3.2Å; L49-E53 WeakPolarHBondContact CD2-OE2 3.5Å; L49-V54 HydrophobicContact CB-CG2 3.71Å; L49-V54 HydrophobicContact CD1-CG2 4.44Å; L49-R194 PolarHBondContact O-NH2 3.19Å
50	P	89.6	Confident	86.2	Confident	51 Å²	51	53.1 Å²	53.1	33%	0.331	28%	0.279	S	S	.	.			trans	-66.9	150.9	168.2	29.6	-33.2	0	0	0	110.5	N52 E53 V54	P50-N52 VanDerWaalsContact C-N 3.25Å; P50-N52 PolarHBondContact O-N 3.16Å; P50-N52 VanDerWaalsContact O-N 3.16Å; P50-E53 WeakPolarHBondContact CD-OE2 3.3Å; P50-E53 HydrophobicContact CG-CB 4.02Å; P50-E53 VanDerWaalsContact CG-CD 3.47Å; P50-E53 HydrophobicContact CG-CG 3.76Å; P50-E53 PolarHBondContact O-N 3.25Å; P50-V54 PolarHBondContact O-N 3.26Å
51	V	89.1	Confident	86.9	Confident	24 Å²	24	54.7 Å²	54.7	15%	0.145	29%	0.286	C	S	.	.	H	α-helix	trans	-52.8	-42	-174.7	174.7	0	0	0	0	112.6	E53 V54 A55 L62 Y196	V51-E53 VanDerWaalsContact C-N 3.3Å; V51-E53 PolarHBondContact O-N 3.3Å; V51-V54 PolarHBondContact O-N 3.47Å; V51-A55 WeakPolarHBondContact O-CB 3.44Å; V51-A55 PolarHBondContact O-N 3.35Å; V51-L62 HydrophobicContact CG1-CD1 4.13Å; V51-L62 HydrophobicContact CG1-CD2 4.21Å; V51-Y196 VanDerWaalsContact CG1-CB 3.41Å; V51-Y196 HydrophobicContact CG1-CG 4.42Å
52	N	87.1	Confident	86.9	Confident	125 Å²	125	56.2 Å²	56.2	67%	0.668	29%	0.294	S	S	*	.	H	α-helix	trans	-64	-35.3	-177.6	-64.3	-9	0	0	0	112.4	P50 C56	P50-N52 VanDerWaalsContact C-N 3.25Å; P50-N52 PolarHBondContact O-N 3.16Å; P50-N52 VanDerWaalsContact O-N 3.16Å; N52-C56 VanDerWaalsContact O-CB 3.32Å; N52-C56 WeakPolarHBondContact O-CB 3.35Å; N52-C56 PolarHBondContact O-N 2.92Å
53	E	87.6	Confident	86.9	Confident	103 Å²	103	60.5 Å²	60.5	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-72.4	-39.2	176	-73.2	177.8	-162	0	0	110.9	L49 P50 V51 C56 V57	L49-E53 WeakPolarHBondContact CD2-OE2 3.5Å; P50-E53 WeakPolarHBondContact CD-OE2 3.3Å; P50-E53 HydrophobicContact CG-CB 4.02Å; P50-E53 VanDerWaalsContact CG-CD 3.47Å; P50-E53 HydrophobicContact CG-CG 3.76Å; P50-E53 PolarHBondContact O-N 3.25Å; V51-E53 VanDerWaalsContact C-N 3.3Å; V51-E53 PolarHBondContact O-N 3.3Å; E53-C56 WeakPolarHBondContact O-CB 3.49Å; E53-C56 PolarHBondContact O-N 2.84Å; E53-V57 VanDerWaalsContact O-CG2 3.27Å; E53-V57 WeakPolarHBondContact O-CG2 3.3Å; E53-V57 PolarHBondContact O-N 3.02Å
54	V	87.3	Confident	86.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-45.4	174.5	177	0	0	0	0	111.1	L41 L49 P50 V51 C56 V57 L58 R194 I253	L41-V54 HydrophobicContact CD1-CG1 4.23Å; L49-V54 HydrophobicContact CB-CG2 3.71Å; L49-V54 HydrophobicContact CD1-CG2 4.44Å; P50-V54 PolarHBondContact O-N 3.26Å; V51-V54 PolarHBondContact O-N 3.47Å; V54-C56 VanDerWaalsContact C-N 3.31Å; V54-C56 PolarHBondContact O-N 3.45Å; V54-V57 PolarHBondContact O-N 3.07Å; V54-L58 HydrophobicContact CG1-CD1 3.9Å; V54-L58 WeakPolarHBondContact O-CB 3.27Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 3.49Å; V54-R194 HydrophobicContact CG1-CB 4.25Å; V54-R194 HydrophobicContact CG1-CG 4.2Å; V54-R194 HydrophobicContact CG2-CG 4.37Å; V54-I253 HydrophobicContact CG1-CG2 4.24Å
55	A	87.5	Confident	86.9	Confident	10 Å²	10	56.1 Å²	56.1	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-38	176	0	0	0	0	0	112.1	V51 Q59 A60 L62 I251	V51-A55 WeakPolarHBondContact O-CB 3.44Å; V51-A55 PolarHBondContact O-N 3.35Å; A55-Q59 WeakPolarHBondContact O-CA 3.48Å; A55-Q59 PolarHBondContact O-N 3.04Å; A55-A60 PolarHBondContact O-N 3.39Å; A55-L62 HydrophobicContact CB-CD2 4.34Å; A55-L62 HydrophobicContact CB-CG 4.33Å; A55-I251 HydrophobicContact CB-CD1 3.93Å
56	C	86.8	Confident	87.1	Confident	96 Å²	96	50.2 Å²	50.2	65%	0.649	28%	0.276	S	S	*	.	H	α-helix	trans	-66	-47	175.9	-170.7	0	0	0	0	112	N52 E53 V54 L58 Q59	N52-C56 VanDerWaalsContact O-CB 3.32Å; N52-C56 WeakPolarHBondContact O-CB 3.35Å; N52-C56 PolarHBondContact O-N 2.92Å; E53-C56 WeakPolarHBondContact O-CB 3.49Å; E53-C56 PolarHBondContact O-N 2.84Å; V54-C56 VanDerWaalsContact C-N 3.31Å; V54-C56 PolarHBondContact O-N 3.45Å; C56-L58 VanDerWaalsContact C-N 3.32Å; C56-L58 PolarHBondContact O-N 3.03Å; C56-Q59 PolarHBondContact O-N 2.76Å; C56-Q59 VanDerWaalsContact O-N 3.14Å
57	V	87	Confident	87.3	Confident	58 Å²	58	53.4 Å²	53.4	35%	0.352	30%	0.295	S	S	.	.	H	α-helix	trans	-63.4	-38.5	178.5	173.3	0	0	0	0	111.6	P39 L41 E53 V54 Q59	P39-V57 HydrophobicContact CG-CG1 3.77Å; L41-V57 HydrophobicContact CD1-CB 3.97Å; L41-V57 HydrophobicContact CD1-CG1 3.55Å; L41-V57 HydrophobicContact CG-CG1 4.12Å; E53-V57 VanDerWaalsContact O-CG2 3.27Å; E53-V57 WeakPolarHBondContact O-CG2 3.3Å; E53-V57 PolarHBondContact O-N 3.02Å; V54-V57 PolarHBondContact O-N 3.07Å; V57-Q59 VanDerWaalsContact C-N 3.3Å
58	L	85.6	Confident	87.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.9	177.8	-66.5	174.4	0	0	0	113.9	V38 L41 V54 C56 A60 R74 I251 I253	V38-L58 HydrophobicContact CG1-CD2 4.17Å; L41-L58 HydrophobicContact CD1-CD1 4.25Å; L41-L58 HydrophobicContact CD1-CD2 3.96Å; L41-L58 HydrophobicContact CD1-CG 3.8Å; V54-L58 HydrophobicContact CG1-CD1 3.9Å; V54-L58 WeakPolarHBondContact O-CB 3.27Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 3.49Å; C56-L58 VanDerWaalsContact C-N 3.32Å; C56-L58 PolarHBondContact O-N 3.03Å; L58-A60 VanDerWaalsContact C-N 3.26Å; L58-A60 HydrophobicContact CB-CB 4.3Å; L58-A60 PolarHBondContact O-N 2.89Å; L58-R74 PolarHBondContact O-NH1 3.26Å; L58-R74 PolarHBondContact O-NH2 2.88Å; L58-R74 VanDerWaalsContact O-NH2 3.07Å; L58-I251 HydrophobicContact CD1-CG2 3.74Å; L58-I253 HydrophobicContact CD1-CG2 4.12Å
59	Q	87	Confident	87.1	Confident	111 Å²	111	62.8 Å²	62.8	52%	0.519	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.1	51.5	-173.8	-61.9	179.5	-16.6	0	0	111.6	A55 C56 V57 R74	A55-Q59 WeakPolarHBondContact O-CA 3.48Å; A55-Q59 PolarHBondContact O-N 3.04Å; C56-Q59 PolarHBondContact O-N 2.76Å; C56-Q59 VanDerWaalsContact O-N 3.14Å; V57-Q59 VanDerWaalsContact C-N 3.3Å; Q59-R74 PolarHBondContact O-NH2 3.2Å
60	A	84.9	Confident	87	Confident	14 Å²	14	62.1 Å²	62.1	12%	0.116	34%	0.335	C	S	.	.			trans	-118.4	139.3	-174.2	0	0	0	0	0	111.4	A55 L58 L66 G178 I251	A55-A60 PolarHBondContact O-N 3.39Å; L58-A60 VanDerWaalsContact C-N 3.26Å; L58-A60 HydrophobicContact CB-CB 4.3Å; L58-A60 PolarHBondContact O-N 2.89Å; A60-L66 HydrophobicContact CB-CD2 4.35Å; A60-G178 VanDerWaalsContact CB-O 3.29Å; A60-G178 WeakPolarHBondContact CB-O 3.32Å; A60-I251 HydrophobicContact CB-CG2 4.21Å
61	D	87.4	Confident	87	Confident	84 Å²	84	59.7 Å²	59.7	45%	0.449	32%	0.319	S	S	.	.			trans	-89.8	124.9	172.1	-170.6	-19.4	0	0	0	110.2	Q63 A64 G65 T180	D61-Q63 VanDerWaalsContact C-N 3.33Å; D61-Q63 PolarHBondContact O-N 2.76Å; D61-Q63 PolarHBondContact OD1-N 2.82Å; D61-A64 HydrophobicContact CB-CB 4.31Å; D61-A64 PolarHBondContact OD1-N 3.15Å; D61-A64 WeakPolarHBondContact OD2-CB 3.48Å; D61-G65 VanDerWaalsContact O-CA 3.25Å; D61-G65 WeakPolarHBondContact O-CA 3.4Å; D61-G65 PolarHBondContact O-N 3.02Å; D61-T180 PolarHBondContact O-OG1 3.31Å
62	L	83.7	Confident	86.9	Confident	45 Å²	45	62.6 Å²	62.6	24%	0.236	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.6	179.6	-65.4	173.1	0	0	0	113	V51 A55 Y196 I251	V51-L62 HydrophobicContact CG1-CD1 4.13Å; V51-L62 HydrophobicContact CG1-CD2 4.21Å; A55-L62 HydrophobicContact CB-CD2 4.34Å; A55-L62 HydrophobicContact CB-CG 4.33Å; L62-Y196 HydrophobicContact CD2-CD1 3.76Å; L62-Y196 HydrophobicContact CD2-CD2 4.34Å; L62-Y196 HydrophobicContact CD2-CE1 3.94Å; L62-Y196 HydrophobicContact CD2-CG 3.95Å; L62-Y196 PolarHBondContact O-OH 2.93Å; L62-Y196 VanDerWaalsContact O-OH 3.1Å; L62-I251 HydrophobicContact CD2-CD1 3.34Å; L62-I251 HydrophobicContact CD2-CG1 3.7Å
63	Q	83.6	Confident	86.9	Confident	173 Å²	173	61.9 Å²	61.9	81%	0.808	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-46.9	-176.1	-68	-163.3	-8.3	0	0	112.5	D61	D61-Q63 VanDerWaalsContact C-N 3.33Å; D61-Q63 PolarHBondContact O-N 2.76Å; D61-Q63 PolarHBondContact OD1-N 2.82Å
64	A	83.5	Confident	87	Confident	35 Å²	35	57.4 Å²	57.4	29%	0.289	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-18.8	-178.8	0	0	0	0	0	113.4	D61 R163 D164 G165	D61-A64 HydrophobicContact CB-CB 4.31Å; D61-A64 PolarHBondContact OD1-N 3.15Å; D61-A64 WeakPolarHBondContact OD2-CB 3.48Å; A64-R163 CarbonylContact O-C 3.56Å; A64-D164 PolarHBondContact O-N 2.8Å; A64-G165 PolarHBondContact O-N 3.48Å
65	G	88.6	Confident	87	Confident	8 Å²	8	59.9 Å²	59.9	8%	0.082	31%	0.313	C	S	.	.			trans	70.4	-162.5	-171.5	0	0	0	0	0	112.6	D61 I162	D61-G65 VanDerWaalsContact O-CA 3.25Å; D61-G65 WeakPolarHBondContact O-CA 3.4Å; D61-G65 PolarHBondContact O-N 3.02Å; G65-I162 WeakPolarHBondContact CA-O 3.33Å
66	L	90.9	Very high	86.9	Confident	7 Å²	7	65 Å²	65	4%	0.037	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-86.8	154.5	177.9	-64.8	-179.1	0	0	0	111.6	A60 E70 V71 R163 D164 V176	A60-L66 HydrophobicContact CB-CD2 4.35Å; L66-E70 HydrophobicContact CD2-CG 4.31Å; L66-V71 HydrophobicContact CB-CG2 3.95Å; L66-V71 HydrophobicContact CD1-CG2 4.42Å; L66-R163 WeakPolarHBondContact O-CA 3.49Å; L66-R163 WeakPolarHBondContact O-CB 3.47Å; L66-D164 PolarHBondContact O-N 2.92Å; L66-D164 VanDerWaalsContact O-N 3.11Å; L66-V176 HydrophobicContact CD1-CG2 3.91Å
67	T	89.8	Confident	86.8	Confident	68 Å²	68	68.4 Å²	68.4	42%	0.417	34%	0.343	S	S	.	.			trans	-83.8	151.4	170.7	65.7	0	0	0	0	110.8	E69 E70 V71 D164	T67-E69 PolarHBondContact O-N 3.07Å; T67-E70 PolarHBondContact O-N 3.29Å; T67-E70 WeakPolarHBondContact OG1-CB 3.25Å; T67-E70 PolarHBondContact OG1-N 3.4Å; T67-V71 WeakPolarHBondContact O-CG2 3.46Å; T67-V71 PolarHBondContact O-N 3.48Å; T67-D164 WeakPolarHBondContact CA-OD1 3.45Å; T67-D164 WeakPolarHBondContact CB-OD1 3.39Å; T67-D164 WeakPolarHBondContact CG2-OD1 3.22Å
68	Q	86.7	Confident	86.5	Confident	92 Å²	92	67.9 Å²	67.9	43%	0.43	34%	0.337	S	S	.	.	H	α-helix	trans	-60.9	-30.9	-178.1	-158.7	73.2	-27.5	0	0	114	T72 D164	Q68-T72 PolarHBondContact O-N 3.1Å; Q68-T72 VanDerWaalsContact O-N 3.08Å; Q68-T72 PolarHBondContact O-OG1 2.77Å; Q68-D164 PolarHBondContact N-OD2 2.92Å
69	E	86.8	Confident	86.6	Confident	168 Å²	168	69.3 Å²	69.3	79%	0.785	35%	0.351	S	S	*	.	H	α-helix	trans	-64.1	-43.5	174	-67.8	-177	174.3	0	0	111.4	T67 T72 R73	T67-E69 PolarHBondContact O-N 3.07Å; E69-T72 PolarHBondContact O-N 2.79Å; E69-R73 WeakPolarHBondContact O-CB 3.42Å; E69-R73 PolarHBondContact O-N 2.92Å
70	E	87.5	Confident	86.5	Confident	32 Å²	32	69.4 Å²	69.4	15%	0.15	35%	0.347	C	S	.	.	H	α-helix	trans	-69.6	-38.1	-179.9	-175	59.1	-166.3	0	0	111.6	L66 T67 R73 R74	L66-E70 HydrophobicContact CD2-CG 4.31Å; T67-E70 PolarHBondContact O-N 3.29Å; T67-E70 WeakPolarHBondContact OG1-CB 3.25Å; T67-E70 PolarHBondContact OG1-N 3.4Å; E70-R73 PolarHBondContact O-N 2.82Å; E70-R73 IonicContact OE1-CZ 3.08Å; E70-R73 IonicContact OE1-NE 2.82Å; E70-R73 IonicContact OE1-NH2 2.89Å; E70-R73 PolarHBondContact OE1-NH2 3.03Å; E70-R73 IonicContact OE2-CZ 3.84Å; E70-R73 IonicContact OE2-NE 2.76Å; E70-R73 PolarHBondContact OE2-NE 3.06Å; E70-R73 IonicContact OE2-NH2 3.59Å; E70-R73 PolarHBondContact OE2-NH2 3.23Å; E70-R74 HydrophobicContact CG-CG 4.49Å; E70-R74 WeakPolarHBondContact O-CB 3.1Å; E70-R74 WeakPolarHBondContact O-CG 3.32Å; E70-R74 PolarHBondContact O-N 2.99Å; E70-R74 IonicContact OE1-CZ 2.72Å; E70-R74 IonicContact OE1-NE 3.31Å; E70-R74 PolarHBondContact OE1-NE 2.91Å; E70-R74 IonicContact OE1-NH2 3.04Å; E70-R74 PolarHBondContact OE1-NH2 3.5Å; E70-R74 VanDerWaalsContact OE1-NH2 3.15Å
71	V	88.6	Confident	86.6	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.006	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-48.5	173.1	172.6	0	0	0	0	110.7	L66 T67 R73 R74 R75 V176	L66-V71 HydrophobicContact CB-CG2 3.95Å; L66-V71 HydrophobicContact CD1-CG2 4.42Å; T67-V71 WeakPolarHBondContact O-CG2 3.46Å; T67-V71 PolarHBondContact O-N 3.48Å; V71-R73 VanDerWaalsContact C-N 3.29Å; V71-R73 PolarHBondContact O-N 2.91Å; V71-R74 PolarHBondContact O-N 3.1Å; V71-R75 VanDerWaalsContact O-CB 3.29Å; V71-R75 WeakPolarHBondContact O-CB 3.27Å; V71-R75 PolarHBondContact O-N 2.94Å; V71-V176 HydrophobicContact CB-CG2 4.4Å; V71-V176 HydrophobicContact CG1-CG1 4.39Å; V71-V176 HydrophobicContact CG1-CG2 4.18Å; V71-V176 HydrophobicContact CG2-CG2 4.22Å
72	T	87.7	Confident	86.2	Confident	84 Å²	84	68.8 Å²	68.8	52%	0.515	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-40.9	-179.9	-52.8	0	0	0	0	110.7	Q68 E69 V76	Q68-T72 PolarHBondContact O-N 3.1Å; Q68-T72 VanDerWaalsContact O-N 3.08Å; Q68-T72 PolarHBondContact O-OG1 2.77Å; E69-T72 PolarHBondContact O-N 2.79Å; T72-V76 PolarHBondContact O-N 3.29Å
73	R	86.9	Confident	85.6	Confident	110 Å²	110	69 Å²	69	42%	0.415	34%	0.338	S	S	.	.	H	α-helix	trans	-62.4	-51.2	175.4	-171.4	175.5	74.6	145	7.8	111.7	E69 E70 V71 R75 V76 Y77	E69-R73 WeakPolarHBondContact O-CB 3.42Å; E69-R73 PolarHBondContact O-N 2.92Å; E70-R73 PolarHBondContact O-N 2.82Å; E70-R73 IonicContact OE1-CZ 3.08Å; E70-R73 IonicContact OE1-NE 2.82Å; E70-R73 IonicContact OE1-NH2 2.89Å; E70-R73 PolarHBondContact OE1-NH2 3.03Å; E70-R73 IonicContact OE2-CZ 3.84Å; E70-R73 IonicContact OE2-NE 2.76Å; E70-R73 PolarHBondContact OE2-NE 3.06Å; E70-R73 IonicContact OE2-NH2 3.59Å; E70-R73 PolarHBondContact OE2-NH2 3.23Å; V71-R73 VanDerWaalsContact C-N 3.29Å; V71-R73 PolarHBondContact O-N 2.91Å; R73-R75 VanDerWaalsContact C-N 3.29Å; R73-R75 PolarHBondContact O-N 3.01Å; R73-V76 PolarHBondContact O-N 3.28Å; R73-Y77 WeakPolarHBondContact O-CD2 3.36Å
74	R	89.1	Confident	84.5	Confident	9 Å²	9	66.2 Å²	66.2	3%	0.034	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-34.7	-179.7	-71.2	-178.5	-169.9	-160.9	5.1	112.3	L58 Q59 E70 V71 V76 Y77 H78 V176 P177	L58-R74 PolarHBondContact O-NH1 3.26Å; L58-R74 PolarHBondContact O-NH2 2.88Å; L58-R74 VanDerWaalsContact O-NH2 3.07Å; Q59-R74 PolarHBondContact O-NH2 3.2Å; E70-R74 HydrophobicContact CG-CG 4.49Å; E70-R74 WeakPolarHBondContact O-CB 3.1Å; E70-R74 WeakPolarHBondContact O-CG 3.32Å; E70-R74 PolarHBondContact O-N 2.99Å; E70-R74 IonicContact OE1-CZ 2.72Å; E70-R74 IonicContact OE1-NE 3.31Å; E70-R74 PolarHBondContact OE1-NE 2.91Å; E70-R74 IonicContact OE1-NH2 3.04Å; E70-R74 PolarHBondContact OE1-NH2 3.5Å; E70-R74 VanDerWaalsContact OE1-NH2 3.15Å; V71-R74 PolarHBondContact O-N 3.1Å; R74-V76 VanDerWaalsContact C-N 3.33Å; R74-V76 PolarHBondContact O-N 2.91Å; R74-Y77 PolarHBondContact O-N 3.03Å; R74-H78 PolarHBondContact O-CD2 2.61Å; R74-H78 PolarHBondContact O-N 3.45Å; R74-V176 HydrophobicContact CB-CB 4.05Å; R74-V176 HydrophobicContact CB-CG1 4.27Å; R74-V176 HydrophobicContact CB-CG2 4.15Å; R74-P177 WeakPolarHBondContact CD-O 3.29Å; R74-P177 PolarHBondContact NH1-O 2.89Å
75	R	87.7	Confident	83.3	Confident	52 Å²	52	70.6 Å²	70.6	20%	0.196	35%	0.346	C	S	.	.	H	α-helix	trans	-63.5	-35	178.1	-171.6	176.4	-63	-167.2	-4.9	113.3	V71 R73 Y77 G79 W80 D174 V176	V71-R75 VanDerWaalsContact O-CB 3.29Å; V71-R75 WeakPolarHBondContact O-CB 3.27Å; V71-R75 PolarHBondContact O-N 2.94Å; R73-R75 VanDerWaalsContact C-N 3.29Å; R73-R75 PolarHBondContact O-N 3.01Å; R75-Y77 VanDerWaalsContact C-N 3.25Å; R75-Y77 PolarHBondContact O-N 3.09Å; R75-G79 VanDerWaalsContact O-CA 3.25Å; R75-G79 WeakPolarHBondContact O-CA 3.29Å; R75-G79 PolarHBondContact O-N 3.32Å; R75-W80 VanDerWaalsContact NH1-CH2 3.31Å; R75-D174 IonicContact CZ-OD1 3.15Å; R75-D174 IonicContact NH1-OD1 2.72Å; R75-D174 PolarHBondContact NH1-OD1 3.13Å; R75-D174 VanDerWaalsContact NH2-CB 3.34Å; R75-D174 PolarHBondContact NH2-O 3.29Å; R75-D174 IonicContact NH2-OD1 2.8Å; R75-D174 PolarHBondContact NH2-OD1 2.91Å; R75-V176 HydrophobicContact CB-CG1 4.13Å
76	V	85.6	Confident	81.6	Confident	119 Å²	119	75.2 Å²	75.2	72%	0.721	38%	0.377	S	S	*	.	H	α-helix	trans	-64.7	-33.1	176.6	174.4	0	0	0	0	111.5	T72 R73 R74	T72-V76 PolarHBondContact O-N 3.29Å; R73-V76 PolarHBondContact O-N 3.28Å; R74-V76 VanDerWaalsContact C-N 3.33Å; R74-V76 PolarHBondContact O-N 2.91Å
77	Y	83.6	Confident	79.7	Confident	167 Å²	167	83.7 Å²	83.7	66%	0.655	42%	0.417	S	S	*	.	H	α-helix	trans	-90.5	-47.3	-177.7	-75	-81.3	0	0	0	113.8	R73 R74 R75	R73-Y77 WeakPolarHBondContact O-CD2 3.36Å; R74-Y77 PolarHBondContact O-N 3.03Å; R75-Y77 VanDerWaalsContact C-N 3.25Å; R75-Y77 PolarHBondContact O-N 3.09Å
78	H	82.4	Confident	78.2	Confident	47 Å²	47	86.6 Å²	86.6	22%	0.218	43%	0.43	C	S	.	.	H	α-helix	trans	-86.2	-11.8	-176.5	-68.5	-72.2	0	0	0	113	V38 V40 R74 P177	V38-H78 PolarHBondContact O-NE2 3.04Å; V40-H78 VanDerWaalsContact CG2-CE1 3.46Å; V40-H78 WeakPolarHBondContact CG2-CE1 3.35Å; R74-H78 PolarHBondContact O-CD2 2.61Å; R74-H78 PolarHBondContact O-N 3.45Å; H78-P177 HydrophobicContact CB-CG 4.44Å
79	G	85.9	Confident	77.3	Confident	29 Å²	29	86.5 Å²	86.5	30%	0.299	43%	0.43	S	S	.	.			trans	74	-164.1	-173.9	0	0	0	0	0	112.4	R75	R75-G79 VanDerWaalsContact O-CA 3.25Å; R75-G79 WeakPolarHBondContact O-CA 3.29Å; R75-G79 PolarHBondContact O-N 3.32Å
80	W	86.3	Confident	77.1	Confident	113 Å²	113	81.3 Å²	81.3	43%	0.428	41%	0.41	S	S	.	.			trans	-85.6	154.4	176.7	-60.5	93.4	0	0	0	110.5	R75 E82 R173 D174	R75-W80 VanDerWaalsContact NH1-CH2 3.31Å; W80-E82 PolarHBondContact O-N 3.39Å; W80-R173 HydrophobicContact CB-CG 4.17Å; W80-R173 HydrophobicContact CD2-CG 4.29Å; W80-R173 HydrophobicContact CE3-CG 3.64Å; W80-R173 VanDerWaalsContact CE3-NE 3.3Å; W80-R173 HydrophobicContact CZ3-CG 4.27Å; W80-D174 WeakPolarHBondContact CZ3-OD1 3.28Å
81	N	85.8	Confident	76.8	Confident	8 Å²	8	84 Å²	84	4%	0.043	43%	0.425	C	S	.	.	S	Bend	trans	-77.5	59.5	170.8	-175.6	36	0	0	0	110.7	A172 R173 L175 P190 T255 G256	N81-A172 WeakPolarHBondContact CB-O 3.46Å; N81-A172 PolarHBondContact ND2-O 3Å; N81-R173 PolarHBondContact N-O 2.86Å; N81-L175 HydrophobicContact CB-CB 4.42Å; N81-P190 PolarHBondContact ND2-O 2.78Å; N81-T255 HydrophobicContact CB-CG2 4.3Å; N81-G256 PolarHBondContact OD1-N 2.82Å
82	E	78.9	Confident	76.6	Confident	78 Å²	78	92.1 Å²	92.1	36%	0.364	46%	0.456	S	S	.	.	S	Bend	trans	-135.3	157.4	176.8	-79.7	176.6	178	0	0	108.9	W80 R173	W80-E82 PolarHBondContact O-N 3.39Å; E82-R173 VanDerWaalsContact CD-CG 3.49Å; E82-R173 VanDerWaalsContact CD-NH1 3.25Å; E82-R173 HydrophobicContact CG-CB 4.14Å; E82-R173 HydrophobicContact CG-CG 3.82Å; E82-R173 WeakPolarHBondContact OE1-CD 3.38Å; E82-R173 WeakPolarHBondContact OE1-CG 3.06Å; E82-R173 IonicContact OE1-CZ 3.65Å; E82-R173 IonicContact OE1-NE 3.82Å; E82-R173 IonicContact OE1-NH1 3.85Å; E82-R173 PolarHBondContact OE1-NH1 2.85Å; E82-R173 IonicContact OE2-CZ 2.81Å; E82-R173 IonicContact OE2-NE 3.06Å; E82-R173 IonicContact OE2-NH1 3.69Å; E82-R173 PolarHBondContact OE2-NH1 2.81Å; E82-R173 IonicContact OE2-NH2 2.76Å
83	F	71.8	Confident	76.4	Confident	48 Å²	48	94.6 Å²	94.6	21%	0.211	46%	0.456	C	S	.	.			trans	-86.5	137.1	172.4	-57.3	-67.3	0	0	0	109.3	I85 M239 F261 F265	F83-I85 PolarHBondContact O-N 3.37Å; F83-M239 HydrophobicContact CE2-CE 3.94Å; F83-M239 HydrophobicContact CZ-CE 3.7Å; F83-M239 HydrophobicContact CZ-SD 4.16Å; F83-F261 HydrophobicContact CE1-CD1 4.43Å; F83-F261 HydrophobicContact CE2-CD1 4.22Å; F83-F261 HydrophobicContact CE2-CE1 4.01Å; F83-F261 AromaticContact CZ-CD1 3.6Å; F83-F261 HydrophobicContact CZ-CD1 3.6Å; F83-F261 AromaticContact CZ-CE1 3.86Å; F83-F261 HydrophobicContact CZ-CE1 3.86Å; F83-F265 HydrophobicContact CB-CD1 4.07Å; F83-F265 HydrophobicContact CB-CE1 3.53Å; F83-F265 HydrophobicContact CB-CE2 4.44Å; F83-F265 HydrophobicContact CB-CZ 3.74Å; F83-F265 HydrophobicContact CD1-CB 4.4Å; F83-F265 AromaticContact CD1-CD1 3.75Å; F83-F265 HydrophobicContact CD1-CD1 3.75Å; F83-F265 HydrophobicContact CD1-CE1 4.12Å; F83-F265 HydrophobicContact CD1-CG 4.03Å; F83-F265 HydrophobicContact CE1-CB 4.4Å; F83-F265 HydrophobicContact CE1-CG 4.46Å; F83-F265 HydrophobicContact CG-CD1 4.01Å; F83-F265 HydrophobicContact CG-CD2 4.5Å; F83-F265 AromaticContact CG-CE1 3.95Å; F83-F265 HydrophobicContact CG-CE1 3.95Å; F83-F265 HydrophobicContact CG-CE2 4.45Å; F83-F265 HydrophobicContact CG-CG 4.28Å; F83-F265 HydrophobicContact CG-CZ 4.18Å
84	D	61.2	Low	76.1	Confident	115 Å²	115	91.6 Å²	91.6	62%	0.615	45%	0.446	S	S	*	.			trans	-71.2	106.1	178.9	-140.9	1.8	0	0	0	109	Q269	D84-Q269 PolarHBondContact O-NE2 3Å
85	I	58.5	Low	75.9	Confident	127 Å²	127	94.4 Å²	94.4	65%	0.651	46%	0.457	S	S	*	.			trans	-88.1	118.8	171.7	-57.3	169	0	0	0	105.3	F83 E87	F83-I85 PolarHBondContact O-N 3.37Å; I85-E87 PolarHBondContact O-N 3.37Å
86	S	52.8	Low	75.9	Confident	105 Å²	105	96.3 Å²	96.3	73%	0.734	47%	0.47	S	S	*	.			trans	-44.3	124.3	-177.1	53.9	0	0	0	0	112.2	D88	S86-D88 PolarHBondContact O-N 3.21Å
87	E	50.4	Low	75.7	Confident	186 Å²	186	92.9 Å²	92.9	87%	0.869	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-56.2	134	-177.4	-65.6	-175.2	157.3	0	0	112.3	I85 E89	I85-E87 PolarHBondContact O-N 3.37Å; E87-E89 PolarHBondContact O-N 2.83Å
88	D	57.7	Low	75.5	Confident	129 Å²	129	87 Å²	87	69%	0.69	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-59.4	134.7	173.6	-76.2	-49.6	0	0	0	111.4	S86	S86-D88 PolarHBondContact O-N 3.21Å
89	E	67.1	Low	75.5	Confident	90 Å²	90	87.5 Å²	87.5	42%	0.421	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-60.2	132.8	171.8	-73	-158.6	136.8	0	0	110.4	E87 R93 K94	E87-E89 PolarHBondContact O-N 2.83Å; E89-R93 IonicContact OE1-CZ 2.77Å; E89-R93 IonicContact OE1-NE 3.88Å; E89-R93 PolarHBondContact OE1-NE 2.86Å; E89-R93 IonicContact OE1-NH2 3.02Å; E89-K94 HydrophobicContact CB-CG 4.05Å
90	P	82.6	Confident	75.1	Confident	58 Å²	58	93.4 Å²	93.4	38%	0.377	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-63.9	142.7	-177.4	25	-33.7	0	0	0	111.5	W92 R93 K94	P90-W92 VanDerWaalsContact C-N 3.26Å; P90-W92 HydrophobicContact CG-CZ2 4.13Å; P90-W92 PolarHBondContact O-N 3.08Å; P90-W92 VanDerWaalsContact O-N 3.09Å; P90-R93 HydrophobicContact CG-CB 3.95Å; P90-R93 WeakPolarHBondContact O-CA 3.37Å; P90-R93 WeakPolarHBondContact O-CB 3.24Å; P90-R93 PolarHBondContact O-N 2.99Å; P90-K94 PolarHBondContact O-N 3.02Å; P90-K94 VanDerWaalsContact O-N 3.12Å
91	L	82.8	Confident	74.5	Confident	89 Å²	89	91.3 Å²	91.3	47%	0.466	45%	0.446	S	S	.	.	H	α-helix	trans	-54.4	-36.4	-171.2	-65.2	175.5	0	0	0	114.3	R93 K94 Y95 Y142	L91-R93 VanDerWaalsContact C-N 3.3Å; L91-R93 PolarHBondContact O-N 3.42Å; L91-K94 PolarHBondContact O-N 3Å; L91-Y95 WeakPolarHBondContact O-CB 3.12Å; L91-Y95 PolarHBondContact O-N 2.86Å; L91-Y142 HydrophobicContact CD1-CE2 4.39Å; L91-Y142 HydrophobicContact CD2-CD2 3.81Å; L91-Y142 HydrophobicContact CD2-CE2 3.61Å
92	W	83.3	Confident	73.6	Confident	172 Å²	172	95.6 Å²	95.6	65%	0.652	47%	0.474	S	S	*	.	H	α-helix	trans	-66.4	-33.9	177.8	64.4	-95.6	0	0	0	112.1	P90 Y95 I96	P90-W92 VanDerWaalsContact C-N 3.26Å; P90-W92 HydrophobicContact CG-CZ2 4.13Å; P90-W92 PolarHBondContact O-N 3.08Å; P90-W92 VanDerWaalsContact O-N 3.09Å; W92-Y95 PolarHBondContact O-N 3.11Å; W92-I96 HydrophobicContact CE3-CD1 3.91Å; W92-I96 HydrophobicContact CZ3-CD1 4.3Å; W92-I96 VanDerWaalsContact O-CG1 3.3Å; W92-I96 WeakPolarHBondContact O-CG1 3.4Å; W92-I96 PolarHBondContact O-N 3.4Å
93	R	84.8	Confident	73	Confident	135 Å²	135	93.1 Å²	93.1	51%	0.509	46%	0.463	S	S	.	.	H	α-helix	trans	-73.4	-40.3	176.5	-177.7	175	167.8	150.6	-1	110.6	E89 P90 L91 Y95 I96 S97	E89-R93 IonicContact OE1-CZ 2.77Å; E89-R93 IonicContact OE1-NE 3.88Å; E89-R93 PolarHBondContact OE1-NE 2.86Å; E89-R93 IonicContact OE1-NH2 3.02Å; P90-R93 HydrophobicContact CG-CB 3.95Å; P90-R93 WeakPolarHBondContact O-CA 3.37Å; P90-R93 WeakPolarHBondContact O-CB 3.24Å; P90-R93 PolarHBondContact O-N 2.99Å; L91-R93 VanDerWaalsContact C-N 3.3Å; L91-R93 PolarHBondContact O-N 3.42Å; R93-Y95 VanDerWaalsContact C-N 3.31Å; R93-Y95 PolarHBondContact O-N 3.3Å; R93-I96 PolarHBondContact O-N 3.31Å; R93-S97 WeakPolarHBondContact O-CB 3.36Å; R93-S97 PolarHBondContact O-N 2.9Å
94	K	80.1	Confident	73.2	Confident	48 Å²	48	91.7 Å²	91.7	21%	0.209	46%	0.458	C	S	.	.	H	α-helix	trans	-60.2	-37.4	169.9	-74.3	-170.9	174.7	-174.2	0	112.3	E89 P90 L91 S97 F138 E145	E89-K94 HydrophobicContact CB-CG 4.05Å; P90-K94 PolarHBondContact O-N 3.02Å; P90-K94 VanDerWaalsContact O-N 3.12Å; L91-K94 PolarHBondContact O-N 3Å; K94-S97 PolarHBondContact O-OG 2.79Å; K94-F138 HydrophobicContact CB-CE2 4.23Å; K94-E145 IonicContact NZ-OE1 2.71Å; K94-E145 IonicContact NZ-OE2 2.87Å; K94-E145 PolarHBondContact NZ-OE2 3.31Å
95	Y	85.1	Confident	73.9	Confident	68 Å²	68	90.6 Å²	90.6	27%	0.267	45%	0.451	S	S	.	.	H	α-helix	trans	-70.8	-43.6	176.2	-175.4	-103.9	0	0	0	112.2	L91 W92 R93 S97 Q98 F99 V134 T135 F138	L91-Y95 WeakPolarHBondContact O-CB 3.12Å; L91-Y95 PolarHBondContact O-N 2.86Å; W92-Y95 PolarHBondContact O-N 3.11Å; R93-Y95 VanDerWaalsContact C-N 3.31Å; R93-Y95 PolarHBondContact O-N 3.3Å; Y95-S97 VanDerWaalsContact C-N 3.3Å; Y95-S97 PolarHBondContact O-N 3.15Å; Y95-Q98 WeakPolarHBondContact O-CB 3.18Å; Y95-Q98 PolarHBondContact O-N 3.46Å; Y95-F99 HydrophobicContact CD1-CE2 4.19Å; Y95-F99 AromaticContact CE1-CE2 3.69Å; Y95-F99 HydrophobicContact CE1-CE2 3.69Å; Y95-F99 HydrophobicContact CE1-CZ 4.33Å; Y95-V134 HydrophobicContact CE2-CG1 3.96Å; Y95-T135 PolarHBondContact OH-OG1 3.38Å; Y95-F138 HydrophobicContact CD2-CB 3.89Å; Y95-F138 AromaticContact CD2-CD1 3.87Å; Y95-F138 HydrophobicContact CD2-CD1 3.87Å; Y95-F138 AromaticContact CD2-CD2 3.96Å; Y95-F138 HydrophobicContact CD2-CD2 3.96Å; Y95-F138 HydrophobicContact CD2-CE1 4.4Å; Y95-F138 HydrophobicContact CD2-CE2 4.48Å; Y95-F138 AromaticContact CD2-CG 3.62Å; Y95-F138 HydrophobicContact CD2-CG 3.62Å; Y95-F138 HydrophobicContact CE2-CB 4.22Å; Y95-F138 HydrophobicContact CE2-CD1 4.45Å; Y95-F138 HydrophobicContact CE2-CG 4.33Å
96	I	86.7	Confident	74.5	Confident	91 Å²	91	86.9 Å²	86.9	47%	0.467	43%	0.433	S	S	.	.	H	α-helix	trans	-67.4	-31.1	178.1	-69.4	174	0	0	0	111.8	W92 R93 Q98 F99	W92-I96 HydrophobicContact CE3-CD1 3.91Å; W92-I96 HydrophobicContact CZ3-CD1 4.3Å; W92-I96 VanDerWaalsContact O-CG1 3.3Å; W92-I96 WeakPolarHBondContact O-CG1 3.4Å; W92-I96 PolarHBondContact O-N 3.4Å; R93-I96 PolarHBondContact O-N 3.31Å; I96-Q98 PolarHBondContact O-N 2.87Å; I96-F99 PolarHBondContact O-N 3.41Å; I96-F99 VanDerWaalsContact O-N 3.12Å
97	S	82.3	Confident	75.4	Confident	47 Å²	47	83.1 Å²	83.1	33%	0.329	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-29.5	178.9	71.3	0	0	0	0	112.5	R93 K94 Y95 F99 K100	R93-S97 WeakPolarHBondContact O-CB 3.36Å; R93-S97 PolarHBondContact O-N 2.9Å; K94-S97 PolarHBondContact O-OG 2.79Å; Y95-S97 VanDerWaalsContact C-N 3.3Å; Y95-S97 PolarHBondContact O-N 3.15Å; S97-F99 PolarHBondContact O-N 3.4Å; S97-K100 VanDerWaalsContact O-CB 3.3Å; S97-K100 WeakPolarHBondContact O-CB 3.33Å; S97-K100 PolarHBondContact O-N 3.43Å
98	Q	78.3	Confident	76.8	Confident	43 Å²	43	77 Å²	77	20%	0.201	38%	0.377	C	S	.	.	H	α-helix	trans	-60	-33.6	175.3	-60.3	-65.6	-20.7	0	0	112.3	Y95 I96 K100 D101 I104 V134 E141	Y95-Q98 WeakPolarHBondContact O-CB 3.18Å; Y95-Q98 PolarHBondContact O-N 3.46Å; I96-Q98 PolarHBondContact O-N 2.87Å; Q98-K100 PolarHBondContact O-N 3.11Å; Q98-D101 WeakPolarHBondContact O-CB 3.38Å; Q98-D101 PolarHBondContact O-N 3.31Å; Q98-I104 VanDerWaalsContact O-CD1 3.23Å; Q98-I104 WeakPolarHBondContact O-CD1 3.09Å; Q98-V134 HydrophobicContact CB-CG1 3.86Å; Q98-E141 PolarHBondContact NE2-OE2 3.19Å
99	F	82.9	Confident	77.8	Confident	58 Å²	58	73.1 Å²	73.1	25%	0.254	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-10.1	177	-70.2	-88.2	0	0	0	113.9	Y95 I96 S97 I104 L108 I130 V134	Y95-F99 HydrophobicContact CD1-CE2 4.19Å; Y95-F99 AromaticContact CE1-CE2 3.69Å; Y95-F99 HydrophobicContact CE1-CE2 3.69Å; Y95-F99 HydrophobicContact CE1-CZ 4.33Å; I96-F99 PolarHBondContact O-N 3.41Å; I96-F99 VanDerWaalsContact O-N 3.12Å; S97-F99 PolarHBondContact O-N 3.4Å; F99-I104 HydrophobicContact CD1-CG2 3.97Å; F99-L108 HydrophobicContact CD1-CD1 4.31Å; F99-I130 HydrophobicContact CE1-CG2 4.4Å; F99-V134 HydrophobicContact CD2-CG1 4.3Å; F99-V134 HydrophobicContact CE1-CG2 4.26Å; F99-V134 HydrophobicContact CE2-CG1 3.74Å; F99-V134 HydrophobicContact CZ-CB 4.33Å; F99-V134 HydrophobicContact CZ-CG1 3.89Å; F99-V134 HydrophobicContact CZ-CG2 4.35Å
100	K	78.3	Confident	78	Confident	154 Å²	154	68.9 Å²	68.9	67%	0.67	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-5.3	175.2	-61.5	-178	178.5	177.4	0	112.8	S97 Q98	S97-K100 VanDerWaalsContact O-CB 3.3Å; S97-K100 WeakPolarHBondContact O-CB 3.33Å; S97-K100 PolarHBondContact O-N 3.43Å; Q98-K100 PolarHBondContact O-N 3.11Å
101	D	73.3	Confident	77.9	Confident	69 Å²	69	66.4 Å²	66.4	37%	0.369	33%	0.328	S	S	.	.	S	Bend	trans	-58.7	126.5	174.1	-167.1	-49.7	0	0	0	109.8	Q98 L103 I104 L105	Q98-D101 WeakPolarHBondContact O-CB 3.38Å; Q98-D101 PolarHBondContact O-N 3.31Å; D101-L103 PolarHBondContact O-N 2.81Å; D101-L103 WeakPolarHBondContact OD1-CB 3.3Å; D101-L103 PolarHBondContact OD1-N 2.94Å; D101-I104 HydrophobicContact CB-CB 4.33Å; D101-I104 HydrophobicContact CB-CD1 3.96Å; D101-I104 HydrophobicContact CB-CG1 4.29Å; D101-I104 PolarHBondContact O-N 2.83Å; D101-L105 WeakPolarHBondContact O-CG 3.47Å; D101-L105 PolarHBondContact O-N 3Å
102	P	67.4	Low	77.9	Confident	98 Å²	98	66.6 Å²	66.6	64%	0.636	33%	0.332	S	S	*	.	H	α-helix	trans	-50.1	-28.7	177	-28.2	35	0	0	0	115	L106	P102-L106 WeakPolarHBondContact O-CB 3.5Å; P102-L106 PolarHBondContact O-N 2.88Å; P102-L106 VanDerWaalsContact O-N 3.09Å
103	L	66.3	Low	77.7	Confident	25 Å²	25	61.3 Å²	61.3	13%	0.131	32%	0.316	C	S	.	.	H	α-helix	trans	-80.2	-42.8	-178.7	-58.3	175.4	0	0	0	112.7	D101 L105 L106 L107 I326	D101-L103 PolarHBondContact O-N 2.81Å; D101-L103 WeakPolarHBondContact OD1-CB 3.3Å; D101-L103 PolarHBondContact OD1-N 2.94Å; L103-L105 PolarHBondContact O-N 2.85Å; L103-L106 WeakPolarHBondContact O-CB 3.43Å; L103-L106 PolarHBondContact O-N 2.85Å; L103-L106 VanDerWaalsContact O-N 3.09Å; L103-L107 PolarHBondContact O-N 3.46Å; L103-I326 HydrophobicContact CD1-CB 4.02Å; L103-I326 HydrophobicContact CD1-CD1 3.42Å; L103-I326 VanDerWaalsContact CD1-CD1 3.42Å; L103-I326 HydrophobicContact CD1-CG1 4.31Å; L103-I326 HydrophobicContact CD1-CG2 3.72Å; L103-I326 HydrophobicContact CD2-CD1 3.34Å; L103-I326 HydrophobicContact CG-CD1 3.97Å
104	I	74.7	Confident	77.2	Confident	18 Å²	18	55 Å²	55	9%	0.092	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-39.1	173	-68.7	164	0	0	0	109.3	Q98 F99 D101 L106 L107 L108 I130 V134	Q98-I104 VanDerWaalsContact O-CD1 3.23Å; Q98-I104 WeakPolarHBondContact O-CD1 3.09Å; F99-I104 HydrophobicContact CD1-CG2 3.97Å; D101-I104 HydrophobicContact CB-CB 4.33Å; D101-I104 HydrophobicContact CB-CD1 3.96Å; D101-I104 HydrophobicContact CB-CG1 4.29Å; D101-I104 PolarHBondContact O-N 2.83Å; I104-L106 VanDerWaalsContact C-N 3.32Å; I104-L106 PolarHBondContact O-N 3.01Å; I104-L107 PolarHBondContact O-N 3.25Å; I104-L108 HydrophobicContact CG2-CD1 3.94Å; I104-L108 HydrophobicContact CG2-CG 4.36Å; I104-L108 WeakPolarHBondContact O-CB 3.31Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.41Å; I104-L108 PolarHBondContact O-N 2.85Å; I104-I130 HydrophobicContact CG2-CG2 3.92Å; I104-V134 HydrophobicContact CD1-CG2 3.54Å; I104-V134 HydrophobicContact CG1-CG2 4.27Å; I104-V134 HydrophobicContact CG2-CG2 4.48Å
105	L	77.2	Confident	77.3	Confident	92 Å²	92	56.3 Å²	56.3	48%	0.482	30%	0.304	S	S	.	.	H	α-helix	trans	-60.8	-39.2	172.7	-74	168.9	0	0	0	112.6	D101 L103 A109	D101-L105 WeakPolarHBondContact O-CG 3.47Å; D101-L105 PolarHBondContact O-N 3Å; L103-L105 PolarHBondContact O-N 2.85Å; L105-A109 WeakPolarHBondContact O-CB 3.29Å; L105-A109 PolarHBondContact O-N 3.24Å
106	L	69.9	Low	77.2	Confident	50 Å²	50	58.3 Å²	58.3	26%	0.262	32%	0.324	S	S	.	.	H	α-helix	trans	-68.4	-39.7	176.6	-173.6	132	0	0	0	112.2	P102 L103 I104 A109 S110 F294 V319 A322	P102-L106 WeakPolarHBondContact O-CB 3.5Å; P102-L106 PolarHBondContact O-N 2.88Å; P102-L106 VanDerWaalsContact O-N 3.09Å; L103-L106 WeakPolarHBondContact O-CB 3.43Å; L103-L106 PolarHBondContact O-N 2.85Å; L103-L106 VanDerWaalsContact O-N 3.09Å; I104-L106 VanDerWaalsContact C-N 3.32Å; I104-L106 PolarHBondContact O-N 3.01Å; L106-A109 WeakPolarHBondContact O-CB 3.33Å; L106-A109 PolarHBondContact O-N 2.85Å; L106-S110 PolarHBondContact O-N 2.82Å; L106-F294 HydrophobicContact CD1-CE1 4.19Å; L106-F294 HydrophobicContact CD1-CZ 4.37Å; L106-V319 HydrophobicContact CD2-CB 4.45Å; L106-V319 HydrophobicContact CD2-CG1 4.16Å; L106-V319 HydrophobicContact CD2-CG2 4.09Å; L106-A322 HydrophobicContact CD2-CB 4.14Å
107	L	72	Confident	76.5	Confident	25 Å²	25	57.5 Å²	57.5	13%	0.131	32%	0.318	C	S	.	.	H	α-helix	trans	-67.7	-41	174.7	-75.1	168.6	0	0	0	112.4	L103 I104 A109 S110 A111 I130 V319 V323	L103-L107 PolarHBondContact O-N 3.46Å; I104-L107 PolarHBondContact O-N 3.25Å; L107-A109 VanDerWaalsContact C-N 3.29Å; L107-A109 PolarHBondContact O-N 3.36Å; L107-S110 WeakPolarHBondContact O-CB 3.35Å; L107-S110 PolarHBondContact O-N 3.05Å; L107-S110 VanDerWaalsContact O-N 3.16Å; L107-A111 PolarHBondContact O-N 3.46Å; L107-I130 HydrophobicContact CB-CD1 3.65Å; L107-I130 HydrophobicContact CB-CG1 3.95Å; L107-I130 HydrophobicContact CD1-CG1 4.25Å; L107-V319 HydrophobicContact CD2-CG1 3.56Å; L107-V323 HydrophobicContact CD1-CG2 3.76Å; L107-V323 HydrophobicContact CD2-CG2 3.39Å; L107-V323 HydrophobicContact CG-CG2 3.86Å
108	L	80.3	Confident	76.3	Confident	59 Å²	59	63.2 Å²	63.2	31%	0.309	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-42	172.1	-77.2	167.9	0	0	0	110.8	F99 I104 S110 A111 V112 I130	F99-L108 HydrophobicContact CD1-CD1 4.31Å; I104-L108 HydrophobicContact CG2-CD1 3.94Å; I104-L108 HydrophobicContact CG2-CG 4.36Å; I104-L108 WeakPolarHBondContact O-CB 3.31Å; I104-L108 VanDerWaalsContact O-CG 3.29Å; I104-L108 WeakPolarHBondContact O-CG 3.41Å; I104-L108 PolarHBondContact O-N 2.85Å; L108-S110 VanDerWaalsContact C-N 3.33Å; L108-S110 PolarHBondContact O-N 3.44Å; L108-A111 PolarHBondContact O-N 3.14Å; L108-V112 VanDerWaalsContact O-CG2 3.31Å; L108-V112 WeakPolarHBondContact O-CG2 3.23Å; L108-V112 PolarHBondContact O-N 2.79Å; L108-I130 HydrophobicContact CD2-CD1 4.08Å; L108-I130 HydrophobicContact CG-CD1 4.12Å
109	A	78.3	Confident	76.1	Confident	46 Å²	46	65 Å²	65	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-40.8	174.5	0	0	0	0	0	112	L105 L106 L107 V112 I113	L105-A109 WeakPolarHBondContact O-CB 3.29Å; L105-A109 PolarHBondContact O-N 3.24Å; L106-A109 WeakPolarHBondContact O-CB 3.33Å; L106-A109 PolarHBondContact O-N 2.85Å; L107-A109 VanDerWaalsContact C-N 3.29Å; L107-A109 PolarHBondContact O-N 3.36Å; A109-V112 PolarHBondContact O-N 2.99Å; A109-I113 WeakPolarHBondContact O-CD1 3.45Å; A109-I113 VanDerWaalsContact O-CG1 3.26Å; A109-I113 WeakPolarHBondContact O-CG1 3.41Å; A109-I113 PolarHBondContact O-N 2.51Å
110	S	72.3	Confident	75.9	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.014	36%	0.36	C	S	.	.	H	α-helix	trans	-64.4	-43.1	175.1	-166.4	0	0	0	0	112.8	L106 L107 L108 V112 I113 S114	L106-S110 PolarHBondContact O-N 2.82Å; L107-S110 WeakPolarHBondContact O-CB 3.35Å; L107-S110 PolarHBondContact O-N 3.05Å; L107-S110 VanDerWaalsContact O-N 3.16Å; L108-S110 VanDerWaalsContact C-N 3.33Å; L108-S110 PolarHBondContact O-N 3.44Å; S110-V112 VanDerWaalsContact C-N 3.32Å; S110-V112 PolarHBondContact O-N 3.36Å; S110-I113 PolarHBondContact O-N 2.7Å; S110-S114 PolarHBondContact O-N 2.88Å; S110-S114 PolarHBondContact O-OG 2.78Å
111	A	79.2	Confident	75.5	Confident	6 Å²	6	65.8 Å²	65.8	5%	0.05	36%	0.362	C	S	.	.	H	α-helix	trans	-59.6	-44.1	176.1	0	0	0	0	0	111.1	L107 L108 I113 S114 V115 I126	L107-A111 PolarHBondContact O-N 3.46Å; L108-A111 PolarHBondContact O-N 3.14Å; A111-I113 PolarHBondContact O-N 2.9Å; A111-S114 PolarHBondContact O-N 2.95Å; A111-V115 WeakPolarHBondContact O-CG2 3.44Å; A111-V115 PolarHBondContact O-N 3.17Å; A111-I126 HydrophobicContact CB-CB 4.34Å; A111-I126 HydrophobicContact CB-CG2 3.96Å
112	V	82.8	Confident	75.2	Confident	93 Å²	93	66.1 Å²	66.1	56%	0.564	36%	0.364	S	S	*	.	H	α-helix	trans	-60.9	-44	175.9	172.2	0	0	0	0	111.3	L108 A109 S110 V115 V116	L108-V112 VanDerWaalsContact O-CG2 3.31Å; L108-V112 WeakPolarHBondContact O-CG2 3.23Å; L108-V112 PolarHBondContact O-N 2.79Å; A109-V112 PolarHBondContact O-N 2.99Å; S110-V112 VanDerWaalsContact C-N 3.32Å; S110-V112 PolarHBondContact O-N 3.36Å; V112-V115 PolarHBondContact O-N 2.97Å; V112-V116 WeakPolarHBondContact O-CG2 3.14Å; V112-V116 PolarHBondContact O-N 3.26Å
113	I	78.9	Confident	75.4	Confident	61 Å²	61	61.6 Å²	61.6	31%	0.313	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-43.3	177.6	-68.7	163.2	0	0	0	110.9	A109 S110 A111 V115 V116 M117 L312 F315	A109-I113 WeakPolarHBondContact O-CD1 3.45Å; A109-I113 VanDerWaalsContact O-CG1 3.26Å; A109-I113 WeakPolarHBondContact O-CG1 3.41Å; A109-I113 PolarHBondContact O-N 2.51Å; S110-I113 PolarHBondContact O-N 2.7Å; A111-I113 PolarHBondContact O-N 2.9Å; I113-V115 VanDerWaalsContact C-N 3.32Å; I113-V115 PolarHBondContact O-N 3.38Å; I113-V116 WeakPolarHBondContact O-CB 3.43Å; I113-V116 PolarHBondContact O-N 3.38Å; I113-M117 WeakPolarHBondContact O-CG 3.38Å; I113-M117 PolarHBondContact O-N 3.06Å; I113-L312 HydrophobicContact CG2-CD2 4.43Å; I113-F315 HydrophobicContact CD1-CD1 4.37Å; I113-F315 HydrophobicContact CD1-CE1 3.44Å; I113-F315 VanDerWaalsContact CD1-CE1 3.44Å; I113-F315 HydrophobicContact CD1-CE2 4.45Å; I113-F315 HydrophobicContact CD1-CZ 3.48Å; I113-F315 VanDerWaalsContact CD1-CZ 3.48Å; I113-F315 HydrophobicContact CG2-CE1 4.49Å
114	S	74.9	Confident	76.1	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-36.6	175.8	-65.8	0	0	0	0	112.8	S110 A111 M117 H118 Q119	S110-S114 PolarHBondContact O-N 2.88Å; S110-S114 PolarHBondContact O-OG 2.78Å; A111-S114 PolarHBondContact O-N 2.95Å; S114-M117 PolarHBondContact O-N 3.1Å; S114-H118 PolarHBondContact O-N 3.09Å; S114-Q119 PolarHBondContact O-N 3.24Å; S114-Q119 VanDerWaalsContact O-N 3.09Å
115	V	81.7	Confident	75.9	Confident	75 Å²	75	67.6 Å²	67.6	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-46.1	172.7	174.7	0	0	0	0	111.2	A111 V112 I113 M117 H118 A123	A111-V115 WeakPolarHBondContact O-CG2 3.44Å; A111-V115 PolarHBondContact O-N 3.17Å; V112-V115 PolarHBondContact O-N 2.97Å; I113-V115 VanDerWaalsContact C-N 3.32Å; I113-V115 PolarHBondContact O-N 3.38Å; V115-M117 PolarHBondContact O-N 2.82Å; V115-H118 PolarHBondContact O-N 3.15Å; V115-A123 HydrophobicContact CG2-CB 3.48Å; V115-A123 VanDerWaalsContact CG2-CB 3.48Å
116	V	83	Confident	75.7	Confident	110 Å²	110	65.2 Å²	65.2	67%	0.667	36%	0.358	S	S	*	.	H	α-helix	trans	-59.5	-29.3	178.2	171.6	0	0	0	0	111.5	V112 I113 H118	V112-V116 WeakPolarHBondContact O-CG2 3.14Å; V112-V116 PolarHBondContact O-N 3.26Å; I113-V116 WeakPolarHBondContact O-CB 3.43Å; I113-V116 PolarHBondContact O-N 3.38Å; V116-H118 VanDerWaalsContact C-N 3.33Å
117	M	73.4	Confident	76.2	Confident	73 Å²	73	65.5 Å²	65.5	36%	0.36	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	0.9	178.3	-74.9	-141.8	72.5	0	0	115.6	I113 S114 V115 Q119 L312	I113-M117 WeakPolarHBondContact O-CG 3.38Å; I113-M117 PolarHBondContact O-N 3.06Å; S114-M117 PolarHBondContact O-N 3.1Å; V115-M117 PolarHBondContact O-N 2.82Å; M117-Q119 PolarHBondContact O-N 3.3Å; M117-L312 HydrophobicContact CE-CD1 3.17Å; M117-L312 HydrophobicContact CE-CD2 4.41Å; M117-L312 HydrophobicContact CE-CG 4.23Å; M117-L312 HydrophobicContact CG-CD2 4.41Å; M117-L312 HydrophobicContact SD-CB 4.03Å; M117-L312 HydrophobicContact SD-CD1 3.23Å; M117-L312 WeakPolarHBondContact SD-CD1 3.35Å; M117-L312 HydrophobicContact SD-CD2 3.29Å; M117-L312 WeakPolarHBondContact SD-CD2 3.12Å; M117-L312 HydrophobicContact SD-CG 3.62Å
118	H	76.8	Confident	76.6	Confident	168 Å²	168	67.9 Å²	67.9	78%	0.778	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	19.7	-172.1	-62.9	-69.9	0	0	0	114.9	S114 V115 V116 L120	S114-H118 PolarHBondContact O-N 3.09Å; V115-H118 PolarHBondContact O-N 3.15Å; V116-H118 VanDerWaalsContact C-N 3.33Å; H118-L120 PolarHBondContact O-N 3.42Å
119	Q	75.1	Confident	76.1	Confident	79 Å²	79	66.1 Å²	66.1	37%	0.369	37%	0.371	S	S	.	.			trans	-92	74.5	171	-72.1	176.2	-39.9	0	0	109.3	S114 M117 D121 D122 A123	S114-Q119 PolarHBondContact O-N 3.24Å; S114-Q119 VanDerWaalsContact O-N 3.09Å; M117-Q119 PolarHBondContact O-N 3.3Å; Q119-D121 VanDerWaalsContact C-N 3.32Å; Q119-D121 PolarHBondContact O-N 3.06Å; Q119-D122 HydrophobicContact CB-CB 4.48Å; Q119-A123 PolarHBondContact O-N 3.33Å
120	L	77.7	Confident	76.1	Confident	97 Å²	97	64.3 Å²	64.3	51%	0.508	36%	0.355	S	S	.	.	H	α-helix	trans	-66.7	-33.5	-174.5	-63.9	179.7	0	0	0	112.6	H118 D122 A123 I124	H118-L120 PolarHBondContact O-N 3.42Å; L120-D122 PolarHBondContact O-N 3.48Å; L120-A123 PolarHBondContact O-N 3.43Å; L120-I124 HydrophobicContact CB-CD1 4.49Å; L120-I124 WeakPolarHBondContact O-CB 3.36Å; L120-I124 WeakPolarHBondContact O-CD1 3.27Å; L120-I124 WeakPolarHBondContact O-CG1 3.48Å; L120-I124 PolarHBondContact O-N 2.79Å
121	D	71.3	Confident	76.7	Confident	132 Å²	132	68.2 Å²	68.2	71%	0.706	38%	0.375	S	S	*	.	H	α-helix	trans	-63.4	-42.6	-179	-60.2	-36.4	0	0	0	111.8	Q119 S125	Q119-D121 VanDerWaalsContact C-N 3.32Å; Q119-D121 PolarHBondContact O-N 3.06Å; D121-S125 WeakPolarHBondContact O-CB 3.25Å; D121-S125 PolarHBondContact O-N 2.76Å; D121-S125 VanDerWaalsContact O-N 3.11Å; D121-S125 PolarHBondContact O-OG 3.44Å
122	D	65.3	Low	76.6	Confident	77 Å²	77	72.5 Å²	72.5	41%	0.412	40%	0.396	S	S	.	.	H	α-helix	trans	-70.2	-42.8	177.6	-65.4	-22.8	0	0	0	111.4	Q119 L120 I124 S125 I126	Q119-D122 HydrophobicContact CB-CB 4.48Å; L120-D122 PolarHBondContact O-N 3.48Å; D122-I124 PolarHBondContact O-N 2.82Å; D122-S125 PolarHBondContact O-N 2.98Å; D122-I126 VanDerWaalsContact O-CG1 3.26Å; D122-I126 WeakPolarHBondContact O-CG1 3.46Å; D122-I126 PolarHBondContact O-N 2.99Å
123	A	73.4	Confident	76.1	Confident	3 Å²	3	69.6 Å²	69.6	3%	0.025	38%	0.378	C	S	.	.	H	α-helix	trans	-63.1	-42.6	179.2	0	0	0	0	0	112.8	V115 Q119 L120 T127	V115-A123 HydrophobicContact CG2-CB 3.48Å; V115-A123 VanDerWaalsContact CG2-CB 3.48Å; Q119-A123 PolarHBondContact O-N 3.33Å; L120-A123 PolarHBondContact O-N 3.43Å; A123-T127 WeakPolarHBondContact O-CB 3.29Å; A123-T127 PolarHBondContact O-N 3Å; A123-T127 PolarHBondContact O-OG1 2.79Å
124	I	79.9	Confident	76.2	Confident	105 Å²	105	66.8 Å²	66.8	54%	0.538	36%	0.364	S	S	.	.	H	α-helix	trans	-65.8	-44.8	177.2	-68	164	0	0	0	109.8	L120 D122 I126 T127 V128	L120-I124 HydrophobicContact CB-CD1 4.49Å; L120-I124 WeakPolarHBondContact O-CB 3.36Å; L120-I124 WeakPolarHBondContact O-CD1 3.27Å; L120-I124 WeakPolarHBondContact O-CG1 3.48Å; L120-I124 PolarHBondContact O-N 2.79Å; D122-I124 PolarHBondContact O-N 2.82Å; I124-I126 PolarHBondContact O-N 2.94Å; I124-T127 PolarHBondContact O-N 2.81Å; I124-V128 HydrophobicContact CG2-CG2 4.34Å; I124-V128 WeakPolarHBondContact O-CG2 3.45Å; I124-V128 PolarHBondContact O-N 3.02Å
125	S	70.2	Confident	76.5	Confident	64 Å²	64	69.2 Å²	69.2	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-59.8	-45.9	179.1	-60	0	0	0	0	112.3	D121 D122 A129	D121-S125 WeakPolarHBondContact O-CB 3.25Å; D121-S125 PolarHBondContact O-N 2.76Å; D121-S125 VanDerWaalsContact O-N 3.11Å; D121-S125 PolarHBondContact O-OG 3.44Å; D122-S125 PolarHBondContact O-N 2.98Å; S125-A129 WeakPolarHBondContact O-CB 3.15Å; S125-A129 PolarHBondContact O-N 2.98Å
126	I	72.9	Confident	76.1	Confident	42 Å²	42	68.5 Å²	68.5	22%	0.215	37%	0.374	C	S	.	.	H	α-helix	trans	-64.1	-45	177.4	-65.7	164.8	0	0	0	110.8	A111 D122 I124 V128 A129 I130	A111-I126 HydrophobicContact CB-CB 4.34Å; A111-I126 HydrophobicContact CB-CG2 3.96Å; D122-I126 VanDerWaalsContact O-CG1 3.26Å; D122-I126 WeakPolarHBondContact O-CG1 3.46Å; D122-I126 PolarHBondContact O-N 2.99Å; I124-I126 PolarHBondContact O-N 2.94Å; I126-V128 PolarHBondContact O-N 3.11Å; I126-A129 PolarHBondContact O-N 3Å; I126-I130 HydrophobicContact CG2-CD1 3.94Å; I126-I130 HydrophobicContact CG2-CG1 4.44Å; I126-I130 VanDerWaalsContact O-CG1 3.31Å; I126-I130 WeakPolarHBondContact O-CG1 3.03Å; I126-I130 PolarHBondContact O-N 3.29Å
127	T	80.4	Confident	75.3	Confident	56 Å²	56	64.1 Å²	64.1	34%	0.344	35%	0.35	S	S	.	.	H	α-helix	trans	-63.6	-42.4	-178.2	-55.4	0	0	0	0	111.7	A123 I124 I130 I131	A123-T127 WeakPolarHBondContact O-CB 3.29Å; A123-T127 PolarHBondContact O-N 3Å; A123-T127 PolarHBondContact O-OG1 2.79Å; I124-T127 PolarHBondContact O-N 2.81Å; T127-I130 PolarHBondContact O-N 3.43Å; T127-I131 HydrophobicContact CG2-CD1 4.31Å; T127-I131 WeakPolarHBondContact O-CG1 3.3Å; T127-I131 PolarHBondContact O-N 2.98Å; T127-I131 VanDerWaalsContact O-N 3.12Å
128	V	80.4	Confident	75.6	Confident	75 Å²	75	62.5 Å²	62.5	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-64.3	-42.2	176.2	171.6	0	0	0	0	110.9	I124 I126 I130 I131 I132	I124-V128 HydrophobicContact CG2-CG2 4.34Å; I124-V128 WeakPolarHBondContact O-CG2 3.45Å; I124-V128 PolarHBondContact O-N 3.02Å; I126-V128 PolarHBondContact O-N 3.11Å; V128-I130 PolarHBondContact O-N 3.44Å; V128-I131 PolarHBondContact O-N 3.11Å; V128-I132 HydrophobicContact CG1-CD1 3.9Å; V128-I132 WeakPolarHBondContact O-CG1 3.34Å; V128-I132 PolarHBondContact O-N 3.21Å; V128-I132 VanDerWaalsContact O-N 3.08Å
129	A	70.4	Confident	75.6	Confident	22 Å²	22	58.2 Å²	58.2	18%	0.182	33%	0.327	C	S	.	.	H	α-helix	trans	-59.7	-45.3	176.1	0	0	0	0	0	111.9	S125 I126 I131 I132 V133 L755	S125-A129 WeakPolarHBondContact O-CB 3.15Å; S125-A129 PolarHBondContact O-N 2.98Å; I126-A129 PolarHBondContact O-N 3Å; A129-I131 PolarHBondContact O-N 2.89Å; A129-I132 PolarHBondContact O-N 3.03Å; A129-V133 VanDerWaalsContact O-CG2 3.31Å; A129-V133 WeakPolarHBondContact O-CG2 3.17Å; A129-V133 PolarHBondContact O-N 2.75Å; A129-L755 HydrophobicContact CB-CD2 4.06Å
130	I	78.8	Confident	74.9	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.041	32%	0.324	C	S	.	.	H	α-helix	trans	-59.2	-47	177.3	-65.7	164.9	0	0	0	111.1	F99 I104 L107 L108 I126 T127 V128 I132 V133 V134	F99-I130 HydrophobicContact CE1-CG2 4.4Å; I104-I130 HydrophobicContact CG2-CG2 3.92Å; L107-I130 HydrophobicContact CB-CD1 3.65Å; L107-I130 HydrophobicContact CB-CG1 3.95Å; L107-I130 HydrophobicContact CD1-CG1 4.25Å; L108-I130 HydrophobicContact CD2-CD1 4.08Å; L108-I130 HydrophobicContact CG-CD1 4.12Å; I126-I130 HydrophobicContact CG2-CD1 3.94Å; I126-I130 HydrophobicContact CG2-CG1 4.44Å; I126-I130 VanDerWaalsContact O-CG1 3.31Å; I126-I130 WeakPolarHBondContact O-CG1 3.03Å; I126-I130 PolarHBondContact O-N 3.29Å; T127-I130 PolarHBondContact O-N 3.43Å; V128-I130 PolarHBondContact O-N 3.44Å; I130-I132 VanDerWaalsContact C-N 3.31Å; I130-I132 PolarHBondContact O-N 3.35Å; I130-V133 PolarHBondContact O-N 3.27Å; I130-V134 HydrophobicContact CG2-CG2 4.15Å; I130-V134 WeakPolarHBondContact O-CB 3.47Å; I130-V134 WeakPolarHBondContact O-CG2 3.48Å; I130-V134 PolarHBondContact O-N 2.79Å
131	I	83.6	Confident	74.4	Confident	84 Å²	84	57.3 Å²	57.3	43%	0.431	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-43.2	-179.4	-68.7	169	0	0	0	110.6	T127 V128 A129 T135	T127-I131 HydrophobicContact CG2-CD1 4.31Å; T127-I131 WeakPolarHBondContact O-CG1 3.3Å; T127-I131 PolarHBondContact O-N 2.98Å; T127-I131 VanDerWaalsContact O-N 3.12Å; V128-I131 PolarHBondContact O-N 3.11Å; A129-I131 PolarHBondContact O-N 2.89Å; I131-T135 VanDerWaalsContact O-CB 3.23Å; I131-T135 WeakPolarHBondContact O-CB 3.2Å; I131-T135 PolarHBondContact O-N 2.93Å; I131-T135 PolarHBondContact O-OG1 3.17Å
132	I	78.7	Confident	74.5	Confident	96 Å²	96	54.8 Å²	54.8	49%	0.492	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-48.9	177.4	-67.4	168.4	0	0	0	110.2	V128 A129 I130 T135 V136	V128-I132 HydrophobicContact CG1-CD1 3.9Å; V128-I132 WeakPolarHBondContact O-CG1 3.34Å; V128-I132 PolarHBondContact O-N 3.21Å; V128-I132 VanDerWaalsContact O-N 3.08Å; A129-I132 PolarHBondContact O-N 3.03Å; I130-I132 VanDerWaalsContact C-N 3.31Å; I130-I132 PolarHBondContact O-N 3.35Å; I132-T135 PolarHBondContact O-N 3.41Å; I132-V136 HydrophobicContact CG2-CG2 4.27Å; I132-V136 WeakPolarHBondContact O-CB 3.35Å; I132-V136 VanDerWaalsContact O-CG2 3.22Å; I132-V136 WeakPolarHBondContact O-CG2 3.36Å; I132-V136 PolarHBondContact O-N 2.91Å
133	V	71.8	Confident	74.6	Confident	31 Å²	31	60 Å²	60	19%	0.188	32%	0.315	C	S	.	.	H	α-helix	trans	-59.4	-50.6	-179.4	170.6	0	0	0	0	111.3	A129 I130 T135 V136 A137 L755 I759	A129-V133 VanDerWaalsContact O-CG2 3.31Å; A129-V133 WeakPolarHBondContact O-CG2 3.17Å; A129-V133 PolarHBondContact O-N 2.75Å; I130-V133 PolarHBondContact O-N 3.27Å; V133-T135 PolarHBondContact O-N 3.25Å; V133-V136 PolarHBondContact O-N 2.7Å; V133-A137 WeakPolarHBondContact O-CB 3.31Å; V133-A137 PolarHBondContact O-N 3.06Å; V133-L755 HydrophobicContact CG2-CD1 4.26Å; V133-I759 HydrophobicContact CG2-CD1 3.89Å
134	V	80.4	Confident	73.9	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-42	-179.8	174.3	0	0	0	0	111.6	Y95 Q98 F99 I104 I130 A137 F138	Y95-V134 HydrophobicContact CE2-CG1 3.96Å; Q98-V134 HydrophobicContact CB-CG1 3.86Å; F99-V134 HydrophobicContact CD2-CG1 4.3Å; F99-V134 HydrophobicContact CE1-CG2 4.26Å; F99-V134 HydrophobicContact CE2-CG1 3.74Å; F99-V134 HydrophobicContact CZ-CB 4.33Å; F99-V134 HydrophobicContact CZ-CG1 3.89Å; F99-V134 HydrophobicContact CZ-CG2 4.35Å; I104-V134 HydrophobicContact CD1-CG2 3.54Å; I104-V134 HydrophobicContact CG1-CG2 4.27Å; I104-V134 HydrophobicContact CG2-CG2 4.48Å; I130-V134 HydrophobicContact CG2-CG2 4.15Å; I130-V134 WeakPolarHBondContact O-CB 3.47Å; I130-V134 WeakPolarHBondContact O-CG2 3.48Å; I130-V134 PolarHBondContact O-N 2.79Å; V134-A137 PolarHBondContact O-N 2.78Å; V134-F138 WeakPolarHBondContact O-CB 3.2Å; V134-F138 PolarHBondContact O-N 2.78Å
135	T	81.8	Confident	73.3	Confident	54 Å²	54	59.7 Å²	59.7	33%	0.331	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-44.3	179.2	-55.6	0	0	0	0	111	Y95 I131 I132 V133 F138 V139	Y95-T135 PolarHBondContact OH-OG1 3.38Å; I131-T135 VanDerWaalsContact O-CB 3.23Å; I131-T135 WeakPolarHBondContact O-CB 3.2Å; I131-T135 PolarHBondContact O-N 2.93Å; I131-T135 PolarHBondContact O-OG1 3.17Å; I132-T135 PolarHBondContact O-N 3.41Å; V133-T135 PolarHBondContact O-N 3.25Å; T135-F138 PolarHBondContact O-N 3.21Å; T135-V139 HydrophobicContact CG2-CG2 4.33Å; T135-V139 WeakPolarHBondContact O-CB 3.26Å; T135-V139 VanDerWaalsContact O-CG2 3.24Å; T135-V139 WeakPolarHBondContact O-CG2 3.42Å; T135-V139 PolarHBondContact O-N 2.86Å
136	V	72.1	Confident	72.9	Confident	60 Å²	60	61 Å²	61	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-45.4	177.5	170.4	0	0	0	0	110.5	I132 V133 V139 Q140	I132-V136 HydrophobicContact CG2-CG2 4.27Å; I132-V136 WeakPolarHBondContact O-CB 3.35Å; I132-V136 VanDerWaalsContact O-CG2 3.22Å; I132-V136 WeakPolarHBondContact O-CG2 3.36Å; I132-V136 PolarHBondContact O-N 2.91Å; V133-V136 PolarHBondContact O-N 2.7Å; V136-V139 PolarHBondContact O-N 2.81Å; V136-Q140 HydrophobicContact CG1-CG 4.35Å; V136-Q140 WeakPolarHBondContact O-CB 3.32Å; V136-Q140 WeakPolarHBondContact O-CG 3.48Å; V136-Q140 PolarHBondContact O-N 3.37Å
137	A	67.2	Low	72	Confident	19 Å²	19	62.4 Å²	62.4	16%	0.157	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-50	176.6	0	0	0	0	0	111.6	V133 V134 V139 Q140 E141 I332	V133-A137 WeakPolarHBondContact O-CB 3.31Å; V133-A137 PolarHBondContact O-N 3.06Å; V134-A137 PolarHBondContact O-N 2.78Å; A137-V139 PolarHBondContact O-N 2.81Å; A137-Q140 PolarHBondContact O-N 3.4Å; A137-E141 WeakPolarHBondContact O-CB 3.41Å; A137-E141 PolarHBondContact O-N 3.01Å; A137-I332 HydrophobicContact CB-CD1 4.35Å
138	F	79.4	Confident	70.8	Confident	38 Å²	38	61.7 Å²	61.7	17%	0.167	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-45.9	177.9	173.9	-101.3	0	0	0	112.7	K94 Y95 V134 T135 Q140 E141 Y142	K94-F138 HydrophobicContact CB-CE2 4.23Å; Y95-F138 HydrophobicContact CD2-CB 3.89Å; Y95-F138 AromaticContact CD2-CD1 3.87Å; Y95-F138 HydrophobicContact CD2-CD1 3.87Å; Y95-F138 AromaticContact CD2-CD2 3.96Å; Y95-F138 HydrophobicContact CD2-CD2 3.96Å; Y95-F138 HydrophobicContact CD2-CE1 4.4Å; Y95-F138 HydrophobicContact CD2-CE2 4.48Å; Y95-F138 AromaticContact CD2-CG 3.62Å; Y95-F138 HydrophobicContact CD2-CG 3.62Å; Y95-F138 HydrophobicContact CE2-CB 4.22Å; Y95-F138 HydrophobicContact CE2-CD1 4.45Å; Y95-F138 HydrophobicContact CE2-CG 4.33Å; V134-F138 WeakPolarHBondContact O-CB 3.2Å; V134-F138 PolarHBondContact O-N 2.78Å; T135-F138 PolarHBondContact O-N 3.21Å; F138-Q140 VanDerWaalsContact C-N 3.32Å; F138-Q140 PolarHBondContact O-N 2.97Å; F138-E141 PolarHBondContact O-N 2.83Å; F138-Y142 VanDerWaalsContact O-CB 3.24Å; F138-Y142 WeakPolarHBondContact O-CB 3.47Å; F138-Y142 PolarHBondContact O-N 3.29Å
139	V	76.3	Confident	69.8	Low	79 Å²	79	63.3 Å²	63.3	48%	0.479	32%	0.321	S	S	.	.	H	α-helix	trans	-63.8	-39.7	179.6	168.9	0	0	0	0	111.1	T135 V136 A137 R143	T135-V139 HydrophobicContact CG2-CG2 4.33Å; T135-V139 WeakPolarHBondContact O-CB 3.26Å; T135-V139 VanDerWaalsContact O-CG2 3.24Å; T135-V139 WeakPolarHBondContact O-CG2 3.42Å; T135-V139 PolarHBondContact O-N 2.86Å; V136-V139 PolarHBondContact O-N 2.81Å; A137-V139 PolarHBondContact O-N 2.81Å; V139-R143 VanDerWaalsContact O-CB 3.27Å; V139-R143 WeakPolarHBondContact O-CB 3.27Å; V139-R143 PolarHBondContact O-N 2.59Å
140	Q	61.9	Low	68.9	Low	67 Å²	67	69 Å²	69	31%	0.313	34%	0.343	S	S	.	.	H	α-helix	trans	-67.8	-39.7	178.4	-74	173.2	-9.5	0	0	112.1	V136 A137 F138 S144 I332	V136-Q140 HydrophobicContact CG1-CG 4.35Å; V136-Q140 WeakPolarHBondContact O-CB 3.32Å; V136-Q140 WeakPolarHBondContact O-CG 3.48Å; V136-Q140 PolarHBondContact O-N 3.37Å; A137-Q140 PolarHBondContact O-N 3.4Å; F138-Q140 VanDerWaalsContact C-N 3.32Å; F138-Q140 PolarHBondContact O-N 2.97Å; Q140-S144 WeakPolarHBondContact O-CB 3.46Å; Q140-S144 PolarHBondContact O-N 3.08Å; Q140-S144 PolarHBondContact O-OG 2.92Å; Q140-I332 HydrophobicContact CB-CG2 4.25Å
141	E	67.1	Low	67.4	Low	90 Å²	90	72.9 Å²	72.9	42%	0.421	36%	0.364	S	S	.	.	H	α-helix	trans	-67.9	-51.7	175.5	-171.3	167.4	-157.3	0	0	111.4	Q98 A137 F138 R143 S144 E145	Q98-E141 PolarHBondContact NE2-OE2 3.19Å; A137-E141 WeakPolarHBondContact O-CB 3.41Å; A137-E141 PolarHBondContact O-N 3.01Å; F138-E141 PolarHBondContact O-N 2.83Å; E141-R143 PolarHBondContact O-N 3.1Å; E141-S144 WeakPolarHBondContact O-CB 3.33Å; E141-S144 PolarHBondContact O-N 2.95Å; E141-E145 PolarHBondContact O-N 3.37Å
142	Y	71.8	Confident	65.3	Low	78 Å²	78	71.6 Å²	71.6	31%	0.306	37%	0.372	S	S	.	.	H	α-helix	trans	-57.8	-44.1	179.8	176.4	-106.1	0	0	0	112.9	L91 F138 S144 E145 K146	L91-Y142 HydrophobicContact CD1-CE2 4.39Å; L91-Y142 HydrophobicContact CD2-CD2 3.81Å; L91-Y142 HydrophobicContact CD2-CE2 3.61Å; F138-Y142 VanDerWaalsContact O-CB 3.24Å; F138-Y142 WeakPolarHBondContact O-CB 3.47Å; F138-Y142 PolarHBondContact O-N 3.29Å; Y142-S144 VanDerWaalsContact C-N 3.26Å; Y142-S144 PolarHBondContact O-N 2.99Å; Y142-E145 PolarHBondContact O-N 3.29Å; Y142-K146 HydrophobicContact CE1-CD 4.12Å; Y142-K146 WeakPolarHBondContact O-CB 3.19Å; Y142-K146 PolarHBondContact O-N 2.73Å; Y142-K146 PolarHBondContact OH-NZ 3.02Å
143	R	68.3	Low	63.6	Low	187 Å²	187	74.8 Å²	74.8	71%	0.706	38%	0.382	S	S	*	.	H	α-helix	trans	-65.2	-34.2	179.1	-172.6	178.3	-178.1	-177.7	1.7	111.9	V139 E141 S147	V139-R143 VanDerWaalsContact O-CB 3.27Å; V139-R143 WeakPolarHBondContact O-CB 3.27Å; V139-R143 PolarHBondContact O-N 2.59Å; E141-R143 PolarHBondContact O-N 3.1Å; R143-S147 PolarHBondContact O-N 3.28Å; R143-S147 PolarHBondContact O-OG 3.35Å
144	S	59.3	Low	62.4	Low	20 Å²	20	78.9 Å²	78.9	14%	0.14	40%	0.402	C	S	.	.	H	α-helix	trans	-68.4	-45.5	177.2	-58.3	0	0	0	0	110.6	Q140 E141 Y142	Q140-S144 WeakPolarHBondContact O-CB 3.46Å; Q140-S144 PolarHBondContact O-N 3.08Å; Q140-S144 PolarHBondContact O-OG 2.92Å; E141-S144 WeakPolarHBondContact O-CB 3.33Å; E141-S144 PolarHBondContact O-N 2.95Å; Y142-S144 VanDerWaalsContact C-N 3.26Å; Y142-S144 PolarHBondContact O-N 2.99Å
145	E	66	Low	60.5	Low	81 Å²	81	85.3 Å²	85.3	38%	0.379	44%	0.441	S	S	.	.	H	α-helix	trans	-62	-49	176.9	-70	-172.7	159.6	0	0	112.6	K94 E141 Y142 S147 L148 E149	K94-E145 IonicContact NZ-OE1 2.71Å; K94-E145 IonicContact NZ-OE2 2.87Å; K94-E145 PolarHBondContact NZ-OE2 3.31Å; E141-E145 PolarHBondContact O-N 3.37Å; Y142-E145 PolarHBondContact O-N 3.29Å; E145-S147 VanDerWaalsContact C-N 3.26Å; E145-S147 PolarHBondContact O-N 2.92Å; E145-L148 WeakPolarHBondContact O-CB 3.47Å; E145-L148 PolarHBondContact O-N 2.82Å; E145-E149 PolarHBondContact O-N 2.86Å; E145-E149 VanDerWaalsContact O-N 3.12Å
146	K	62.9	Low	59.2	Low	91 Å²	91	85.7 Å²	85.7	40%	0.396	44%	0.444	S	S	.	.	H	α-helix	trans	-61.2	-34.1	-176.1	-170.3	172.4	-170	166.6	0	113.5	Y142 L148 E149 E150	Y142-K146 HydrophobicContact CE1-CD 4.12Å; Y142-K146 WeakPolarHBondContact O-CB 3.19Å; Y142-K146 PolarHBondContact O-N 2.73Å; Y142-K146 PolarHBondContact OH-NZ 3.02Å; K146-L148 PolarHBondContact O-N 2.82Å; K146-E149 PolarHBondContact O-N 3.01Å; K146-E150 PolarHBondContact O-N 3.27Å
147	S	54.1	Low	59.1	Low	73 Å²	73	86.7 Å²	86.7	51%	0.51	45%	0.452	S	S	.	.	H	α-helix	trans	-68.4	-23.2	178.2	-54.7	0	0	0	0	112.5	R143 E145	R143-S147 PolarHBondContact O-N 3.28Å; R143-S147 PolarHBondContact O-OG 3.35Å; E145-S147 VanDerWaalsContact C-N 3.26Å; E145-S147 PolarHBondContact O-N 2.92Å
148	L	54.1	Low	59.7	Low	41 Å²	41	91.8 Å²	91.8	22%	0.215	47%	0.473	C	S	.	.	H	α-helix	trans	-85.9	-36.2	174.6	-87.9	133.6	0	0	0	112.4	E145 K146 E150 L151 L355	E145-L148 WeakPolarHBondContact O-CB 3.47Å; E145-L148 PolarHBondContact O-N 2.82Å; K146-L148 PolarHBondContact O-N 2.82Å; L148-E150 VanDerWaalsContact C-N 3.29Å; L148-E150 PolarHBondContact O-N 3.04Å; L148-L151 WeakPolarHBondContact O-CB 3.25Å; L148-L151 PolarHBondContact O-N 3.09Å; L148-L151 VanDerWaalsContact O-N 3.1Å; L148-L355 HydrophobicContact CD1-CD1 3.84Å; L148-L355 HydrophobicContact CD1-CD2 3.74Å; L148-L355 HydrophobicContact CD1-CG 3.78Å; L148-L355 HydrophobicContact CD2-CD2 4.35Å
149	E	60.5	Low	60	Low	109 Å²	109	90.4 Å²	90.4	51%	0.509	47%	0.468	S	S	.	.	H	α-helix	trans	-61.2	-36.4	-178.1	-161.1	-168.8	152.7	0	0	112.5	E145 K146 L151 G152	E145-E149 PolarHBondContact O-N 2.86Å; E145-E149 VanDerWaalsContact O-N 3.12Å; K146-E149 PolarHBondContact O-N 3.01Å; E149-L151 PolarHBondContact O-N 3.23Å; E149-G152 PolarHBondContact O-N 3.16Å; E149-G152 VanDerWaalsContact O-N 3.14Å
150	E	50.3	Low	60.6	Low	140 Å²	140	89 Å²	89	65%	0.654	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.6	177.6	-69.8	-171.9	174.3	0	0	113.6	K146 L148	K146-E150 PolarHBondContact O-N 3.27Å; L148-E150 VanDerWaalsContact C-N 3.29Å; L148-E150 PolarHBondContact O-N 3.04Å
151	L	48.2	Very low	62	Low	90 Å²	90	85.8 Å²	85.8	47%	0.471	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-11.9	177.6	-67.9	166	0	0	0	113.2	L148 E149	L148-L151 WeakPolarHBondContact O-CB 3.25Å; L148-L151 PolarHBondContact O-N 3.09Å; L148-L151 VanDerWaalsContact O-N 3.1Å; E149-L151 PolarHBondContact O-N 3.23Å
152	G	40	Very low	63.1	Low	58 Å²	58	82.4 Å²	82.4	60%	0.598	43%	0.425	S	S	*	.			trans	-99.7	-1.1	-172.2	0	0	0	0	0	116.2	E149 L154	E149-G152 PolarHBondContact O-N 3.16Å; E149-G152 VanDerWaalsContact O-N 3.14Å; G152-L154 PolarHBondContact O-N 3.21Å; G152-L154 VanDerWaalsContact O-N 3.1Å
153	K	42.6	Very low	64	Low	163 Å²	163	79 Å²	79	71%	0.709	41%	0.412	S	S	*	.			trans	-77.2	100.3	-175.9	-66.1	-176.9	-178.6	178	0	111.1
154	L	46.2	Very low	64.9	Low	116 Å²	116	74.7 Å²	74.7	61%	0.607	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-80.4	139	169.3	-68.6	167	0	0	0	110	G152	G152-L154 PolarHBondContact O-N 3.21Å; G152-L154 VanDerWaalsContact O-N 3.1Å
155	V	41.1	Very low	66	Low	137 Å²	137	76.1 Å²	76.1	83%	0.83	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-75.9	126.9	174.7	179.1	0	0	0	0	108.5
156	P	54.7	Low	66.8	Low	62 Å²	62	78.8 Å²	78.8	40%	0.403	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-67.8	142.7	178.8	25.4	-31.8	0	0	0	111.3	L171	P156-L171 HydrophobicContact CG-CD2 4.22Å
157	P	68.3	Low	67.9	Low	81 Å²	81	79.8 Å²	79.8	53%	0.526	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-72.9	147.9	-179.6	27.4	-31.5	0	0	0	112.4	A172	P157-A172 HydrophobicContact CG-CB 3.99Å; P157-A172 VanDerWaalsContact O-CB 3.28Å; P157-A172 WeakPolarHBondContact O-CB 3.47Å; P157-A172 PolarHBondContact O-N 3.22Å
158	E	80.6	Confident	69.5	Low	126 Å²	126	79.8 Å²	79.8	59%	0.589	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	156.8	174.9	-64.5	176	148.2	0	0	110.8	H169 L171	E158-H169 IonicContact OE1-CE1 3.14Å; E158-H169 IonicContact OE2-CE1 3.06Å; E158-H169 PolarHBondContact OE2-CE1 2.9Å; E158-H169 IonicContact OE2-NE2 3.69Å; E158-L171 HydrophobicContact CG-CD2 4.06Å
159	C	86.7	Confident	70.9	Confident	9 Å²	9	83 Å²	83	6%	0.061	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	163.6	178.9	71.4	0	0	0	0	113.1	L170 P190	C159-L170 PolarHBondContact N-O 3Å; C159-L170 PolarHBondContact O-N 2.79Å; C159-L170 VanDerWaalsContact O-O 3.12Å; C159-L170 VanDerWaalsContact SG-CD1 3.53Å; C159-P190 HydrophobicContact CB-CB 3.79Å; C159-P190 HydrophobicContact CB-CG 3.82Å
160	H	88.8	Confident	72.2	Confident	50 Å²	50	78.8 Å²	78.8	23%	0.231	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.8	177.3	-59.1	144.8	0	0	0	110.8	L167 E168 H169 C182 E187	H160-L167 HydrophobicContact CB-CD1 4.28Å; H160-E168 WeakPolarHBondContact CA-O 3.17Å; H160-H169 AromaticContact CD2-CD2 3.38Å; H160-H169 PolarHBondContact CD2-CD2 2.77Å; H160-H169 AromaticContact NE2-CD2 3.19Å; H160-H169 PolarHBondContact NE2-CD2 3.06Å; H160-H169 AromaticContact NE2-NE2 3.87Å; H160-C182 HydrophobicContact CB-CB 4.39Å; H160-C182 PolarHBondContact O-N 3.38Å; H160-E187 IonicContact CE1-OE1 2.79Å; H160-E187 PolarHBondContact CE1-OE1 3.39Å; H160-E187 IonicContact ND1-OE1 3.8Å; H160-E187 PolarHBondContact ND1-OE1 3.46Å
161	C	91.5	Very high	74	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	158.8	175.7	73.6	0	0	0	0	112	L167 E168 L170 L175 T180	C161-L167 CarbonylContact O-C 3.54Å; C161-L167 WeakPolarHBondContact O-CA 3.48Å; C161-E168 PolarHBondContact N-O 3.1Å; C161-E168 PolarHBondContact O-N 3Å; C161-L170 WeakPolarHBondContact SG-CD2 3.31Å; C161-L175 HydrophobicContact CB-CD2 4.21Å; C161-T180 CarbonylContact C-O 3.47Å; C161-T180 VanDerWaalsContact CA-O 3.23Å; C161-T180 WeakPolarHBondContact CA-O 3.33Å
162	I	90.1	Very high	75.7	Confident	18 Å²	18	71.2 Å²	71.2	9%	0.092	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.5	170.9	-55.5	176.5	0	0	0	107.9	G65 Q166 L167 T180 K249	G65-I162 WeakPolarHBondContact CA-O 3.33Å; I162-Q166 VanDerWaalsContact CA-O 3.31Å; I162-Q166 WeakPolarHBondContact CA-O 3.39Å; I162-L167 HydrophobicContact CG1-CD1 3.98Å; I162-T180 HydrophobicContact CB-CG2 4.21Å; I162-T180 HydrophobicContact CD1-CG2 3.97Å; I162-T180 HydrophobicContact CG1-CG2 4.3Å; I162-T180 PolarHBondContact N-O 2.9Å; I162-K249 HydrophobicContact CD1-CD 4.34Å
163	R	89.9	Confident	78	Confident	6 Å²	6	72.6 Å²	72.6	2%	0.023	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.5	173.8	-72.1	-179	177.5	168.1	3.6	109.3	A64 L66 G165 Q166 D174 D179	A64-R163 CarbonylContact O-C 3.56Å; L66-R163 WeakPolarHBondContact O-CA 3.49Å; L66-R163 WeakPolarHBondContact O-CB 3.47Å; R163-G165 PolarHBondContact O-N 3.31Å; R163-Q166 PolarHBondContact N-O 3.02Å; R163-Q166 PolarHBondContact O-N 3.23Å; R163-Q166 VanDerWaalsContact O-O 3.12Å; R163-D174 PolarHBondContact NH2-O 2.92Å; R163-D179 IonicContact CZ-OD1 3.91Å; R163-D179 IonicContact CZ-OD2 3.71Å; R163-D179 IonicContact NE-OD1 3.63Å; R163-D179 PolarHBondContact NE-OD1 2.86Å; R163-D179 VanDerWaalsContact NE-OD1 3.15Å; R163-D179 IonicContact NE-OD2 2.59Å; R163-D179 IonicContact NH2-OD1 3.74Å; R163-D179 IonicContact NH2-OD2 3.68Å; R163-D179 PolarHBondContact NH2-OD2 2.95Å
164	D	86.4	Confident	80.2	Confident	97 Å²	97	66.5 Å²	66.5	52%	0.519	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	33.1	-176.5	-67	-51.4	0	0	0	114.1	A64 L66 T67 Q68 Q166	A64-D164 PolarHBondContact O-N 2.8Å; L66-D164 PolarHBondContact O-N 2.92Å; L66-D164 VanDerWaalsContact O-N 3.11Å; T67-D164 WeakPolarHBondContact CA-OD1 3.45Å; T67-D164 WeakPolarHBondContact CB-OD1 3.39Å; T67-D164 WeakPolarHBondContact CG2-OD1 3.22Å; Q68-D164 PolarHBondContact N-OD2 2.92Å; D164-Q166 VanDerWaalsContact C-N 3.27Å; D164-Q166 PolarHBondContact O-N 3.37Å
165	G	82.4	Confident	82.3	Confident	50 Å²	50	61 Å²	61	52%	0.515	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	4.6	-178.3	0	0	0	0	0	115.5	A64 R163	A64-G165 PolarHBondContact O-N 3.48Å; R163-G165 PolarHBondContact O-N 3.31Å
166	Q	84.6	Confident	84.7	Confident	137 Å²	137	54.5 Å²	54.5	64%	0.64	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	145.1	178	-60.5	-164.5	5.1	0	0	111.6	I162 R163 D164 E168	I162-Q166 VanDerWaalsContact CA-O 3.31Å; I162-Q166 WeakPolarHBondContact CA-O 3.39Å; R163-Q166 PolarHBondContact N-O 3.02Å; R163-Q166 PolarHBondContact O-N 3.23Å; R163-Q166 VanDerWaalsContact O-O 3.12Å; D164-Q166 VanDerWaalsContact C-N 3.27Å; D164-Q166 PolarHBondContact O-N 3.37Å; Q166-E168 PolarHBondContact O-N 3.09Å
167	L	86	Confident	86.5	Confident	113 Å²	113	51.5 Å²	51.5	59%	0.592	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.5	172.4	-171.7	75.2	0	0	0	108.8	H160 C161 I162 C182	H160-L167 HydrophobicContact CB-CD1 4.28Å; C161-L167 CarbonylContact O-C 3.54Å; C161-L167 WeakPolarHBondContact O-CA 3.48Å; I162-L167 HydrophobicContact CG1-CD1 3.98Å; L167-C182 HydrophobicContact CD1-CB 4.23Å
168	E	86.8	Confident	87.5	Confident	72 Å²	72	47.7 Å²	47.7	34%	0.336	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	146.8	177.3	-67.1	-165.3	155	0	0	111.5	H160 C161 Q166 L170	H160-E168 WeakPolarHBondContact CA-O 3.17Å; C161-E168 PolarHBondContact N-O 3.1Å; C161-E168 PolarHBondContact O-N 3Å; Q166-E168 PolarHBondContact O-N 3.09Å; E168-L170 HydrophobicContact CB-CD2 4.46Å
169	H	84.4	Confident	88	Confident	110 Å²	110	41.7 Å²	41.7	51%	0.509	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	114.1	174.5	-175	-77.9	0	0	0	108.9	E158 H160	E158-H169 IonicContact OE1-CE1 3.14Å; E158-H169 IonicContact OE2-CE1 3.06Å; E158-H169 PolarHBondContact OE2-CE1 2.9Å; E158-H169 IonicContact OE2-NE2 3.69Å; H160-H169 AromaticContact CD2-CD2 3.38Å; H160-H169 PolarHBondContact CD2-CD2 2.77Å; H160-H169 AromaticContact NE2-CD2 3.19Å; H160-H169 PolarHBondContact NE2-CD2 3.06Å; H160-H169 AromaticContact NE2-NE2 3.87Å
170	L	87.6	Confident	88.3	Confident	20 Å²	20	41.2 Å²	41.2	11%	0.105	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	164.6	-173.4	53.1	81.7	0	0	0	113	C159 C161 E168 D174 L175	C159-L170 PolarHBondContact N-O 3Å; C159-L170 PolarHBondContact O-N 2.79Å; C159-L170 VanDerWaalsContact O-O 3.12Å; C159-L170 VanDerWaalsContact SG-CD1 3.53Å; C161-L170 WeakPolarHBondContact SG-CD2 3.31Å; E168-L170 HydrophobicContact CB-CD2 4.46Å; L170-D174 HydrophobicContact CD1-CB 4.02Å; L170-L175 HydrophobicContact CD1-CD2 4.02Å; L170-L175 HydrophobicContact CD1-CG 4.34Å
171	L	86.5	Confident	88.5	Confident	65 Å²	65	38.9 Å²	38.9	34%	0.34	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	139.9	176.9	-67.2	169.5	0	0	0	109.7	P156 E158 R173 D174	P156-L171 HydrophobicContact CG-CD2 4.22Å; E158-L171 HydrophobicContact CG-CD2 4.06Å; L171-R173 HydrophobicContact CB-CB 4.36Å; L171-R173 PolarHBondContact O-N 3.02Å; L171-D174 WeakPolarHBondContact O-CB 2.9Å; L171-D174 PolarHBondContact O-N 2.83Å
172	A	85.6	Confident	88.4	Confident	6 Å²	6	39.8 Å²	39.8	5%	0.05	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-56.5	-28.9	178.1	0	0	0	0	0	112.5	N81 P157 D174 L175 P190	N81-A172 WeakPolarHBondContact CB-O 3.46Å; N81-A172 PolarHBondContact ND2-O 3Å; P157-A172 HydrophobicContact CG-CB 3.99Å; P157-A172 VanDerWaalsContact O-CB 3.28Å; P157-A172 WeakPolarHBondContact O-CB 3.47Å; P157-A172 PolarHBondContact O-N 3.22Å; A172-D174 PolarHBondContact O-N 3.1Å; A172-L175 WeakPolarHBondContact O-CB 3.2Å; A172-L175 WeakPolarHBondContact O-CG 3.41Å; A172-L175 PolarHBondContact O-N 3.41Å; A172-P190 HydrophobicContact CB-CB 3.83Å
173	R	87	Confident	88.4	Confident	87 Å²	87	39.1 Å²	39.1	33%	0.328	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-50.8	-35.5	171.7	175.5	-164.5	-178.2	122.4	0.1	113.1	W80 N81 E82 L171 L175	W80-R173 HydrophobicContact CB-CG 4.17Å; W80-R173 HydrophobicContact CD2-CG 4.29Å; W80-R173 HydrophobicContact CE3-CG 3.64Å; W80-R173 VanDerWaalsContact CE3-NE 3.3Å; W80-R173 HydrophobicContact CZ3-CG 4.27Å; N81-R173 PolarHBondContact N-O 2.86Å; E82-R173 VanDerWaalsContact CD-CG 3.49Å; E82-R173 VanDerWaalsContact CD-NH1 3.25Å; E82-R173 HydrophobicContact CG-CB 4.14Å; E82-R173 HydrophobicContact CG-CG 3.82Å; E82-R173 WeakPolarHBondContact OE1-CD 3.38Å; E82-R173 WeakPolarHBondContact OE1-CG 3.06Å; E82-R173 IonicContact OE1-CZ 3.65Å; E82-R173 IonicContact OE1-NE 3.82Å; E82-R173 IonicContact OE1-NH1 3.85Å; E82-R173 PolarHBondContact OE1-NH1 2.85Å; E82-R173 IonicContact OE2-CZ 2.81Å; E82-R173 IonicContact OE2-NE 3.06Å; E82-R173 IonicContact OE2-NH1 3.69Å; E82-R173 PolarHBondContact OE2-NH1 2.81Å; E82-R173 IonicContact OE2-NH2 2.76Å; L171-R173 HydrophobicContact CB-CB 4.36Å; L171-R173 PolarHBondContact O-N 3.02Å; R173-L175 VanDerWaalsContact C-N 3.3Å; R173-L175 PolarHBondContact O-N 2.77Å
174	D	88.7	Confident	88.1	Confident	35 Å²	35	40.7 Å²	40.7	19%	0.187	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-80.2	-5.5	-172.3	-80.6	-61	0	0	0	114.4	R75 W80 R163 L170 L171 A172	R75-D174 IonicContact CZ-OD1 3.15Å; R75-D174 IonicContact NH1-OD1 2.72Å; R75-D174 PolarHBondContact NH1-OD1 3.13Å; R75-D174 VanDerWaalsContact NH2-CB 3.34Å; R75-D174 PolarHBondContact NH2-O 3.29Å; R75-D174 IonicContact NH2-OD1 2.8Å; R75-D174 PolarHBondContact NH2-OD1 2.91Å; W80-D174 WeakPolarHBondContact CZ3-OD1 3.28Å; R163-D174 PolarHBondContact NH2-O 2.92Å; L170-D174 HydrophobicContact CD1-CB 4.02Å; L171-D174 WeakPolarHBondContact O-CB 2.9Å; L171-D174 PolarHBondContact O-N 2.83Å; A172-D174 PolarHBondContact O-N 3.1Å
175	L	90.5	Very high	87.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.214	C	C	.	.			trans	-72.1	144.3	-178.9	-68.1	174.6	0	0	0	112.5	N81 C161 L170 A172 R173 D179 V181 P190 A191	N81-L175 HydrophobicContact CB-CB 4.42Å; C161-L175 HydrophobicContact CB-CD2 4.21Å; L170-L175 HydrophobicContact CD1-CD2 4.02Å; L170-L175 HydrophobicContact CD1-CG 4.34Å; A172-L175 WeakPolarHBondContact O-CB 3.2Å; A172-L175 WeakPolarHBondContact O-CG 3.41Å; A172-L175 PolarHBondContact O-N 3.41Å; R173-L175 VanDerWaalsContact C-N 3.3Å; R173-L175 PolarHBondContact O-N 2.77Å; L175-D179 HydrophobicContact CD2-CB 4.21Å; L175-V181 HydrophobicContact CD1-CG2 4.25Å; L175-V181 HydrophobicContact CD2-CG2 3.89Å; L175-P190 HydrophobicContact CD1-CB 3.55Å; L175-P190 HydrophobicContact CD1-CG 3.52Å; L175-A191 HydrophobicContact CD1-CB 4.23Å
176	V	91.8	Very high	87.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.			trans	-128.1	156.6	174	-63.9	0	0	0	0	111.2	L66 V71 R74 R75 G178 D179	L66-V176 HydrophobicContact CD1-CG2 3.91Å; V71-V176 HydrophobicContact CB-CG2 4.4Å; V71-V176 HydrophobicContact CG1-CG1 4.39Å; V71-V176 HydrophobicContact CG1-CG2 4.18Å; V71-V176 HydrophobicContact CG2-CG2 4.22Å; R74-V176 HydrophobicContact CB-CB 4.05Å; R74-V176 HydrophobicContact CB-CG1 4.27Å; R74-V176 HydrophobicContact CB-CG2 4.15Å; R75-V176 HydrophobicContact CB-CG1 4.13Å; V176-G178 PolarHBondContact O-N 2.86Å; V176-D179 WeakPolarHBondContact CG2-OD2 3.01Å; V176-D179 PolarHBondContact N-OD2 3.34Å; V176-D179 WeakPolarHBondContact O-CB 3.49Å; V176-D179 PolarHBondContact O-N 2.83Å; V176-D179 VanDerWaalsContact O-N 3.11Å
177	P	91.7	Very high	87.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	130.2	173	-26.3	35.6	0	0	0	112.1	R74 H78 T255	R74-P177 WeakPolarHBondContact CD-O 3.29Å; R74-P177 PolarHBondContact NH1-O 2.89Å; H78-P177 HydrophobicContact CB-CG 4.44Å; P177-T255 HydrophobicContact CG-CG2 4.28Å
178	G	89.2	Confident	86.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	-9	-175.2	0	0	0	0	0	115.7	A60 V176 V252	A60-G178 VanDerWaalsContact CB-O 3.29Å; A60-G178 WeakPolarHBondContact CB-O 3.32Å; V176-G178 PolarHBondContact O-N 2.86Å; G178-V252 PolarHBondContact N-O 2.96Å
179	D	91.8	Very high	87.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.173	C	C	.	.			trans	-61.7	147.9	172	-87.5	-33.8	0	0	0	110.8	R163 L175 V176 I251 V252	R163-D179 IonicContact CZ-OD1 3.91Å; R163-D179 IonicContact CZ-OD2 3.71Å; R163-D179 IonicContact NE-OD1 3.63Å; R163-D179 PolarHBondContact NE-OD1 2.86Å; R163-D179 VanDerWaalsContact NE-OD1 3.15Å; R163-D179 IonicContact NE-OD2 2.59Å; R163-D179 IonicContact NH2-OD1 3.74Å; R163-D179 IonicContact NH2-OD2 3.68Å; R163-D179 PolarHBondContact NH2-OD2 2.95Å; L175-D179 HydrophobicContact CD2-CB 4.21Å; V176-D179 WeakPolarHBondContact CG2-OD2 3.01Å; V176-D179 PolarHBondContact N-OD2 3.34Å; V176-D179 WeakPolarHBondContact O-CB 3.49Å; V176-D179 PolarHBondContact O-N 2.83Å; V176-D179 VanDerWaalsContact O-N 3.11Å; D179-I251 CarbonylContact O-C 3.54Å; D179-I251 WeakPolarHBondContact O-CA 3.31Å; D179-V252 HydrophobicContact CB-CB 4.45Å; D179-V252 HydrophobicContact CB-CG2 3.87Å; D179-V252 WeakPolarHBondContact O-CG2 3.38Å; D179-V252 PolarHBondContact O-N 3.49Å
180	T	92.1	Very high	87.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.3	174.5	-68	0	0	0	0	109.2	D61 C161 I162 Y196	D61-T180 PolarHBondContact O-OG1 3.31Å; C161-T180 CarbonylContact C-O 3.47Å; C161-T180 VanDerWaalsContact CA-O 3.23Å; C161-T180 WeakPolarHBondContact CA-O 3.33Å; I162-T180 HydrophobicContact CB-CG2 4.21Å; I162-T180 HydrophobicContact CD1-CG2 3.97Å; I162-T180 HydrophobicContact CG1-CG2 4.3Å; I162-T180 PolarHBondContact N-O 2.9Å; T180-Y196 HydrophobicContact CG2-CE1 4Å; T180-Y196 WeakPolarHBondContact CG2-OH 3.21Å
181	V	93.1	Very high	87.4	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	136.9	-177.4	175.3	0	0	0	0	110.1	L175 L183 P190 L193 K249 G250 V252	L175-V181 HydrophobicContact CD1-CG2 4.25Å; L175-V181 HydrophobicContact CD2-CG2 3.89Å; V181-L183 HydrophobicContact CG1-CD2 4.18Å; V181-P190 HydrophobicContact CG1-CG 3.8Å; V181-P190 HydrophobicContact CG2-CG 4.43Å; V181-L193 HydrophobicContact CB-CD1 3.89Å; V181-L193 HydrophobicContact CB-CD2 4Å; V181-L193 HydrophobicContact CG1-CD1 3.92Å; V181-L193 HydrophobicContact CG2-CD2 4.02Å; V181-K249 WeakPolarHBondContact O-CA 3.42Å; V181-G250 PolarHBondContact N-O 3.37Å; V181-G250 PolarHBondContact O-N 3.48Å; V181-V252 HydrophobicContact CG2-CG2 3.71Å
182	C	90.5	Very high	87.7	Confident	20 Å²	20	23.8 Å²	23.8	14%	0.135	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.9	172.4	-66	0	0	0	0	109.6	H160 L167	H160-C182 HydrophobicContact CB-CB 4.39Å; H160-C182 PolarHBondContact O-N 3.38Å; L167-C182 HydrophobicContact CD1-CB 4.23Å
183	L	89.6	Confident	88.1	Confident	3 Å²	3	23.5 Å²	23.5	2%	0.016	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.9	179	-65.9	-179.3	0	0	0	110.3	V181 E187 V189 L193 L195 A237 V243 K247 A248	V181-L183 HydrophobicContact CG1-CD2 4.18Å; L183-E187 WeakPolarHBondContact CA-OE2 3.37Å; L183-V189 HydrophobicContact CD1-CG2 3.94Å; L183-V189 HydrophobicContact CD2-CG2 4.19Å; L183-L193 HydrophobicContact CD1-CD1 3.88Å; L183-L193 HydrophobicContact CD2-CD1 4.19Å; L183-L193 HydrophobicContact CG-CD1 4.05Å; L183-L195 HydrophobicContact CD1-CD2 4.5Å; L183-A237 HydrophobicContact CD1-CB 4.17Å; L183-V243 HydrophobicContact CB-CG2 4.15Å; L183-V243 HydrophobicContact CD1-CG2 4.29Å; L183-V243 HydrophobicContact CD2-CG2 4.47Å; L183-K247 WeakPolarHBondContact O-CA 3.44Å; L183-A248 HydrophobicContact CB-CB 4.4Å; L183-A248 PolarHBondContact N-O 3.27Å; L183-A248 PolarHBondContact O-N 3.4Å
184	S	84.6	Confident	88.4	Confident	39 Å²	39	19.3 Å²	19.3	27%	0.273	11%	0.114	S	C	.	.			trans	-120.3	162.4	173.3	-59.9	0	0	0	0	111.8	G186 E187 V243	S184-G186 PolarHBondContact O-N 2.86Å; S184-E187 PolarHBondContact N-OE2 2.64Å; S184-E187 WeakPolarHBondContact O-CB 3.46Å; S184-E187 PolarHBondContact O-N 3.06Å; S184-E187 VanDerWaalsContact O-N 3.1Å; S184-V243 WeakPolarHBondContact O-CB 3.29Å
185	V	80.5	Confident	88.7	Confident	77 Å²	77	17.7 Å²	17.7	47%	0.467	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	127.8	176.6	-178.7	0	0	0	0	111	R244 G246	V185-R244 WeakPolarHBondContact CG1-O 3.42Å; V185-G246 VanDerWaalsContact CG2-O 3.22Å; V185-G246 WeakPolarHBondContact CG2-O 3.47Å
186	G	71.1	Confident	88.7	Confident	55 Å²	55	19.7 Å²	19.7	57%	0.567	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.3	-9.6	180	0	0	0	0	0	114.9	S184 V243	S184-G186 PolarHBondContact O-N 2.86Å; G186-V243 PolarHBondContact N-O 2.84Å
187	E	79.4	Confident	88.6	Confident	44 Å²	44	24.3 Å²	24.3	21%	0.206	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-81.9	149.3	175.9	-66.6	172.8	179.6	0	0	111.4	H160 L183 S184 V243	H160-E187 IonicContact CE1-OE1 2.79Å; H160-E187 PolarHBondContact CE1-OE1 3.39Å; H160-E187 IonicContact ND1-OE1 3.8Å; H160-E187 PolarHBondContact ND1-OE1 3.46Å; L183-E187 WeakPolarHBondContact CA-OE2 3.37Å; S184-E187 PolarHBondContact N-OE2 2.64Å; S184-E187 WeakPolarHBondContact O-CB 3.46Å; S184-E187 PolarHBondContact O-N 3.06Å; S184-E187 VanDerWaalsContact O-N 3.1Å; E187-V243 WeakPolarHBondContact O-CG2 3.17Å; E187-V243 PolarHBondContact O-N 2.87Å
188	R	83.6	Confident	88.5	Confident	117 Å²	117	26 Å²	26	44%	0.442	15%	0.149	S	C	.	.	B	Isolated β-bridge	trans	-89.5	141.5	167.5	-72.9	-171.6	178.7	-171.9	1.6	109.8	P190 T241 L242 D687	R188-P190 WeakPolarHBondContact O-CD 3.5Å; R188-T241 CarbonylContact C-O 3.58Å; R188-T241 WeakPolarHBondContact CA-O 3.24Å; R188-L242 HydrophobicContact CG-CD1 4.08Å; R188-D687 IonicContact CZ-OD2 3.8Å; R188-D687 IonicContact NH1-OD2 3.29Å; R188-D687 PolarHBondContact NH1-OD2 3.25Å
189	V	90.1	Very high	88.1	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.012	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-69.2	118.7	176.8	179.7	0	0	0	0	108.8	L183 A191 L193 I203 A237 F238 M239 G240 T241 V243	L183-V189 HydrophobicContact CD1-CG2 3.94Å; L183-V189 HydrophobicContact CD2-CG2 4.19Å; V189-A191 WeakPolarHBondContact CG1-O 3.22Å; V189-L193 HydrophobicContact CG1-CD1 4.13Å; V189-L193 HydrophobicContact CG1-CG 4.17Å; V189-I203 HydrophobicContact CG2-CD1 4.26Å; V189-A237 HydrophobicContact CG1-CB 4.02Å; V189-A237 HydrophobicContact CG2-CB 4.15Å; V189-F238 VanDerWaalsContact CB-O 3.23Å; V189-F238 WeakPolarHBondContact CB-O 3.15Å; V189-F238 VanDerWaalsContact CG1-O 3.31Å; V189-F238 WeakPolarHBondContact CG1-O 3.43Å; V189-M239 CarbonylContact O-C 3.6Å; V189-M239 WeakPolarHBondContact O-CA 3.48Å; V189-G240 PolarHBondContact O-N 3.26Å; V189-T241 WeakPolarHBondContact CG2-OG1 3.36Å; V189-T241 PolarHBondContact N-O 3.26Å; V189-V243 HydrophobicContact CG2-CG2 4.29Å
190	P	88.8	Confident	87.6	Confident	11 Å²	11	36.3 Å²	36.3	7%	0.071	21%	0.209	C	C	.	.			trans	-85.5	-18.9	-166.3	34	-38.7	0	0	0	114.7	N81 C159 A172 L175 V181 R188	N81-P190 PolarHBondContact ND2-O 2.78Å; C159-P190 HydrophobicContact CB-CB 3.79Å; C159-P190 HydrophobicContact CB-CG 3.82Å; A172-P190 HydrophobicContact CB-CB 3.83Å; L175-P190 HydrophobicContact CD1-CB 3.55Å; L175-P190 HydrophobicContact CD1-CG 3.52Å; V181-P190 HydrophobicContact CG1-CG 3.8Å; V181-P190 HydrophobicContact CG2-CG 4.43Å; R188-P190 WeakPolarHBondContact O-CD 3.5Å
191	A	90.2	Very high	87.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-155.4	170.7	177.4	0	0	0	0	0	108.5	L175 V189 L193 V252 T255	L175-A191 HydrophobicContact CD1-CB 4.23Å; V189-A191 WeakPolarHBondContact CG1-O 3.22Å; A191-L193 WeakPolarHBondContact O-CG 3.36Å; A191-L193 PolarHBondContact O-N 2.81Å; A191-V252 HydrophobicContact CB-CG1 3.84Å; A191-V252 HydrophobicContact CB-CG2 4.36Å; A191-T255 HydrophobicContact CB-CG2 4.26Å
192	D	92.2	Very high	86.8	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.9	175.2	-77.3	-6	0	0	0	109.9	A237 F238 M239 V252 I253 G254 S259 E260	D192-A237 WeakPolarHBondContact CA-O 3.49Å; D192-F238 VanDerWaalsContact OD1-CA 3.32Å; D192-F238 WeakPolarHBondContact OD1-CA 3.49Å; D192-M239 PolarHBondContact OD1-N 2.77Å; D192-V252 WeakPolarHBondContact O-CA 3.08Å; D192-I253 HydrophobicContact CB-CD1 4.08Å; D192-I253 HydrophobicContact CB-CG1 3.76Å; D192-I253 WeakPolarHBondContact O-CG1 3.19Å; D192-I253 PolarHBondContact O-N 3.22Å; D192-G254 PolarHBondContact N-O 2.86Å; D192-G254 VanDerWaalsContact N-O 3.11Å; D192-S259 VanDerWaalsContact OD2-CA 3.29Å; D192-S259 WeakPolarHBondContact OD2-CA 3.45Å; D192-S259 WeakPolarHBondContact OD2-CB 3.46Å; D192-E260 PolarHBondContact OD2-N 3.28Å
193	L	93.4	Very high	86.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136	-174.5	-50	178.9	0	0	0	112.2	V181 L183 V189 A191 I236 A237 I251 V252	V181-L193 HydrophobicContact CB-CD1 3.89Å; V181-L193 HydrophobicContact CB-CD2 4Å; V181-L193 HydrophobicContact CG1-CD1 3.92Å; V181-L193 HydrophobicContact CG2-CD2 4.02Å; L183-L193 HydrophobicContact CD1-CD1 3.88Å; L183-L193 HydrophobicContact CD2-CD1 4.19Å; L183-L193 HydrophobicContact CG-CD1 4.05Å; V189-L193 HydrophobicContact CG1-CD1 4.13Å; V189-L193 HydrophobicContact CG1-CG 4.17Å; A191-L193 WeakPolarHBondContact O-CG 3.36Å; A191-L193 PolarHBondContact O-N 2.81Å; L193-I236 CarbonylContact O-C 3.48Å; L193-I236 VanDerWaalsContact O-CA 3.29Å; L193-I236 WeakPolarHBondContact O-CA 3.39Å; L193-A237 HydrophobicContact CB-CB 4.3Å; L193-A237 PolarHBondContact N-O 3.09Å; L193-A237 PolarHBondContact O-N 3.08Å; L193-I251 CarbonylContact C-O 3.57Å; L193-I251 VanDerWaalsContact CA-O 3.27Å; L193-I251 WeakPolarHBondContact CA-O 3.21Å; L193-V252 HydrophobicContact CD2-CB 4.19Å; L193-V252 HydrophobicContact CD2-CG2 3.54Å
194	R	94.1	Very high	86.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	115	162.3	-179.6	64.4	175	89.3	3.6	109.7	A46 L49 V54 T219 N235 I236 G250 I251 I253	A46-R194 VanDerWaalsContact O-CD 3.24Å; A46-R194 WeakPolarHBondContact O-CD 3.34Å; A46-R194 PolarHBondContact O-NE 2.99Å; L49-R194 PolarHBondContact O-NH2 3.19Å; V54-R194 HydrophobicContact CG1-CB 4.25Å; V54-R194 HydrophobicContact CG1-CG 4.2Å; V54-R194 HydrophobicContact CG2-CG 4.37Å; R194-T219 PolarHBondContact NH1-O 3.46Å; R194-T219 PolarHBondContact NH2-O 2.69Å; R194-N235 VanDerWaalsContact CZ-ND2 3.3Å; R194-N235 PolarHBondContact NH1-O 2.65Å; R194-N235 PolarHBondContact NH2-ND2 3.21Å; R194-I236 HydrophobicContact CB-CD1 4.23Å; R194-I236 HydrophobicContact CG-CD1 4.5Å; R194-G250 CarbonylContact O-C 3.59Å; R194-G250 WeakPolarHBondContact O-CA 3.49Å; R194-I251 PolarHBondContact N-O 3.31Å; R194-I251 PolarHBondContact O-N 3.34Å; R194-I253 HydrophobicContact CB-CG2 3.72Å
195	L	93.6	Very high	85.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	129.2	-177	-60.1	176.5	0	0	0	111.6	L183 L201 K217 N235 A237 A248	L183-L195 HydrophobicContact CD1-CD2 4.5Å; L195-L201 HydrophobicContact CD1-CD2 3.6Å; L195-L201 HydrophobicContact CD2-CD2 4.23Å; L195-K217 HydrophobicContact CD1-CB 3.66Å; L195-K217 HydrophobicContact CD1-CD 4.35Å; L195-K217 HydrophobicContact CD1-CG 4.12Å; L195-N235 PolarHBondContact N-O 3.27Å; L195-A237 HydrophobicContact CD1-CB 4.47Å; L195-A237 HydrophobicContact CD2-CB 3.96Å; L195-A237 HydrophobicContact CG-CB 4.31Å; L195-A248 HydrophobicContact CD2-CB 4.01Å
196	Y	92.1	Very high	85.4	Confident	43 Å²	43	33.5 Å²	33.5	17%	0.169	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	-21.8	174.2	67.2	-96.8	0	0	0	113.5	V51 L62 T180 T219 K249 I251	V51-Y196 VanDerWaalsContact CG1-CB 3.41Å; V51-Y196 HydrophobicContact CG1-CG 4.42Å; L62-Y196 HydrophobicContact CD2-CD1 3.76Å; L62-Y196 HydrophobicContact CD2-CD2 4.34Å; L62-Y196 HydrophobicContact CD2-CE1 3.94Å; L62-Y196 HydrophobicContact CD2-CG 3.95Å; L62-Y196 PolarHBondContact O-OH 2.93Å; L62-Y196 VanDerWaalsContact O-OH 3.1Å; T180-Y196 HydrophobicContact CG2-CE1 4Å; T180-Y196 WeakPolarHBondContact CG2-OH 3.21Å; Y196-T219 VanDerWaalsContact C-CG2 3.44Å; Y196-T219 WeakPolarHBondContact O-CG2 3.35Å; Y196-K249 HydrophobicContact CD1-CB 4.45Å; Y196-K249 WeakPolarHBondContact CD1-O 3.45Å; Y196-K249 HydrophobicContact CE1-CB 3.72Å; Y196-K249 HydrophobicContact CE2-CB 3.81Å; Y196-K249 HydrophobicContact CE2-CD 4.21Å; Y196-K249 PolarHBondContact N-O 3.41Å; Y196-K249 WeakPolarHBondContact OH-CB 3.26Å; Y196-K249 VanDerWaalsContact OH-CD 3.27Å; Y196-K249 WeakPolarHBondContact OH-CD 3.35Å; Y196-I251 HydrophobicContact CD1-CG1 3.92Å; Y196-I251 HydrophobicContact CE1-CG1 4.17Å
197	E	89.4	Confident	85.2	Confident	96 Å²	96	32.1 Å²	32.1	45%	0.449	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.4	172.8	-166.8	180	169.6	0	0	107.7	A248 K249	E197-A248 CarbonylContact O-C 3.33Å; E197-A248 WeakPolarHBondContact O-CA 3.26Å; E197-A248 VanDerWaalsContact O-CB 3.25Å; E197-A248 WeakPolarHBondContact O-CB 3.39Å; E197-K249 HydrophobicContact CB-CB 4.13Å; E197-K249 HydrophobicContact CB-CG 4.45Å; E197-K249 PolarHBondContact N-O 2.88Å; E197-K249 PolarHBondContact O-N 3.17Å; E197-K249 WeakPolarHBondContact OE2-CD 3.33Å; E197-K249 WeakPolarHBondContact OE2-CE 3.37Å; E197-K249 IonicContact OE2-NZ 3.58Å; E197-K249 PolarHBondContact OE2-NZ 3.3Å
198	A	88.1	Confident	84.7	Confident	37 Å²	37	30.6 Å²	30.6	31%	0.306	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	126.8	177.6	0	0	0	0	0	109.7	L201 T219 A248	A198-L201 HydrophobicContact CB-CB 4.08Å; A198-L201 HydrophobicContact CB-CD2 4.43Å; A198-T219 HydrophobicContact CB-CG2 4.01Å; A198-A248 HydrophobicContact CB-CB 4.32Å
199	S	82.3	Confident	84	Confident	64 Å²	64	26.4 Å²	26.4	45%	0.448	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	110.5	174.7	43.2	0	0	0	0	109.2	L201 G246 K247	S199-L201 PolarHBondContact O-N 3.47Å; S199-G246 WeakPolarHBondContact O-CA 3.41Å; S199-K247 PolarHBondContact N-O 3.4Å; S199-K247 PolarHBondContact O-N 3.23Å; S199-K247 VanDerWaalsContact O-N 3.11Å; S199-K247 PolarHBondContact OG-O 3.25Å
200	D	81.3	Confident	82.6	Confident	152 Å²	152	28.3 Å²	28.3	81%	0.813	17%	0.173	S	C	*	.	E	Extended strand (participates in β ladder)	trans	44.9	37.3	-177	-61.9	-38.3	0	0	0	114	S202 C245 G246	D200-S202 PolarHBondContact O-N 3.24Å; D200-C245 CarbonylContact O-C 3.55Å; D200-G246 WeakPolarHBondContact O-CA 3.27Å
201	L	83.8	Confident	81.5	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	122.6	-173.5	-172.5	73.8	0	0	0	110.5	L195 A198 S199 I203 K217 V243 C245 A248	L195-L201 HydrophobicContact CD1-CD2 3.6Å; L195-L201 HydrophobicContact CD2-CD2 4.23Å; A198-L201 HydrophobicContact CB-CB 4.08Å; A198-L201 HydrophobicContact CB-CD2 4.43Å; S199-L201 PolarHBondContact O-N 3.47Å; L201-I203 HydrophobicContact CD1-CG1 4.36Å; L201-I203 HydrophobicContact CD2-CD1 3.83Å; L201-I203 HydrophobicContact CD2-CG1 4.12Å; L201-I203 HydrophobicContact CG-CD1 4.29Å; L201-I203 HydrophobicContact CG-CG1 4.03Å; L201-K217 HydrophobicContact CB-CB 4.16Å; L201-K217 HydrophobicContact CD2-CB 3.66Å; L201-K217 HydrophobicContact CD2-CG 3.99Å; L201-K217 HydrophobicContact CG-CB 4.1Å; L201-K217 HydrophobicContact CG-CG 4.38Å; L201-K217 PolarHBondContact O-N 3.4Å; L201-V243 HydrophobicContact CD1-CG1 3.78Å; L201-C245 WeakPolarHBondContact CA-O 3.39Å; L201-A248 HydrophobicContact CB-CB 4.48Å; L201-A248 HydrophobicContact CD1-CB 3.79Å; L201-A248 HydrophobicContact CD2-CB 3.34Å; L201-A248 HydrophobicContact CG-CB 4.05Å
202	S	83.8	Confident	79.9	Confident	26 Å²	26	35.8 Å²	35.8	18%	0.182	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	128.2	168	61.3	0	0	0	0	110.2	D200 S215 R244 C245	D200-S202 PolarHBondContact O-N 3.24Å; S202-S215 WeakPolarHBondContact CA-O 3.39Å; S202-R244 PolarHBondContact O-N 3.32Å; S202-C245 PolarHBondContact N-O 3.19Å; S202-C245 PolarHBondContact O-N 3.45Å; S202-C245 WeakPolarHBondContact OG-CB 3.47Å; S202-C245 PolarHBondContact OG-N 3.42Å
203	I	85.6	Confident	78.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.8	-177.2	-59.3	-176.2	0	0	0	108.3	V189 L201 E205 P214 S215 K217 A237 T241 V243	V189-I203 HydrophobicContact CG2-CD1 4.26Å; L201-I203 HydrophobicContact CD1-CG1 4.36Å; L201-I203 HydrophobicContact CD2-CD1 3.83Å; L201-I203 HydrophobicContact CD2-CG1 4.12Å; L201-I203 HydrophobicContact CG-CD1 4.29Å; L201-I203 HydrophobicContact CG-CG1 4.03Å; I203-E205 HydrophobicContact CB-CG 4.41Å; I203-E205 HydrophobicContact CG2-CG 4.06Å; I203-E205 PolarHBondContact O-N 3.04Å; I203-P214 CarbonylContact O-C 3.53Å; I203-P214 WeakPolarHBondContact O-CA 3.16Å; I203-S215 PolarHBondContact N-O 2.95Å; I203-S215 PolarHBondContact O-N 3.36Å; I203-K217 HydrophobicContact CB-CG 4.4Å; I203-K217 HydrophobicContact CD1-CG 3.98Å; I203-K217 HydrophobicContact CG1-CG 4Å; I203-A237 HydrophobicContact CD1-CB 3.56Å; I203-T241 VanDerWaalsContact CG2-OG1 3.23Å; I203-T241 WeakPolarHBondContact CG2-OG1 3.45Å; I203-V243 HydrophobicContact CG1-CG2 4.46Å
204	D	80.1	Confident	77.8	Confident	16 Å²	16	40.9 Å²	40.9	9%	0.086	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	101.3	171.4	-171.4	-9.9	0	0	0	109.4	S206 T241 L242 R244	D204-S206 WeakPolarHBondContact OD1-CB 3.4Å; D204-S206 PolarHBondContact OD1-N 3Å; D204-S206 VanDerWaalsContact OD1-N 3.09Å; D204-S206 PolarHBondContact OD1-OG 2.71Å; D204-T241 WeakPolarHBondContact O-CB 3.29Å; D204-L242 HydrophobicContact CB-CB 4.31Å; D204-L242 PolarHBondContact N-O 3.48Å; D204-L242 PolarHBondContact O-N 3.22Å; D204-R244 HydrophobicContact CB-CG 3.68Å; D204-R244 IonicContact OD2-CZ 2.77Å; D204-R244 VanDerWaalsContact OD2-CZ 3.31Å; D204-R244 IonicContact OD2-NE 3.1Å; D204-R244 PolarHBondContact OD2-NE 3.06Å; D204-R244 IonicContact OD2-NH2 3Å; D204-R244 PolarHBondContact OD2-NH2 3.06Å
205	E	81.2	Confident	77.2	Confident	5 Å²	5	42.1 Å²	42.1	2%	0.023	25%	0.246	C	C	.	.			trans	-95.8	7.2	179.9	-51.6	-167.9	128.1	0	0	112	I203 S207 L208 T209 S215 K217 F238 T241	I203-E205 HydrophobicContact CB-CG 4.41Å; I203-E205 HydrophobicContact CG2-CG 4.06Å; I203-E205 PolarHBondContact O-N 3.04Å; E205-S207 PolarHBondContact O-N 2.87Å; E205-L208 PolarHBondContact O-N 2.68Å; E205-T209 HydrophobicContact CB-CG2 4.12Å; E205-T209 PolarHBondContact O-N 3.47Å; E205-T209 PolarHBondContact O-OG1 3.09Å; E205-S215 WeakPolarHBondContact OE2-CB 3.35Å; E205-S215 PolarHBondContact OE2-OG 3.03Å; E205-S215 VanDerWaalsContact OE2-OG 3.1Å; E205-K217 WeakPolarHBondContact OE1-CE 3.35Å; E205-K217 IonicContact OE1-NZ 3.77Å; E205-K217 PolarHBondContact OE1-NZ 3.32Å; E205-K217 IonicContact OE2-NZ 2.77Å; E205-K217 PolarHBondContact OE2-NZ 2.87Å; E205-F238 WeakPolarHBondContact OE1-CD2 3.41Å; E205-F238 WeakPolarHBondContact OE1-CE2 3.08Å; E205-T241 HydrophobicContact CB-CG2 4.31Å; E205-T241 HydrophobicContact CG-CG2 4.25Å
206	S	68.6	Low	76.8	Confident	31 Å²	31	46.7 Å²	46.7	22%	0.217	28%	0.278	C	S	.	.	H	α-helix	trans	-51.2	-33.7	179.8	58.5	0	0	0	0	112.5	D204 L208 G210 E211	D204-S206 WeakPolarHBondContact OD1-CB 3.4Å; D204-S206 PolarHBondContact OD1-N 3Å; D204-S206 VanDerWaalsContact OD1-N 3.09Å; D204-S206 PolarHBondContact OD1-OG 2.71Å; S206-L208 PolarHBondContact O-N 2.89Å; S206-G210 WeakPolarHBondContact O-CA 3.41Å; S206-G210 PolarHBondContact O-N 2.84Å; S206-E211 WeakPolarHBondContact CA-O 3.28Å; S206-E211 WeakPolarHBondContact CB-O 3.41Å
207	S	66.9	Low	76.7	Confident	26 Å²	26	45.2 Å²	45.2	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-56.6	-47.7	174.4	-64.6	0	0	0	0	112.1	E205 V666 T686	E205-S207 PolarHBondContact O-N 2.87Å; S207-V666 WeakPolarHBondContact O-CA 3.44Å; S207-V666 WeakPolarHBondContact O-CB 3.38Å; S207-V666 WeakPolarHBondContact O-CG2 3.4Å; S207-V666 PolarHBondContact O-N 3.19Å; S207-T686 VanDerWaalsContact CB-CG2 3.42Å; S207-T686 VanDerWaalsContact OG-CG2 3.25Å; S207-T686 WeakPolarHBondContact OG-CG2 3.23Å
208	L	70.6	Confident	76.6	Confident	12 Å²	12	42.3 Å²	42.3	6%	0.063	26%	0.263	C	S	.	.	H	α-helix	trans	-94.7	-34.9	-175.2	-174	66.9	0	0	0	113.3	E205 S206 I230 F238 F261 V666 N667	E205-L208 PolarHBondContact O-N 2.68Å; S206-L208 PolarHBondContact O-N 2.89Å; L208-I230 HydrophobicContact CD2-CG2 3.99Å; L208-F238 HydrophobicContact CD2-CB 3.69Å; L208-F238 HydrophobicContact CD2-CD1 4.06Å; L208-F238 HydrophobicContact CD2-CD2 3.94Å; L208-F238 HydrophobicContact CD2-CG 3.63Å; L208-F261 HydrophobicContact CD1-CD2 4.41Å; L208-V666 HydrophobicContact CD1-CG1 4.28Å; L208-N667 PolarHBondContact O-OD1 3.31Å
209	T	68.9	Low	76.6	Confident	29 Å²	29	43 Å²	43	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-104.5	-19.9	-172.9	65.5	0	0	0	0	113	E205 E211 I230 A231 N667	E205-T209 HydrophobicContact CB-CG2 4.12Å; E205-T209 PolarHBondContact O-N 3.47Å; E205-T209 PolarHBondContact O-OG1 3.09Å; T209-E211 PolarHBondContact O-N 2.99Å; T209-E211 PolarHBondContact OG1-N 3.39Å; T209-I230 HydrophobicContact CG2-CG2 4.42Å; T209-A231 HydrophobicContact CG2-CB 3.99Å; T209-N667 PolarHBondContact O-ND2 3.28Å
210	G	59.3	Low	76.9	Confident	41 Å²	41	43.7 Å²	43.7	42%	0.423	27%	0.265	S	S	.	.			trans	78.3	-2.7	-175.7	0	0	0	0	0	114.2	S206 T212 N667	S206-G210 WeakPolarHBondContact O-CA 3.41Å; S206-G210 PolarHBondContact O-N 2.84Å; G210-T212 PolarHBondContact O-N 2.95Å; G210-N667 VanDerWaalsContact CA-ND2 3.29Å; G210-N667 WeakPolarHBondContact CA-ND2 3.33Å; G210-N667 PolarHBondContact N-ND2 3.3Å; G210-N667 VanDerWaalsContact N-ND2 3.11Å
211	E	65.6	Low	77.1	Confident	114 Å²	114	39.7 Å²	39.7	53%	0.533	25%	0.247	S	C	.	.			trans	-75.9	122.8	176.9	-69.4	-72.9	167.6	0	0	109.7	S206 T209 H213	S206-E211 WeakPolarHBondContact CA-O 3.28Å; S206-E211 WeakPolarHBondContact CB-O 3.41Å; T209-E211 PolarHBondContact O-N 2.99Å; T209-E211 PolarHBondContact OG1-N 3.39Å; E211-H213 PolarHBondContact O-N 3.03Å
212	T	57.1	Low	77.1	Confident	54 Å²	54	41.2 Å²	41.2	33%	0.331	25%	0.254	S	S	.	.	S	Bend	trans	-75.8	-10	-177.6	52.9	0	0	0	0	113.6	G210 T372	G210-T212 PolarHBondContact O-N 2.95Å; T212-T372 HydrophobicContact CG2-CG2 3.76Å
213	H	65.4	Low	76.8	Confident	77 Å²	77	43.6 Å²	43.6	36%	0.356	27%	0.269	S	S	.	.	S	Bend	trans	-93.7	127.8	179.5	-75.4	-53.8	0	0	0	111.1	E211 S215 R543	E211-H213 PolarHBondContact O-N 3.03Å; H213-S215 PolarHBondContact O-N 3.41Å; H213-R543 PolarHBondContact CE1-NH1 2.99Å; H213-R543 PolarHBondContact NE2-NH1 3.11Å
214	P	75.5	Confident	76.1	Confident	33 Å²	33	47.8 Å²	47.8	21%	0.214	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-57.6	131.3	174.9	-24.8	33.9	0	0	0	111.7	I203 R244	I203-P214 CarbonylContact O-C 3.53Å; I203-P214 WeakPolarHBondContact O-CA 3.16Å; P214-R244 HydrophobicContact CB-CG 4.4Å; P214-R244 HydrophobicContact CG-CG 4.2Å
215	S	82.3	Confident	75.2	Confident	27 Å²	27	52 Å²	52	19%	0.189	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.3	-179.4	-176.1	0	0	0	0	110	S202 I203 E205 H213	S202-S215 WeakPolarHBondContact CA-O 3.39Å; I203-S215 PolarHBondContact N-O 2.95Å; I203-S215 PolarHBondContact O-N 3.36Å; E205-S215 WeakPolarHBondContact OE2-CB 3.35Å; E205-S215 PolarHBondContact OE2-OG 3.03Å; E205-S215 VanDerWaalsContact OE2-OG 3.1Å; H213-S215 PolarHBondContact O-N 3.41Å
216	S	85.6	Confident	74.3	Confident	95 Å²	95	54.1 Å²	54.1	66%	0.664	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	131.2	175.6	-173.6	0	0	0	0	110
217	K	88.3	Confident	74	Confident	12 Å²	12	52.7 Å²	52.7	5%	0.052	34%	0.339	C	S	.	.			trans	-107.2	141.4	-172.9	-63.2	-65	-179.6	175.6	0	112.3	L195 L201 I203 E205 R233 S234 I236	L195-K217 HydrophobicContact CD1-CB 3.66Å; L195-K217 HydrophobicContact CD1-CD 4.35Å; L195-K217 HydrophobicContact CD1-CG 4.12Å; L201-K217 HydrophobicContact CB-CB 4.16Å; L201-K217 HydrophobicContact CD2-CB 3.66Å; L201-K217 HydrophobicContact CD2-CG 3.99Å; L201-K217 HydrophobicContact CG-CB 4.1Å; L201-K217 HydrophobicContact CG-CG 4.38Å; L201-K217 PolarHBondContact O-N 3.4Å; I203-K217 HydrophobicContact CB-CG 4.4Å; I203-K217 HydrophobicContact CD1-CG 3.98Å; I203-K217 HydrophobicContact CG1-CG 4Å; E205-K217 WeakPolarHBondContact OE1-CE 3.35Å; E205-K217 IonicContact OE1-NZ 3.77Å; E205-K217 PolarHBondContact OE1-NZ 3.32Å; E205-K217 IonicContact OE2-NZ 2.77Å; E205-K217 PolarHBondContact OE2-NZ 2.87Å; K217-R233 PolarHBondContact NZ-O 3.28Å; K217-R233 VanDerWaalsContact NZ-O 3.1Å; K217-S234 CarbonylContact C-O 3.53Å; K217-S234 WeakPolarHBondContact CA-O 3.49Å; K217-S234 WeakPolarHBondContact CB-O 3.48Å; K217-S234 WeakPolarHBondContact CD-O 3.45Å; K217-I236 WeakPolarHBondContact CE-O 3.4Å; K217-I236 PolarHBondContact NZ-O 3.33Å
218	S	87.8	Confident	73.6	Confident	36 Å²	36	54.8 Å²	54.8	25%	0.252	36%	0.364	S	S	.	.			trans	-128.9	161.7	179	75	0	0	0	0	111.2	T220 S234 N235	S218-T220 PolarHBondContact OG-OG1 3.03Å; S218-S234 PolarHBondContact N-O 3.1Å; S218-S234 PolarHBondContact OG-OG 3.24Å; S218-N235 WeakPolarHBondContact O-CA 3.38Å; S218-N235 WeakPolarHBondContact O-CB 3.23Å
219	T	89.1	Confident	73.6	Confident	50 Å²	50	59.5 Å²	59.5	31%	0.307	39%	0.389	S	S	.	.			trans	-92.4	-15.1	177.5	55	0	0	0	0	112.6	R194 Y196 A198	R194-T219 PolarHBondContact NH1-O 3.46Å; R194-T219 PolarHBondContact NH2-O 2.69Å; Y196-T219 VanDerWaalsContact C-CG2 3.44Å; Y196-T219 WeakPolarHBondContact O-CG2 3.35Å; A198-T219 HydrophobicContact CB-CG2 4.01Å
220	T	87.3	Confident	74	Confident	79 Å²	79	60.7 Å²	60.7	49%	0.485	39%	0.394	S	S	.	.	S	Bend	trans	-64.5	140	-174.7	47.6	0	0	0	0	112.9	S218 N235	S218-T220 PolarHBondContact OG-OG1 3.03Å; T220-N235 WeakPolarHBondContact O-CB 3.41Å; T220-N235 PolarHBondContact O-ND2 3.36Å
221	P	86.7	Confident	74.7	Confident	68 Å²	68	60.5 Å²	60.5	44%	0.442	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-63.2	142.2	173.5	25.5	-31.4	0	0	0	110.9	E48	E48-P221 WeakPolarHBondContact O-CB 3.46Å
222	Q	83.5	Confident	75.2	Confident	35 Å²	35	57 Å²	57	16%	0.164	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-98.1	136.5	-177.5	-66.4	-59.5	-48	0	0	110.8	S47 S234	S47-Q222 PolarHBondContact O-N 2.92Å; Q222-S234 PolarHBondContact NE2-OG 2.94Å; Q222-S234 VanDerWaalsContact NE2-OG 3.09Å
223	P	77.3	Confident	76.6	Confident	75 Å²	75	55.3 Å²	55.3	49%	0.487	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-68.5	145	179.1	24.5	-29.5	0	0	0	111.6	A225 S226 N227	P223-A225 PolarHBondContact O-N 2.94Å; P223-S226 WeakPolarHBondContact CD-OG 3.38Å; P223-S226 WeakPolarHBondContact CG-OG 3.34Å; P223-S226 PolarHBondContact O-N 2.97Å; P223-S226 PolarHBondContact O-OG 2.77Å; P223-S226 VanDerWaalsContact O-OG 3.07Å; P223-N227 PolarHBondContact O-N 3.33Å
224	P	70.7	Confident	77.7	Confident	88 Å²	88	52.7 Å²	52.7	57%	0.571	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.9	-174.9	19.6	-30.7	0	0	0	114
225	A	61.9	Low	78.4	Confident	104 Å²	104	51.1 Å²	51.1	86%	0.86	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-29.8	176.9	0	0	0	0	0	114	P223	P223-A225 PolarHBondContact O-N 2.94Å
226	S	61	Low	78.9	Confident	51 Å²	51	49.9 Å²	49.9	36%	0.357	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.6	176.4	62.9	0	0	0	0	112.9	P223 G228 S232	P223-S226 WeakPolarHBondContact CD-OG 3.38Å; P223-S226 WeakPolarHBondContact CG-OG 3.34Å; P223-S226 PolarHBondContact O-N 2.97Å; P223-S226 PolarHBondContact O-OG 2.77Å; P223-S226 VanDerWaalsContact O-OG 3.07Å; S226-G228 VanDerWaalsContact C-N 3.3Å; S226-G228 PolarHBondContact O-N 3.03Å; S226-S232 VanDerWaalsContact O-CB 3.3Å; S226-S232 WeakPolarHBondContact O-CB 3.23Å; S226-S232 PolarHBondContact O-OG 2.87Å
227	N	62.2	Low	79.2	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	12.3	-169.2	-153.8	20.4	0	0	0	114.7	R44 S47 E48 P223 R233	R44-N227 WeakPolarHBondContact CG-ND2 3.46Å; R44-N227 PolarHBondContact O-ND2 2.86Å; S47-N227 VanDerWaalsContact OG-CG 3.25Å; S47-N227 PolarHBondContact OG-ND2 3.02Å; S47-N227 PolarHBondContact OG-OD1 2.98Å; E48-N227 VanDerWaalsContact CG-ND2 3.3Å; E48-N227 WeakPolarHBondContact CG-ND2 3.39Å; E48-N227 PolarHBondContact OE1-ND2 2.89Å; P223-N227 PolarHBondContact O-N 3.33Å; N227-R233 VanDerWaalsContact OD1-CG 3.31Å; N227-R233 WeakPolarHBondContact OD1-CG 2.86Å; N227-R233 PolarHBondContact OD1-NE 2.82Å
228	G	60.3	Low	79.3	Confident	69 Å²	69	44.8 Å²	44.8	71%	0.711	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-24.9	-174.3	0	0	0	0	0	114.9	S226	S226-G228 VanDerWaalsContact C-N 3.3Å; S226-G228 PolarHBondContact O-N 3.03Å
229	N	69.6	Low	79.2	Confident	112 Å²	112	44.2 Å²	44.2	60%	0.599	30%	0.295	S	S	*	.	S	Bend	trans	-115.4	146.2	-179	-154.1	-2.4	0	0	0	110.4	A231 S232	N229-A231 VanDerWaalsContact C-N 3.28Å; N229-A231 PolarHBondContact O-N 2.8Å; N229-S232 PolarHBondContact O-N 2.92Å; N229-S232 PolarHBondContact O-OG 3.1Å
230	I	76.6	Confident	78.7	Confident	54 Å²	54	42.8 Å²	42.8	28%	0.277	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-62.1	-40.4	-178.8	-70.3	168.4	0	0	0	110.5	L208 T209 S232 R233 F238	L208-I230 HydrophobicContact CD2-CG2 3.99Å; T209-I230 HydrophobicContact CG2-CG2 4.42Å; I230-S232 PolarHBondContact O-N 2.99Å; I230-S232 VanDerWaalsContact O-N 3.15Å; I230-R233 WeakPolarHBondContact O-CB 3.16Å; I230-R233 PolarHBondContact O-N 3.02Å; I230-F238 HydrophobicContact CG2-CE1 4.14Å; I230-F238 HydrophobicContact CG2-CE2 3.91Å; I230-F238 HydrophobicContact CG2-CZ 3.65Å
231	A	74.1	Confident	78.6	Confident	37 Å²	37	39 Å²	39	31%	0.306	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-63.5	-18.6	-179.2	0	0	0	0	0	114.6	T209 N229	T209-A231 HydrophobicContact CG2-CB 3.99Å; N229-A231 VanDerWaalsContact C-N 3.28Å; N229-A231 PolarHBondContact O-N 2.8Å
232	S	77	Confident	78.4	Confident	41 Å²	41	38.1 Å²	38.1	29%	0.287	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-87.8	-5.6	179.1	59.5	0	0	0	0	113.8	S226 N229 I230 S234	S226-S232 VanDerWaalsContact O-CB 3.3Å; S226-S232 WeakPolarHBondContact O-CB 3.23Å; S226-S232 PolarHBondContact O-OG 2.87Å; N229-S232 PolarHBondContact O-N 2.92Å; N229-S232 PolarHBondContact O-OG 3.1Å; I230-S232 PolarHBondContact O-N 2.99Å; I230-S232 VanDerWaalsContact O-N 3.15Å; S232-S234 VanDerWaalsContact C-N 3.32Å; S232-S234 PolarHBondContact O-N 3.07Å
233	R	87.2	Confident	78.4	Confident	18 Å²	18	36.5 Å²	36.5	7%	0.068	25%	0.251	C	S	.	.			trans	-79.8	74.9	179	-60.9	179.5	-174.2	149.1	9.3	110.8	S43 K217 N227 I230 N235 I236 F238 E260	S43-R233 PolarHBondContact OG-NH1 3.26Å; K217-R233 PolarHBondContact NZ-O 3.28Å; K217-R233 VanDerWaalsContact NZ-O 3.1Å; N227-R233 VanDerWaalsContact OD1-CG 3.31Å; N227-R233 WeakPolarHBondContact OD1-CG 2.86Å; N227-R233 PolarHBondContact OD1-NE 2.82Å; I230-R233 WeakPolarHBondContact O-CB 3.16Å; I230-R233 PolarHBondContact O-N 3.02Å; R233-N235 PolarHBondContact O-N 3.2Å; R233-N235 VanDerWaalsContact O-N 3.14Å; R233-I236 HydrophobicContact CB-CB 4.43Å; R233-I236 HydrophobicContact CB-CG1 4.33Å; R233-I236 PolarHBondContact O-N 3.16Å; R233-F238 HydrophobicContact CB-CZ 3.95Å; R233-E260 IonicContact NH1-OE1 3.87Å; R233-E260 PolarHBondContact NH1-OE1 3.45Å; R233-E260 IonicContact NH1-OE2 3.42Å; R233-E260 PolarHBondContact NH1-OE2 3.4Å
234	S	86.9	Confident	78.5	Confident	22 Å²	22	37.7 Å²	37.7	15%	0.154	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.6	-178.1	62.4	0	0	0	0	114.5	K217 S218 Q222 S232	K217-S234 CarbonylContact C-O 3.53Å; K217-S234 WeakPolarHBondContact CA-O 3.49Å; K217-S234 WeakPolarHBondContact CB-O 3.48Å; K217-S234 WeakPolarHBondContact CD-O 3.45Å; S218-S234 PolarHBondContact N-O 3.1Å; S218-S234 PolarHBondContact OG-OG 3.24Å; Q222-S234 PolarHBondContact NE2-OG 2.94Å; Q222-S234 VanDerWaalsContact NE2-OG 3.09Å; S232-S234 VanDerWaalsContact C-N 3.32Å; S232-S234 PolarHBondContact O-N 3.07Å
235	N	91.3	Very high	78.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	4.5	-174.6	71.7	-11.9	0	0	0	115	S47 R194 L195 S218 T220 R233	S47-N235 WeakPolarHBondContact CA-OD1 3.48Å; S47-N235 WeakPolarHBondContact CB-OD1 3.18Å; S47-N235 PolarHBondContact O-ND2 3.42Å; R194-N235 VanDerWaalsContact CZ-ND2 3.3Å; R194-N235 PolarHBondContact NH1-O 2.65Å; R194-N235 PolarHBondContact NH2-ND2 3.21Å; L195-N235 PolarHBondContact N-O 3.27Å; S218-N235 WeakPolarHBondContact O-CA 3.38Å; S218-N235 WeakPolarHBondContact O-CB 3.23Å; T220-N235 WeakPolarHBondContact O-CB 3.41Å; T220-N235 PolarHBondContact O-ND2 3.36Å; R233-N235 PolarHBondContact O-N 3.2Å; R233-N235 VanDerWaalsContact O-N 3.14Å
236	I	92.3	Very high	79.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140	171.4	-56.2	-59.6	0	0	0	108.5	A46 L193 R194 K217 R233 F238 I253	A46-I236 HydrophobicContact CB-CD1 4.02Å; L193-I236 CarbonylContact O-C 3.48Å; L193-I236 VanDerWaalsContact O-CA 3.29Å; L193-I236 WeakPolarHBondContact O-CA 3.39Å; R194-I236 HydrophobicContact CB-CD1 4.23Å; R194-I236 HydrophobicContact CG-CD1 4.5Å; K217-I236 WeakPolarHBondContact CE-O 3.4Å; K217-I236 PolarHBondContact NZ-O 3.33Å; R233-I236 HydrophobicContact CB-CB 4.43Å; R233-I236 HydrophobicContact CB-CG1 4.33Å; R233-I236 PolarHBondContact O-N 3.16Å; I236-F238 HydrophobicContact CB-CE1 4.15Å; I236-F238 HydrophobicContact CB-CZ 4.16Å; I236-F238 HydrophobicContact CG2-CD1 3.76Å; I236-F238 HydrophobicContact CG2-CE1 3.55Å; I236-F238 HydrophobicContact CG2-CG 4.41Å; I236-F238 HydrophobicContact CG2-CZ 4.05Å; I236-I253 HydrophobicContact CD1-CD1 4.03Å; I236-I253 HydrophobicContact CG2-CD1 4.33Å
237	A	91.8	Very high	80.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126	163.7	0	0	0	0	0	108.3	L183 V189 D192 L193 L195 I203	L183-A237 HydrophobicContact CD1-CB 4.17Å; V189-A237 HydrophobicContact CG1-CB 4.02Å; V189-A237 HydrophobicContact CG2-CB 4.15Å; D192-A237 WeakPolarHBondContact CA-O 3.49Å; L193-A237 HydrophobicContact CB-CB 4.3Å; L193-A237 PolarHBondContact N-O 3.09Å; L193-A237 PolarHBondContact O-N 3.08Å; L195-A237 HydrophobicContact CD1-CB 4.47Å; L195-A237 HydrophobicContact CD2-CB 3.96Å; L195-A237 HydrophobicContact CG-CB 4.31Å; I203-A237 HydrophobicContact CD1-CB 3.56Å
238	F	90.1	Very high	82.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.217	C	C	.	.			trans	-93.5	143	-173.1	-57.9	-73.6	0	0	0	112.3	V189 D192 E205 L208 I230 R233 I236 G240 T241 E260	V189-F238 VanDerWaalsContact CB-O 3.23Å; V189-F238 WeakPolarHBondContact CB-O 3.15Å; V189-F238 VanDerWaalsContact CG1-O 3.31Å; V189-F238 WeakPolarHBondContact CG1-O 3.43Å; D192-F238 VanDerWaalsContact OD1-CA 3.32Å; D192-F238 WeakPolarHBondContact OD1-CA 3.49Å; E205-F238 WeakPolarHBondContact OE1-CD2 3.41Å; E205-F238 WeakPolarHBondContact OE1-CE2 3.08Å; L208-F238 HydrophobicContact CD2-CB 3.69Å; L208-F238 HydrophobicContact CD2-CD1 4.06Å; L208-F238 HydrophobicContact CD2-CD2 3.94Å; L208-F238 HydrophobicContact CD2-CG 3.63Å; I230-F238 HydrophobicContact CG2-CE1 4.14Å; I230-F238 HydrophobicContact CG2-CE2 3.91Å; I230-F238 HydrophobicContact CG2-CZ 3.65Å; R233-F238 HydrophobicContact CB-CZ 3.95Å; I236-F238 HydrophobicContact CB-CE1 4.15Å; I236-F238 HydrophobicContact CB-CZ 4.16Å; I236-F238 HydrophobicContact CG2-CD1 3.76Å; I236-F238 HydrophobicContact CG2-CE1 3.55Å; I236-F238 HydrophobicContact CG2-CG 4.41Å; I236-F238 HydrophobicContact CG2-CZ 4.05Å; F238-G240 PolarHBondContact O-N 3.45Å; F238-T241 HydrophobicContact CB-CG2 4Å; F238-T241 WeakPolarHBondContact O-CB 3.45Å; F238-T241 WeakPolarHBondContact O-CG2 3.4Å; F238-T241 PolarHBondContact O-N 2.64Å; F238-T241 PolarHBondContact O-OG1 3.46Å; F238-E260 HydrophobicContact CD1-CB 4.26Å; F238-E260 HydrophobicContact CD1-CG 4.01Å; F238-E260 HydrophobicContact CE1-CG 3.93Å
239	M	86.6	Confident	83.7	Confident	24 Å²	24	36.2 Å²	36.2	12%	0.118	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	135.7	175	-176	179.2	173.6	0	0	111.6	F83 V189 D192 T241 F261	F83-M239 HydrophobicContact CE2-CE 3.94Å; F83-M239 HydrophobicContact CZ-CE 3.7Å; F83-M239 HydrophobicContact CZ-SD 4.16Å; V189-M239 CarbonylContact O-C 3.6Å; V189-M239 WeakPolarHBondContact O-CA 3.48Å; D192-M239 PolarHBondContact OD1-N 2.77Å; M239-T241 VanDerWaalsContact C-N 3.3Å; M239-T241 PolarHBondContact O-N 3.07Å; M239-F261 HydrophobicContact CB-CB 4.24Å
240	G	79.1	Confident	84.8	Confident	20 Å²	20	30.9 Å²	30.9	21%	0.206	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	-7.5	177.2	0	0	0	0	0	115.6	V189 F238	V189-G240 PolarHBondContact O-N 3.26Å; F238-G240 PolarHBondContact O-N 3.45Å
241	T	83.8	Confident	85.6	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.			trans	-79.2	155	176.4	62.8	0	0	0	0	112.2	R188 V189 I203 D204 E205 F238 M239	R188-T241 CarbonylContact C-O 3.58Å; R188-T241 WeakPolarHBondContact CA-O 3.24Å; V189-T241 WeakPolarHBondContact CG2-OG1 3.36Å; V189-T241 PolarHBondContact N-O 3.26Å; I203-T241 VanDerWaalsContact CG2-OG1 3.23Å; I203-T241 WeakPolarHBondContact CG2-OG1 3.45Å; D204-T241 WeakPolarHBondContact O-CB 3.29Å; E205-T241 HydrophobicContact CB-CG2 4.31Å; E205-T241 HydrophobicContact CG-CG2 4.25Å; F238-T241 HydrophobicContact CB-CG2 4Å; F238-T241 WeakPolarHBondContact O-CB 3.45Å; F238-T241 WeakPolarHBondContact O-CG2 3.4Å; F238-T241 PolarHBondContact O-N 2.64Å; F238-T241 PolarHBondContact O-OG1 3.46Å; M239-T241 VanDerWaalsContact C-N 3.3Å; M239-T241 PolarHBondContact O-N 3.07Å
242	L	82.6	Confident	86.6	Confident	49 Å²	49	26.5 Å²	26.5	26%	0.257	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130	-172.9	179.8	72.7	0	0	0	112	R188 D204 R244	R188-L242 HydrophobicContact CG-CD1 4.08Å; D204-L242 HydrophobicContact CB-CB 4.31Å; D204-L242 PolarHBondContact N-O 3.48Å; D204-L242 PolarHBondContact O-N 3.22Å; L242-R244 PolarHBondContact O-N 3.33Å
243	V	84.9	Confident	87.3	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.006	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	115.5	176.5	-176.1	0	0	0	0	110.2	L183 S184 G186 E187 V189 L201 I203	L183-V243 HydrophobicContact CB-CG2 4.15Å; L183-V243 HydrophobicContact CD1-CG2 4.29Å; L183-V243 HydrophobicContact CD2-CG2 4.47Å; S184-V243 WeakPolarHBondContact O-CB 3.29Å; G186-V243 PolarHBondContact N-O 2.84Å; E187-V243 WeakPolarHBondContact O-CG2 3.17Å; E187-V243 PolarHBondContact O-N 2.87Å; V189-V243 HydrophobicContact CG2-CG2 4.29Å; L201-V243 HydrophobicContact CD1-CG1 3.78Å; I203-V243 HydrophobicContact CG1-CG2 4.46Å
244	R	79.4	Confident	87.4	Confident	101 Å²	101	23.8 Å²	23.8	38%	0.381	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-39.9	-178.1	-70.9	-68.9	-170.7	173.9	-0.5	113.2	V185 S202 D204 P214 L242	V185-R244 WeakPolarHBondContact CG1-O 3.42Å; S202-R244 PolarHBondContact O-N 3.32Å; D204-R244 HydrophobicContact CB-CG 3.68Å; D204-R244 IonicContact OD2-CZ 2.77Å; D204-R244 VanDerWaalsContact OD2-CZ 3.31Å; D204-R244 IonicContact OD2-NE 3.1Å; D204-R244 PolarHBondContact OD2-NE 3.06Å; D204-R244 IonicContact OD2-NH2 3Å; D204-R244 PolarHBondContact OD2-NH2 3.06Å; P214-R244 HydrophobicContact CB-CG 4.4Å; P214-R244 HydrophobicContact CG-CG 4.2Å; L242-R244 PolarHBondContact O-N 3.33Å
245	C	76.9	Confident	87.4	Confident	64 Å²	64	23 Å²	23	43%	0.432	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	156	179.9	-160.9	0	0	0	0	110.2	D200 L201 S202	D200-C245 CarbonylContact O-C 3.55Å; L201-C245 WeakPolarHBondContact CA-O 3.39Å; S202-C245 PolarHBondContact N-O 3.19Å; S202-C245 PolarHBondContact O-N 3.45Å; S202-C245 WeakPolarHBondContact OG-CB 3.47Å; S202-C245 PolarHBondContact OG-N 3.42Å
246	G	79.6	Confident	87	Confident	13 Å²	13	23 Å²	23	13%	0.134	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	83.9	-176.2	176.2	0	0	0	0	0	114.6	V185 S199 D200	V185-G246 VanDerWaalsContact CG2-O 3.22Å; V185-G246 WeakPolarHBondContact CG2-O 3.47Å; S199-G246 WeakPolarHBondContact O-CA 3.41Å; D200-G246 WeakPolarHBondContact O-CA 3.27Å
247	K	84.4	Confident	86.4	Confident	133 Å²	133	26.2 Å²	26.2	58%	0.578	13%	0.134	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.3	174.6	-65.8	-176.4	179.8	-176	0	109.7	L183 S199	L183-K247 WeakPolarHBondContact O-CA 3.44Å; S199-K247 PolarHBondContact N-O 3.4Å; S199-K247 PolarHBondContact O-N 3.23Å; S199-K247 VanDerWaalsContact O-N 3.11Å; S199-K247 PolarHBondContact OG-O 3.25Å
248	A	91.3	Very high	86	Confident	6 Å²	6	30 Å²	30	5%	0.05	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	160.5	176.9	0	0	0	0	0	113.1	L183 L195 E197 A198 L201	L183-A248 HydrophobicContact CB-CB 4.4Å; L183-A248 PolarHBondContact N-O 3.27Å; L183-A248 PolarHBondContact O-N 3.4Å; L195-A248 HydrophobicContact CD2-CB 4.01Å; E197-A248 CarbonylContact O-C 3.33Å; E197-A248 WeakPolarHBondContact O-CA 3.26Å; E197-A248 VanDerWaalsContact O-CB 3.25Å; E197-A248 WeakPolarHBondContact O-CB 3.39Å; A198-A248 HydrophobicContact CB-CB 4.32Å; L201-A248 HydrophobicContact CB-CB 4.48Å; L201-A248 HydrophobicContact CD1-CB 3.79Å; L201-A248 HydrophobicContact CD2-CB 3.34Å; L201-A248 HydrophobicContact CG-CB 4.05Å
249	K	92.4	Very high	85.8	Confident	65 Å²	65	30.2 Å²	30.2	28%	0.283	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	139.8	165.3	-56.5	-174.2	-169.5	137.1	0	109.5	I162 V181 Y196 E197	I162-K249 HydrophobicContact CD1-CD 4.34Å; V181-K249 WeakPolarHBondContact O-CA 3.42Å; Y196-K249 HydrophobicContact CD1-CB 4.45Å; Y196-K249 WeakPolarHBondContact CD1-O 3.45Å; Y196-K249 HydrophobicContact CE1-CB 3.72Å; Y196-K249 HydrophobicContact CE2-CB 3.81Å; Y196-K249 HydrophobicContact CE2-CD 4.21Å; Y196-K249 PolarHBondContact N-O 3.41Å; Y196-K249 WeakPolarHBondContact OH-CB 3.26Å; Y196-K249 VanDerWaalsContact OH-CD 3.27Å; Y196-K249 WeakPolarHBondContact OH-CD 3.35Å; E197-K249 HydrophobicContact CB-CB 4.13Å; E197-K249 HydrophobicContact CB-CG 4.45Å; E197-K249 PolarHBondContact N-O 2.88Å; E197-K249 PolarHBondContact O-N 3.17Å; E197-K249 WeakPolarHBondContact OE2-CD 3.33Å; E197-K249 WeakPolarHBondContact OE2-CE 3.37Å; E197-K249 IonicContact OE2-NZ 3.58Å; E197-K249 PolarHBondContact OE2-NZ 3.3Å
250	G	93.1	Very high	85.7	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	156.3	-179.9	0	0	0	0	0	112.4	V181 R194	V181-G250 PolarHBondContact N-O 3.37Å; V181-G250 PolarHBondContact O-N 3.48Å; R194-G250 CarbonylContact O-C 3.59Å; R194-G250 WeakPolarHBondContact O-CA 3.49Å
251	I	93.8	Very high	85.6	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	132.8	174	-47	172.3	0	0	0	108.2	A55 L58 A60 L62 D179 L193 R194 Y196 I253	A55-I251 HydrophobicContact CB-CD1 3.93Å; L58-I251 HydrophobicContact CD1-CG2 3.74Å; A60-I251 HydrophobicContact CB-CG2 4.21Å; L62-I251 HydrophobicContact CD2-CD1 3.34Å; L62-I251 HydrophobicContact CD2-CG1 3.7Å; D179-I251 CarbonylContact O-C 3.54Å; D179-I251 WeakPolarHBondContact O-CA 3.31Å; L193-I251 CarbonylContact C-O 3.57Å; L193-I251 VanDerWaalsContact CA-O 3.27Å; L193-I251 WeakPolarHBondContact CA-O 3.21Å; R194-I251 PolarHBondContact N-O 3.31Å; R194-I251 PolarHBondContact O-N 3.34Å; Y196-I251 HydrophobicContact CD1-CG1 3.92Å; Y196-I251 HydrophobicContact CE1-CG1 4.17Å; I251-I253 PolarHBondContact O-N 3.19Å
252	V	93.5	Very high	85.2	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	118.1	175.1	-179.3	0	0	0	0	109.8	G178 D179 V181 A191 D192 L193 T255	G178-V252 PolarHBondContact N-O 2.96Å; D179-V252 HydrophobicContact CB-CB 4.45Å; D179-V252 HydrophobicContact CB-CG2 3.87Å; D179-V252 WeakPolarHBondContact O-CG2 3.38Å; D179-V252 PolarHBondContact O-N 3.49Å; V181-V252 HydrophobicContact CG2-CG2 3.71Å; A191-V252 HydrophobicContact CB-CG1 3.84Å; A191-V252 HydrophobicContact CB-CG2 4.36Å; D192-V252 WeakPolarHBondContact O-CA 3.08Å; L193-V252 HydrophobicContact CD2-CB 4.19Å; L193-V252 HydrophobicContact CD2-CG2 3.54Å; V252-T255 HydrophobicContact CG1-CG2 3.56Å
253	I	92.4	Very high	85	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-29.2	177.9	52.7	161.7	0	0	0	112.7	V40 L41 A46 V54 L58 D192 R194 I236 I251	V40-I253 WeakPolarHBondContact CG1-O 3.34Å; L41-I253 HydrophobicContact CB-CB 4.43Å; L41-I253 PolarHBondContact N-O 3.38Å; A46-I253 HydrophobicContact CB-CB 4.49Å; A46-I253 HydrophobicContact CB-CD1 3.84Å; A46-I253 HydrophobicContact CB-CG2 3.94Å; V54-I253 HydrophobicContact CG1-CG2 4.24Å; L58-I253 HydrophobicContact CD1-CG2 4.12Å; D192-I253 HydrophobicContact CB-CD1 4.08Å; D192-I253 HydrophobicContact CB-CG1 3.76Å; D192-I253 WeakPolarHBondContact O-CG1 3.19Å; D192-I253 PolarHBondContact O-N 3.22Å; R194-I253 HydrophobicContact CB-CG2 3.72Å; I236-I253 HydrophobicContact CD1-CD1 4.03Å; I236-I253 HydrophobicContact CG2-CD1 4.33Å; I251-I253 PolarHBondContact O-N 3.19Å
254	G	88.4	Confident	84.5	Confident	1 Å²	1	34 Å²	34	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	138.4	-179.1	0	0	0	0	0	111.9	D192	D192-G254 PolarHBondContact N-O 2.86Å; D192-G254 VanDerWaalsContact N-O 3.11Å
255	T	88.4	Confident	84.1	Confident	4 Å²	4	29.7 Å²	29.7	3%	0.025	15%	0.152	C	C	.	.			trans	-118.7	152.1	-179.7	51.9	0	0	0	0	110.7	N81 P177 A191 V252 E257 N258	N81-T255 HydrophobicContact CB-CG2 4.3Å; P177-T255 HydrophobicContact CG-CG2 4.28Å; A191-T255 HydrophobicContact CB-CG2 4.26Å; V252-T255 HydrophobicContact CG1-CG2 3.56Å; T255-E257 PolarHBondContact O-N 2.86Å; T255-N258 PolarHBondContact O-N 2.92Å
256	G	82.3	Confident	84.1	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.01	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	49.6	-122.8	173.7	0	0	0	0	0	112.6	N81 N258 S259 G262	N81-G256 PolarHBondContact OD1-N 2.82Å; G256-N258 PolarHBondContact O-N 3.18Å; G256-S259 PolarHBondContact O-N 2.79Å; G256-S259 PolarHBondContact O-OG 2.87Å; G256-G262 WeakPolarHBondContact O-CA 3.21Å
257	E	78.9	Confident	83.8	Confident	68 Å²	68	34.6 Å²	34.6	32%	0.318	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-59.1	-20.5	178.7	-79.8	-161.6	177.7	0	0	116.4	T255 K266	T255-E257 PolarHBondContact O-N 2.86Å; E257-K266 WeakPolarHBondContact OE2-CE 3.22Å; E257-K266 IonicContact OE2-NZ 2.96Å; E257-K266 PolarHBondContact OE2-NZ 3.01Å
258	N	84.4	Confident	83.3	Confident	80 Å²	80	28.5 Å²	28.5	43%	0.428	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-97.1	1.8	-178	-61.3	-35.4	0	0	0	113.2	V40 T255 G256	V40-N258 HydrophobicContact CG1-CB 3.89Å; T255-N258 PolarHBondContact O-N 2.92Å; G256-N258 PolarHBondContact O-N 3.18Å
259	S	86.3	Confident	82.3	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.021	16%	0.157	C	C	.	.	S	Bend	trans	-77.8	161.5	167.6	66.6	0	0	0	0	111.1	D192 G256 F261 G262 E263	D192-S259 VanDerWaalsContact OD2-CA 3.29Å; D192-S259 WeakPolarHBondContact OD2-CA 3.45Å; D192-S259 WeakPolarHBondContact OD2-CB 3.46Å; G256-S259 PolarHBondContact O-N 2.79Å; G256-S259 PolarHBondContact O-OG 2.87Å; S259-F261 PolarHBondContact O-N 3.06Å; S259-G262 WeakPolarHBondContact O-CA 3.39Å; S259-G262 PolarHBondContact O-N 2.71Å; S259-G262 PolarHBondContact OG-N 3.36Å; S259-E263 PolarHBondContact O-N 2.84Å
260	E	83.4	Confident	81.4	Confident	26 Å²	26	33.6 Å²	33.6	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-59.3	-34.5	172.5	-62.8	-76.5	144.2	0	0	110.9	S43 D192 R233 F238 E263 V264	S43-E260 WeakPolarHBondContact CB-OE1 3.49Å; S43-E260 WeakPolarHBondContact OG-CG 3.45Å; S43-E260 PolarHBondContact OG-OE1 3.46Å; D192-E260 PolarHBondContact OD2-N 3.28Å; R233-E260 IonicContact NH1-OE1 3.87Å; R233-E260 PolarHBondContact NH1-OE1 3.45Å; R233-E260 IonicContact NH1-OE2 3.42Å; R233-E260 PolarHBondContact NH1-OE2 3.4Å; F238-E260 HydrophobicContact CD1-CB 4.26Å; F238-E260 HydrophobicContact CD1-CG 4.01Å; F238-E260 HydrophobicContact CE1-CG 3.93Å; E260-E263 PolarHBondContact O-N 3.18Å; E260-V264 PolarHBondContact O-N 2.91Å
261	F	77.4	Confident	80.6	Confident	15 Å²	15	36.2 Å²	36.2	7%	0.066	19%	0.189	C	C	.	.	H	α-helix	trans	-67	-38.6	173.9	-168.6	-87.8	0	0	0	111.8	F83 L208 M239 S259 V264 F265 V666 V688	F83-F261 HydrophobicContact CE1-CD1 4.43Å; F83-F261 HydrophobicContact CE2-CD1 4.22Å; F83-F261 HydrophobicContact CE2-CE1 4.01Å; F83-F261 AromaticContact CZ-CD1 3.6Å; F83-F261 HydrophobicContact CZ-CD1 3.6Å; F83-F261 AromaticContact CZ-CE1 3.86Å; F83-F261 HydrophobicContact CZ-CE1 3.86Å; L208-F261 HydrophobicContact CD1-CD2 4.41Å; M239-F261 HydrophobicContact CB-CB 4.24Å; S259-F261 PolarHBondContact O-N 3.06Å; F261-V264 PolarHBondContact O-N 3.2Å; F261-F265 PolarHBondContact O-N 3.27Å; F261-V666 HydrophobicContact CD2-CG2 4.04Å; F261-V666 HydrophobicContact CE2-CG1 4.44Å; F261-V666 HydrophobicContact CE2-CG2 3.41Å; F261-V666 VanDerWaalsContact CE2-CG2 3.41Å; F261-V666 HydrophobicContact CZ-CG2 4.25Å; F261-V688 HydrophobicContact CD1-CG2 4Å; F261-V688 HydrophobicContact CE1-CB 4.03Å; F261-V688 HydrophobicContact CE1-CG2 3.02Å; F261-V688 HydrophobicContact CE2-CB 4.3Å; F261-V688 HydrophobicContact CE2-CG2 4.12Å; F261-V688 HydrophobicContact CZ-CB 3.57Å; F261-V688 HydrophobicContact CZ-CG2 3.09Å
262	G	75.9	Confident	79.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-33.4	173.7	0	0	0	0	0	113.7	G256 S259 F265 K266	G256-G262 WeakPolarHBondContact O-CA 3.21Å; S259-G262 WeakPolarHBondContact O-CA 3.39Å; S259-G262 PolarHBondContact O-N 2.71Å; S259-G262 PolarHBondContact OG-N 3.36Å; G262-F265 WeakPolarHBondContact O-CB 3.35Å; G262-F265 PolarHBondContact O-N 2.72Å; G262-K266 WeakPolarHBondContact O-CG 3.34Å; G262-K266 PolarHBondContact O-N 2.89Å
263	E	77.9	Confident	78.3	Confident	102 Å²	102	47 Å²	47	48%	0.477	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-42.4	174.6	-156.6	-177.1	164.8	0	0	111.4	S259 E260 F265 K266 M267	S259-E263 PolarHBondContact O-N 2.84Å; E260-E263 PolarHBondContact O-N 3.18Å; E263-F265 VanDerWaalsContact C-N 3.31Å; E263-F265 PolarHBondContact O-N 3.04Å; E263-K266 PolarHBondContact O-N 2.91Å; E263-M267 HydrophobicContact CG-CE 3.78Å; E263-M267 WeakPolarHBondContact O-CG 3.11Å; E263-M267 PolarHBondContact O-N 2.88Å
264	V	73.3	Confident	77.5	Confident	30 Å²	30	49.4 Å²	49.4	18%	0.182	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-39.7	173	-177.8	0	0	0	0	111.1	E260 F261 M267 M268 V666 V670	E260-V264 PolarHBondContact O-N 2.91Å; F261-V264 PolarHBondContact O-N 3.2Å; V264-M267 PolarHBondContact O-N 3.37Å; V264-M268 PolarHBondContact O-N 2.97Å; V264-V666 HydrophobicContact CB-CG1 4.16Å; V264-V666 HydrophobicContact CG1-CG1 3.68Å; V264-V666 HydrophobicContact CG2-CG1 4.43Å; V264-V670 HydrophobicContact CG1-CG2 4.38Å
265	F	72.8	Confident	76.9	Confident	11 Å²	11	55.5 Å²	55.5	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-40.5	175.9	-173.9	-98.3	0	0	0	112.5	F83 F261 G262 E263 M268 Q269 V688 E691	F83-F265 HydrophobicContact CB-CD1 4.07Å; F83-F265 HydrophobicContact CB-CE1 3.53Å; F83-F265 HydrophobicContact CB-CE2 4.44Å; F83-F265 HydrophobicContact CB-CZ 3.74Å; F83-F265 HydrophobicContact CD1-CB 4.4Å; F83-F265 AromaticContact CD1-CD1 3.75Å; F83-F265 HydrophobicContact CD1-CD1 3.75Å; F83-F265 HydrophobicContact CD1-CE1 4.12Å; F83-F265 HydrophobicContact CD1-CG 4.03Å; F83-F265 HydrophobicContact CE1-CB 4.4Å; F83-F265 HydrophobicContact CE1-CG 4.46Å; F83-F265 HydrophobicContact CG-CD1 4.01Å; F83-F265 HydrophobicContact CG-CD2 4.5Å; F83-F265 AromaticContact CG-CE1 3.95Å; F83-F265 HydrophobicContact CG-CE1 3.95Å; F83-F265 HydrophobicContact CG-CE2 4.45Å; F83-F265 HydrophobicContact CG-CG 4.28Å; F83-F265 HydrophobicContact CG-CZ 4.18Å; F261-F265 PolarHBondContact O-N 3.27Å; G262-F265 WeakPolarHBondContact O-CB 3.35Å; G262-F265 PolarHBondContact O-N 2.72Å; E263-F265 VanDerWaalsContact C-N 3.31Å; E263-F265 PolarHBondContact O-N 3.04Å; F265-M268 HydrophobicContact CD2-CE 3.44Å; F265-M268 VanDerWaalsContact CD2-CE 3.44Å; F265-M268 HydrophobicContact CE2-CE 3.38Å; F265-M268 HydrophobicContact CG-CE 4.23Å; F265-M268 HydrophobicContact CZ-CE 4.12Å; F265-M268 WeakPolarHBondContact O-CB 3.01Å; F265-M268 PolarHBondContact O-N 2.91Å; F265-Q269 HydrophobicContact CD1-CG 4.35Å; F265-Q269 HydrophobicContact CE1-CG 3.98Å; F265-Q269 HydrophobicContact CZ-CG 4.32Å; F265-Q269 PolarHBondContact O-N 3.46Å; F265-V688 HydrophobicContact CD2-CG2 4.17Å; F265-E691 HydrophobicContact CE2-CG 4.24Å
266	K	75.2	Confident	76.7	Confident	81 Å²	81	55.9 Å²	55.9	35%	0.352	29%	0.291	S	S	.	.	H	α-helix	trans	-62	-44.3	172.9	-77.8	177.9	174.6	173.3	0	112.5	E257 G262 E263 M268 Q269 A270	E257-K266 WeakPolarHBondContact OE2-CE 3.22Å; E257-K266 IonicContact OE2-NZ 2.96Å; E257-K266 PolarHBondContact OE2-NZ 3.01Å; G262-K266 WeakPolarHBondContact O-CG 3.34Å; G262-K266 PolarHBondContact O-N 2.89Å; E263-K266 PolarHBondContact O-N 2.91Å; K266-M268 PolarHBondContact O-N 2.86Å; K266-Q269 PolarHBondContact O-N 2.85Å; K266-A270 WeakPolarHBondContact O-CB 3.25Å; K266-A270 PolarHBondContact O-N 3.2Å
267	M	73.8	Confident	76.7	Confident	100 Å²	100	56.6 Å²	56.6	49%	0.493	30%	0.296	S	S	.	.	H	α-helix	trans	-61.4	-36.7	175.3	-66.9	-175.6	-144.1	0	0	111.5	E263 V264	E263-M267 HydrophobicContact CG-CE 3.78Å; E263-M267 WeakPolarHBondContact O-CG 3.11Å; E263-M267 PolarHBondContact O-N 2.88Å; V264-M267 PolarHBondContact O-N 3.37Å
268	M	74.9	Confident	76.8	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-68.2	-43	175.2	-179.7	-81.2	-62.9	0	0	112.2	V264 F265 K266 A270 E271 K673 A692	V264-M268 PolarHBondContact O-N 2.97Å; F265-M268 HydrophobicContact CD2-CE 3.44Å; F265-M268 VanDerWaalsContact CD2-CE 3.44Å; F265-M268 HydrophobicContact CE2-CE 3.38Å; F265-M268 HydrophobicContact CG-CE 4.23Å; F265-M268 HydrophobicContact CZ-CE 4.12Å; F265-M268 WeakPolarHBondContact O-CB 3.01Å; F265-M268 PolarHBondContact O-N 2.91Å; K266-M268 PolarHBondContact O-N 2.86Å; M268-A270 VanDerWaalsContact C-N 3.32Å; M268-A270 PolarHBondContact O-N 3.41Å; M268-E271 PolarHBondContact O-N 3.22Å; M268-K673 HydrophobicContact CG-CB 3.89Å; M268-K673 HydrophobicContact CG-CD 4.43Å; M268-K673 HydrophobicContact CG-CG 3.99Å; M268-K673 HydrophobicContact SD-CB 4.48Å; M268-K673 HydrophobicContact SD-CD 3.92Å; M268-K673 HydrophobicContact SD-CG 4.07Å; M268-A692 HydrophobicContact CG-CB 3.91Å; M268-A692 HydrophobicContact SD-CB 4.29Å
269	Q	70.6	Confident	76.5	Confident	95 Å²	95	53.9 Å²	53.9	44%	0.444	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-32.9	176.6	-77.8	-161.6	0.4	0	0	113.2	D84 F265 K266 E271	D84-Q269 PolarHBondContact O-NE2 3Å; F265-Q269 HydrophobicContact CD1-CG 4.35Å; F265-Q269 HydrophobicContact CE1-CG 3.98Å; F265-Q269 HydrophobicContact CZ-CG 4.32Å; F265-Q269 PolarHBondContact O-N 3.46Å; K266-Q269 PolarHBondContact O-N 2.85Å; Q269-E271 PolarHBondContact O-N 2.91Å
270	A	73.1	Confident	76.2	Confident	82 Å²	82	59.4 Å²	59.4	68%	0.678	31%	0.305	S	S	*	.	H	α-helix	trans	-66.3	-20.5	178.3	0	0	0	0	0	113.3	K266 M268	K266-A270 WeakPolarHBondContact O-CB 3.25Å; K266-A270 PolarHBondContact O-N 3.2Å; M268-A270 VanDerWaalsContact C-N 3.32Å; M268-A270 PolarHBondContact O-N 3.41Å
271	E	75.3	Confident	76	Confident	55 Å²	55	59 Å²	59	26%	0.257	31%	0.305	S	S	.	.	S	Bend	trans	-85.9	113.2	177.1	-161.9	77.5	-174.2	0	0	110.5	M268 Q269 A273 K650 K673 A674	M268-E271 PolarHBondContact O-N 3.22Å; Q269-E271 PolarHBondContact O-N 2.91Å; E271-A273 PolarHBondContact O-N 2.74Å; E271-K650 WeakPolarHBondContact OE1-CE 3.43Å; E271-K650 IonicContact OE1-NZ 2.74Å; E271-K650 PolarHBondContact OE1-NZ 2.9Å; E271-K650 IonicContact OE2-NZ 3.82Å; E271-K673 HydrophobicContact CB-CG 4.37Å; E271-A674 HydrophobicContact CG-CB 4.18Å
272	E	72.5	Confident	76	Confident	179 Å²	179	60 Å²	60	84%	0.836	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-71.7	127.4	175.2	-70.2	-174.5	174.5	0	0	111.1
273	A	67.6	Low	76	Confident	48 Å²	48	63.9 Å²	63.9	40%	0.397	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-67.2	136.3	175.5	0	0	0	0	0	110.8	E271	E271-A273 PolarHBondContact O-N 2.74Å
274	P	74.3	Confident	76.1	Confident	51 Å²	51	63.1 Å²	63.1	33%	0.331	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-66	145.5	-179.1	26.6	-33.9	0	0	0	112	T276	P274-T276 PolarHBondContact O-N 2.58Å
275	K	77.4	Confident	76.4	Confident	130 Å²	130	62.2 Å²	62.2	57%	0.565	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-62.9	133.5	171.2	-71.3	-171	178.2	-168.7	0	111	K280	K275-K280 HydrophobicContact CB-CG 4.33Å; K275-K280 VanDerWaalsContact O-CE 3.27Å; K275-K280 WeakPolarHBondContact O-CE 3.42Å; K275-K280 PolarHBondContact O-NZ 3.17Å; K275-K280 VanDerWaalsContact O-NZ 3.11Å
276	T	83.1	Confident	76.5	Confident	11 Å²	11	63.6 Å²	63.6	7%	0.067	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-70.6	154.8	-176	66.6	0	0	0	0	112.9	P274 L278 Q279 K280 P356 I357	P274-T276 PolarHBondContact O-N 2.58Å; T276-L278 VanDerWaalsContact C-N 3.3Å; T276-L278 PolarHBondContact O-N 2.92Å; T276-Q279 PolarHBondContact O-N 2.96Å; T276-Q279 WeakPolarHBondContact OG1-CG 3.37Å; T276-Q279 PolarHBondContact OG1-N 3.36Å; T276-K280 PolarHBondContact O-N 3.38Å; T276-K280 VanDerWaalsContact O-N 3.11Å; T276-P356 HydrophobicContact CG2-CB 3.67Å; T276-P356 WeakPolarHBondContact OG1-CB 3.42Å; T276-I357 HydrophobicContact CG2-CD1 4.11Å
277	P	81.8	Confident	76.8	Confident	17 Å²	17	67.1 Å²	67.1	11%	0.11	36%	0.356	C	S	.	.	H	α-helix	trans	-58.2	-39	178.2	-23.9	34.4	0	0	0	113.3	S281 T360 V786	P277-S281 WeakPolarHBondContact O-CB 3.39Å; P277-S281 PolarHBondContact O-N 3.41Å; P277-S281 PolarHBondContact O-OG 3.46Å; P277-T360 WeakPolarHBondContact CD-OG1 3.4Å; P277-V786 HydrophobicContact CG-CG1 4.18Å
278	L	80.8	Confident	77.2	Confident	6 Å²	6	65.9 Å²	65.9	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-60.4	-48.3	175.1	-174.1	61.4	0	0	0	112.3	T276 K280 S281 M282 V334 L338 E359 I719 I790	T276-L278 VanDerWaalsContact C-N 3.3Å; T276-L278 PolarHBondContact O-N 2.92Å; L278-K280 PolarHBondContact O-N 3.16Å; L278-S281 CarbonylContact O-C 3.31Å; L278-S281 PolarHBondContact O-N 3.31Å; L278-S281 VanDerWaalsContact O-N 3.13Å; L278-M282 HydrophobicContact CD1-CE 4.13Å; L278-M282 HydrophobicContact CD1-CG 4.26Å; L278-M282 HydrophobicContact CG-CG 4.33Å; L278-M282 WeakPolarHBondContact O-CG 3.35Å; L278-M282 PolarHBondContact O-N 3.09Å; L278-V334 HydrophobicContact CD2-CG1 3.73Å; L278-L338 HydrophobicContact CD2-CD1 3.96Å; L278-E359 HydrophobicContact CB-CB 4.04Å; L278-E359 HydrophobicContact CB-CG 3.81Å; L278-E359 WeakPolarHBondContact CB-OE2 3.23Å; L278-E359 HydrophobicContact CD1-CG 4.4Å; L278-E359 HydrophobicContact CD2-CB 4.01Å; L278-E359 HydrophobicContact CD2-CG 4.27Å; L278-E359 HydrophobicContact CG-CG 4.39Å; L278-E359 PolarHBondContact N-OE2 3Å; L278-I719 HydrophobicContact CD1-CD1 4.45Å; L278-I719 HydrophobicContact CD2-CD1 4.22Å; L278-I790 HydrophobicContact CD1-CD1 3.87Å
279	Q	78.6	Confident	77.3	Confident	84 Å²	84	67 Å²	67	39%	0.393	36%	0.355	S	S	.	.	H	α-helix	trans	-59.6	-48.1	179.2	-75.7	175.4	-16	0	0	111.1	T276 S281 M282 D283	T276-Q279 PolarHBondContact O-N 2.96Å; T276-Q279 WeakPolarHBondContact OG1-CG 3.37Å; T276-Q279 PolarHBondContact OG1-N 3.36Å; Q279-S281 PolarHBondContact O-N 3.09Å; Q279-M282 PolarHBondContact O-N 3.43Å; Q279-D283 PolarHBondContact O-N 3.46Å
280	K	81.3	Confident	77.6	Confident	120 Å²	120	64.1 Å²	64.1	52%	0.522	35%	0.345	S	S	.	.	H	α-helix	trans	-57.1	-40.2	175.3	-70.8	172	179.1	158.8	0	112	K275 T276 L278 L284	K275-K280 HydrophobicContact CB-CG 4.33Å; K275-K280 VanDerWaalsContact O-CE 3.27Å; K275-K280 WeakPolarHBondContact O-CE 3.42Å; K275-K280 PolarHBondContact O-NZ 3.17Å; K275-K280 VanDerWaalsContact O-NZ 3.11Å; T276-K280 PolarHBondContact O-N 3.38Å; T276-K280 VanDerWaalsContact O-N 3.11Å; L278-K280 PolarHBondContact O-N 3.16Å; K280-L284 WeakPolarHBondContact O-CB 3.42Å; K280-L284 PolarHBondContact O-N 3.11Å; K280-L284 VanDerWaalsContact O-N 3.13Å
281	S	78.6	Confident	78.1	Confident	18 Å²	18	65.9 Å²	65.9	13%	0.126	34%	0.343	C	S	.	.	H	α-helix	trans	-72.3	-37.3	-179.8	-58.2	0	0	0	0	112.7	P277 L278 Q279 L285	P277-S281 WeakPolarHBondContact O-CB 3.39Å; P277-S281 PolarHBondContact O-N 3.41Å; P277-S281 PolarHBondContact O-OG 3.46Å; L278-S281 CarbonylContact O-C 3.31Å; L278-S281 PolarHBondContact O-N 3.31Å; L278-S281 VanDerWaalsContact O-N 3.13Å; Q279-S281 PolarHBondContact O-N 3.09Å; S281-L285 WeakPolarHBondContact O-CB 3.33Å; S281-L285 PolarHBondContact O-N 2.78Å
282	M	76.6	Confident	78.6	Confident	35 Å²	35	70 Å²	70	17%	0.172	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-43.5	175.3	-71.7	-61.2	102.4	0	0	111.3	L278 Q279 L284 L285 G286 L330 I790	L278-M282 HydrophobicContact CD1-CE 4.13Å; L278-M282 HydrophobicContact CD1-CG 4.26Å; L278-M282 HydrophobicContact CG-CG 4.33Å; L278-M282 WeakPolarHBondContact O-CG 3.35Å; L278-M282 PolarHBondContact O-N 3.09Å; Q279-M282 PolarHBondContact O-N 3.43Å; M282-L284 VanDerWaalsContact C-N 3.31Å; M282-L284 PolarHBondContact O-N 3.3Å; M282-L285 HydrophobicContact CE-CD1 3.55Å; M282-L285 PolarHBondContact O-N 3.32Å; M282-G286 PolarHBondContact O-N 3Å; M282-L330 HydrophobicContact SD-CD2 3.88Å; M282-L330 HydrophobicContact SD-CG 4.3Å; M282-I790 HydrophobicContact CE-CD1 3.21Å
283	D	76	Confident	79	Confident	82 Å²	82	61.8 Å²	61.8	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-59.3	-43.3	174.8	-74.6	-9.9	0	0	0	111.4	Q279 K287	Q279-D283 PolarHBondContact O-N 3.46Å; D283-K287 WeakPolarHBondContact O-CB 3.28Å; D283-K287 VanDerWaalsContact O-CG 3.27Å; D283-K287 WeakPolarHBondContact O-CG 3.44Å; D283-K287 PolarHBondContact O-N 3.2Å
284	L	80.4	Confident	79.7	Confident	85 Å²	85	64 Å²	64	45%	0.445	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-45.5	177.1	-169.6	83.2	0	0	0	111.3	K280 M282 K287 Q288	K280-L284 WeakPolarHBondContact O-CB 3.42Å; K280-L284 PolarHBondContact O-N 3.11Å; K280-L284 VanDerWaalsContact O-N 3.13Å; M282-L284 VanDerWaalsContact C-N 3.31Å; M282-L284 PolarHBondContact O-N 3.3Å; L284-K287 PolarHBondContact O-N 3.49Å; L284-Q288 WeakPolarHBondContact O-CB 3.48Å; L284-Q288 VanDerWaalsContact O-CG 3.31Å; L284-Q288 WeakPolarHBondContact O-CG 3.33Å; L284-Q288 PolarHBondContact O-N 3.25Å
285	L	79.6	Confident	80.3	Confident	11 Å²	11	63.6 Å²	63.6	6%	0.058	33%	0.326	C	S	.	.	H	α-helix	trans	-59.9	-48.6	177.6	-98.6	168	0	0	0	111.7	S281 M282 K287 Q288 L289 I790 L791	S281-L285 WeakPolarHBondContact O-CB 3.33Å; S281-L285 PolarHBondContact O-N 2.78Å; M282-L285 HydrophobicContact CE-CD1 3.55Å; M282-L285 PolarHBondContact O-N 3.32Å; L285-K287 PolarHBondContact O-N 3.13Å; L285-Q288 PolarHBondContact O-N 3.41Å; L285-L289 WeakPolarHBondContact O-CB 3.45Å; L285-L289 WeakPolarHBondContact O-CG 3.39Å; L285-L289 PolarHBondContact O-N 3.41Å; L285-I790 HydrophobicContact CD1-CB 4.16Å; L285-I790 HydrophobicContact CD1-CD1 4.44Å; L285-I790 HydrophobicContact CD1-CG2 4.26Å; L285-L791 HydrophobicContact CD2-CD1 3.36Å; L285-L791 HydrophobicContact CD2-CG 3.79Å
286	G	76.1	Confident	80.7	Confident	41 Å²	41	60.4 Å²	60.4	42%	0.423	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-45.2	177.2	0	0	0	0	0	111.8	M282 S290	M282-G286 PolarHBondContact O-N 3Å; G286-S290 WeakPolarHBondContact O-CB 3.06Å; G286-S290 PolarHBondContact O-N 2.98Å
287	K	79.8	Confident	80.8	Confident	154 Å²	154	60.5 Å²	60.5	67%	0.67	31%	0.314	S	S	*	.	H	α-helix	trans	-61.7	-44.4	175.6	-75.6	173.7	-177.7	176.3	0	112.7	D283 L284 L285 L291	D283-K287 WeakPolarHBondContact O-CB 3.28Å; D283-K287 VanDerWaalsContact O-CG 3.27Å; D283-K287 WeakPolarHBondContact O-CG 3.44Å; D283-K287 PolarHBondContact O-N 3.2Å; L284-K287 PolarHBondContact O-N 3.49Å; L285-K287 PolarHBondContact O-N 3.13Å; K287-L291 VanDerWaalsContact O-CB 3.27Å; K287-L291 WeakPolarHBondContact O-CB 3.37Å; K287-L291 PolarHBondContact O-N 3.2Å
288	Q	81.9	Confident	80.9	Confident	74 Å²	74	61.6 Å²	61.6	35%	0.346	33%	0.328	S	S	.	.	H	α-helix	trans	-66.6	-47.7	179.7	-75.7	178.6	-10.6	0	0	111.8	L284 L285 L291 Y292	L284-Q288 WeakPolarHBondContact O-CB 3.48Å; L284-Q288 VanDerWaalsContact O-CG 3.31Å; L284-Q288 WeakPolarHBondContact O-CG 3.33Å; L284-Q288 PolarHBondContact O-N 3.25Å; L285-Q288 PolarHBondContact O-N 3.41Å; Q288-L291 PolarHBondContact O-N 3.31Å; Q288-Y292 HydrophobicContact CB-CE2 4.17Å; Q288-Y292 WeakPolarHBondContact O-CD2 3.25Å; Q288-Y292 VanDerWaalsContact O-CG 3.31Å; Q288-Y292 PolarHBondContact O-N 2.88Å
289	L	77.8	Confident	81.3	Confident	29 Å²	29	65.4 Å²	65.4	15%	0.152	35%	0.351	C	S	.	.	H	α-helix	trans	-61	-49.2	177	-73.3	174.3	0	0	0	110.6	L285 L291 Y292 S293 P327 L727	L285-L289 WeakPolarHBondContact O-CB 3.45Å; L285-L289 WeakPolarHBondContact O-CG 3.39Å; L285-L289 PolarHBondContact O-N 3.41Å; L289-L291 VanDerWaalsContact C-N 3.32Å; L289-L291 PolarHBondContact O-N 3.46Å; L289-Y292 PolarHBondContact O-N 2.84Å; L289-S293 VanDerWaalsContact O-CB 3.25Å; L289-S293 WeakPolarHBondContact O-CB 3.16Å; L289-S293 PolarHBondContact O-N 2.73Å; L289-S293 PolarHBondContact O-OG 3.11Å; L289-P327 HydrophobicContact CD1-CG 4.21Å; L289-L727 HydrophobicContact CD1-CD1 4.16Å; L289-L727 HydrophobicContact CD2-CD1 4.29Å
290	S	77.4	Confident	81.6	Confident	34 Å²	34	61.8 Å²	61.8	24%	0.238	34%	0.335	C	S	.	.	H	α-helix	trans	-55.7	-46.3	176.8	179.7	0	0	0	0	111.7	G286 S293 F294	G286-S290 WeakPolarHBondContact O-CB 3.06Å; G286-S290 PolarHBondContact O-N 2.98Å; S290-S293 PolarHBondContact O-N 2.87Å; S290-F294 WeakPolarHBondContact O-CB 3.2Å; S290-F294 WeakPolarHBondContact O-CD2 3.11Å; S290-F294 PolarHBondContact O-N 2.74Å; S290-F294 WeakPolarHBondContact OG-CD2 3Å; S290-F294 VanDerWaalsContact OG-CE2 3.24Å; S290-F294 WeakPolarHBondContact OG-CE2 3.2Å
291	L	84.4	Confident	81.7	Confident	120 Å²	120	59 Å²	59	63%	0.628	32%	0.324	S	S	*	.	H	α-helix	trans	-63.3	-44.6	178.6	-176	135.5	0	0	0	112.8	K287 Q288 L289 G295	K287-L291 VanDerWaalsContact O-CB 3.27Å; K287-L291 WeakPolarHBondContact O-CB 3.37Å; K287-L291 PolarHBondContact O-N 3.2Å; Q288-L291 PolarHBondContact O-N 3.31Å; L289-L291 VanDerWaalsContact C-N 3.32Å; L289-L291 PolarHBondContact O-N 3.46Å; L291-G295 PolarHBondContact O-N 2.84Å; L291-G295 VanDerWaalsContact O-N 3.07Å
292	Y	84.3	Confident	82.1	Confident	140 Å²	140	62.9 Å²	62.9	55%	0.549	34%	0.343	S	S	.	.	H	α-helix	trans	-67.2	-42.8	176.8	-63.3	-40	0	0	0	112.2	Q288 L289 G295 I296	Q288-Y292 HydrophobicContact CB-CE2 4.17Å; Q288-Y292 WeakPolarHBondContact O-CD2 3.25Å; Q288-Y292 VanDerWaalsContact O-CG 3.31Å; Q288-Y292 PolarHBondContact O-N 2.88Å; L289-Y292 PolarHBondContact O-N 2.84Å; Y292-G295 PolarHBondContact O-N 2.85Å; Y292-I296 WeakPolarHBondContact O-CG1 3.4Å; Y292-I296 PolarHBondContact O-N 2.92Å
293	S	80.8	Confident	82.6	Confident	7 Å²	7	63.1 Å²	63.1	5%	0.049	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-48.6	178.9	-60.7	0	0	0	0	111.5	L289 S290 G295 I296 I297 A325	L289-S293 VanDerWaalsContact O-CB 3.25Å; L289-S293 WeakPolarHBondContact O-CB 3.16Å; L289-S293 PolarHBondContact O-N 2.73Å; L289-S293 PolarHBondContact O-OG 3.11Å; S290-S293 PolarHBondContact O-N 2.87Å; S293-G295 VanDerWaalsContact C-N 3.29Å; S293-G295 PolarHBondContact O-N 3.27Å; S293-I296 PolarHBondContact O-N 2.6Å; S293-I297 WeakPolarHBondContact O-CB 3.45Å; S293-I297 WeakPolarHBondContact O-CD1 3.19Å; S293-I297 WeakPolarHBondContact O-CG1 3.41Å; S293-I297 PolarHBondContact O-N 2.78Å; S293-A325 WeakPolarHBondContact OG-CB 3.38Å
294	F	83.7	Confident	83	Confident	96 Å²	96	59.2 Å²	59.2	42%	0.421	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-36.5	175.4	-79.6	-59	0	0	0	112.4	L106 S290 G298	L106-F294 HydrophobicContact CD1-CE1 4.19Å; L106-F294 HydrophobicContact CD1-CZ 4.37Å; S290-F294 WeakPolarHBondContact O-CB 3.2Å; S290-F294 WeakPolarHBondContact O-CD2 3.11Å; S290-F294 PolarHBondContact O-N 2.74Å; S290-F294 WeakPolarHBondContact OG-CD2 3Å; S290-F294 VanDerWaalsContact OG-CE2 3.24Å; S290-F294 WeakPolarHBondContact OG-CE2 3.2Å; F294-G298 PolarHBondContact O-N 3.18Å
295	G	86.9	Confident	83.2	Confident	42 Å²	42	62.6 Å²	62.6	43%	0.433	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-48.8	172.5	0	0	0	0	0	112.4	L291 Y292 S293 G298 V299	L291-G295 PolarHBondContact O-N 2.84Å; L291-G295 VanDerWaalsContact O-N 3.07Å; Y292-G295 PolarHBondContact O-N 2.85Å; S293-G295 VanDerWaalsContact C-N 3.29Å; S293-G295 PolarHBondContact O-N 3.27Å; G295-G298 PolarHBondContact O-N 3.49Å; G295-V299 WeakPolarHBondContact O-CG2 3.42Å; G295-V299 PolarHBondContact O-N 2.85Å; G295-V299 VanDerWaalsContact O-N 3.09Å
296	I	84.6	Confident	83.6	Confident	62 Å²	62	68.5 Å²	68.5	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-65.4	-45.5	178.9	-68.8	164.6	0	0	0	111.1	Y292 S293 G298 V299 I300 L734	Y292-I296 WeakPolarHBondContact O-CG1 3.4Å; Y292-I296 PolarHBondContact O-N 2.92Å; S293-I296 PolarHBondContact O-N 2.6Å; I296-G298 VanDerWaalsContact C-N 3.32Å; I296-G298 PolarHBondContact O-N 3.43Å; I296-V299 PolarHBondContact O-N 3.34Å; I296-I300 HydrophobicContact CG2-CD1 3.63Å; I296-I300 HydrophobicContact CG2-CG1 4.38Å; I296-I300 VanDerWaalsContact O-CG1 3.31Å; I296-I300 WeakPolarHBondContact O-CG1 3.21Å; I296-I300 PolarHBondContact O-N 2.98Å; I296-L734 HydrophobicContact CD1-CD2 3.81Å; I296-L734 HydrophobicContact CD1-CG 4.47Å; I296-L734 HydrophobicContact CG2-CD1 4.13Å; I296-L734 HydrophobicContact CG2-CG 4.47Å
297	I	84.8	Confident	84	Confident	14 Å²	14	69.9 Å²	69.9	7%	0.072	36%	0.359	C	S	.	.	H	α-helix	trans	-58	-46	176.6	-68.4	159	0	0	0	110.4	S293 V299 I300 M301 L321 A322	S293-I297 WeakPolarHBondContact O-CB 3.45Å; S293-I297 WeakPolarHBondContact O-CD1 3.19Å; S293-I297 WeakPolarHBondContact O-CG1 3.41Å; S293-I297 PolarHBondContact O-N 2.78Å; I297-V299 VanDerWaalsContact C-N 3.34Å; I297-V299 PolarHBondContact O-N 2.73Å; I297-I300 PolarHBondContact O-N 3.02Å; I297-M301 HydrophobicContact CG2-CG 4.42Å; I297-M301 HydrophobicContact CG2-SD 4.31Å; I297-M301 WeakPolarHBondContact O-CG 3.29Å; I297-M301 PolarHBondContact O-N 3.48Å; I297-L321 HydrophobicContact CG1-CB 4.09Å; I297-L321 HydrophobicContact CG1-CD2 3.72Å; I297-L321 HydrophobicContact CG1-CG 4.03Å; I297-A322 HydrophobicContact CD1-CB 3.82Å
298	G	85.6	Confident	84.1	Confident	39 Å²	39	65.8 Å²	65.8	40%	0.402	36%	0.36	S	S	.	.	H	α-helix	trans	-60.4	-42	177.8	0	0	0	0	0	112.9	F294 G295 I296 L302	F294-G298 PolarHBondContact O-N 3.18Å; G295-G298 PolarHBondContact O-N 3.49Å; I296-G298 VanDerWaalsContact C-N 3.32Å; I296-G298 PolarHBondContact O-N 3.43Å; G298-L302 WeakPolarHBondContact O-CB 3.32Å; G298-L302 PolarHBondContact O-N 3.07Å
299	V	87.9	Confident	84.1	Confident	87 Å²	87	64.7 Å²	64.7	53%	0.527	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-44.3	175	171.9	0	0	0	0	111.2	G295 I296 I297 L302 V303	G295-V299 WeakPolarHBondContact O-CG2 3.42Å; G295-V299 PolarHBondContact O-N 2.85Å; G295-V299 VanDerWaalsContact O-N 3.09Å; I296-V299 PolarHBondContact O-N 3.34Å; I297-V299 VanDerWaalsContact C-N 3.34Å; I297-V299 PolarHBondContact O-N 2.73Å; V299-L302 PolarHBondContact O-N 3.18Å; V299-V303 HydrophobicContact CG1-CG2 4.36Å; V299-V303 WeakPolarHBondContact O-CG2 3.29Å; V299-V303 PolarHBondContact O-N 3.02Å
300	I	84.4	Confident	84.3	Confident	8 Å²	8	72.1 Å²	72.1	4%	0.041	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-44.5	179.5	-68.4	164.3	0	0	0	110.9	I296 I297 L302 V303 G304 L321 T741	I296-I300 HydrophobicContact CG2-CD1 3.63Å; I296-I300 HydrophobicContact CG2-CG1 4.38Å; I296-I300 VanDerWaalsContact O-CG1 3.31Å; I296-I300 WeakPolarHBondContact O-CG1 3.21Å; I296-I300 PolarHBondContact O-N 2.98Å; I297-I300 PolarHBondContact O-N 3.02Å; I300-L302 VanDerWaalsContact C-N 3.3Å; I300-L302 PolarHBondContact O-N 2.99Å; I300-V303 PolarHBondContact O-N 2.94Å; I300-G304 PolarHBondContact O-N 2.7Å; I300-L321 HydrophobicContact CD1-CD2 3.38Å; I300-T741 HydrophobicContact CG2-CG2 3.78Å
301	M	84.7	Confident	84.5	Confident	62 Å²	62	75.6 Å²	75.6	31%	0.305	40%	0.395	S	S	.	.	H	α-helix	trans	-59.9	-42.3	175.7	-76.8	-172	60.9	0	0	111.7	I297 W305 M314	I297-M301 HydrophobicContact CG2-CG 4.42Å; I297-M301 HydrophobicContact CG2-SD 4.31Å; I297-M301 WeakPolarHBondContact O-CG 3.29Å; I297-M301 PolarHBondContact O-N 3.48Å; M301-W305 VanDerWaalsContact O-CB 3.32Å; M301-W305 WeakPolarHBondContact O-CB 3.45Å; M301-W305 PolarHBondContact O-N 2.74Å; M301-M314 HydrophobicContact CG-CB 4.49Å
302	L	87.3	Confident	83.9	Confident	99 Å²	99	73 Å²	73	52%	0.518	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-47.8	177.3	-176.2	69.8	0	0	0	111.4	G298 V299 I300 W305 L306	G298-L302 WeakPolarHBondContact O-CB 3.32Å; G298-L302 PolarHBondContact O-N 3.07Å; V299-L302 PolarHBondContact O-N 3.18Å; I300-L302 VanDerWaalsContact C-N 3.3Å; I300-L302 PolarHBondContact O-N 2.99Å; L302-W305 HydrophobicContact CD1-CE3 4.25Å; L302-W305 PolarHBondContact O-N 3.43Å; L302-L306 HydrophobicContact CG-CD1 4.49Å; L302-L306 WeakPolarHBondContact O-CG 3.22Å; L302-L306 PolarHBondContact O-N 3.18Å
303	V	86.6	Confident	83.4	Confident	39 Å²	39	69.6 Å²	69.6	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-65.3	-43.6	178.9	173.8	0	0	0	0	111.1	V299 I300 W305 L306 Q307 L742	V299-V303 HydrophobicContact CG1-CG2 4.36Å; V299-V303 WeakPolarHBondContact O-CG2 3.29Å; V299-V303 PolarHBondContact O-N 3.02Å; I300-V303 PolarHBondContact O-N 2.94Å; V303-W305 VanDerWaalsContact C-N 3.3Å; V303-W305 PolarHBondContact O-N 3.46Å; V303-L306 CarbonylContact O-C 3.59Å; V303-L306 WeakPolarHBondContact O-CB 3.42Å; V303-L306 PolarHBondContact O-N 3.04Å; V303-L306 VanDerWaalsContact O-N 3.15Å; V303-Q307 HydrophobicContact CG1-CG 4.33Å; V303-Q307 WeakPolarHBondContact O-CG 3.48Å; V303-Q307 PolarHBondContact O-N 3.38Å; V303-L742 HydrophobicContact CB-CD2 4.3Å; V303-L742 HydrophobicContact CG1-CD2 3.89Å; V303-L742 HydrophobicContact CG2-CD2 4.21Å
304	G	84	Confident	83.3	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-36.2	178	0	0	0	0	0	113	I300 Q307 G308 K309 M314	I300-G304 PolarHBondContact O-N 2.7Å; G304-Q307 PolarHBondContact O-N 3.03Å; G304-G308 PolarHBondContact O-N 3.41Å; G304-K309 WeakPolarHBondContact O-CB 3.39Å; G304-K309 PolarHBondContact O-N 3.35Å; G304-M314 VanDerWaalsContact CA-SD 3.57Å
305	W	85.5	Confident	82.9	Confident	157 Å²	157	68 Å²	68	60%	0.595	37%	0.365	S	S	*	.	H	α-helix	trans	-65.1	-43.1	171.2	-178.2	46.5	0	0	0	112	M301 L302 V303 Q307 G308	M301-W305 VanDerWaalsContact O-CB 3.32Å; M301-W305 WeakPolarHBondContact O-CB 3.45Å; M301-W305 PolarHBondContact O-N 2.74Å; L302-W305 HydrophobicContact CD1-CE3 4.25Å; L302-W305 PolarHBondContact O-N 3.43Å; V303-W305 VanDerWaalsContact C-N 3.3Å; V303-W305 PolarHBondContact O-N 3.46Å; W305-Q307 VanDerWaalsContact C-N 3.28Å; W305-Q307 PolarHBondContact O-N 2.92Å; W305-G308 PolarHBondContact O-N 3.08Å
306	L	87.6	Confident	82.2	Confident	135 Å²	135	68 Å²	68	71%	0.707	36%	0.356	S	S	*	.	H	α-helix	trans	-64.5	-30	174.5	-69.7	172	0	0	0	113.1	L302 V303 G308	L302-L306 HydrophobicContact CG-CD1 4.49Å; L302-L306 WeakPolarHBondContact O-CG 3.22Å; L302-L306 PolarHBondContact O-N 3.18Å; V303-L306 CarbonylContact O-C 3.59Å; V303-L306 WeakPolarHBondContact O-CB 3.42Å; V303-L306 PolarHBondContact O-N 3.04Å; V303-L306 VanDerWaalsContact O-N 3.15Å; L306-G308 PolarHBondContact O-N 3.09Å
307	Q	85	Confident	81.7	Confident	70 Å²	70	66.2 Å²	66.2	33%	0.327	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3.4	173.3	-72.3	175.2	-8	0	0	113.3	V303 G304 W305 K309 T741 L742	V303-Q307 HydrophobicContact CG1-CG 4.33Å; V303-Q307 WeakPolarHBondContact O-CG 3.48Å; V303-Q307 PolarHBondContact O-N 3.38Å; G304-Q307 PolarHBondContact O-N 3.03Å; W305-Q307 VanDerWaalsContact C-N 3.28Å; W305-Q307 PolarHBondContact O-N 2.92Å; Q307-K309 HydrophobicContact CB-CG 4.46Å; Q307-K309 VanDerWaalsContact OE1-NZ 3.1Å; Q307-T741 PolarHBondContact NE2-O 3.04Å; Q307-T741 PolarHBondContact OE1-O 3.39Å; Q307-L742 PolarHBondContact NE2-O 2.91Å
308	G	82.1	Confident	81.4	Confident	67 Å²	67	65.9 Å²	65.9	69%	0.691	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	14.8	179.4	0	0	0	0	0	114.7	G304 W305 L306	G304-G308 PolarHBondContact O-N 3.41Å; W305-G308 PolarHBondContact O-N 3.08Å; L306-G308 PolarHBondContact O-N 3.09Å
309	K	81.1	Confident	80.8	Confident	51 Å²	51	64.5 Å²	64.5	22%	0.222	33%	0.331	C	S	.	.			trans	-74.4	151.9	175.6	-58.1	-178.8	177.3	164	0	110.7	G304 Q307 I311 M314 N744	G304-K309 WeakPolarHBondContact O-CB 3.39Å; G304-K309 PolarHBondContact O-N 3.35Å; Q307-K309 HydrophobicContact CB-CG 4.46Å; Q307-K309 VanDerWaalsContact OE1-NZ 3.1Å; K309-I311 PolarHBondContact O-N 3.15Å; K309-M314 HydrophobicContact CB-CE 3.6Å; K309-M314 HydrophobicContact CB-CG 4.11Å; K309-M314 HydrophobicContact CB-SD 4.06Å; K309-M314 HydrophobicContact CD-CE 3.3Å; K309-M314 HydrophobicContact CD-SD 3.92Å; K309-M314 HydrophobicContact CG-CE 4.04Å; K309-N744 WeakPolarHBondContact CE-OD1 3.06Å; K309-N744 PolarHBondContact NZ-OD1 3.44Å
310	R	82.6	Confident	80	Confident	186 Å²	186	62.3 Å²	62.3	70%	0.702	32%	0.32	S	S	*	.			trans	-64.4	135.3	179.2	-58.9	176.4	119.7	178.1	-0.3	109.2	L312 D313 M314	R310-L312 PolarHBondContact O-N 2.92Å; R310-L312 VanDerWaalsContact O-N 3.11Å; R310-D313 HydrophobicContact CB-CB 4.42Å; R310-D313 WeakPolarHBondContact CB-OD2 3.44Å; R310-D313 PolarHBondContact O-N 2.88Å; R310-D313 VanDerWaalsContact O-N 3.11Å; R310-M314 PolarHBondContact O-N 3.41Å
311	I	79.9	Confident	79.6	Confident	106 Å²	106	62 Å²	62	54%	0.544	32%	0.318	S	S	.	.	H	α-helix	trans	-56.3	-32.5	-179.1	-66.2	165.3	0	0	0	111.3	K309 M314 F315	K309-I311 PolarHBondContact O-N 3.15Å; I311-M314 PolarHBondContact O-N 3.44Å; I311-F315 WeakPolarHBondContact O-CB 3.48Å; I311-F315 PolarHBondContact O-N 3.48Å
312	L	72	Confident	79.1	Confident	65 Å²	65	59.4 Å²	59.4	34%	0.34	31%	0.306	S	S	.	.	H	α-helix	trans	-70.8	-43.6	-179.8	-66.9	155.5	0	0	0	112.2	I113 M117 R310 M314 F315 T316	I113-L312 HydrophobicContact CG2-CD2 4.43Å; M117-L312 HydrophobicContact CE-CD1 3.17Å; M117-L312 HydrophobicContact CE-CD2 4.41Å; M117-L312 HydrophobicContact CE-CG 4.23Å; M117-L312 HydrophobicContact CG-CD2 4.41Å; M117-L312 HydrophobicContact SD-CB 4.03Å; M117-L312 HydrophobicContact SD-CD1 3.23Å; M117-L312 WeakPolarHBondContact SD-CD1 3.35Å; M117-L312 HydrophobicContact SD-CD2 3.29Å; M117-L312 WeakPolarHBondContact SD-CD2 3.12Å; M117-L312 HydrophobicContact SD-CG 3.62Å; R310-L312 PolarHBondContact O-N 2.92Å; R310-L312 VanDerWaalsContact O-N 3.11Å; L312-M314 PolarHBondContact O-N 3.3Å; L312-F315 WeakPolarHBondContact O-CB 3.43Å; L312-F315 PolarHBondContact O-N 2.95Å; L312-F315 VanDerWaalsContact O-N 3.12Å; L312-T316 WeakPolarHBondContact O-CG2 3.41Å; L312-T316 PolarHBondContact O-N 3.24Å; L312-T316 PolarHBondContact O-OG1 3.34Å
313	D	73.7	Confident	78.3	Confident	69 Å²	69	55.9 Å²	55.9	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-63.6	-35.5	173.9	-54.9	-19.1	0	0	0	110.3	R310 T316 I317	R310-D313 HydrophobicContact CB-CB 4.42Å; R310-D313 WeakPolarHBondContact CB-OD2 3.44Å; R310-D313 PolarHBondContact O-N 2.88Å; R310-D313 VanDerWaalsContact O-N 3.11Å; D313-T316 WeakPolarHBondContact CA-OG1 3.37Å; D313-T316 PolarHBondContact O-OG1 3.03Å; D313-I317 WeakPolarHBondContact O-CB 3.21Å; D313-I317 WeakPolarHBondContact O-CD1 3.12Å; D313-I317 WeakPolarHBondContact O-CG1 3.18Å; D313-I317 PolarHBondContact O-N 3.18Å
314	M	79.5	Confident	77.6	Confident	7 Å²	7	54 Å²	54	3%	0.034	28%	0.277	C	S	.	.	H	α-helix	trans	-71.1	-33.4	174.4	-65.3	-58.3	98.3	0	0	112.6	M301 G304 K309 R310 I311 L312 I317 G318	M301-M314 HydrophobicContact CG-CB 4.49Å; G304-M314 VanDerWaalsContact CA-SD 3.57Å; K309-M314 HydrophobicContact CB-CE 3.6Å; K309-M314 HydrophobicContact CB-CG 4.11Å; K309-M314 HydrophobicContact CB-SD 4.06Å; K309-M314 HydrophobicContact CD-CE 3.3Å; K309-M314 HydrophobicContact CD-SD 3.92Å; K309-M314 HydrophobicContact CG-CE 4.04Å; R310-M314 PolarHBondContact O-N 3.41Å; I311-M314 PolarHBondContact O-N 3.44Å; L312-M314 PolarHBondContact O-N 3.3Å; M314-I317 HydrophobicContact CE-CD1 3.65Å; M314-G318 PolarHBondContact O-N 3.19Å
315	F	75.6	Confident	77	Confident	62 Å²	62	54.2 Å²	54.2	27%	0.272	28%	0.279	S	S	.	.	H	α-helix	trans	-70.5	-44.4	176.1	-178.5	-97.4	0	0	0	111.4	I113 I311 L312 G318 V319	I113-F315 HydrophobicContact CD1-CD1 4.37Å; I113-F315 HydrophobicContact CD1-CE1 3.44Å; I113-F315 VanDerWaalsContact CD1-CE1 3.44Å; I113-F315 HydrophobicContact CD1-CE2 4.45Å; I113-F315 HydrophobicContact CD1-CZ 3.48Å; I113-F315 VanDerWaalsContact CD1-CZ 3.48Å; I113-F315 HydrophobicContact CG2-CE1 4.49Å; I311-F315 WeakPolarHBondContact O-CB 3.48Å; I311-F315 PolarHBondContact O-N 3.48Å; L312-F315 WeakPolarHBondContact O-CB 3.43Å; L312-F315 PolarHBondContact O-N 2.95Å; L312-F315 VanDerWaalsContact O-N 3.12Å; F315-G318 PolarHBondContact O-N 3.47Å; F315-G318 VanDerWaalsContact O-N 3.16Å; F315-V319 HydrophobicContact CD1-CG2 4.28Å; F315-V319 HydrophobicContact CE1-CG2 3.87Å; F315-V319 HydrophobicContact CE2-CG2 4.46Å; F315-V319 HydrophobicContact CZ-CG2 3.97Å; F315-V319 WeakPolarHBondContact O-CG2 3.43Å; F315-V319 PolarHBondContact O-N 2.96Å
316	T	71.9	Confident	76.2	Confident	43 Å²	43	48.2 Å²	48.2	26%	0.264	26%	0.259	S	S	.	.	H	α-helix	trans	-66.1	-38.2	176.1	54.4	0	0	0	0	112	L312 D313 V319 S320	L312-T316 WeakPolarHBondContact O-CG2 3.41Å; L312-T316 PolarHBondContact O-N 3.24Å; L312-T316 PolarHBondContact O-OG1 3.34Å; D313-T316 WeakPolarHBondContact CA-OG1 3.37Å; D313-T316 PolarHBondContact O-OG1 3.03Å; T316-V319 PolarHBondContact O-N 3.11Å; T316-S320 WeakPolarHBondContact O-CB 3.43Å; T316-S320 PolarHBondContact O-N 3.4Å; T316-S320 PolarHBondContact O-OG 3.35Å
317	I	74.4	Confident	75.2	Confident	25 Å²	25	42.8 Å²	42.8	13%	0.128	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-43.3	170	-70.2	171	0	0	0	110.6	D313 M314 V319 S320 L321 N747	D313-I317 WeakPolarHBondContact O-CB 3.21Å; D313-I317 WeakPolarHBondContact O-CD1 3.12Å; D313-I317 WeakPolarHBondContact O-CG1 3.18Å; D313-I317 PolarHBondContact O-N 3.18Å; M314-I317 HydrophobicContact CE-CD1 3.65Å; I317-V319 PolarHBondContact O-N 2.82Å; I317-S320 PolarHBondContact O-N 3.31Å; I317-L321 VanDerWaalsContact O-CB 3.25Å; I317-L321 WeakPolarHBondContact O-CB 3.39Å; I317-L321 PolarHBondContact O-N 2.77Å; I317-N747 WeakPolarHBondContact CD1-ND2 3.47Å
318	G	77.8	Confident	74.4	Confident	7 Å²	7	42.4 Å²	42.4	7%	0.072	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-41.8	177.6	0	0	0	0	0	113.3	M314 F315 L321 A322	M314-G318 PolarHBondContact O-N 3.19Å; F315-G318 PolarHBondContact O-N 3.47Å; F315-G318 VanDerWaalsContact O-N 3.16Å; G318-L321 PolarHBondContact O-N 2.86Å; G318-A322 PolarHBondContact O-N 2.86Å
319	V	73.2	Confident	73.6	Confident	9 Å²	9	40.2 Å²	40.2	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-46	174.5	172	0	0	0	0	110.8	L106 L107 F315 T316 I317 L321 A322 V323	L106-V319 HydrophobicContact CD2-CB 4.45Å; L106-V319 HydrophobicContact CD2-CG1 4.16Å; L106-V319 HydrophobicContact CD2-CG2 4.09Å; L107-V319 HydrophobicContact CD2-CG1 3.56Å; F315-V319 HydrophobicContact CD1-CG2 4.28Å; F315-V319 HydrophobicContact CE1-CG2 3.87Å; F315-V319 HydrophobicContact CE2-CG2 4.46Å; F315-V319 HydrophobicContact CZ-CG2 3.97Å; F315-V319 WeakPolarHBondContact O-CG2 3.43Å; F315-V319 PolarHBondContact O-N 2.96Å; T316-V319 PolarHBondContact O-N 3.11Å; I317-V319 PolarHBondContact O-N 2.82Å; V319-L321 PolarHBondContact O-N 3.49Å; V319-A322 WeakPolarHBondContact O-CB 3.46Å; V319-A322 PolarHBondContact O-N 3.22Å; V319-A322 VanDerWaalsContact O-N 3.12Å; V319-V323 PolarHBondContact O-N 2.96Å; V319-V323 VanDerWaalsContact O-N 3.13Å
320	S	71.7	Confident	73.4	Confident	42 Å²	42	38.5 Å²	38.5	29%	0.294	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-36.8	176.9	-57.7	0	0	0	0	111.7	T316 I317 A324	T316-S320 WeakPolarHBondContact O-CB 3.43Å; T316-S320 PolarHBondContact O-N 3.4Å; T316-S320 PolarHBondContact O-OG 3.35Å; I317-S320 PolarHBondContact O-N 3.31Å; S320-A324 WeakPolarHBondContact O-CB 3.34Å; S320-A324 PolarHBondContact O-N 3.1Å
321	L	75	Confident	73	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-71.8	-35.1	176.5	-162.5	64.3	0	0	0	112.3	I297 I300 I317 G318 V319 A324 A325 L734 I737	I297-L321 HydrophobicContact CG1-CB 4.09Å; I297-L321 HydrophobicContact CG1-CD2 3.72Å; I297-L321 HydrophobicContact CG1-CG 4.03Å; I300-L321 HydrophobicContact CD1-CD2 3.38Å; I317-L321 VanDerWaalsContact O-CB 3.25Å; I317-L321 WeakPolarHBondContact O-CB 3.39Å; I317-L321 PolarHBondContact O-N 2.77Å; G318-L321 PolarHBondContact O-N 2.86Å; V319-L321 PolarHBondContact O-N 3.49Å; L321-A324 PolarHBondContact O-N 2.89Å; L321-A325 WeakPolarHBondContact O-CB 3.26Å; L321-A325 PolarHBondContact O-N 3.28Å; L321-L734 HydrophobicContact CD1-CD1 3.42Å; L321-L734 VanDerWaalsContact CD1-CD1 3.42Å; L321-L734 HydrophobicContact CD2-CD1 3.68Å; L321-L734 HydrophobicContact CG-CD1 3.4Å; L321-L734 VanDerWaalsContact CG-CD1 3.4Å; L321-I737 HydrophobicContact CD1-CB 3.89Å; L321-I737 HydrophobicContact CD1-CD1 3.88Å; L321-I737 HydrophobicContact CD1-CG2 3.89Å
322	A	74.5	Confident	72.8	Confident	6 Å²	6	30.4 Å²	30.4	5%	0.05	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-43.3	174.6	0	0	0	0	0	111.6	L106 I297 G318 V319 A325	L106-A322 HydrophobicContact CD2-CB 4.14Å; I297-A322 HydrophobicContact CD1-CB 3.82Å; G318-A322 PolarHBondContact O-N 2.86Å; V319-A322 WeakPolarHBondContact O-CB 3.46Å; V319-A322 PolarHBondContact O-N 3.22Å; V319-A322 VanDerWaalsContact O-N 3.12Å; A322-A325 PolarHBondContact O-N 2.88Å
323	V	71.4	Confident	73.2	Confident	25 Å²	25	27.4 Å²	27.4	15%	0.152	16%	0.16	C	C	.	.	H	α-helix	trans	-65.4	-40.8	174.1	179.5	0	0	0	0	111.5	L107 V319 A325	L107-V323 HydrophobicContact CD1-CG2 3.76Å; L107-V323 HydrophobicContact CD2-CG2 3.39Å; L107-V323 HydrophobicContact CG-CG2 3.86Å; V319-V323 PolarHBondContact O-N 2.96Å; V319-V323 VanDerWaalsContact O-N 3.13Å; V323-A325 VanDerWaalsContact C-N 3.27Å; V323-A325 PolarHBondContact O-N 3.46Å
324	A	71.5	Confident	73.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.5	-32.6	178.3	0	0	0	0	0	113	S320 L321 I754	S320-A324 WeakPolarHBondContact O-CB 3.34Å; S320-A324 PolarHBondContact O-N 3.1Å; L321-A324 PolarHBondContact O-N 2.89Å; A324-I754 HydrophobicContact CB-CG2 3.77Å
325	A	71.8	Confident	73.7	Confident	4 Å²	4	26.5 Å²	26.5	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-87.9	-16.7	-168	0	0	0	0	0	114.6	S293 L321 A322 V323 L734	S293-A325 WeakPolarHBondContact OG-CB 3.38Å; L321-A325 WeakPolarHBondContact O-CB 3.26Å; L321-A325 PolarHBondContact O-N 3.28Å; A322-A325 PolarHBondContact O-N 2.88Å; V323-A325 VanDerWaalsContact C-N 3.27Å; V323-A325 PolarHBondContact O-N 3.46Å; A325-L734 HydrophobicContact CB-CD1 4.2Å; A325-L734 HydrophobicContact CB-CD2 4.22Å
326	I	68.6	Low	74	Confident	32 Å²	32	25.1 Å²	25.1	16%	0.164	15%	0.154	C	C	.	.	S	Bend	trans	-106.7	121.5	179.6	-62.7	171.9	0	0	0	108.7	L103 E328	L103-I326 HydrophobicContact CD1-CB 4.02Å; L103-I326 HydrophobicContact CD1-CD1 3.42Å; L103-I326 VanDerWaalsContact CD1-CD1 3.42Å; L103-I326 HydrophobicContact CD1-CG1 4.31Å; L103-I326 HydrophobicContact CD1-CG2 3.72Å; L103-I326 HydrophobicContact CD2-CD1 3.34Å; L103-I326 HydrophobicContact CG-CD1 3.97Å; I326-E328 VanDerWaalsContact C-N 3.27Å; I326-E328 PolarHBondContact O-N 3.32Å
327	P	66.9	Low	74.6	Confident	21 Å²	21	23.2 Å²	23.2	14%	0.136	14%	0.143	C	C	.	.			trans	-76.6	82.8	179.3	31.8	-34.6	0	0	0	109.4	L289 G329 L330	L289-P327 HydrophobicContact CD1-CG 4.21Å; P327-G329 PolarHBondContact O-N 2.97Å; P327-L330 HydrophobicContact CB-CB 3.99Å; P327-L330 HydrophobicContact CG-CB 4.04Å; P327-L330 HydrophobicContact CG-CD2 4.22Å; P327-L330 VanDerWaalsContact O-CB 3.23Å; P327-L330 WeakPolarHBondContact O-CB 3.43Å; P327-L330 PolarHBondContact O-N 3.21Å
328	E	66.7	Low	75.2	Confident	61 Å²	61	22.2 Å²	22.2	29%	0.285	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.1	176.9	-65.5	178	179.6	0	0	111.8	I326 L330 P331	I326-E328 VanDerWaalsContact C-N 3.27Å; I326-E328 PolarHBondContact O-N 3.32Å; E328-L330 VanDerWaalsContact C-N 3.29Å; E328-L330 PolarHBondContact O-N 2.86Å; E328-P331 WeakPolarHBondContact O-CD 3.25Å
329	G	66.8	Low	75.5	Confident	22 Å²	22	22.9 Å²	22.9	23%	0.227	14%	0.142	C	C	.	.	H	α-helix	trans	-72.7	-13.5	174.7	0	0	0	0	0	114.8	P327 V333	P327-G329 PolarHBondContact O-N 2.97Å; G329-V333 WeakPolarHBondContact O-CB 3.41Å; G329-V333 WeakPolarHBondContact O-CG2 3.17Å; G329-V333 PolarHBondContact O-N 3.35Å
330	L	75.6	Confident	75.9	Confident	15 Å²	15	26 Å²	26	8%	0.079	16%	0.159	C	C	.	.	H	α-helix	trans	-65.7	-51.6	-172.6	-179.6	73.2	0	0	0	113	M282 P327 E328 I332 V333 V334 F722 V723	M282-L330 HydrophobicContact SD-CD2 3.88Å; M282-L330 HydrophobicContact SD-CG 4.3Å; P327-L330 HydrophobicContact CB-CB 3.99Å; P327-L330 HydrophobicContact CG-CB 4.04Å; P327-L330 HydrophobicContact CG-CD2 4.22Å; P327-L330 VanDerWaalsContact O-CB 3.23Å; P327-L330 WeakPolarHBondContact O-CB 3.43Å; P327-L330 PolarHBondContact O-N 3.21Å; E328-L330 VanDerWaalsContact C-N 3.29Å; E328-L330 PolarHBondContact O-N 2.86Å; L330-I332 VanDerWaalsContact C-N 3.27Å; L330-I332 PolarHBondContact O-N 3.33Å; L330-V333 PolarHBondContact O-N 3.31Å; L330-V334 HydrophobicContact CD1-CG2 4.47Å; L330-V334 VanDerWaalsContact O-CG2 3.24Å; L330-V334 WeakPolarHBondContact O-CG2 3.5Å; L330-V334 PolarHBondContact O-N 3.31Å; L330-F722 HydrophobicContact CD1-CD2 4.18Å; L330-F722 HydrophobicContact CD1-CE2 3.67Å; L330-V723 HydrophobicContact CD1-CG2 3.67Å
331	P	73.6	Confident	76.6	Confident	80 Å²	80	24.2 Å²	24.2	52%	0.519	15%	0.146	S	C	.	.	H	α-helix	trans	-60.2	-38.7	178.7	-23	35.2	0	0	0	112.5	E328 V334 T335	E328-P331 WeakPolarHBondContact O-CD 3.25Å; P331-V334 PolarHBondContact O-N 3.12Å; P331-T335 PolarHBondContact O-N 2.87Å; P331-T335 PolarHBondContact O-OG1 3.5Å; P331-T335 VanDerWaalsContact O-OG1 3.05Å
332	I	76.1	Confident	77.1	Confident	42 Å²	42	24.3 Å²	24.3	22%	0.215	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-51.3	179.2	-62.6	168.8	0	0	0	110.5	A137 Q140 L330 V334 T335 V336	A137-I332 HydrophobicContact CB-CD1 4.35Å; Q140-I332 HydrophobicContact CB-CG2 4.25Å; L330-I332 VanDerWaalsContact C-N 3.27Å; L330-I332 PolarHBondContact O-N 3.33Å; I332-V334 VanDerWaalsContact C-N 3.28Å; I332-V334 PolarHBondContact O-N 2.83Å; I332-T335 PolarHBondContact O-N 3.29Å; I332-V336 WeakPolarHBondContact O-CG2 3.36Å; I332-V336 PolarHBondContact O-N 2.85Å
333	V	81.4	Confident	77.5	Confident	1 Å²	1	29 Å²	29	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-40.1	-180	174	0	0	0	0	110.7	G329 L330 T337 F722 A766 Q767	G329-V333 WeakPolarHBondContact O-CB 3.41Å; G329-V333 WeakPolarHBondContact O-CG2 3.17Å; G329-V333 PolarHBondContact O-N 3.35Å; L330-V333 PolarHBondContact O-N 3.31Å; V333-T337 VanDerWaalsContact O-CB 3.26Å; V333-T337 WeakPolarHBondContact O-CB 3.47Å; V333-T337 PolarHBondContact O-N 2.98Å; V333-T337 PolarHBondContact O-OG1 2.88Å; V333-F722 HydrophobicContact CB-CE2 4.23Å; V333-F722 HydrophobicContact CB-CZ 4.48Å; V333-F722 HydrophobicContact CG1-CD1 4.01Å; V333-F722 HydrophobicContact CG1-CD2 3.73Å; V333-F722 HydrophobicContact CG1-CE1 3.88Å; V333-F722 HydrophobicContact CG1-CE2 3.67Å; V333-F722 HydrophobicContact CG1-CG 3.93Å; V333-F722 HydrophobicContact CG1-CZ 3.76Å; V333-A766 HydrophobicContact CG1-CB 4.17Å; V333-A766 HydrophobicContact CG2-CB 4.13Å; V333-Q767 HydrophobicContact CB-CG 4.39Å; V333-Q767 HydrophobicContact CG1-CG 4.28Å; V333-Q767 HydrophobicContact CG2-CG 3.76Å
334	V	83.8	Confident	78.2	Confident	8 Å²	8	31 Å²	31	5%	0.048	17%	0.174	C	C	.	.	H	α-helix	trans	-59.2	-52.6	174.1	170	0	0	0	0	110.6	L278 L330 P331 I332 V336 T337 L338 F722	L278-V334 HydrophobicContact CD2-CG1 3.73Å; L330-V334 HydrophobicContact CD1-CG2 4.47Å; L330-V334 VanDerWaalsContact O-CG2 3.24Å; L330-V334 WeakPolarHBondContact O-CG2 3.5Å; L330-V334 PolarHBondContact O-N 3.31Å; P331-V334 PolarHBondContact O-N 3.12Å; I332-V334 VanDerWaalsContact C-N 3.28Å; I332-V334 PolarHBondContact O-N 2.83Å; V334-V336 PolarHBondContact O-N 3.29Å; V334-T337 PolarHBondContact O-N 3.27Å; V334-L338 HydrophobicContact CG1-CD1 3.68Å; V334-L338 HydrophobicContact CG1-CG 4.29Å; V334-L338 VanDerWaalsContact O-CG 3.26Å; V334-L338 WeakPolarHBondContact O-CG 3.39Å; V334-L338 PolarHBondContact O-N 3.05Å; V334-F722 HydrophobicContact CB-CZ 4.41Å; V334-F722 HydrophobicContact CG2-CE2 3.9Å; V334-F722 HydrophobicContact CG2-CZ 3.59Å
335	T	80.4	Confident	79	Confident	50 Å²	50	31.1 Å²	31.1	31%	0.307	17%	0.174	S	C	.	.	H	α-helix	trans	-59.4	-46	-179.1	-61.7	0	0	0	0	112.1	P331 I332 T337 L338 A339 L355	P331-T335 PolarHBondContact O-N 2.87Å; P331-T335 PolarHBondContact O-OG1 3.5Å; P331-T335 VanDerWaalsContact O-OG1 3.05Å; I332-T335 PolarHBondContact O-N 3.29Å; T335-T337 VanDerWaalsContact C-N 3.35Å; T335-T337 PolarHBondContact O-N 3.43Å; T335-L338 PolarHBondContact O-N 2.88Å; T335-A339 WeakPolarHBondContact O-CB 3.26Å; T335-A339 PolarHBondContact O-N 3Å; T335-L355 HydrophobicContact CG2-CD1 3.81Å
336	V	81.6	Confident	79.7	Confident	32 Å²	32	33 Å²	33	19%	0.194	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-42.4	177.2	173.2	0	0	0	0	111.1	I332 V334 A339 L340	I332-V336 WeakPolarHBondContact O-CG2 3.36Å; I332-V336 PolarHBondContact O-N 2.85Å; V334-V336 PolarHBondContact O-N 3.29Å; V336-A339 PolarHBondContact O-N 3.04Å; V336-L340 HydrophobicContact CG1-CD1 4.04Å; V336-L340 HydrophobicContact CG1-CG 4.44Å; V336-L340 WeakPolarHBondContact O-CB 3.39Å; V336-L340 WeakPolarHBondContact O-CG 3.48Å; V336-L340 PolarHBondContact O-N 3.1Å
337	T	84.8	Confident	80.6	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-44.1	177.9	-59.4	0	0	0	0	111.4	V333 V334 T335 G341 I715 F722 G770	V333-T337 VanDerWaalsContact O-CB 3.26Å; V333-T337 WeakPolarHBondContact O-CB 3.47Å; V333-T337 PolarHBondContact O-N 2.98Å; V333-T337 PolarHBondContact O-OG1 2.88Å; V334-T337 PolarHBondContact O-N 3.27Å; T335-T337 VanDerWaalsContact C-N 3.35Å; T335-T337 PolarHBondContact O-N 3.43Å; T337-G341 PolarHBondContact O-N 3.26Å; T337-I715 HydrophobicContact CG2-CG2 4.2Å; T337-F722 HydrophobicContact CG2-CE1 4.37Å; T337-G770 WeakPolarHBondContact CG2-O 3.11Å
338	L	86.4	Confident	81.6	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-45.7	175.9	-68	166.8	0	0	0	110.9	L278 V334 T335 L340 G341 V342 L355 V358 I715 I719	L278-L338 HydrophobicContact CD2-CD1 3.96Å; V334-L338 HydrophobicContact CG1-CD1 3.68Å; V334-L338 HydrophobicContact CG1-CG 4.29Å; V334-L338 VanDerWaalsContact O-CG 3.26Å; V334-L338 WeakPolarHBondContact O-CG 3.39Å; V334-L338 PolarHBondContact O-N 3.05Å; T335-L338 PolarHBondContact O-N 2.88Å; L338-L340 PolarHBondContact O-N 3.33Å; L338-G341 CarbonylContact O-C 3.56Å; L338-G341 WeakPolarHBondContact O-CA 3.45Å; L338-G341 PolarHBondContact O-N 3.02Å; L338-G341 VanDerWaalsContact O-N 3.09Å; L338-V342 WeakPolarHBondContact O-CG2 3.41Å; L338-V342 PolarHBondContact O-N 3.15Å; L338-L355 HydrophobicContact CB-CB 4.24Å; L338-L355 HydrophobicContact CB-CD2 4.44Å; L338-V358 HydrophobicContact CD2-CB 3.84Å; L338-V358 HydrophobicContact CD2-CG1 3.93Å; L338-I715 HydrophobicContact CD2-CG2 3.92Å; L338-I719 HydrophobicContact CD2-CD1 4.46Å
339	A	83.1	Confident	82.7	Confident	21 Å²	21	46.6 Å²	46.6	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-45.6	178.9	0	0	0	0	0	112.4	T335 V336 G341 V342 M343 L355	T335-A339 WeakPolarHBondContact O-CB 3.26Å; T335-A339 PolarHBondContact O-N 3Å; V336-A339 PolarHBondContact O-N 3.04Å; A339-G341 VanDerWaalsContact C-N 3.25Å; A339-G341 PolarHBondContact O-N 3.41Å; A339-V342 PolarHBondContact O-N 2.82Å; A339-M343 WeakPolarHBondContact O-CG 3.31Å; A339-M343 PolarHBondContact O-N 3.49Å; A339-L355 HydrophobicContact CB-CD1 4.39Å; A339-L355 HydrophobicContact CB-CD2 4.12Å
340	L	82.9	Confident	83.8	Confident	75 Å²	75	45.6 Å²	45.6	39%	0.393	23%	0.226	S	C	.	.	H	α-helix	trans	-63.4	-34.3	173.9	-69.4	174.7	0	0	0	112	V336 L338 M343 R344 V771	V336-L340 HydrophobicContact CG1-CD1 4.04Å; V336-L340 HydrophobicContact CG1-CG 4.44Å; V336-L340 WeakPolarHBondContact O-CB 3.39Å; V336-L340 WeakPolarHBondContact O-CG 3.48Å; V336-L340 PolarHBondContact O-N 3.1Å; L338-L340 PolarHBondContact O-N 3.33Å; L340-M343 PolarHBondContact O-N 2.97Å; L340-R344 PolarHBondContact O-N 2.74Å; L340-V771 HydrophobicContact CD1-CG2 3.54Å
341	G	85.3	Confident	84.4	Confident	3 Å²	3	47.1 Å²	47.1	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-60.9	-47.9	170.8	0	0	0	0	0	113.1	T337 L338 A339 M343 R344 M345 I715	T337-G341 PolarHBondContact O-N 3.26Å; L338-G341 CarbonylContact O-C 3.56Å; L338-G341 WeakPolarHBondContact O-CA 3.45Å; L338-G341 PolarHBondContact O-N 3.02Å; L338-G341 VanDerWaalsContact O-N 3.09Å; A339-G341 VanDerWaalsContact C-N 3.25Å; A339-G341 PolarHBondContact O-N 3.41Å; G341-M343 VanDerWaalsContact C-N 3.29Å; G341-M343 PolarHBondContact O-N 3.46Å; G341-R344 WeakPolarHBondContact O-CB 3.37Å; G341-R344 PolarHBondContact O-N 2.98Å; G341-M345 PolarHBondContact O-N 3.09Å; G341-I715 VanDerWaalsContact CA-CD1 3.46Å
342	V	85.8	Confident	85.1	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.024	21%	0.209	C	C	.	.	H	α-helix	trans	-57.7	-43.7	173.9	175.4	0	0	0	0	110.5	L338 A339 R344 M345 V346 V352 L355 V358	L338-V342 WeakPolarHBondContact O-CG2 3.41Å; L338-V342 PolarHBondContact O-N 3.15Å; A339-V342 PolarHBondContact O-N 2.82Å; V342-R344 PolarHBondContact O-N 3.41Å; V342-M345 CarbonylContact O-C 3.56Å; V342-M345 WeakPolarHBondContact O-CA 3.4Å; V342-M345 WeakPolarHBondContact O-CB 3.44Å; V342-M345 PolarHBondContact O-N 2.97Å; V342-V346 HydrophobicContact CG1-CG2 4.19Å; V342-V346 WeakPolarHBondContact O-CG2 3.37Å; V342-V346 PolarHBondContact O-N 2.54Å; V342-V352 HydrophobicContact CG1-CB 4.1Å; V342-V352 HydrophobicContact CG2-CB 3.92Å; V342-V352 HydrophobicContact CG2-CG1 4.35Å; V342-V352 HydrophobicContact CG2-CG2 4.46Å; V342-L355 HydrophobicContact CB-CD2 4.46Å; V342-L355 HydrophobicContact CG2-CD2 3.68Å; V342-V358 HydrophobicContact CG2-CG2 3.43Å; V342-V358 VanDerWaalsContact CG2-CG2 3.43Å
343	M	83.4	Confident	85.2	Confident	104 Å²	104	44.9 Å²	44.9	51%	0.512	21%	0.214	S	C	.	.	H	α-helix	trans	-61.1	-29.8	176.8	-66.7	-60.9	-74.9	0	0	113.2	A339 L340 G341 K347	A339-M343 WeakPolarHBondContact O-CG 3.31Å; A339-M343 PolarHBondContact O-N 3.49Å; L340-M343 PolarHBondContact O-N 2.97Å; G341-M343 VanDerWaalsContact C-N 3.29Å; G341-M343 PolarHBondContact O-N 3.46Å; M343-K347 WeakPolarHBondContact O-CG 3.45Å; M343-K347 PolarHBondContact O-N 3.12Å
344	R	85.6	Confident	84.9	Confident	69 Å²	69	48.4 Å²	48.4	26%	0.26	23%	0.229	S	C	.	.	H	α-helix	trans	-74	-39.4	172	-66.7	175.1	-175.8	-177.1	-1.1	111.7	L340 G341 V342 K347 K348 V771 E772	L340-R344 PolarHBondContact O-N 2.74Å; G341-R344 WeakPolarHBondContact O-CB 3.37Å; G341-R344 PolarHBondContact O-N 2.98Å; V342-R344 PolarHBondContact O-N 3.41Å; R344-K347 WeakPolarHBondContact O-CB 3.33Å; R344-K347 PolarHBondContact O-N 3.04Å; R344-K348 PolarHBondContact O-N 2.66Å; R344-V771 PolarHBondContact NH2-O 2.81Å; R344-E772 PolarHBondContact NH1-O 2.82Å
345	M	88.9	Confident	84.7	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-40.6	175.1	-69.6	179.1	176.3	0	0	112	G341 V342 K347 K348 R349 A350 V352 V358 L361 A708 E711 I715	G341-M345 PolarHBondContact O-N 3.09Å; V342-M345 CarbonylContact O-C 3.56Å; V342-M345 WeakPolarHBondContact O-CA 3.4Å; V342-M345 WeakPolarHBondContact O-CB 3.44Å; V342-M345 PolarHBondContact O-N 2.97Å; M345-K347 VanDerWaalsContact C-N 3.28Å; M345-K347 PolarHBondContact O-N 3.33Å; M345-K348 CarbonylContact O-C 3.56Å; M345-K348 VanDerWaalsContact O-CA 3.24Å; M345-K348 WeakPolarHBondContact O-CA 3.42Å; M345-K348 WeakPolarHBondContact O-CB 3.4Å; M345-K348 PolarHBondContact O-N 3.47Å; M345-R349 PolarHBondContact O-N 3.08Å; M345-R349 VanDerWaalsContact O-N 3.09Å; M345-A350 CarbonylContact C-O 3.43Å; M345-A350 HydrophobicContact CB-CB 4.12Å; M345-A350 PolarHBondContact O-N 3.47Å; M345-V352 HydrophobicContact SD-CG2 3.7Å; M345-V358 HydrophobicContact CE-CB 4.46Å; M345-V358 HydrophobicContact CE-CG1 3.73Å; M345-V358 HydrophobicContact CE-CG2 4.43Å; M345-V358 HydrophobicContact SD-CG1 4.49Å; M345-V358 HydrophobicContact SD-CG2 4.23Å; M345-L361 HydrophobicContact CE-CD1 3.94Å; M345-L361 HydrophobicContact SD-CD1 4.38Å; M345-A708 WeakPolarHBondContact CE-O 3.38Å; M345-E711 HydrophobicContact CE-CB 3.52Å; M345-E711 HydrophobicContact CG-CB 4.01Å; M345-E711 HydrophobicContact CG-CG 4.24Å; M345-I715 HydrophobicContact CE-CD1 4.3Å
346	V	87.1	Confident	84.8	Confident	45 Å²	45	48.3 Å²	48.3	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-61.3	-37.9	176.5	172.4	0	0	0	0	111.1	V342 K348 R349 A350 I351	V342-V346 HydrophobicContact CG1-CG2 4.19Å; V342-V346 WeakPolarHBondContact O-CG2 3.37Å; V342-V346 PolarHBondContact O-N 2.54Å; V346-K348 PolarHBondContact O-N 3.27Å; V346-R349 WeakPolarHBondContact O-CA 3.18Å; V346-R349 PolarHBondContact O-N 2.87Å; V346-A350 VanDerWaalsContact CA-O 3.29Å; V346-A350 WeakPolarHBondContact CA-O 3.07Å; V346-A350 PolarHBondContact N-O 2.83Å; V346-A350 VanDerWaalsContact N-O 3.07Å; V346-I351 HydrophobicContact CG2-CG1 4.31Å
347	K	87	Confident	85	Confident	184 Å²	184	47.2 Å²	47.2	80%	0.8	22%	0.222	S	C	*	.	H	α-helix	trans	-64.4	-27.9	172.6	-69.2	177.2	-177.8	-177.1	0	112.9	M343 R344 M345 R349	M343-K347 WeakPolarHBondContact O-CG 3.45Å; M343-K347 PolarHBondContact O-N 3.12Å; R344-K347 WeakPolarHBondContact O-CB 3.33Å; R344-K347 PolarHBondContact O-N 3.04Å; M345-K347 VanDerWaalsContact C-N 3.28Å; M345-K347 PolarHBondContact O-N 3.33Å; K347-R349 VanDerWaalsContact C-N 3.27Å
348	K	87.3	Confident	85.1	Confident	69 Å²	69	47.1 Å²	47.1	30%	0.3	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	19.1	169	-59.2	-168.3	-171.9	171.7	0	112.4	R344 M345 V346 A350 T704 E710 E711	R344-K348 PolarHBondContact O-N 2.66Å; M345-K348 CarbonylContact O-C 3.56Å; M345-K348 VanDerWaalsContact O-CA 3.24Å; M345-K348 WeakPolarHBondContact O-CA 3.42Å; M345-K348 WeakPolarHBondContact O-CB 3.4Å; M345-K348 PolarHBondContact O-N 3.47Å; V346-K348 PolarHBondContact O-N 3.27Å; K348-A350 VanDerWaalsContact C-N 3.27Å; K348-A350 PolarHBondContact O-N 3Å; K348-T704 WeakPolarHBondContact O-CG2 3.44Å; K348-E710 IonicContact NZ-OE2 3.41Å; K348-E710 PolarHBondContact NZ-OE2 3.36Å; K348-E711 HydrophobicContact CD-CG 4.48Å; K348-E711 WeakPolarHBondContact CE-OE1 3.25Å; K348-E711 IonicContact NZ-OE1 2.69Å; K348-E711 PolarHBondContact NZ-OE1 3.45Å
349	R	89.9	Confident	85.1	Confident	146 Å²	146	46.9 Å²	46.9	55%	0.551	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	19.1	175	-56.7	171.7	173.4	-175.1	-2.2	115.7	M345 V346 K347 V698 D699	M345-R349 PolarHBondContact O-N 3.08Å; M345-R349 VanDerWaalsContact O-N 3.09Å; V346-R349 WeakPolarHBondContact O-CA 3.18Å; V346-R349 PolarHBondContact O-N 2.87Å; K347-R349 VanDerWaalsContact C-N 3.27Å; R349-V698 HydrophobicContact CB-CB 4.2Å; R349-V698 WeakPolarHBondContact O-CB 3.42Å; R349-V698 WeakPolarHBondContact O-CG2 3.35Å; R349-V698 PolarHBondContact O-N 2.92Å; R349-D699 WeakPolarHBondContact CD-OD2 3.48Å; R349-D699 IonicContact NH1-OD2 3.02Å; R349-D699 PolarHBondContact NH1-OD2 3.07Å
350	A	90.4	Very high	85.4	Confident	1 Å²	1	46 Å²	46	1%	0.008	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.1	169.2	0	0	0	0	0	110.6	M345 V346 K348 M695 T704 A708	M345-A350 CarbonylContact C-O 3.43Å; M345-A350 HydrophobicContact CB-CB 4.12Å; M345-A350 PolarHBondContact O-N 3.47Å; V346-A350 VanDerWaalsContact CA-O 3.29Å; V346-A350 WeakPolarHBondContact CA-O 3.07Å; V346-A350 PolarHBondContact N-O 2.83Å; V346-A350 VanDerWaalsContact N-O 3.07Å; K348-A350 VanDerWaalsContact C-N 3.27Å; K348-A350 PolarHBondContact O-N 3Å; A350-M695 HydrophobicContact CB-SD 4.37Å; A350-T704 HydrophobicContact CB-CG2 3.66Å; A350-A708 HydrophobicContact CB-CB 4.4Å
351	I	88.8	Confident	85.7	Confident	46 Å²	46	42.5 Å²	42.5	24%	0.236	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.7	174.3	-61	173	0	0	0	108.3	V346 M695 I696 V698	V346-I351 HydrophobicContact CG2-CG1 4.31Å; I351-M695 CarbonylContact O-C 3.54Å; I351-M695 VanDerWaalsContact O-CA 3.24Å; I351-M695 WeakPolarHBondContact O-CA 3.28Å; I351-M695 WeakPolarHBondContact O-CG 3.25Å; I351-I696 HydrophobicContact CB-CB 4.38Å; I351-I696 PolarHBondContact N-O 2.83Å; I351-I696 PolarHBondContact O-N 3.38Å; I351-V698 HydrophobicContact CD1-CG2 3.43Å; I351-V698 VanDerWaalsContact CD1-CG2 3.43Å; I351-V698 HydrophobicContact CG1-CG2 3.66Å
352	V	86.4	Confident	85.9	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.6	176.7	-178	0	0	0	0	109	V342 M345 K354 I357 V358 M695	V342-V352 HydrophobicContact CG1-CB 4.1Å; V342-V352 HydrophobicContact CG2-CB 3.92Å; V342-V352 HydrophobicContact CG2-CG1 4.35Å; V342-V352 HydrophobicContact CG2-CG2 4.46Å; M345-V352 HydrophobicContact SD-CG2 3.7Å; V352-K354 VanDerWaalsContact CG1-O 3.24Å; V352-K354 WeakPolarHBondContact CG1-O 3.48Å; V352-I357 HydrophobicContact CG1-CB 4.31Å; V352-V358 HydrophobicContact CB-CG2 4.41Å; V352-V358 HydrophobicContact CG1-CG2 3.99Å; V352-V358 HydrophobicContact CG2-CG2 4.35Å; V352-M695 HydrophobicContact CG2-CE 3.92Å; V352-M695 HydrophobicContact CG2-CG 4.39Å
353	K	79.3	Confident	86.1	Confident	73 Å²	73	42.3 Å²	42.3	32%	0.317	19%	0.192	S	C	.	.	S	Bend	trans	-74.8	-37.4	180	-72.3	-176.1	58.7	179	0	112.3	E691 A693 D694 I696	K353-E691 PolarHBondContact NZ-O 2.92Å; K353-E691 IonicContact NZ-OE1 3.56Å; K353-E691 PolarHBondContact NZ-OE1 3.11Å; K353-E691 IonicContact NZ-OE2 3.37Å; K353-E691 PolarHBondContact NZ-OE2 2.84Å; K353-A693 WeakPolarHBondContact CD-O 3.36Å; K353-D694 PolarHBondContact N-O 3.12Å; K353-I696 HydrophobicContact CD-CD1 4.29Å
354	K	75.8	Confident	86.6	Confident	75 Å²	75	37.5 Å²	37.5	33%	0.326	17%	0.169	S	C	.	.	S	Bend	trans	-116.7	119	-177.3	-63.2	-178.5	-165.8	147.5	0	111.9	V352 P356 I357 D694	V352-K354 VanDerWaalsContact CG1-O 3.24Å; V352-K354 WeakPolarHBondContact CG1-O 3.48Å; K354-P356 VanDerWaalsContact C-CD 3.48Å; K354-I357 HydrophobicContact CB-CG1 3.74Å; K354-I357 WeakPolarHBondContact O-CB 3.41Å; K354-I357 PolarHBondContact O-N 2.59Å; K354-I357 VanDerWaalsContact O-N 3.1Å; K354-D694 WeakPolarHBondContact CD-OD1 3.44Å; K354-D694 WeakPolarHBondContact CE-OD1 3.21Å; K354-D694 IonicContact NZ-OD1 2.86Å; K354-D694 PolarHBondContact NZ-OD1 2.68Å
355	L	79.1	Confident	86.9	Confident	24 Å²	24	36.7 Å²	36.7	13%	0.126	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-44.1	-178.5	-66.9	-179.6	0	0	0	114.9	L148 T335 L338 A339 V342 I357 V358	L148-L355 HydrophobicContact CD1-CD1 3.84Å; L148-L355 HydrophobicContact CD1-CD2 3.74Å; L148-L355 HydrophobicContact CD1-CG 3.78Å; L148-L355 HydrophobicContact CD2-CD2 4.35Å; T335-L355 HydrophobicContact CG2-CD1 3.81Å; L338-L355 HydrophobicContact CB-CB 4.24Å; L338-L355 HydrophobicContact CB-CD2 4.44Å; A339-L355 HydrophobicContact CB-CD1 4.39Å; A339-L355 HydrophobicContact CB-CD2 4.12Å; V342-L355 HydrophobicContact CB-CD2 4.46Å; V342-L355 HydrophobicContact CG2-CD2 3.68Å; L355-I357 PolarHBondContact O-N 2.64Å; L355-I357 VanDerWaalsContact O-N 3.12Å; L355-V358 WeakPolarHBondContact O-CB 3.49Å; L355-V358 WeakPolarHBondContact O-CG2 3.12Å; L355-V358 PolarHBondContact O-N 3.35Å
356	P	81.8	Confident	87.2	Confident	33 Å²	33	37.2 Å²	37.2	21%	0.214	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-16	-177	-22.6	36.4	0	0	0	114.3	T276 K354 V358 E359 T360	T276-P356 HydrophobicContact CG2-CB 3.67Å; T276-P356 WeakPolarHBondContact OG1-CB 3.42Å; K354-P356 VanDerWaalsContact C-CD 3.48Å; P356-V358 VanDerWaalsContact C-N 3.26Å; P356-V358 PolarHBondContact O-N 2.97Å; P356-E359 PolarHBondContact O-N 3.12Å; P356-T360 PolarHBondContact O-OG1 3.28Å
357	I	85.5	Confident	87.6	Confident	9 Å²	9	35.1 Å²	35.1	5%	0.046	16%	0.16	C	C	.	.	H	α-helix	trans	-70.6	-27.3	-180	-62.1	-68.9	0	0	0	111.5	T276 V352 K354 L355 E359 T360 L361 I677 D694	T276-I357 HydrophobicContact CG2-CD1 4.11Å; V352-I357 HydrophobicContact CG1-CB 4.31Å; K354-I357 HydrophobicContact CB-CG1 3.74Å; K354-I357 WeakPolarHBondContact O-CB 3.41Å; K354-I357 PolarHBondContact O-N 2.59Å; K354-I357 VanDerWaalsContact O-N 3.1Å; L355-I357 PolarHBondContact O-N 2.64Å; L355-I357 VanDerWaalsContact O-N 3.12Å; I357-E359 PolarHBondContact O-N 2.8Å; I357-T360 WeakPolarHBondContact O-CA 3.44Å; I357-T360 WeakPolarHBondContact O-CB 3.4Å; I357-T360 PolarHBondContact O-N 2.75Å; I357-L361 WeakPolarHBondContact O-CG 3.36Å; I357-L361 PolarHBondContact O-N 3.47Å; I357-I677 HydrophobicContact CG2-CG1 4.35Å; I357-I677 HydrophobicContact CG2-CG2 3.88Å; I357-D694 HydrophobicContact CB-CB 4.36Å; I357-D694 HydrophobicContact CD1-CB 4.22Å; I357-D694 HydrophobicContact CG1-CB 3.86Å; I357-D694 HydrophobicContact CG2-CB 3.94Å
358	V	87.5	Confident	88	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-53.5	-38.9	173.8	174.5	0	0	0	0	112	L338 V342 M345 V352 L355 P356 G712 I715	L338-V358 HydrophobicContact CD2-CB 3.84Å; L338-V358 HydrophobicContact CD2-CG1 3.93Å; V342-V358 HydrophobicContact CG2-CG2 3.43Å; V342-V358 VanDerWaalsContact CG2-CG2 3.43Å; M345-V358 HydrophobicContact CE-CB 4.46Å; M345-V358 HydrophobicContact CE-CG1 3.73Å; M345-V358 HydrophobicContact CE-CG2 4.43Å; M345-V358 HydrophobicContact SD-CG1 4.49Å; M345-V358 HydrophobicContact SD-CG2 4.23Å; V352-V358 HydrophobicContact CB-CG2 4.41Å; V352-V358 HydrophobicContact CG1-CG2 3.99Å; V352-V358 HydrophobicContact CG2-CG2 4.35Å; L355-V358 WeakPolarHBondContact O-CB 3.49Å; L355-V358 WeakPolarHBondContact O-CG2 3.12Å; L355-V358 PolarHBondContact O-N 3.35Å; P356-V358 VanDerWaalsContact C-N 3.26Å; P356-V358 PolarHBondContact O-N 2.97Å; V358-G712 VanDerWaalsContact O-CA 3.25Å; V358-G712 WeakPolarHBondContact O-CA 3.45Å; V358-I715 HydrophobicContact CG1-CB 4.37Å; V358-I715 HydrophobicContact CG1-CD1 3.26Å; V358-I715 HydrophobicContact CG1-CG1 4.4Å; V358-I715 HydrophobicContact CG1-CG2 4.24Å
359	E	86.5	Confident	88.2	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-75.8	-36.3	174.4	-176.6	-91.1	168.7	0	0	112.3	L278 P356 I357 L361 S362 Y716 R784	L278-E359 HydrophobicContact CB-CB 4.04Å; L278-E359 HydrophobicContact CB-CG 3.81Å; L278-E359 WeakPolarHBondContact CB-OE2 3.23Å; L278-E359 HydrophobicContact CD1-CG 4.4Å; L278-E359 HydrophobicContact CD2-CB 4.01Å; L278-E359 HydrophobicContact CD2-CG 4.27Å; L278-E359 HydrophobicContact CG-CG 4.39Å; L278-E359 PolarHBondContact N-OE2 3Å; P356-E359 PolarHBondContact O-N 3.12Å; I357-E359 PolarHBondContact O-N 2.8Å; E359-L361 PolarHBondContact O-N 3.44Å; E359-S362 VanDerWaalsContact O-CB 3.25Å; E359-S362 WeakPolarHBondContact O-CB 3.27Å; E359-S362 PolarHBondContact O-N 2.83Å; E359-S362 PolarHBondContact O-OG 2.99Å; E359-Y716 HydrophobicContact CG-CD2 3.83Å; E359-R784 IonicContact OE1-CZ 2.76Å; E359-R784 IonicContact OE1-NE 2.99Å; E359-R784 IonicContact OE1-NH2 3.25Å; E359-R784 PolarHBondContact OE1-NH2 3.19Å
360	T	89	Confident	88.2	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.012	8%	0.084	C	C	.	.	H	α-helix	trans	-61.6	-35.2	-179.6	-50.8	0	0	0	0	110.7	P277 P356 I357 S362 C363 C364 V658 D676 I677	P277-T360 WeakPolarHBondContact CD-OG1 3.4Å; P356-T360 PolarHBondContact O-OG1 3.28Å; I357-T360 WeakPolarHBondContact O-CA 3.44Å; I357-T360 WeakPolarHBondContact O-CB 3.4Å; I357-T360 PolarHBondContact O-N 2.75Å; T360-S362 PolarHBondContact O-N 3.12Å; T360-C363 PolarHBondContact O-N 2.5Å; T360-C364 PolarHBondContact O-N 2.95Å; T360-C364 VanDerWaalsContact O-N 3.11Å; T360-V658 HydrophobicContact CG2-CG1 3.72Å; T360-D676 HydrophobicContact CG2-CB 4.12Å; T360-I677 HydrophobicContact CG2-CD1 3.91Å; T360-I677 HydrophobicContact CG2-CG1 3.66Å
361	L	90.3	Very high	88	Confident	2 Å²	2	17 Å²	17	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-55.6	-31.7	171.5	-68.8	161.9	0	0	0	113.4	M345 I357 E359 C363 C364 I677 M695 A708 I709	M345-L361 HydrophobicContact CE-CD1 3.94Å; M345-L361 HydrophobicContact SD-CD1 4.38Å; I357-L361 WeakPolarHBondContact O-CG 3.36Å; I357-L361 PolarHBondContact O-N 3.47Å; E359-L361 PolarHBondContact O-N 3.44Å; L361-C363 VanDerWaalsContact C-N 3.25Å; L361-C363 PolarHBondContact O-N 3.45Å; L361-C364 WeakPolarHBondContact O-CB 3.48Å; L361-C364 PolarHBondContact O-N 2.96Å; L361-I677 HydrophobicContact CB-CD1 4.34Å; L361-I677 HydrophobicContact CD2-CD1 3.74Å; L361-I677 HydrophobicContact CD2-CG2 3.94Å; L361-I677 HydrophobicContact CG-CD1 4Å; L361-M695 HydrophobicContact CD1-CE 3.23Å; L361-M695 HydrophobicContact CD2-CE 3.57Å; L361-M695 HydrophobicContact CG-CE 3.96Å; L361-A708 HydrophobicContact CD1-CB 4.26Å; L361-I709 HydrophobicContact CD2-CG1 4.44Å
362	S	88.8	Confident	87.6	Confident	3 Å²	3	15.7 Å²	15.7	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-70.1	-24.3	177.3	79	0	0	0	0	113.4	E359 T360 R784	E359-S362 VanDerWaalsContact O-CB 3.25Å; E359-S362 WeakPolarHBondContact O-CB 3.27Å; E359-S362 PolarHBondContact O-N 2.83Å; E359-S362 PolarHBondContact O-OG 2.99Å; T360-S362 PolarHBondContact O-N 3.12Å; S362-R784 PolarHBondContact O-N 3.32Å
363	C	90.3	Very high	87.1	Confident	1 Å²	1	15.6 Å²	15.6	1%	0.007	8%	0.079	C	C	.	.	H	α-helix	trans	-99	-8.1	-179.3	-56.7	0	0	0	0	112.6	T360 L361 N365 V658 R784 V786	T360-C363 PolarHBondContact O-N 2.5Å; L361-C363 VanDerWaalsContact C-N 3.25Å; L361-C363 PolarHBondContact O-N 3.45Å; C363-N365 PolarHBondContact O-N 3.04Å; C363-N365 VanDerWaalsContact O-N 3.13Å; C363-V658 HydrophobicContact CB-CG2 4.07Å; C363-V658 WeakPolarHBondContact O-CB 3.35Å; C363-R784 PolarHBondContact SG-NE 3.44Å; C363-R784 PolarHBondContact SG-NH2 3.35Å; C363-V786 HydrophobicContact CB-CG1 4.07Å
364	C	92.7	Very high	87.2	Confident	2 Å²	2	12.1 Å²	12.1	1%	0.014	6%	0.064	C	C	.	.			trans	-55.3	117.8	-179.6	-179	0	0	0	0	110.5	T360 L361 A660 I677 P783	T360-C364 PolarHBondContact O-N 2.95Å; T360-C364 VanDerWaalsContact O-N 3.11Å; L361-C364 WeakPolarHBondContact O-CB 3.48Å; L361-C364 PolarHBondContact O-N 2.96Å; C364-A660 VanDerWaalsContact SG-CB 3.59Å; C364-I677 HydrophobicContact CB-CD1 4.04Å; C364-P783 WeakPolarHBondContact O-CB 3.37Å; C364-P783 VanDerWaalsContact O-CG 3.3Å; C364-P783 WeakPolarHBondContact O-CG 3.41Å
365	N	92.5	Very high	87.8	Confident	53 Å²	53	8.6 Å²	8.6	28%	0.283	5%	0.049	S	C	.	.			trans	-118.7	-15.4	-179.2	68.3	-7.4	0	0	0	113.2	C363 A585 A657 V658 P783	C363-N365 PolarHBondContact O-N 3.04Å; C363-N365 VanDerWaalsContact O-N 3.13Å; N365-A585 PolarHBondContact O-N 2.9Å; N365-A657 WeakPolarHBondContact OD1-CA 3.43Å; N365-A657 WeakPolarHBondContact OD1-CB 3.24Å; N365-V658 PolarHBondContact N-O 3.45Å; N365-V658 PolarHBondContact OD1-N 2.84Å; N365-V658 PolarHBondContact OD1-O 2.99Å; N365-V658 VanDerWaalsContact OD1-O 3.04Å; N365-P783 HydrophobicContact CB-CB 4.03Å; N365-P783 HydrophobicContact CB-CG 4.22Å
366	V	94.7	Very high	88.2	Confident	12 Å²	12	7.4 Å²	7.4	7%	0.073	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	128.3	173	-174.4	0	0	0	0	109.7	A585 K587 L652 A657 V658 V659 A660	V366-A585 CarbonylContact C-O 3.59Å; V366-A585 VanDerWaalsContact CA-O 3.28Å; V366-A585 WeakPolarHBondContact CA-O 3.14Å; V366-A585 HydrophobicContact CG2-CB 4.33Å; V366-K587 HydrophobicContact CG1-CD 3.95Å; V366-K587 HydrophobicContact CG1-CG 4.26Å; V366-L652 HydrophobicContact CG1-CD1 3.95Å; V366-L652 HydrophobicContact CG1-CD2 4.37Å; V366-L652 HydrophobicContact CG2-CD2 4.48Å; V366-A657 HydrophobicContact CG2-CB 3.94Å; V366-V658 PolarHBondContact N-O 2.96Å; V366-V659 WeakPolarHBondContact O-CA 3.15Å; V366-A660 PolarHBondContact O-N 2.98Å
367	I	95.5	Very high	88.1	Confident	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	110.9	170.3	-58.2	172.2	0	0	0	107.8	L579 V584 A585 I586 K587 A660 T662 F702 I705 I709	I367-L579 HydrophobicContact CD1-CD1 3.95Å; I367-V584 HydrophobicContact CD1-CG1 3.84Å; I367-V584 HydrophobicContact CG1-CG1 3.84Å; I367-A585 PolarHBondContact N-O 2.9Å; I367-I586 HydrophobicContact CB-CG1 4.4Å; I367-I586 CarbonylContact O-C 3.48Å; I367-I586 WeakPolarHBondContact O-CA 3.22Å; I367-K587 PolarHBondContact O-N 2.83Å; I367-A660 CarbonylContact C-O 3.53Å; I367-A660 WeakPolarHBondContact CA-O 3.37Å; I367-A660 HydrophobicContact CG1-CB 4.28Å; I367-T662 HydrophobicContact CG2-CG2 4.46Å; I367-F702 HydrophobicContact CG2-CE2 4.34Å; I367-F702 HydrophobicContact CG2-CZ 4.39Å; I367-I705 HydrophobicContact CD1-CG2 4.34Å; I367-I709 HydrophobicContact CD1-CD1 4.08Å
368	C	95.1	Very high	87.8	Confident	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	115.8	165.9	-72	0	0	0	0	107.7	K587 I589 L652 V659 A660 M661 T662	C368-K587 CarbonylContact C-O 3.12Å; C368-K587 WeakPolarHBondContact CA-O 3.33Å; C368-I589 HydrophobicContact CB-CD1 3.9Å; C368-L652 WeakPolarHBondContact SG-CD1 3.43Å; C368-V659 HydrophobicContact CB-CG1 4.42Å; C368-A660 PolarHBondContact N-O 3.14Å; C368-M661 HydrophobicContact CB-SD 3.54Å; C368-M661 VanDerWaalsContact CB-SD 3.54Å; C368-M661 CarbonylContact O-C 3.6Å; C368-M661 VanDerWaalsContact O-CA 3.3Å; C368-M661 WeakPolarHBondContact O-CA 3.13Å; C368-T662 PolarHBondContact O-N 2.83Å
369	S	92.6	Very high	87.7	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.4	-178.7	-172.1	0	0	0	0	111.9	T374 L375 K587 M588 I589 T662	S369-T374 WeakPolarHBondContact OG-CG2 3.21Å; S369-L375 WeakPolarHBondContact OG-CG 3.49Å; S369-K587 PolarHBondContact N-O 3.43Å; S369-M588 WeakPolarHBondContact O-CA 3.31Å; S369-I589 PolarHBondContact O-N 2.95Å; S369-T662 WeakPolarHBondContact CA-OG1 3.41Å; S369-T662 WeakPolarHBondContact CB-OG1 3.11Å; S369-T662 PolarHBondContact OG-OG1 2.95Å
370	D	90.1	Very high	87.7	Confident	9 Å²	9	15.4 Å²	15.4	5%	0.048	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	150.2	161.9	-161.8	72.3	0	0	0	110.1	T372 T374 L375 I589 K645 T662	D370-T372 PolarHBondContact OD2-N 2.99Å; D370-T374 WeakPolarHBondContact O-CB 3.48Å; D370-L375 WeakPolarHBondContact O-CG 3.46Å; D370-I589 WeakPolarHBondContact CA-O 3.49Å; D370-K645 WeakPolarHBondContact OD1-CE 3.26Å; D370-K645 IonicContact OD1-NZ 2.83Å; D370-K645 PolarHBondContact OD1-NZ 3.2Å; D370-T662 PolarHBondContact N-O 3.4Å
371	K	86.9	Confident	87.8	Confident	10 Å²	10	15.5 Å²	15.5	4%	0.043	8%	0.079	C	C	.	.	I	π-helix	trans	-83.5	-54	179	-176.4	-127.7	60.6	170.9	0	110.8	L375 T376 D566 M588 I589 D592 I600	K371-L375 PolarHBondContact O-N 3.39Å; K371-L375 VanDerWaalsContact O-N 3.08Å; K371-T376 HydrophobicContact CD-CG2 4.32Å; K371-T376 HydrophobicContact CG-CG2 4.15Å; K371-T376 PolarHBondContact O-N 3.3Å; K371-T376 VanDerWaalsContact O-N 3.11Å; K371-T376 PolarHBondContact O-OG1 3.49Å; K371-D566 IonicContact NZ-OD2 3.2Å; K371-M588 HydrophobicContact CB-CG 4.12Å; K371-M588 HydrophobicContact CB-SD 4.17Å; K371-M588 HydrophobicContact CG-SD 4.03Å; K371-I589 PolarHBondContact N-O 3.31Å; K371-D592 VanDerWaalsContact CD-OD2 3.24Å; K371-D592 WeakPolarHBondContact CD-OD2 3.42Å; K371-D592 WeakPolarHBondContact CE-OD2 3.34Å; K371-D592 IonicContact NZ-OD1 3.37Å; K371-D592 IonicContact NZ-OD2 2.84Å; K371-D592 PolarHBondContact NZ-OD2 3.41Å; K371-I600 HydrophobicContact CG-CG2 4.23Å
372	T	79.9	Confident	88	Confident	19 Å²	19	15.5 Å²	15.5	12%	0.117	8%	0.079	C	C	.	.	I	π-helix	trans	-75.5	134.6	-169.5	-55.8	0	0	0	0	109.2	T212 D370 T374 N378	T212-T372 HydrophobicContact CG2-CG2 3.76Å; D370-T372 PolarHBondContact OD2-N 2.99Å; T372-T374 PolarHBondContact O-N 3.47Å; T372-N378 HydrophobicContact CG2-CB 4.22Å; T372-N378 WeakPolarHBondContact CG2-OD1 3.39Å
373	G	75.5	Confident	88.2	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	72.6	-22.6	178.8	0	0	0	0	0	114.6	T376 R569 M681	G373-T376 CarbonylContact C-O 3.39Å; G373-R569 PolarHBondContact O-NE 3.03Å; G373-R569 PolarHBondContact O-NH2 3.45Å; G373-M681 WeakPolarHBondContact O-CE 3.32Å
374	T	82.1	Confident	88.3	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.006	9%	0.094	C	C	.	.	I	π-helix	trans	-101.3	-63.9	-179.1	-54	0	0	0	0	113.1	S369 D370 T372 R569 T662 M681	S369-T374 WeakPolarHBondContact OG-CG2 3.21Å; D370-T374 WeakPolarHBondContact O-CB 3.48Å; T372-T374 PolarHBondContact O-N 3.47Å; T374-R569 WeakPolarHBondContact O-CD 3.43Å; T374-R569 PolarHBondContact O-NE 2.93Å; T374-T662 WeakPolarHBondContact CG2-OG1 3.24Å; T374-M681 HydrophobicContact CG2-CE 4.47Å; T374-M681 HydrophobicContact CG2-SD 4Å
375	L	87.6	Confident	88.5	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	I	π-helix	trans	-81.9	-27.7	176.7	-64.3	175.1	0	0	0	111.8	S369 D370 K371 P568 R569 V572 I576 M588 L604 L606 F702	S369-L375 WeakPolarHBondContact OG-CG 3.49Å; D370-L375 WeakPolarHBondContact O-CG 3.46Å; K371-L375 PolarHBondContact O-N 3.39Å; K371-L375 VanDerWaalsContact O-N 3.08Å; L375-P568 WeakPolarHBondContact O-CA 3.33Å; L375-R569 PolarHBondContact O-N 2.6Å; L375-V572 HydrophobicContact CD2-CG1 3.83Å; L375-I576 HydrophobicContact CD2-CD1 4.38Å; L375-M588 HydrophobicContact CD1-CE 3.84Å; L375-M588 HydrophobicContact CD1-CG 4.17Å; L375-L604 HydrophobicContact CB-CD1 4.05Å; L375-L604 HydrophobicContact CD1-CD1 4.05Å; L375-L604 HydrophobicContact CG-CD1 4.46Å; L375-L606 HydrophobicContact CD1-CD1 4.4Å; L375-F702 HydrophobicContact CD2-CD2 3.89Å; L375-F702 HydrophobicContact CD2-CE2 3.98Å; L375-F702 HydrophobicContact CD2-CG 4.43Å
376	T	87.1	Confident	88.6	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.082	C	C	.	.	B	Isolated β-bridge	trans	-108.3	161.9	177.6	63.1	0	0	0	0	111.5	K371 G373 N378 D566 P567 R569 I600	K371-T376 HydrophobicContact CD-CG2 4.32Å; K371-T376 HydrophobicContact CG-CG2 4.15Å; K371-T376 PolarHBondContact O-N 3.3Å; K371-T376 VanDerWaalsContact O-N 3.11Å; K371-T376 PolarHBondContact O-OG1 3.49Å; G373-T376 CarbonylContact C-O 3.39Å; T376-N378 PolarHBondContact O-N 2.87Å; T376-D566 VanDerWaalsContact CB-CG 3.4Å; T376-D566 WeakPolarHBondContact CB-OD1 3.49Å; T376-D566 WeakPolarHBondContact CB-OD2 3.42Å; T376-D566 VanDerWaalsContact OG1-CG 3.26Å; T376-D566 PolarHBondContact OG1-OD1 3.43Å; T376-D566 PolarHBondContact OG1-OD2 3.11Å; T376-P567 VanDerWaalsContact CA-O 3.3Å; T376-P567 WeakPolarHBondContact CA-O 3.19Å; T376-P567 WeakPolarHBondContact CB-O 3.4Å; T376-R569 PolarHBondContact O-NE 3.44Å; T376-I600 HydrophobicContact CG2-CG2 4.32Å
377	K	79.9	Confident	88.6	Confident	50 Å²	50	15.5 Å²	15.5	22%	0.217	8%	0.078	C	C	.	.			trans	-74.1	-12.7	178.9	-75.5	-171.8	-171.7	178.9	0	112.9	E379 V398 P567 R569 E570	K377-E379 HydrophobicContact CB-CB 4.14Å; K377-E379 HydrophobicContact CB-CG 4.21Å; K377-E379 PolarHBondContact O-N 3.17Å; K377-V398 HydrophobicContact CD-CG1 3.66Å; K377-P567 PolarHBondContact N-O 2.95Å; K377-P567 VanDerWaalsContact N-O 3.09Å; K377-R569 HydrophobicContact CB-CG 4.45Å; K377-R569 HydrophobicContact CG-CB 4.4Å; K377-R569 HydrophobicContact CG-CG 3.55Å; K377-E570 IonicContact NZ-OE1 3.1Å; K377-E570 PolarHBondContact NZ-OE1 2.8Å
378	N	79.1	Confident	88.4	Confident	64 Å²	64	15.6 Å²	15.6	34%	0.342	8%	0.079	S	C	.	.	S	Bend	trans	56.8	31.4	-168.3	-162.6	22.8	0	0	0	112	T372 T376 D566	T372-N378 HydrophobicContact CG2-CB 4.22Å; T372-N378 WeakPolarHBondContact CG2-OD1 3.39Å; T376-N378 PolarHBondContact O-N 2.87Å; N378-D566 WeakPolarHBondContact CA-OD1 3.11Å; N378-D566 PolarHBondContact N-OD1 3.18Å
379	E	84.9	Confident	88.2	Confident	63 Å²	63	17.6 Å²	17.6	29%	0.294	9%	0.089	S	C	.	.			trans	-121.9	97.4	-179.2	-70	-176.1	159.6	0	0	108.6	K377 T381 G399 Y400 D566 P567	K377-E379 HydrophobicContact CB-CB 4.14Å; K377-E379 HydrophobicContact CB-CG 4.21Å; K377-E379 PolarHBondContact O-N 3.17Å; E379-T381 PolarHBondContact O-N 3.43Å; E379-T381 VanDerWaalsContact O-N 3.12Å; E379-T381 PolarHBondContact O-OG1 3.22Å; E379-G399 WeakPolarHBondContact OE2-CA 3.38Å; E379-Y400 HydrophobicContact CB-CE2 4.09Å; E379-Y400 HydrophobicContact CG-CD2 4.32Å; E379-Y400 HydrophobicContact CG-CE2 3.92Å; E379-D566 PolarHBondContact N-OD1 3.15Å; E379-P567 WeakPolarHBondContact O-CD 3.36Å
380	M	88.1	Confident	88	Confident	32 Å²	32	19.2 Å²	19.2	16%	0.158	11%	0.106	C	C	.	.			trans	-56.2	121.9	179.6	-66.5	-61.3	-72.1	0	0	110.1	Y400 P445 A449 I564 D566	M380-Y400 PolarHBondContact N-OH 3.15Å; M380-Y400 VanDerWaalsContact N-OH 3.15Å; M380-Y400 WeakPolarHBondContact O-CE1 3.33Å; M380-P445 HydrophobicContact CB-CB 4.07Å; M380-P445 HydrophobicContact CG-CB 3.63Å; M380-A449 HydrophobicContact CB-CB 4.26Å; M380-A449 WeakPolarHBondContact O-CB 3.42Å; M380-I564 HydrophobicContact CB-CG2 4.01Å; M380-I564 HydrophobicContact CE-CB 4.28Å; M380-I564 HydrophobicContact CE-CG2 3.75Å; M380-D566 HydrophobicContact SD-CB 4.05Å
381	T	91.1	Very high	88	Confident	4 Å²	4	21.2 Å²	21.2	3%	0.025	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	134.2	-173.3	-61.3	0	0	0	0	109.7	E379 G397 G399 I564 I565	E379-T381 PolarHBondContact O-N 3.43Å; E379-T381 VanDerWaalsContact O-N 3.12Å; E379-T381 PolarHBondContact O-OG1 3.22Å; T381-G397 WeakPolarHBondContact CG2-O 3.37Å; T381-G399 PolarHBondContact OG1-N 2.84Å; T381-I564 WeakPolarHBondContact O-CA 3.4Å; T381-I564 WeakPolarHBondContact O-CG2 3.22Å; T381-I565 PolarHBondContact N-O 3.3Å; T381-I565 PolarHBondContact O-N 3.37Å
382	V	94.3	Very high	88.3	Confident	3 Å²	3	25 Å²	25	2%	0.018	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.7	171	178	0	0	0	0	109.1	V385 V395 A449 L450 L453 V562 I564	V382-V385 HydrophobicContact CG1-CG2 4.17Å; V382-V395 HydrophobicContact CG1-CB 4.35Å; V382-V395 HydrophobicContact CG1-CG2 3.99Å; V382-V395 WeakPolarHBondContact O-CB 3.46Å; V382-V395 WeakPolarHBondContact O-CG1 3.27Å; V382-A449 HydrophobicContact CG2-CB 4.08Å; V382-A449 WeakPolarHBondContact CG2-O 3.43Å; V382-L450 HydrophobicContact CG2-CD2 4.16Å; V382-L453 HydrophobicContact CB-CB 4.34Å; V382-L453 HydrophobicContact CB-CD1 4.45Å; V382-L453 HydrophobicContact CB-CD2 4.5Å; V382-L453 HydrophobicContact CG1-CD1 4.14Å; V382-L453 HydrophobicContact CG1-CD2 4.07Å; V382-L453 HydrophobicContact CG2-CB 4.11Å; V382-L453 HydrophobicContact CG2-CD2 4.28Å; V382-V562 HydrophobicContact CB-CG1 4.18Å; V382-V562 HydrophobicContact CG1-CG1 3.36Å; V382-V562 HydrophobicContact CG2-CG1 3.75Å; V382-I564 HydrophobicContact CG2-CG1 4.17Å
383	T	91.8	Very high	88.9	Confident	29 Å²	29	24.1 Å²	24.1	18%	0.178	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-24.5	177	56.7	0	0	0	0	113.6	V395 L542 G563 I565	T383-V395 PolarHBondContact O-N 3.2Å; T383-L542 WeakPolarHBondContact OG1-CD2 3.43Å; T383-G563 PolarHBondContact N-O 2.94Å; T383-I565 HydrophobicContact CG2-CG2 3.53Å
384	Q	94	Very high	89.8	Confident	35 Å²	35	30 Å²	30	16%	0.164	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	138.2	-177.7	-70.5	-175.3	-5.7	0	0	110.6	A393 M537 L542 G563	Q384-A393 CarbonylContact C-O 3.58Å; Q384-A393 WeakPolarHBondContact CA-O 3.36Å; Q384-M537 HydrophobicContact CB-CE 3.86Å; Q384-L542 HydrophobicContact CB-CD1 4Å; Q384-L542 HydrophobicContact CG-CD1 3.9Å; Q384-G563 PolarHBondContact N-O 3.13Å; Q384-G563 PolarHBondContact O-N 3.46Å
385	V	94.9	Very high	90.3	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.012	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.3	169.8	-179	0	0	0	0	107.5	V382 A393 V395 V424 L453 V562	V382-V385 HydrophobicContact CG1-CG2 4.17Å; V385-A393 HydrophobicContact CB-CB 4.36Å; V385-A393 PolarHBondContact N-O 2.96Å; V385-A393 PolarHBondContact O-N 2.98Å; V385-V395 HydrophobicContact CG2-CG2 3.99Å; V385-V424 HydrophobicContact CG1-CG1 4.2Å; V385-L453 HydrophobicContact CG2-CD1 4.35Å; V385-L453 HydrophobicContact CG2-CD2 4.03Å; V385-V562 HydrophobicContact CG1-CG2 4.41Å; V385-V562 HydrophobicContact CG2-CG1 4.48Å; V385-V562 HydrophobicContact CG2-CG2 4.35Å
386	F	95.4	Very high	90.5	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.6	175.7	175.4	-96	0	0	0	109.1	L391 H392 L529 Y530 Q533 M537 G560 L561	F386-L391 WeakPolarHBondContact CA-O 3.48Å; F386-H392 AromaticContact CD2-CD2 3.7Å; F386-H392 AromaticContact CD2-CE1 3.37Å; F386-H392 WeakPolarHBondContact CD2-CE1 3.31Å; F386-H392 AromaticContact CD2-CG 3.86Å; F386-H392 AromaticContact CD2-ND1 3.63Å; F386-H392 AromaticContact CD2-NE2 3.4Å; F386-H392 WeakPolarHBondContact CD2-NE2 3.26Å; F386-H392 AromaticContact CE2-CD2 3.77Å; F386-H392 AromaticContact CE2-CE1 3.65Å; F386-H392 AromaticContact CE2-NE2 3.26Å; F386-H392 VanDerWaalsContact CE2-NE2 3.26Å; F386-H392 WeakPolarHBondContact CE2-NE2 3.4Å; F386-L529 HydrophobicContact CE1-CD2 4.32Å; F386-L529 HydrophobicContact CZ-CD2 3.8Å; F386-Y530 AromaticContact CE1-CD1 3.76Å; F386-Y530 HydrophobicContact CE1-CD1 3.76Å; F386-Y530 HydrophobicContact CE1-CE1 4.01Å; F386-Y530 HydrophobicContact CZ-CD1 4.46Å; F386-Q533 HydrophobicContact CB-CG 4.31Å; F386-Q533 HydrophobicContact CD1-CG 3.77Å; F386-Q533 HydrophobicContact CD2-CG 3.86Å; F386-Q533 HydrophobicContact CE1-CB 4.36Å; F386-Q533 HydrophobicContact CE1-CG 3.99Å; F386-Q533 HydrophobicContact CE2-CG 4.06Å; F386-Q533 HydrophobicContact CG-CG 3.68Å; F386-Q533 HydrophobicContact CZ-CB 4.48Å; F386-Q533 HydrophobicContact CZ-CG 4.12Å; F386-M537 HydrophobicContact CB-SD 4.42Å; F386-G560 CarbonylContact O-C 3.57Å; F386-G560 WeakPolarHBondContact O-CA 3.23Å; F386-L561 HydrophobicContact CB-CB 4.31Å; F386-L561 HydrophobicContact CD1-CB 4.46Å; F386-L561 HydrophobicContact CD1-CD1 4Å; F386-L561 HydrophobicContact CD1-CG 4.32Å; F386-L561 PolarHBondContact N-O 2.81Å; F386-L561 PolarHBondContact O-N 3.22Å
387	T	94.6	Very high	90.4	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	160.4	-178.2	60.8	0	0	0	0	111.8	D389 G390 L391 I421 V424	T387-D389 WeakPolarHBondContact CB-OD1 3.37Å; T387-D389 PolarHBondContact O-N 3.07Å; T387-D389 PolarHBondContact OG1-OD1 2.98Å; T387-G390 PolarHBondContact O-N 3.48Å; T387-L391 HydrophobicContact CG2-CB 4.48Å; T387-L391 PolarHBondContact N-O 3.42Å; T387-L391 WeakPolarHBondContact OG1-CB 3.49Å; T387-L391 PolarHBondContact OG1-N 3.19Å; T387-L391 VanDerWaalsContact OG1-N 3.12Å; T387-I421 HydrophobicContact CG2-CB 4.4Å; T387-I421 HydrophobicContact CG2-CG1 3.65Å; T387-V424 HydrophobicContact CG2-CG2 4.5Å
388	S	92.1	Very high	90.6	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.014	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.6	-178.7	50.8	0	0	0	0	114.6	G390 N514 Y530 F558 L559	S388-G390 VanDerWaalsContact C-N 3.33Å; S388-N514 WeakPolarHBondContact CB-O 3.37Å; S388-N514 PolarHBondContact OG-N 2.69Å; S388-N514 PolarHBondContact OG-O 3.44Å; S388-Y530 PolarHBondContact O-OH 2.84Å; S388-F558 PolarHBondContact OG-O 2.91Å; S388-L559 WeakPolarHBondContact CB-O 3.41Å; S388-L559 PolarHBondContact N-O 2.87Å; S388-L559 PolarHBondContact OG-O 2.92Å; S388-L559 VanDerWaalsContact OG-O 3.11Å
389	D	89.5	Confident	90.8	Very high	41 Å²	41	31.2 Å²	31.2	22%	0.219	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	4.5	171.4	50.7	-10.4	0	0	0	114.5	T387 S420 R516	T387-D389 WeakPolarHBondContact CB-OD1 3.37Å; T387-D389 PolarHBondContact O-N 3.07Å; T387-D389 PolarHBondContact OG1-OD1 2.98Å; D389-S420 WeakPolarHBondContact OD1-CB 3.27Å; D389-S420 PolarHBondContact OD1-OG 3.12Å; D389-S420 WeakPolarHBondContact OD2-CB 3.35Å; D389-S420 PolarHBondContact OD2-OG 3.09Å; D389-R516 PolarHBondContact OD2-N 2.78Å
390	G	88.8	Confident	90.8	Very high	34 Å²	34	29.2 Å²	29.2	35%	0.351	17%	0.166	S	C	.	.	S	Bend	trans	89.7	15.2	172.7	0	0	0	0	0	115.2	T387 S388 H392	T387-G390 PolarHBondContact O-N 3.48Å; S388-G390 VanDerWaalsContact C-N 3.33Å; G390-H392 PolarHBondContact O-CD2 3.13Å
391	L	91.1	Very high	90.7	Very high	52 Å²	52	29.3 Å²	29.3	27%	0.272	17%	0.168	S	C	.	.			trans	-79.5	137.3	175	-53	172	0	0	0	109.8	F386 T387 L408	F386-L391 WeakPolarHBondContact CA-O 3.48Å; T387-L391 HydrophobicContact CG2-CB 4.48Å; T387-L391 PolarHBondContact N-O 3.42Å; T387-L391 WeakPolarHBondContact OG1-CB 3.49Å; T387-L391 PolarHBondContact OG1-N 3.19Å; T387-L391 VanDerWaalsContact OG1-N 3.12Å; L391-L408 HydrophobicContact CB-CD1 3.97Å; L391-L408 HydrophobicContact CD1-CD2 4.47Å
392	H	92.9	Very high	90.4	Very high	88 Å²	88	31.2 Å²	31.2	41%	0.407	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.7	175.3	-71.9	-103	0	0	0	109.4	F386 G390 L408 Q533	F386-H392 AromaticContact CD2-CD2 3.7Å; F386-H392 AromaticContact CD2-CE1 3.37Å; F386-H392 WeakPolarHBondContact CD2-CE1 3.31Å; F386-H392 AromaticContact CD2-CG 3.86Å; F386-H392 AromaticContact CD2-ND1 3.63Å; F386-H392 AromaticContact CD2-NE2 3.4Å; F386-H392 WeakPolarHBondContact CD2-NE2 3.26Å; F386-H392 AromaticContact CE2-CD2 3.77Å; F386-H392 AromaticContact CE2-CE1 3.65Å; F386-H392 AromaticContact CE2-NE2 3.26Å; F386-H392 VanDerWaalsContact CE2-NE2 3.26Å; F386-H392 WeakPolarHBondContact CE2-NE2 3.4Å; G390-H392 PolarHBondContact O-CD2 3.13Å; H392-L408 VanDerWaalsContact O-CD1 3.31Å; H392-L408 WeakPolarHBondContact O-CD1 3.46Å; H392-Q533 PolarHBondContact CE1-NE2 3.43Å; H392-Q533 PolarHBondContact CE1-OE1 2.92Å
393	A	93.3	Very high	90	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.7	173.4	0	0	0	0	0	110.7	Q384 V385 V406 L407 I421	Q384-A393 CarbonylContact C-O 3.58Å; Q384-A393 WeakPolarHBondContact CA-O 3.36Å; V385-A393 HydrophobicContact CB-CB 4.36Å; V385-A393 PolarHBondContact N-O 2.96Å; V385-A393 PolarHBondContact O-N 2.98Å; A393-V406 HydrophobicContact CB-CG1 3.84Å; A393-L407 CarbonylContact C-O 3.53Å; A393-L407 WeakPolarHBondContact CA-O 3.28Å; A393-I421 HydrophobicContact CB-CD1 3.85Å
394	E	93.5	Very high	89.8	Confident	122 Å²	122	35.3 Å²	35.3	57%	0.57	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	141.8	172.4	-63.7	-170.7	165.3	0	0	109.7	V406 L407	E394-V406 CarbonylContact O-C 3.59Å; E394-V406 WeakPolarHBondContact O-CA 3.26Å; E394-L407 PolarHBondContact N-O 3.32Å; E394-L407 PolarHBondContact O-N 3.28Å
395	V	92.7	Very high	89.8	Confident	11 Å²	11	38.4 Å²	38.4	7%	0.067	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.5	-179.1	-176.8	0	0	0	0	108.1	V382 T383 V385 V406 L453 K456	V382-V395 HydrophobicContact CG1-CB 4.35Å; V382-V395 HydrophobicContact CG1-CG2 3.99Å; V382-V395 WeakPolarHBondContact O-CB 3.46Å; V382-V395 WeakPolarHBondContact O-CG1 3.27Å; T383-V395 PolarHBondContact O-N 3.2Å; V385-V395 HydrophobicContact CG2-CG2 3.99Å; V395-V406 HydrophobicContact CG1-CG2 4.39Å; V395-V406 HydrophobicContact CG2-CG1 4.38Å; V395-V406 HydrophobicContact CG2-CG2 4.16Å; V395-L453 HydrophobicContact CB-CD1 4.39Å; V395-L453 HydrophobicContact CG1-CD1 3.82Å; V395-L453 HydrophobicContact CG2-CD1 3.67Å; V395-K456 HydrophobicContact CG1-CD 3.96Å
396	T	91.1	Very high	89.6	Confident	56 Å²	56	38.3 Å²	38.3	34%	0.344	23%	0.233	S	C	.	.			trans	-96.6	168.1	178.1	62.9	0	0	0	0	111.1	E405 L407 K456	T396-E405 PolarHBondContact N-O 3.25Å; T396-E405 PolarHBondContact OG1-N 2.64Å; T396-E405 PolarHBondContact OG1-O 3.04Å; T396-L407 HydrophobicContact CG2-CD1 3.72Å; T396-K456 WeakPolarHBondContact O-CE 3.36Å; T396-K456 PolarHBondContact O-NZ 2.86Å
397	G	85.9	Confident	89.5	Confident	27 Å²	27	39.9 Å²	39.9	28%	0.278	24%	0.242	S	C	.	.			trans	83.3	141.7	-177.8	0	0	0	0	0	113.1	T381 K456	T381-G397 WeakPolarHBondContact CG2-O 3.37Å; G397-K456 PolarHBondContact O-NZ 2.84Å
398	V	84.4	Confident	89.4	Confident	45 Å²	45	41.4 Å²	41.4	27%	0.273	25%	0.249	S	C	.	.			trans	-119.2	142.6	-174.6	178.6	0	0	0	0	110.3	K377 P567	K377-V398 HydrophobicContact CD-CG1 3.66Å; V398-P567 HydrophobicContact CB-CG 4.46Å; V398-P567 HydrophobicContact CG1-CB 4.3Å; V398-P567 HydrophobicContact CG1-CG 3.42Å; V398-P567 VanDerWaalsContact CG1-CG 3.42Å; V398-P567 HydrophobicContact CG2-CB 4.36Å; V398-P567 HydrophobicContact CG2-CG 4.25Å
399	G	82.3	Confident	89.2	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.021	29%	0.288	C	S	.	.	S	Bend	trans	95.5	-175.7	174	0	0	0	0	0	114.5	E379 T381 N401	E379-G399 WeakPolarHBondContact OE2-CA 3.38Å; T381-G399 PolarHBondContact OG1-N 2.84Å; G399-N401 VanDerWaalsContact C-N 3.29Å; G399-N401 PolarHBondContact O-N 3.49Å; G399-N401 VanDerWaalsContact O-N 3.14Å
400	Y	85.4	Confident	89	Confident	21 Å²	21	49.6 Å²	49.6	8%	0.082	31%	0.308	C	S	.	.	S	Bend	trans	-89.6	55.8	-174.2	-58.5	-55.5	0	0	0	112.6	E379 M380 I436 L441	E379-Y400 HydrophobicContact CB-CE2 4.09Å; E379-Y400 HydrophobicContact CG-CD2 4.32Å; E379-Y400 HydrophobicContact CG-CE2 3.92Å; M380-Y400 PolarHBondContact N-OH 3.15Å; M380-Y400 VanDerWaalsContact N-OH 3.15Å; M380-Y400 WeakPolarHBondContact O-CE1 3.33Å; Y400-I436 HydrophobicContact CD1-CD1 4.39Å; Y400-I436 WeakPolarHBondContact O-CG2 3.44Å; Y400-L441 HydrophobicContact CD1-CD2 4.44Å; Y400-L441 HydrophobicContact CD2-CB 3.92Å; Y400-L441 HydrophobicContact CE1-CD2 3.89Å; Y400-L441 HydrophobicContact CE2-CB 4.04Å; Y400-L441 HydrophobicContact CE2-CD2 3.95Å; Y400-L441 HydrophobicContact CG-CB 4.23Å
401	N	86.8	Confident	89	Confident	35 Å²	35	55.1 Å²	55.1	19%	0.187	32%	0.324	C	S	.	.	S	Bend	trans	-137.9	166.5	178.5	62.2	45.4	0	0	0	111.2	G399 T403	G399-N401 VanDerWaalsContact C-N 3.29Å; G399-N401 PolarHBondContact O-N 3.49Å; G399-N401 VanDerWaalsContact O-N 3.14Å; N401-T403 VanDerWaalsContact CG-OG1 3.27Å; N401-T403 PolarHBondContact ND2-OG1 3.12Å; N401-T403 PolarHBondContact O-N 2.92Å; N401-T403 WeakPolarHBondContact OD1-CB 3.36Å; N401-T403 PolarHBondContact OD1-N 3.27Å; N401-T403 PolarHBondContact OD1-O 2.89Å; N401-T403 PolarHBondContact OD1-OG1 2.9Å
402	G	84.1	Confident	89	Confident	44 Å²	44	56.4 Å²	56.4	45%	0.454	33%	0.334	S	S	.	.	S	Bend	trans	-80.5	12.7	174.5	0	0	0	0	0	114.3
403	T	86.3	Confident	88.8	Confident	88 Å²	88	52.8 Å²	52.8	54%	0.54	32%	0.318	S	S	.	.			trans	-86.2	128.6	-179.7	71.3	0	0	0	0	110.4	N401 K456	N401-T403 VanDerWaalsContact CG-OG1 3.27Å; N401-T403 PolarHBondContact ND2-OG1 3.12Å; N401-T403 PolarHBondContact O-N 2.92Å; N401-T403 WeakPolarHBondContact OD1-CB 3.36Å; N401-T403 PolarHBondContact OD1-N 3.27Å; N401-T403 PolarHBondContact OD1-O 2.89Å; N401-T403 PolarHBondContact OD1-OG1 2.9Å; T403-K456 VanDerWaalsContact O-CE 3.32Å; T403-K456 WeakPolarHBondContact O-CE 3.37Å
404	G	87.8	Confident	88.6	Confident	30 Å²	30	58.1 Å²	58.1	31%	0.309	34%	0.343	S	S	.	.	S	Bend	trans	121.4	169.6	-174.8	0	0	0	0	0	112.3
405	E	92.1	Very high	88.3	Confident	99 Å²	99	53 Å²	53	46%	0.463	32%	0.322	S	S	.	.			trans	-133.3	149.9	-171.5	-64.4	177.3	171.3	0	0	110.5	T396 V412	T396-E405 PolarHBondContact N-O 3.25Å; T396-E405 PolarHBondContact OG1-N 2.64Å; T396-E405 PolarHBondContact OG1-O 3.04Å; E405-V412 HydrophobicContact CB-CG1 4.21Å; E405-V412 HydrophobicContact CB-CG2 4.49Å; E405-V412 HydrophobicContact CG-CG1 4.29Å; E405-V412 WeakPolarHBondContact OE2-CG2 3.48Å
406	V	92.6	Very high	87.9	Confident	1 Å²	1	59 Å²	59	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.4	170	-178	0	0	0	0	108.1	A393 E394 V395 V412 V413 L453 M457	A393-V406 HydrophobicContact CB-CG1 3.84Å; E394-V406 CarbonylContact O-C 3.59Å; E394-V406 WeakPolarHBondContact O-CA 3.26Å; V395-V406 HydrophobicContact CG1-CG2 4.39Å; V395-V406 HydrophobicContact CG2-CG1 4.38Å; V395-V406 HydrophobicContact CG2-CG2 4.16Å; V406-V412 WeakPolarHBondContact O-CA 3.42Å; V406-V413 PolarHBondContact O-N 3.39Å; V406-L453 HydrophobicContact CG2-CD1 3.96Å; V406-M457 HydrophobicContact CB-CG 4.22Å; V406-M457 HydrophobicContact CB-SD 4.47Å; V406-M457 HydrophobicContact CG2-CG 3.52Å; V406-M457 HydrophobicContact CG2-SD 4.02Å
407	L	93.3	Very high	87.5	Confident	37 Å²	37	60.1 Å²	60.1	19%	0.194	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.8	-173.7	-62.4	165.3	0	0	0	109.7	A393 E394 T396 E411 V412	A393-L407 CarbonylContact C-O 3.53Å; A393-L407 WeakPolarHBondContact CA-O 3.28Å; E394-L407 PolarHBondContact N-O 3.32Å; E394-L407 PolarHBondContact O-N 3.28Å; T396-L407 HydrophobicContact CG2-CD1 3.72Å; L407-E411 CarbonylContact C-O 3.56Å; L407-E411 WeakPolarHBondContact CA-O 3.49Å; L407-V412 HydrophobicContact CD2-CG2 3.82Å
408	L	92.1	Very high	87.6	Confident	32 Å²	32	59.7 Å²	59.7	17%	0.168	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	115.4	169.9	178.4	66.6	0	0	0	107.6	L391 H392 G410 E411 V413 I421	L391-L408 HydrophobicContact CB-CD1 3.97Å; L391-L408 HydrophobicContact CD1-CD2 4.47Å; H392-L408 VanDerWaalsContact O-CD1 3.31Å; H392-L408 WeakPolarHBondContact O-CD1 3.46Å; L408-G410 PolarHBondContact O-N 3.09Å; L408-E411 PolarHBondContact N-O 2.79Å; L408-E411 PolarHBondContact O-N 3.2Å; L408-V413 HydrophobicContact CB-CG2 3.6Å; L408-V413 HydrophobicContact CD2-CG2 4.41Å; L408-I421 HydrophobicContact CD2-CD1 4.39Å
409	D	87.1	Confident	87.8	Confident	153 Å²	153	61 Å²	61	82%	0.818	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	29.2	-175.5	-60.8	-38.4	0	0	0	114.3
410	G	85.3	Confident	88.2	Confident	62 Å²	62	61.2 Å²	61.2	64%	0.639	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-5.1	-178.1	0	0	0	0	0	115.4	L408	L408-G410 PolarHBondContact O-N 3.09Å
411	E	89.9	Confident	88.5	Confident	151 Å²	151	60.3 Å²	60.3	71%	0.706	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	139	174.9	-63.8	-169.7	167.7	0	0	111.8	L407 L408 V413	L407-E411 CarbonylContact C-O 3.56Å; L407-E411 WeakPolarHBondContact CA-O 3.49Å; L408-E411 PolarHBondContact N-O 2.79Å; L408-E411 PolarHBondContact O-N 3.2Å; E411-V413 PolarHBondContact O-N 3.47Å
412	V	90.6	Very high	88.8	Confident	78 Å²	78	58.8 Å²	58.8	47%	0.473	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	122.1	-179.4	-177.7	0	0	0	0	110.5	E405 V406 L407	E405-V412 HydrophobicContact CB-CG1 4.21Å; E405-V412 HydrophobicContact CB-CG2 4.49Å; E405-V412 HydrophobicContact CG-CG1 4.29Å; E405-V412 WeakPolarHBondContact OE2-CG2 3.48Å; V406-V412 WeakPolarHBondContact O-CA 3.42Å; L407-V412 HydrophobicContact CD2-CG2 3.82Å
413	V	88.4	Confident	89.2	Confident	12 Å²	12	59.6 Å²	59.6	7%	0.073	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-100.8	117.9	174.8	-176.4	0	0	0	0	109.1	V406 L408 E411 A417 C418 I421 M457	V406-V413 PolarHBondContact O-N 3.39Å; L408-V413 HydrophobicContact CB-CG2 3.6Å; L408-V413 HydrophobicContact CD2-CG2 4.41Å; E411-V413 PolarHBondContact O-N 3.47Å; V413-A417 HydrophobicContact CG1-CB 4.41Å; V413-C418 HydrophobicContact CG1-CB 3.68Å; V413-I421 HydrophobicContact CG1-CD1 4.42Å; V413-I421 HydrophobicContact CG2-CD1 4.45Å; V413-M457 HydrophobicContact CG1-CE 4.08Å
414	H	89.1	Confident	89.6	Confident	115 Å²	115	55.5 Å²	55.5	53%	0.532	33%	0.325	S	S	.	.			trans	-126.2	144.1	179.4	-165	-77	0	0	0	111.7	L416 A417 M457	H414-L416 PolarHBondContact O-N 3.47Å; H414-A417 VanDerWaalsContact O-CB 3.23Å; H414-A417 WeakPolarHBondContact O-CB 3.22Å; H414-A417 PolarHBondContact O-N 3.14Å; H414-M457 PolarHBondContact CE1-O 3.3Å
415	G	86.6	Confident	89.9	Confident	13 Å²	13	54.1 Å²	54.1	13%	0.134	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	-131.7	179.3	0	0	0	0	0	112.7	A417 S422 M457	G415-A417 VanDerWaalsContact C-N 3.31Å; G415-A417 PolarHBondContact O-N 3.33Å; G415-S422 PolarHBondContact O-OG 3.04Å; G415-M457 VanDerWaalsContact CA-O 3.26Å; G415-M457 WeakPolarHBondContact CA-O 3.4Å; G415-M457 PolarHBondContact N-O 2.9Å; G415-M457 WeakPolarHBondContact O-CE 3.41Å
416	L	83.9	Confident	89.9	Confident	139 Å²	139	51.9 Å²	51.9	73%	0.728	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	13.5	-177.8	-68.3	161.6	0	0	0	113.8	H414 C418 S422 L459	H414-L416 PolarHBondContact O-N 3.47Å; L416-C418 VanDerWaalsContact C-N 3.27Å; L416-C418 PolarHBondContact O-N 2.87Å; L416-S422 WeakPolarHBondContact CA-OG 3.43Å; L416-L459 HydrophobicContact CG-CD2 4.47Å
417	A	84.3	Confident	90	Very high	78 Å²	78	51.9 Å²	51.9	65%	0.645	30%	0.301	S	S	*	.	S	Bend	trans	-58.4	-36.8	-174.4	0	0	0	0	0	113.2	V413 H414 G415	V413-A417 HydrophobicContact CG1-CB 4.41Å; H414-A417 VanDerWaalsContact O-CB 3.23Å; H414-A417 WeakPolarHBondContact O-CB 3.22Å; H414-A417 PolarHBondContact O-N 3.14Å; G415-A417 VanDerWaalsContact C-N 3.31Å; G415-A417 PolarHBondContact O-N 3.33Å
418	C	87.1	Confident	90	Very high	18 Å²	18	50.2 Å²	50.2	12%	0.122	29%	0.292	C	S	.	.	S	Bend	trans	-117	106.1	173.5	-175.7	0	0	0	0	110.2	V413 L416 S420 I421 S422	V413-C418 HydrophobicContact CG1-CB 3.68Å; L416-C418 VanDerWaalsContact C-N 3.27Å; L416-C418 PolarHBondContact O-N 2.87Å; C418-S420 VanDerWaalsContact C-N 3.3Å; C418-S420 PolarHBondContact O-N 3.45Å; C418-I421 HydrophobicContact CB-CB 4.33Å; C418-I421 HydrophobicContact CB-CD1 4.13Å; C418-I421 HydrophobicContact CB-CG1 4.37Å; C418-I421 PolarHBondContact O-N 3.49Å; C418-S422 WeakPolarHBondContact O-CB 3.45Å; C418-S422 PolarHBondContact O-N 3.1Å; C418-S422 PolarHBondContact O-OG 2.92Å
419	P	89.1	Confident	90	Very high	73 Å²	73	48.7 Å²	48.7	47%	0.474	29%	0.285	S	S	.	.	H	α-helix	trans	-59	-36.3	-175.7	-27.5	34.9	0	0	0	114.2	K423	P419-K423 WeakPolarHBondContact O-CG 3.48Å; P419-K423 PolarHBondContact O-N 3.23Å; P419-K423 VanDerWaalsContact O-N 3.09Å
420	S	91	Very high	90.3	Very high	7 Å²	7	41.5 Å²	41.5	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-44.6	-178.5	-55.6	0	0	0	0	111.7	D389 C418	D389-S420 WeakPolarHBondContact OD1-CB 3.27Å; D389-S420 PolarHBondContact OD1-OG 3.12Å; D389-S420 WeakPolarHBondContact OD2-CB 3.35Å; D389-S420 PolarHBondContact OD2-OG 3.09Å; C418-S420 VanDerWaalsContact C-N 3.3Å; C418-S420 PolarHBondContact O-N 3.45Å
421	I	92.1	Very high	90.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-70.4	-45.1	177.4	-62.4	171.8	0	0	0	110.2	T387 A393 L408 V413 C418 K423 V424 V425 M457	T387-I421 HydrophobicContact CG2-CB 4.4Å; T387-I421 HydrophobicContact CG2-CG1 3.65Å; A393-I421 HydrophobicContact CB-CD1 3.85Å; L408-I421 HydrophobicContact CD2-CD1 4.39Å; V413-I421 HydrophobicContact CG1-CD1 4.42Å; V413-I421 HydrophobicContact CG2-CD1 4.45Å; C418-I421 HydrophobicContact CB-CB 4.33Å; C418-I421 HydrophobicContact CB-CD1 4.13Å; C418-I421 HydrophobicContact CB-CG1 4.37Å; C418-I421 PolarHBondContact O-N 3.49Å; I421-K423 VanDerWaalsContact C-N 3.27Å; I421-K423 PolarHBondContact O-N 3.23Å; I421-V424 WeakPolarHBondContact O-CB 3.28Å; I421-V424 PolarHBondContact O-N 2.87Å; I421-V425 HydrophobicContact CG2-CG2 4.41Å; I421-V425 PolarHBondContact O-N 2.9Å; I421-V425 VanDerWaalsContact O-N 3.1Å; I421-M457 HydrophobicContact CG2-CE 3.95Å; I421-M457 HydrophobicContact CG2-SD 3.79Å
422	S	92.2	Very high	90.6	Very high	4 Å²	4	31.3 Å²	31.3	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-58.1	-39.6	-177.4	-51.9	0	0	0	0	112.1	G415 L416 C418 V425 E426	G415-S422 PolarHBondContact O-OG 3.04Å; L416-S422 WeakPolarHBondContact CA-OG 3.43Å; C418-S422 WeakPolarHBondContact O-CB 3.45Å; C418-S422 PolarHBondContact O-N 3.1Å; C418-S422 PolarHBondContact O-OG 2.92Å; S422-V425 PolarHBondContact O-N 3.36Å; S422-E426 WeakPolarHBondContact O-CB 3.28Å; S422-E426 PolarHBondContact O-N 3.33Å
423	K	91.8	Very high	90.5	Very high	61 Å²	61	31.6 Å²	31.6	27%	0.265	18%	0.181	S	C	.	.	H	α-helix	trans	-63.7	-40.1	175.7	-79.9	-174.8	179.6	-176.9	0	113.1	P419 I421 V425 E426 V427 N514 L559	P419-K423 WeakPolarHBondContact O-CG 3.48Å; P419-K423 PolarHBondContact O-N 3.23Å; P419-K423 VanDerWaalsContact O-N 3.09Å; I421-K423 VanDerWaalsContact C-N 3.27Å; I421-K423 PolarHBondContact O-N 3.23Å; K423-V425 VanDerWaalsContact C-N 3.32Å; K423-E426 PolarHBondContact O-N 2.81Å; K423-V427 WeakPolarHBondContact O-CG2 3.26Å; K423-V427 PolarHBondContact O-N 3.36Å; K423-V427 VanDerWaalsContact O-N 3.09Å; K423-N514 PolarHBondContact NZ-ND2 3.44Å; K423-L559 HydrophobicContact CB-CD1 4.31Å; K423-L559 HydrophobicContact CB-CD2 4.36Å; K423-L559 HydrophobicContact CD-CD2 4.21Å
424	V	94.6	Very high	90.4	Very high	1 Å²	1	31 Å²	31	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-44	176.9	176.1	0	0	0	0	110	V385 T387 I421 V427 G428 F547 L559 V562	V385-V424 HydrophobicContact CG1-CG1 4.2Å; T387-V424 HydrophobicContact CG2-CG2 4.5Å; I421-V424 WeakPolarHBondContact O-CB 3.28Å; I421-V424 PolarHBondContact O-N 2.87Å; V424-V427 PolarHBondContact O-N 3.02Å; V424-G428 PolarHBondContact O-N 2.98Å; V424-G428 VanDerWaalsContact O-N 3.09Å; V424-F547 HydrophobicContact CG1-CB 4.36Å; V424-F547 HydrophobicContact CG1-CD2 3.97Å; V424-F547 HydrophobicContact CG1-CG 4.1Å; V424-L559 HydrophobicContact CG2-CB 3.92Å; V424-L559 WeakPolarHBondContact CG2-O 3.02Å; V424-V562 HydrophobicContact CG1-CG2 3.6Å
425	V	94.1	Very high	90.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-67	-40	178.2	178.7	0	0	0	0	112	I421 S422 K423 V427 G428 C429 L453 A454 M457 L459	I421-V425 HydrophobicContact CG2-CG2 4.41Å; I421-V425 PolarHBondContact O-N 2.9Å; I421-V425 VanDerWaalsContact O-N 3.1Å; S422-V425 PolarHBondContact O-N 3.36Å; K423-V425 VanDerWaalsContact C-N 3.32Å; V425-V427 PolarHBondContact O-N 3.28Å; V425-G428 CarbonylContact O-C 3.57Å; V425-G428 PolarHBondContact O-N 3.3Å; V425-G428 VanDerWaalsContact O-N 3.16Å; V425-C429 WeakPolarHBondContact O-CB 3.26Å; V425-C429 PolarHBondContact O-N 2.81Å; V425-L453 HydrophobicContact CG2-CD2 3.76Å; V425-L453 HydrophobicContact CG2-CG 3.99Å; V425-A454 HydrophobicContact CG1-CB 3.69Å; V425-M457 HydrophobicContact CB-SD 4.38Å; V425-M457 HydrophobicContact CG2-SD 3.62Å; V425-L459 HydrophobicContact CB-CD1 4.31Å; V425-L459 HydrophobicContact CG1-CB 4.36Å; V425-L459 HydrophobicContact CG1-CD1 4.06Å
426	E	93.7	Very high	90.2	Very high	52 Å²	52	29.1 Å²	29.1	24%	0.243	17%	0.17	C	C	.	.	H	α-helix	trans	-56.1	-48.8	173.7	174.8	179.2	-149.8	0	0	111.2	S422 K423 G428 C429 V430 V462 F466 F498	S422-E426 WeakPolarHBondContact O-CB 3.28Å; S422-E426 PolarHBondContact O-N 3.33Å; K423-E426 PolarHBondContact O-N 2.81Å; E426-G428 VanDerWaalsContact C-N 3.32Å; E426-G428 PolarHBondContact O-N 3.14Å; E426-C429 PolarHBondContact O-N 3.07Å; E426-V430 HydrophobicContact CG-CG2 4.33Å; E426-V430 WeakPolarHBondContact O-CB 3.32Å; E426-V430 WeakPolarHBondContact O-CG2 3.48Å; E426-V430 PolarHBondContact O-N 2.83Å; E426-V462 HydrophobicContact CG-CG1 3.95Å; E426-F466 HydrophobicContact CG-CE2 4.48Å; E426-F466 WeakPolarHBondContact OE1-CE2 3.41Å; E426-F466 VanDerWaalsContact OE1-CZ 3.28Å; E426-F466 WeakPolarHBondContact OE1-CZ 3.19Å; E426-F498 HydrophobicContact CG-CE1 4.31Å; E426-F498 HydrophobicContact CG-CZ 4.33Å
427	V	94.4	Very high	90.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-43.1	176.2	-176.4	0	0	0	0	111	K423 V424 V425 C429 C431 F498 M499 F547 L559	K423-V427 WeakPolarHBondContact O-CG2 3.26Å; K423-V427 PolarHBondContact O-N 3.36Å; K423-V427 VanDerWaalsContact O-N 3.09Å; V424-V427 PolarHBondContact O-N 3.02Å; V425-V427 PolarHBondContact O-N 3.28Å; V427-C429 VanDerWaalsContact C-N 3.26Å; V427-C429 PolarHBondContact O-N 3.44Å; V427-C431 VanDerWaalsContact O-CB 3.24Å; V427-C431 WeakPolarHBondContact O-CB 3.49Å; V427-C431 PolarHBondContact O-N 3.25Å; V427-F498 HydrophobicContact CB-CD1 4.11Å; V427-F498 HydrophobicContact CG1-CB 4.05Å; V427-F498 HydrophobicContact CG1-CD1 4.2Å; V427-F498 HydrophobicContact CG2-CD1 3.51Å; V427-F498 HydrophobicContact CG2-CE1 3.99Å; V427-M499 WeakPolarHBondContact CG1-O 3.15Å; V427-F547 HydrophobicContact CB-CB 4.45Å; V427-F547 HydrophobicContact CB-CD1 3.96Å; V427-F547 HydrophobicContact CG1-CB 4.3Å; V427-F547 HydrophobicContact CG1-CD1 3.75Å; V427-L559 HydrophobicContact CG2-CD1 3.28Å
428	G	92.6	Very high	89.7	Confident	2 Å²	2	34.6 Å²	34.6	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-25.9	178.6	0	0	0	0	0	114.4	V424 V425 E426 N432	V424-G428 PolarHBondContact O-N 2.98Å; V424-G428 VanDerWaalsContact O-N 3.09Å; V425-G428 CarbonylContact O-C 3.57Å; V425-G428 PolarHBondContact O-N 3.3Å; V425-G428 VanDerWaalsContact O-N 3.16Å; E426-G428 VanDerWaalsContact C-N 3.32Å; E426-G428 PolarHBondContact O-N 3.14Å; G428-N432 WeakPolarHBondContact O-CB 3.38Å; G428-N432 PolarHBondContact O-ND2 2.79Å
429	C	93	Very high	89.1	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-86.5	-44.5	176.5	-172.2	0	0	0	0	112	V425 E426 V427 N432 A454	V425-C429 WeakPolarHBondContact O-CB 3.26Å; V425-C429 PolarHBondContact O-N 2.81Å; E426-C429 PolarHBondContact O-N 3.07Å; V427-C429 VanDerWaalsContact C-N 3.26Å; V427-C429 PolarHBondContact O-N 3.44Å; C429-N432 WeakPolarHBondContact O-CB 3.42Å; C429-A454 HydrophobicContact CB-CB 4.1Å
430	V	92.3	Very high	88.6	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-76.6	-40.4	-176.4	177.7	0	0	0	0	112	E426 N432 V462 F466 R468 V483 C485 F498	E426-V430 HydrophobicContact CG-CG2 4.33Å; E426-V430 WeakPolarHBondContact O-CB 3.32Å; E426-V430 WeakPolarHBondContact O-CG2 3.48Å; E426-V430 PolarHBondContact O-N 2.83Å; V430-N432 PolarHBondContact O-N 3.44Å; V430-V462 HydrophobicContact CG2-CG1 4.2Å; V430-F466 HydrophobicContact CG1-CB 4.14Å; V430-F466 HydrophobicContact CG1-CD2 4.44Å; V430-F466 HydrophobicContact CG1-CG 4.29Å; V430-F466 HydrophobicContact CG2-CD2 3.56Å; V430-F466 HydrophobicContact CG2-CE2 4.03Å; V430-F466 HydrophobicContact CG2-CG 4.23Å; V430-R468 PolarHBondContact O-NE 2.84Å; V430-R468 PolarHBondContact O-NH2 3.22Å; V430-V483 HydrophobicContact CG1-CG2 4.29Å; V430-C485 HydrophobicContact CG1-CB 4.37Å; V430-C485 WeakPolarHBondContact CG1-SG 3.44Å; V430-F498 HydrophobicContact CB-CD2 4.16Å; V430-F498 HydrophobicContact CB-CE2 4.37Å; V430-F498 HydrophobicContact CG1-CD2 3.61Å; V430-F498 HydrophobicContact CG1-CE2 3.89Å; V430-F498 HydrophobicContact CG1-CG 4.37Å
431	C	92.3	Very high	88.2	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-91.6	68.5	177.5	-169.7	0	0	0	0	109.6	V427 V483 F498 K500	V427-C431 VanDerWaalsContact O-CB 3.24Å; V427-C431 WeakPolarHBondContact O-CB 3.49Å; V427-C431 PolarHBondContact O-N 3.25Å; C431-V483 HydrophobicContact CB-CG2 3.73Å; C431-F498 HydrophobicContact CB-CB 4.04Å; C431-F498 PolarHBondContact SG-O 3.22Å; C431-F498 VanDerWaalsContact SG-O 3.37Å; C431-K500 VanDerWaalsContact O-CD 3.29Å; C431-K500 WeakPolarHBondContact O-CD 3.5Å; C431-K500 WeakPolarHBondContact O-CE 3.46Å; C431-K500 PolarHBondContact O-NZ 2.97Å
432	N	90.6	Very high	87.5	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.			trans	-158.9	127.5	-169.4	-162.4	-46.6	0	0	0	113.3	G428 C429 V430 S434 E447 I451 Q463 R468	G428-N432 WeakPolarHBondContact O-CB 3.38Å; G428-N432 PolarHBondContact O-ND2 2.79Å; C429-N432 WeakPolarHBondContact O-CB 3.42Å; V430-N432 PolarHBondContact O-N 3.44Å; N432-S434 WeakPolarHBondContact OD1-CB 3.32Å; N432-S434 PolarHBondContact OD1-N 3.34Å; N432-E447 PolarHBondContact ND2-O 2.72Å; N432-E447 WeakPolarHBondContact OD1-CB 3.43Å; N432-E447 PolarHBondContact OD1-OE2 2.82Å; N432-I451 HydrophobicContact CB-CD1 4.02Å; N432-Q463 PolarHBondContact O-NE2 3.36Å; N432-R468 PolarHBondContact O-NH2 3.11Å
433	D	87.3	Confident	86.9	Confident	83 Å²	83	48.2 Å²	48.2	44%	0.444	25%	0.246	S	C	.	.			trans	-99.7	-1.6	-176.6	-58.5	-29.2	0	0	0	112.7	E447 R468 M481	D433-E447 PolarHBondContact N-OE2 3.1Å; D433-E447 VanDerWaalsContact N-OE2 3.09Å; D433-R468 IonicContact OD1-CZ 3.63Å; D433-R468 IonicContact OD1-NH1 3.15Å; D433-R468 PolarHBondContact OD1-NH1 3.3Å; D433-M481 WeakPolarHBondContact OD1-CE 3.34Å; D433-M481 WeakPolarHBondContact OD2-CE 3.07Å
434	S	86.5	Confident	86.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	25%	0.253	C	S	.	.			trans	-91	142.8	-176.1	-56.2	0	0	0	0	111.8	N432 L442 R444 E447	N432-S434 WeakPolarHBondContact OD1-CB 3.32Å; N432-S434 PolarHBondContact OD1-N 3.34Å; S434-L442 CarbonylContact C-O 3.56Å; S434-L442 VanDerWaalsContact CA-O 3.25Å; S434-L442 WeakPolarHBondContact CA-O 3.12Å; S434-R444 PolarHBondContact OG-N 3.24Å; S434-R444 PolarHBondContact OG-O 3.39Å; S434-E447 VanDerWaalsContact OG-CB 3.23Å; S434-E447 WeakPolarHBondContact OG-CB 3.33Å; S434-E447 PolarHBondContact OG-OE2 3.03Å; S434-E447 VanDerWaalsContact OG-OE2 3.08Å
435	V	85.5	Confident	85.9	Confident	64 Å²	64	52 Å²	52	39%	0.388	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133	179.7	-177.4	0	0	0	0	108.8	R437 L442	V435-R437 HydrophobicContact CG1-CG 4.14Å; V435-L442 PolarHBondContact N-O 3.41Å; V435-L442 WeakPolarHBondContact O-CB 3.31Å; V435-L442 PolarHBondContact O-N 3.34Å
436	I	86.1	Confident	85.6	Confident	24 Å²	24	52.5 Å²	52.5	12%	0.123	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.2	174.2	-59.7	172.6	0	0	0	107.8	Y400 L441 I451 A452 M455	Y400-I436 HydrophobicContact CD1-CD1 4.39Å; Y400-I436 WeakPolarHBondContact O-CG2 3.44Å; I436-L441 HydrophobicContact CG1-CD1 3.99Å; I436-I451 HydrophobicContact CD1-CB 4.03Å; I436-I451 HydrophobicContact CD1-CG2 3.87Å; I436-I451 HydrophobicContact CG1-CG2 4.23Å; I436-A452 HydrophobicContact CD1-CB 4.21Å; I436-M455 HydrophobicContact CD1-SD 4.08Å
437	R	82.6	Confident	85.3	Confident	172 Å²	172	50.6 Å²	50.6	65%	0.649	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.2	173.6	-72.9	-170.5	179.8	-173.2	1.4	109.4	V435 Q439 N440 L442	V435-R437 HydrophobicContact CG1-CG 4.14Å; R437-Q439 PolarHBondContact O-N 2.89Å; R437-N440 PolarHBondContact N-O 3.35Å; R437-N440 WeakPolarHBondContact O-CB 3.34Å; R437-N440 PolarHBondContact O-N 3.29Å; R437-L442 HydrophobicContact CG-CD1 4.42Å
438	N	75.8	Confident	85.1	Confident	160 Å²	160	50.6 Å²	50.6	86%	0.856	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	43.5	-179.1	-60.9	-15.4	0	0	0	112.7	N440	N438-N440 PolarHBondContact O-N 2.78Å
439	Q	74.2	Confident	85.1	Confident	134 Å²	134	50.6 Å²	50.6	63%	0.626	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	-5	-175.6	-53.4	174.6	2.3	0	0	115.8	R437	R437-Q439 PolarHBondContact O-N 2.89Å
440	N	77.4	Confident	85.2	Confident	119 Å²	119	50.7 Å²	50.7	64%	0.636	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	126.6	170.8	-74	-22.3	0	0	0	110.2	R437 N438	R437-N440 PolarHBondContact N-O 3.35Å; R437-N440 WeakPolarHBondContact O-CB 3.34Å; R437-N440 PolarHBondContact O-N 3.29Å; N438-N440 PolarHBondContact O-N 2.78Å
441	L	82.3	Confident	85.2	Confident	22 Å²	22	51.3 Å²	51.3	12%	0.115	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121.8	174.7	177.7	63.9	0	0	0	110.6	Y400 I436 P445	Y400-L441 HydrophobicContact CD1-CD2 4.44Å; Y400-L441 HydrophobicContact CD2-CB 3.92Å; Y400-L441 HydrophobicContact CE1-CD2 3.89Å; Y400-L441 HydrophobicContact CE2-CB 4.04Å; Y400-L441 HydrophobicContact CE2-CD2 3.95Å; Y400-L441 HydrophobicContact CG-CB 4.23Å; I436-L441 HydrophobicContact CG1-CD1 3.99Å; L441-P445 VanDerWaalsContact CD2-CA 3.48Å; L441-P445 HydrophobicContact CD2-CB 4.44Å
442	L	78.7	Confident	85.2	Confident	83 Å²	83	51.5 Å²	51.5	44%	0.435	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111	165.7	-58.8	172.8	0	0	0	107.7	S434 V435 R437	S434-L442 CarbonylContact C-O 3.56Å; S434-L442 VanDerWaalsContact CA-O 3.25Å; S434-L442 WeakPolarHBondContact CA-O 3.12Å; V435-L442 PolarHBondContact N-O 3.41Å; V435-L442 WeakPolarHBondContact O-CB 3.31Å; V435-L442 PolarHBondContact O-N 3.34Å; R437-L442 HydrophobicContact CG-CD1 4.42Å
443	G	79.2	Confident	85.4	Confident	31 Å²	31	51.6 Å²	51.6	32%	0.32	26%	0.262	S	S	.	.	S	Bend	trans	123.5	-155.9	-177.3	0	0	0	0	0	113.1
444	R	80.3	Confident	85.7	Confident	109 Å²	109	47.7 Å²	47.7	41%	0.411	24%	0.241	S	C	.	.			trans	-86.7	133.3	-172.8	-66.8	-180	-179.1	-177.6	4	111.2	S434 T446 E447 G448	S434-R444 PolarHBondContact OG-N 3.24Å; S434-R444 PolarHBondContact OG-O 3.39Å; R444-T446 VanDerWaalsContact C-N 3.3Å; R444-T446 PolarHBondContact O-N 3.26Å; R444-T446 VanDerWaalsContact O-N 3.17Å; R444-E447 HydrophobicContact CB-CB 4.31Å; R444-E447 HydrophobicContact CB-CG 4.05Å; R444-E447 WeakPolarHBondContact O-CB 3.35Å; R444-E447 PolarHBondContact O-N 3.03Å; R444-G448 PolarHBondContact O-N 2.68Å
445	P	84.4	Confident	86	Confident	31 Å²	31	50 Å²	50	20%	0.201	25%	0.252	C	S	.	.	H	α-helix	trans	-50.1	-43.7	179.5	-32	37.2	0	0	0	115	M380 L441 E447 G448 A449	M380-P445 HydrophobicContact CB-CB 4.07Å; M380-P445 HydrophobicContact CG-CB 3.63Å; L441-P445 VanDerWaalsContact CD2-CA 3.48Å; L441-P445 HydrophobicContact CD2-CB 4.44Å; P445-E447 VanDerWaalsContact C-N 3.27Å; P445-E447 PolarHBondContact O-N 3.27Å; P445-G448 PolarHBondContact O-N 3.46Å; P445-A449 PolarHBondContact O-N 3.47Å
446	T	87.9	Confident	86.3	Confident	14 Å²	14	47.4 Å²	47.4	9%	0.086	24%	0.236	C	C	.	.	H	α-helix	trans	-63.1	-34.6	179.8	-46.1	0	0	0	0	112.5	R444 L545 I564	R444-T446 VanDerWaalsContact C-N 3.3Å; R444-T446 PolarHBondContact O-N 3.26Å; R444-T446 VanDerWaalsContact O-N 3.17Å; T446-L545 HydrophobicContact CG2-CD1 3.68Å; T446-L545 HydrophobicContact CG2-CG 4.47Å; T446-I564 HydrophobicContact CG2-CD1 3.64Å
447	E	88.9	Confident	86.5	Confident	12 Å²	12	46.3 Å²	46.3	6%	0.056	23%	0.23	C	C	.	.	H	α-helix	trans	-82.1	-38.3	179.2	-63.5	-162.3	153.8	0	0	111.8	N432 D433 S434 R444 P445 A449 L450 I451 K500	N432-E447 PolarHBondContact ND2-O 2.72Å; N432-E447 WeakPolarHBondContact OD1-CB 3.43Å; N432-E447 PolarHBondContact OD1-OE2 2.82Å; D433-E447 PolarHBondContact N-OE2 3.1Å; D433-E447 VanDerWaalsContact N-OE2 3.09Å; S434-E447 VanDerWaalsContact OG-CB 3.23Å; S434-E447 WeakPolarHBondContact OG-CB 3.33Å; S434-E447 PolarHBondContact OG-OE2 3.03Å; S434-E447 VanDerWaalsContact OG-OE2 3.08Å; R444-E447 HydrophobicContact CB-CB 4.31Å; R444-E447 HydrophobicContact CB-CG 4.05Å; R444-E447 WeakPolarHBondContact O-CB 3.35Å; R444-E447 PolarHBondContact O-N 3.03Å; P445-E447 VanDerWaalsContact C-N 3.27Å; P445-E447 PolarHBondContact O-N 3.27Å; E447-A449 PolarHBondContact O-N 2.72Å; E447-L450 WeakPolarHBondContact O-CB 3.29Å; E447-L450 PolarHBondContact O-N 3.09Å; E447-I451 PolarHBondContact O-N 2.88Å; E447-I451 VanDerWaalsContact O-N 3.12Å; E447-K500 VanDerWaalsContact CG-NZ 3.34Å; E447-K500 WeakPolarHBondContact OE1-CE 3.49Å; E447-K500 IonicContact OE1-NZ 3.29Å; E447-K500 PolarHBondContact OE1-NZ 2.83Å
448	G	89.5	Confident	86.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-54.1	-39.7	169.4	0	0	0	0	0	112.6	R444 P445 L450 I451 A452	R444-G448 PolarHBondContact O-N 2.68Å; P445-G448 PolarHBondContact O-N 3.46Å; G448-L450 VanDerWaalsContact C-N 3.26Å; G448-L450 PolarHBondContact O-N 3.02Å; G448-I451 PolarHBondContact O-N 3.41Å; G448-A452 PolarHBondContact O-N 3.46Å
449	A	92.6	Very high	87.5	Confident	2 Å²	2	33 Å²	33	2%	0.017	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-37.1	175	0	0	0	0	0	112.9	M380 V382 P445 E447 L453 I564	M380-A449 HydrophobicContact CB-CB 4.26Å; M380-A449 WeakPolarHBondContact O-CB 3.42Å; V382-A449 HydrophobicContact CG2-CB 4.08Å; V382-A449 WeakPolarHBondContact CG2-O 3.43Å; P445-A449 PolarHBondContact O-N 3.47Å; E447-A449 PolarHBondContact O-N 2.72Å; A449-L453 PolarHBondContact O-N 3.11Å; A449-I564 HydrophobicContact CB-CD1 4.5Å; A449-I564 HydrophobicContact CB-CG2 3.84Å
450	L	94.2	Very high	87.9	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-74.5	-35.3	178.7	-59.3	174	0	0	0	111.9	V382 E447 G448 L453 A454 K500 L545 F547 V562 I564	V382-L450 HydrophobicContact CG2-CD2 4.16Å; E447-L450 WeakPolarHBondContact O-CB 3.29Å; E447-L450 PolarHBondContact O-N 3.09Å; G448-L450 VanDerWaalsContact C-N 3.26Å; G448-L450 PolarHBondContact O-N 3.02Å; L450-L453 WeakPolarHBondContact O-CB 3.39Å; L450-L453 PolarHBondContact O-N 3.38Å; L450-A454 PolarHBondContact O-N 3.09Å; L450-K500 HydrophobicContact CD1-CD 4.13Å; L450-L545 HydrophobicContact CD1-CD1 4.29Å; L450-F547 HydrophobicContact CD1-CE1 3.95Å; L450-F547 HydrophobicContact CD1-CZ 3.81Å; L450-F547 HydrophobicContact CD2-CE1 4.41Å; L450-F547 HydrophobicContact CD2-CZ 3.73Å; L450-F547 HydrophobicContact CG-CZ 4.44Å; L450-V562 HydrophobicContact CD2-CB 4.48Å; L450-V562 HydrophobicContact CD2-CG1 4.06Å; L450-I564 HydrophobicContact CD2-CD1 4.2Å
451	I	93.3	Very high	88.3	Confident	13 Å²	13	28.3 Å²	28.3	7%	0.067	16%	0.161	C	C	.	.	H	α-helix	trans	-65.4	-45.5	171.4	-60	-56.8	0	0	0	109.8	N432 I436 E447 G448 L453 A454 M455	N432-I451 HydrophobicContact CB-CD1 4.02Å; I436-I451 HydrophobicContact CD1-CB 4.03Å; I436-I451 HydrophobicContact CD1-CG2 3.87Å; I436-I451 HydrophobicContact CG1-CG2 4.23Å; E447-I451 PolarHBondContact O-N 2.88Å; E447-I451 VanDerWaalsContact O-N 3.12Å; G448-I451 PolarHBondContact O-N 3.41Å; I451-L453 VanDerWaalsContact C-N 3.27Å; I451-L453 PolarHBondContact O-N 2.94Å; I451-A454 CarbonylContact O-C 3.58Å; I451-A454 WeakPolarHBondContact O-CA 3.3Å; I451-A454 WeakPolarHBondContact O-CB 3.35Å; I451-A454 PolarHBondContact O-N 3.01Å; I451-M455 HydrophobicContact CG2-CG 4.35Å; I451-M455 HydrophobicContact CG2-SD 4.44Å; I451-M455 WeakPolarHBondContact O-CG 3.46Å; I451-M455 PolarHBondContact O-N 2.94Å
452	A	92.9	Very high	88.5	Confident	4 Å²	4	28 Å²	28	3%	0.033	16%	0.16	C	C	.	.	H	α-helix	trans	-58.6	-39	176	0	0	0	0	0	112	I436 G448 M455 K456	I436-A452 HydrophobicContact CD1-CB 4.21Å; G448-A452 PolarHBondContact O-N 3.46Å; A452-M455 PolarHBondContact O-N 2.95Å; A452-K456 VanDerWaalsContact O-CG 3.32Å; A452-K456 WeakPolarHBondContact O-CG 3.33Å; A452-K456 PolarHBondContact O-N 2.91Å
453	L	94.3	Very high	88.8	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-44.3	170.9	177.2	67.7	0	0	0	112.2	V382 V385 V395 V406 V425 A449 L450 I451 K456 M457	V382-L453 HydrophobicContact CB-CB 4.34Å; V382-L453 HydrophobicContact CB-CD1 4.45Å; V382-L453 HydrophobicContact CB-CD2 4.5Å; V382-L453 HydrophobicContact CG1-CD1 4.14Å; V382-L453 HydrophobicContact CG1-CD2 4.07Å; V382-L453 HydrophobicContact CG2-CB 4.11Å; V382-L453 HydrophobicContact CG2-CD2 4.28Å; V385-L453 HydrophobicContact CG2-CD1 4.35Å; V385-L453 HydrophobicContact CG2-CD2 4.03Å; V395-L453 HydrophobicContact CB-CD1 4.39Å; V395-L453 HydrophobicContact CG1-CD1 3.82Å; V395-L453 HydrophobicContact CG2-CD1 3.67Å; V406-L453 HydrophobicContact CG2-CD1 3.96Å; V425-L453 HydrophobicContact CG2-CD2 3.76Å; V425-L453 HydrophobicContact CG2-CG 3.99Å; A449-L453 PolarHBondContact O-N 3.11Å; L450-L453 WeakPolarHBondContact O-CB 3.39Å; L450-L453 PolarHBondContact O-N 3.38Å; I451-L453 VanDerWaalsContact C-N 3.27Å; I451-L453 PolarHBondContact O-N 2.94Å; L453-K456 PolarHBondContact O-N 3.08Å; L453-M457 PolarHBondContact O-N 3.05Å
454	A	93.2	Very high	89.1	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-39.7	176.3	0	0	0	0	0	112.1	V425 C429 L450 I451 M457 G458 L459	V425-A454 HydrophobicContact CG1-CB 3.69Å; C429-A454 HydrophobicContact CB-CB 4.1Å; L450-A454 PolarHBondContact O-N 3.09Å; I451-A454 CarbonylContact O-C 3.58Å; I451-A454 WeakPolarHBondContact O-CA 3.3Å; I451-A454 WeakPolarHBondContact O-CB 3.35Å; I451-A454 PolarHBondContact O-N 3.01Å; A454-M457 CarbonylContact O-C 3.56Å; A454-M457 PolarHBondContact O-N 3.36Å; A454-G458 PolarHBondContact O-N 2.78Å; A454-G458 VanDerWaalsContact O-N 3.07Å; A454-L459 PolarHBondContact O-N 2.84Å
455	M	92.3	Very high	89.4	Confident	49 Å²	49	30.1 Å²	30.1	24%	0.241	16%	0.164	C	C	.	.	H	α-helix	trans	-60.6	-44.5	174.9	-61.6	-178.1	118.1	0	0	111.5	I436 I451 A452 M457 G458 E460	I436-M455 HydrophobicContact CD1-SD 4.08Å; I451-M455 HydrophobicContact CG2-CG 4.35Å; I451-M455 HydrophobicContact CG2-SD 4.44Å; I451-M455 WeakPolarHBondContact O-CG 3.46Å; I451-M455 PolarHBondContact O-N 2.94Å; A452-M455 PolarHBondContact O-N 2.95Å; M455-M457 PolarHBondContact O-N 2.94Å; M455-G458 PolarHBondContact O-N 3.27Å; M455-E460 WeakPolarHBondContact CE-OE2 3.1Å; M455-E460 HydrophobicContact CG-CB 4.03Å; M455-E460 VanDerWaalsContact CG-OE2 3.28Å; M455-E460 WeakPolarHBondContact CG-OE2 3.3Å
456	K	91.7	Very high	89.6	Confident	11 Å²	11	29.9 Å²	29.9	5%	0.048	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-27.1	177.8	-69.1	171.8	-174.2	-173.9	0	113.7	V395 T396 G397 T403 A452 L453	V395-K456 HydrophobicContact CG1-CD 3.96Å; T396-K456 WeakPolarHBondContact O-CE 3.36Å; T396-K456 PolarHBondContact O-NZ 2.86Å; G397-K456 PolarHBondContact O-NZ 2.84Å; T403-K456 VanDerWaalsContact O-CE 3.32Å; T403-K456 WeakPolarHBondContact O-CE 3.37Å; A452-K456 VanDerWaalsContact O-CG 3.32Å; A452-K456 WeakPolarHBondContact O-CG 3.33Å; A452-K456 PolarHBondContact O-N 2.91Å; L453-K456 PolarHBondContact O-N 3.08Å
457	M	91.5	Very high	89.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-2.9	173.4	-71.3	-167.4	64.4	0	0	113.6	V406 V413 H414 G415 I421 V425 L453 A454 M455 L459	V406-M457 HydrophobicContact CB-CG 4.22Å; V406-M457 HydrophobicContact CB-SD 4.47Å; V406-M457 HydrophobicContact CG2-CG 3.52Å; V406-M457 HydrophobicContact CG2-SD 4.02Å; V413-M457 HydrophobicContact CG1-CE 4.08Å; H414-M457 PolarHBondContact CE1-O 3.3Å; G415-M457 VanDerWaalsContact CA-O 3.26Å; G415-M457 WeakPolarHBondContact CA-O 3.4Å; G415-M457 PolarHBondContact N-O 2.9Å; G415-M457 WeakPolarHBondContact O-CE 3.41Å; I421-M457 HydrophobicContact CG2-CE 3.95Å; I421-M457 HydrophobicContact CG2-SD 3.79Å; V425-M457 HydrophobicContact CB-SD 4.38Å; V425-M457 HydrophobicContact CG2-SD 3.62Å; L453-M457 PolarHBondContact O-N 3.05Å; A454-M457 CarbonylContact O-C 3.56Å; A454-M457 PolarHBondContact O-N 3.36Å; M455-M457 PolarHBondContact O-N 2.94Å; M457-L459 VanDerWaalsContact C-N 3.33Å; M457-L459 HydrophobicContact CB-CD1 4.18Å; M457-L459 HydrophobicContact CB-CG 4.21Å; M457-L459 HydrophobicContact CE-CD1 4.25Å
458	G	89.9	Confident	89.6	Confident	37 Å²	37	34.4 Å²	34.4	38%	0.381	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	26.3	-174.2	0	0	0	0	0	114.4	A454 M455	A454-G458 PolarHBondContact O-N 2.78Å; A454-G458 VanDerWaalsContact O-N 3.07Å; M455-G458 PolarHBondContact O-N 3.27Å
459	L	88.8	Confident	89.6	Confident	15 Å²	15	39 Å²	39	8%	0.079	20%	0.202	C	C	.	.			trans	-107.4	18	-178.9	-65.7	176.4	0	0	0	113.1	L416 V425 A454 M457 S461 V462	L416-L459 HydrophobicContact CG-CD2 4.47Å; V425-L459 HydrophobicContact CB-CD1 4.31Å; V425-L459 HydrophobicContact CG1-CB 4.36Å; V425-L459 HydrophobicContact CG1-CD1 4.06Å; A454-L459 PolarHBondContact O-N 2.84Å; M457-L459 VanDerWaalsContact C-N 3.33Å; M457-L459 HydrophobicContact CB-CD1 4.18Å; M457-L459 HydrophobicContact CB-CG 4.21Å; M457-L459 HydrophobicContact CE-CD1 4.25Å; L459-S461 VanDerWaalsContact C-N 3.29Å; L459-S461 PolarHBondContact O-N 2.95Å; L459-V462 HydrophobicContact CB-CG2 3.99Å; L459-V462 HydrophobicContact CD2-CG2 4.03Å; L459-V462 WeakPolarHBondContact O-CB 3.33Å; L459-V462 VanDerWaalsContact O-CG2 3.25Å; L459-V462 WeakPolarHBondContact O-CG2 3.27Å; L459-V462 PolarHBondContact O-N 2.93Å
460	E	83.5	Confident	89.3	Confident	100 Å²	100	42.4 Å²	42.4	47%	0.467	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.7	-178.9	63.8	-171.1	-150.3	0	0	113.9	M455 V462	M455-E460 WeakPolarHBondContact CE-OE2 3.1Å; M455-E460 HydrophobicContact CG-CB 4.03Å; M455-E460 VanDerWaalsContact CG-OE2 3.28Å; M455-E460 WeakPolarHBondContact CG-OE2 3.3Å; E460-V462 VanDerWaalsContact C-N 3.26Å; E460-V462 PolarHBondContact O-N 3.48Å
461	S	85.4	Confident	89	Confident	56 Å²	56	47.1 Å²	47.1	39%	0.392	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-15.3	-179.9	58.9	0	0	0	0	113.4	L459 Q463 Q464	L459-S461 VanDerWaalsContact C-N 3.29Å; L459-S461 PolarHBondContact O-N 2.95Å; S461-Q463 PolarHBondContact O-N 3.34Å; S461-Q464 WeakPolarHBondContact O-CB 3.4Å; S461-Q464 PolarHBondContact O-N 3.46Å
462	V	85.8	Confident	88.7	Confident	15 Å²	15	49.3 Å²	49.3	9%	0.091	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-34.1	-173.3	178	0	0	0	0	111.5	E426 V430 L459 E460 Q464 E465 F466	E426-V462 HydrophobicContact CG-CG1 3.95Å; V430-V462 HydrophobicContact CG2-CG1 4.2Å; L459-V462 HydrophobicContact CB-CG2 3.99Å; L459-V462 HydrophobicContact CD2-CG2 4.03Å; L459-V462 WeakPolarHBondContact O-CB 3.33Å; L459-V462 VanDerWaalsContact O-CG2 3.25Å; L459-V462 WeakPolarHBondContact O-CG2 3.27Å; L459-V462 PolarHBondContact O-N 2.93Å; E460-V462 VanDerWaalsContact C-N 3.26Å; E460-V462 PolarHBondContact O-N 3.48Å; V462-Q464 PolarHBondContact O-N 3.41Å; V462-E465 WeakPolarHBondContact O-CB 3.14Å; V462-E465 PolarHBondContact O-N 3.1Å; V462-F466 HydrophobicContact CG1-CD2 4.24Å; V462-F466 HydrophobicContact CG1-CE2 3.91Å; V462-F466 WeakPolarHBondContact O-CD2 3.47Å
463	Q	84.5	Confident	88.3	Confident	58 Å²	58	53 Å²	53	27%	0.271	27%	0.274	S	S	.	.	H	α-helix	trans	-56.6	-34.8	174.8	-169.6	-176.8	20.7	0	0	112.4	N432 S461 E465 F466 R468	N432-Q463 PolarHBondContact O-NE2 3.36Å; S461-Q463 PolarHBondContact O-N 3.34Å; Q463-E465 VanDerWaalsContact C-N 3.27Å; Q463-E465 PolarHBondContact O-N 3.01Å; Q463-F466 PolarHBondContact O-N 2.78Å; Q463-R468 VanDerWaalsContact NE2-NH2 3.19Å
464	Q	85.6	Confident	87.8	Confident	128 Å²	128	56 Å²	56	60%	0.598	29%	0.286	S	S	*	.	H	α-helix	trans	-75.9	-16.5	179.8	-54.9	-178.2	6.4	0	0	112.5	S461 V462 F466 R488	S461-Q464 WeakPolarHBondContact O-CB 3.4Å; S461-Q464 PolarHBondContact O-N 3.46Å; V462-Q464 PolarHBondContact O-N 3.41Å; Q464-F466 VanDerWaalsContact C-N 3.29Å; Q464-R488 WeakPolarHBondContact O-CD 3.44Å; Q464-R488 PolarHBondContact O-NE 3.12Å; Q464-R488 PolarHBondContact O-NH1 3.14Å
465	E	88.2	Confident	86.9	Confident	82 Å²	82	58.6 Å²	58.6	38%	0.383	30%	0.303	S	S	.	.	H	α-helix	trans	-78.7	-18.3	178.1	-61.6	178.6	-165.9	0	0	111.9	V462 Q463 H487 R488	V462-E465 WeakPolarHBondContact O-CB 3.14Å; V462-E465 PolarHBondContact O-N 3.1Å; Q463-E465 VanDerWaalsContact C-N 3.27Å; Q463-E465 PolarHBondContact O-N 3.01Å; E465-H487 IonicContact OE2-NE2 2.59Å; E465-R488 WeakPolarHBondContact O-CB 3.37Å; E465-R488 WeakPolarHBondContact O-CG 3.36Å; E465-R488 PolarHBondContact O-N 3.39Å
466	F	88.4	Confident	85.8	Confident	25 Å²	25	61 Å²	61	11%	0.11	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	141.7	-179.6	-70.7	-83.8	0	0	0	112.4	E426 V430 V462 Q463 Q464 C485 H487 F498	E426-F466 HydrophobicContact CG-CE2 4.48Å; E426-F466 WeakPolarHBondContact OE1-CE2 3.41Å; E426-F466 VanDerWaalsContact OE1-CZ 3.28Å; E426-F466 WeakPolarHBondContact OE1-CZ 3.19Å; V430-F466 HydrophobicContact CG1-CB 4.14Å; V430-F466 HydrophobicContact CG1-CD2 4.44Å; V430-F466 HydrophobicContact CG1-CG 4.29Å; V430-F466 HydrophobicContact CG2-CD2 3.56Å; V430-F466 HydrophobicContact CG2-CE2 4.03Å; V430-F466 HydrophobicContact CG2-CG 4.23Å; V462-F466 HydrophobicContact CG1-CD2 4.24Å; V462-F466 HydrophobicContact CG1-CE2 3.91Å; V462-F466 WeakPolarHBondContact O-CD2 3.47Å; Q463-F466 PolarHBondContact O-N 2.78Å; Q464-F466 VanDerWaalsContact C-N 3.29Å; F466-C485 HydrophobicContact CB-CB 4.12Å; F466-C485 HydrophobicContact CD1-CB 3.92Å; F466-C485 HydrophobicContact CG-CB 4.35Å; F466-H487 HydrophobicContact CD1-CB 4.4Å; F466-H487 HydrophobicContact CE1-CB 4.17Å; F466-H487 AromaticContact CE1-CD2 3.99Å; F466-H487 AromaticContact CZ-CD2 3.89Å; F466-F498 HydrophobicContact CD1-CE2 4.19Å; F466-F498 HydrophobicContact CE1-CE2 4Å; F466-F498 HydrophobicContact CE1-CZ 4.2Å; F466-F498 HydrophobicContact CZ-CE2 4.27Å; F466-F498 HydrophobicContact CZ-CZ 4.1Å
467	I	88.2	Confident	84.9	Confident	62 Å²	62	69.4 Å²	69.4	32%	0.318	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.5	167.9	-56	174.9	0	0	0	107.1	C485 V486 R488	I467-C485 CarbonylContact O-C 3.59Å; I467-C485 VanDerWaalsContact O-CA 3.28Å; I467-C485 WeakPolarHBondContact O-CA 3.39Å; I467-V486 PolarHBondContact N-O 3.35Å; I467-V486 PolarHBondContact O-N 3.5Å; I467-R488 HydrophobicContact CD1-CG 3.9Å; I467-R488 HydrophobicContact CG1-CG 3.6Å
468	R	88.7	Confident	84.4	Confident	60 Å²	60	73.5 Å²	73.5	23%	0.226	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	124.8	173.2	-60.6	-175.6	-176	171.3	6.3	109.3	V430 N432 D433 Q463 E471	V430-R468 PolarHBondContact O-NE 2.84Å; V430-R468 PolarHBondContact O-NH2 3.22Å; N432-R468 PolarHBondContact O-NH2 3.11Å; D433-R468 IonicContact OD1-CZ 3.63Å; D433-R468 IonicContact OD1-NH1 3.15Å; D433-R468 PolarHBondContact OD1-NH1 3.3Å; Q463-R468 VanDerWaalsContact NE2-NH2 3.19Å; R468-E471 HydrophobicContact CB-CG 4.47Å; R468-E471 WeakPolarHBondContact CD-OE1 3.18Å; R468-E471 IonicContact CZ-OE1 2.68Å; R468-E471 IonicContact NE-OE1 3.23Å; R468-E471 IonicContact NH1-OE1 2.64Å; R468-E471 PolarHBondContact NH1-OE1 2.99Å
469	L	87.8	Confident	84.3	Confident	95 Å²	95	76.8 Å²	76.8	50%	0.497	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-33.3	177.1	-65.4	-176.9	0	0	0	112.2	R484 V486	L469-R484 PolarHBondContact N-O 3.16Å; L469-V486 HydrophobicContact CD1-CG2 3.37Å; L469-V486 HydrophobicContact CG-CG2 4.01Å
470	E	88.1	Confident	84.5	Confident	75 Å²	75	77.5 Å²	77.5	35%	0.35	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	140.6	-174.8	-173	176.2	-174.1	0	0	109.2	H472 V483 R484	E470-H472 IonicContact OE1-CE1 3.86Å; E470-H472 IonicContact OE1-NE2 2.74Å; E470-V483 WeakPolarHBondContact O-CA 3.36Å; E470-R484 HydrophobicContact CB-CB 3.91Å; E470-R484 PolarHBondContact N-O 2.68Å; E470-R484 PolarHBondContact O-N 3.47Å; E470-R484 IonicContact OE2-CZ 2.77Å; E470-R484 IonicContact OE2-NE 2.86Å; E470-R484 PolarHBondContact OE2-NE 2.72Å; E470-R484 IonicContact OE2-NH2 3.58Å
471	E	86.5	Confident	84.9	Confident	101 Å²	101	72.9 Å²	72.9	47%	0.472	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.7	-175.5	-59.7	-173	152.2	0	0	110.1	R468 V483	R468-E471 HydrophobicContact CB-CG 4.47Å; R468-E471 WeakPolarHBondContact CD-OE1 3.18Å; R468-E471 IonicContact CZ-OE1 2.68Å; R468-E471 IonicContact NE-OE1 3.23Å; R468-E471 IonicContact NH1-OE1 2.64Å; R468-E471 PolarHBondContact NH1-OE1 2.99Å; E471-V483 HydrophobicContact CB-CG1 4.44Å; E471-V483 HydrophobicContact CG-CG1 4.1Å
472	H	87.1	Confident	85.2	Confident	60 Å²	60	70.2 Å²	70.2	28%	0.278	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	99	169.3	-63.5	-59.3	0	0	0	107.7	E470 W480 M481 A482	E470-H472 IonicContact OE1-CE1 3.86Å; E470-H472 IonicContact OE1-NE2 2.74Å; H472-W480 HydrophobicContact CB-CH2 4.25Å; H472-W480 HydrophobicContact CB-CZ3 3.84Å; H472-M481 WeakPolarHBondContact O-CA 3.45Å; H472-M481 WeakPolarHBondContact O-CG 3.3Å; H472-A482 HydrophobicContact CB-CB 4.45Å; H472-A482 PolarHBondContact N-O 2.91Å; H472-A482 PolarHBondContact O-N 3.43Å; H472-A482 VanDerWaalsContact O-N 3.08Å
473	P	84.1	Confident	85.5	Confident	82 Å²	82	69.5 Å²	69.5	53%	0.532	34%	0.344	S	S	.	.			trans	-68.5	154.6	-174.8	28.7	-35.1	0	0	0	111.1	T475	P473-T475 PolarHBondContact O-N 3.4Å
474	F	84	Confident	85.9	Confident	64 Å²	64	69.9 Å²	69.9	28%	0.281	34%	0.343	S	S	.	.			trans	-67.3	128.3	176.4	177.8	-83.9	0	0	0	111.8	W480 M481	F474-W480 WeakPolarHBondContact CA-O 3.31Å; F474-M481 HydrophobicContact CB-CB 4.14Å
475	T	74	Confident	86.2	Confident	56 Å²	56	63.8 Å²	63.8	34%	0.344	31%	0.314	S	S	.	.			trans	-121.7	147.4	167.5	61.3	0	0	0	0	110.8	P473 E477 Q478 K479	P473-T475 PolarHBondContact O-N 3.4Å; T475-E477 PolarHBondContact O-N 3.49Å; T475-Q478 PolarHBondContact O-N 3.36Å; T475-Q478 VanDerWaalsContact OG1-CB 3.26Å; T475-Q478 WeakPolarHBondContact OG1-CB 3.4Å; T475-Q478 VanDerWaalsContact OG1-CD 3.28Å; T475-Q478 WeakPolarHBondContact OG1-CG 3.44Å; T475-Q478 PolarHBondContact OG1-N 2.94Å; T475-Q478 PolarHBondContact OG1-OE1 3Å; T475-Q478 VanDerWaalsContact OG1-OE1 3.09Å; T475-K479 PolarHBondContact O-N 3.33Å
476	S	70.9	Confident	86.3	Confident	100 Å²	100	60.6 Å²	60.6	70%	0.699	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.7	-179.2	-59.9	0	0	0	0	113.4	K479	S476-K479 WeakPolarHBondContact O-CG 3.41Å
477	E	72.4	Confident	86.2	Confident	187 Å²	187	61.8 Å²	61.8	87%	0.874	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-44.3	174.7	-65	-178.5	179.2	0	0	111.5	T475	T475-E477 PolarHBondContact O-N 3.49Å
478	Q	81.4	Confident	86	Confident	86 Å²	86	65.7 Å²	65.7	40%	0.402	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-34.1	-178.3	-64.4	173.1	-19.2	0	0	112.5	T475 W480	T475-Q478 PolarHBondContact O-N 3.36Å; T475-Q478 VanDerWaalsContact OG1-CB 3.26Å; T475-Q478 WeakPolarHBondContact OG1-CB 3.4Å; T475-Q478 VanDerWaalsContact OG1-CD 3.28Å; T475-Q478 WeakPolarHBondContact OG1-CG 3.44Å; T475-Q478 PolarHBondContact OG1-N 2.94Å; T475-Q478 PolarHBondContact OG1-OE1 3Å; T475-Q478 VanDerWaalsContact OG1-OE1 3.09Å; Q478-W480 PolarHBondContact O-N 3.24Å
479	K	87.4	Confident	85.5	Confident	106 Å²	106	68.1 Å²	68.1	46%	0.461	34%	0.339	S	S	.	.			trans	60.6	21.4	-178.8	-52.4	-179.3	178.8	179.5	0	115.3	T475 S476 G501 A502 Q505	T475-K479 PolarHBondContact O-N 3.33Å; S476-K479 WeakPolarHBondContact O-CG 3.41Å; K479-G501 WeakPolarHBondContact O-CA 3.42Å; K479-A502 HydrophobicContact CB-CB 4.01Å; K479-A502 PolarHBondContact O-N 3.21Å; K479-Q505 HydrophobicContact CB-CG 4.28Å
480	W	92	Very high	84.9	Confident	30 Å²	30	67.8 Å²	67.8	11%	0.114	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	162.7	173.4	60.1	-95.1	0	0	0	111.1	H472 F474 Q478 A482 M499 K500 V506 F509 M553	H472-W480 HydrophobicContact CB-CH2 4.25Å; H472-W480 HydrophobicContact CB-CZ3 3.84Å; F474-W480 WeakPolarHBondContact CA-O 3.31Å; Q478-W480 PolarHBondContact O-N 3.24Å; W480-A482 HydrophobicContact CE3-CB 4Å; W480-A482 HydrophobicContact CZ3-CB 3.68Å; W480-M499 HydrophobicContact CD2-CE 3.95Å; W480-M499 HydrophobicContact CE3-CE 3.62Å; W480-M499 HydrophobicContact CZ3-CE 3.94Å; W480-K500 CarbonylContact C-O 3.55Å; W480-K500 WeakPolarHBondContact CA-O 3.5Å; W480-V506 HydrophobicContact CB-CG2 4.48Å; W480-F509 HydrophobicContact CZ2-CZ 4.34Å; W480-F509 AromaticContact NE1-CE2 3.94Å; W480-M553 HydrophobicContact CE3-CE 4.29Å; W480-M553 HydrophobicContact CH2-CE 3.37Å; W480-M553 HydrophobicContact CZ2-CE 4.05Å; W480-M553 HydrophobicContact CZ3-CE 3.51Å
481	M	91.9	Very high	83.9	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.3	175	-177.6	-173.7	175.5	0	0	108.1	D433 H472 F474 V483 M499 K500	D433-M481 WeakPolarHBondContact OD1-CE 3.34Å; D433-M481 WeakPolarHBondContact OD2-CE 3.07Å; H472-M481 WeakPolarHBondContact O-CA 3.45Å; H472-M481 WeakPolarHBondContact O-CG 3.3Å; F474-M481 HydrophobicContact CB-CB 4.14Å; M481-V483 HydrophobicContact CE-CG1 4.17Å; M481-M499 WeakPolarHBondContact O-CA 3.22Å; M481-K500 HydrophobicContact CB-CG 4.18Å; M481-K500 PolarHBondContact N-O 2.99Å; M481-K500 PolarHBondContact O-N 3.37Å; M481-K500 VanDerWaalsContact O-O 3.14Å; M481-K500 WeakPolarHBondContact SD-CE 3.47Å
482	A	92.8	Very high	82.9	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.3	173.1	0	0	0	0	0	111.8	H472 W480 F498 M499 M553	H472-A482 HydrophobicContact CB-CB 4.45Å; H472-A482 PolarHBondContact N-O 2.91Å; H472-A482 PolarHBondContact O-N 3.43Å; H472-A482 VanDerWaalsContact O-N 3.08Å; W480-A482 HydrophobicContact CE3-CB 4Å; W480-A482 HydrophobicContact CZ3-CB 3.68Å; A482-F498 CarbonylContact C-O 3.57Å; A482-F498 WeakPolarHBondContact CA-O 3.3Å; A482-M499 HydrophobicContact CB-CB 4.18Å; A482-M499 HydrophobicContact CB-CE 4.27Å; A482-M499 HydrophobicContact CB-CG 4.42Å; A482-M553 HydrophobicContact CB-CE 4.4Å
483	V	92.5	Very high	82.2	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.6	173.3	-62.4	0	0	0	0	109.4	V430 C431 E470 E471 M481 Y497 F498	V430-V483 HydrophobicContact CG1-CG2 4.29Å; C431-V483 HydrophobicContact CB-CG2 3.73Å; E470-V483 WeakPolarHBondContact O-CA 3.36Å; E471-V483 HydrophobicContact CB-CG1 4.44Å; E471-V483 HydrophobicContact CG-CG1 4.1Å; M481-V483 HydrophobicContact CE-CG1 4.17Å; V483-Y497 CarbonylContact O-C 3.52Å; V483-Y497 WeakPolarHBondContact O-CA 3.4Å; V483-F498 HydrophobicContact CG2-CB 3.95Å; V483-F498 PolarHBondContact N-O 3.49Å; V483-F498 PolarHBondContact O-N 2.89Å
484	R	92.9	Very high	81.8	Confident	66 Å²	66	78.6 Å²	78.6	25%	0.249	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.8	173.2	-167.1	173.4	69.7	85.1	-0.3	108.7	L469 E470 Y497	L469-R484 PolarHBondContact N-O 3.16Å; E470-R484 HydrophobicContact CB-CB 3.91Å; E470-R484 PolarHBondContact N-O 2.68Å; E470-R484 PolarHBondContact O-N 3.47Å; E470-R484 IonicContact OE2-CZ 2.77Å; E470-R484 IonicContact OE2-NE 2.86Å; E470-R484 PolarHBondContact OE2-NE 2.72Å; E470-R484 IonicContact OE2-NH2 3.58Å; R484-Y497 HydrophobicContact CB-CD1 3.92Å; R484-Y497 HydrophobicContact CB-CE1 3.75Å; R484-Y497 VanDerWaalsContact CD-OH 3.3Å; R484-Y497 WeakPolarHBondContact CD-OH 3.3Å; R484-Y497 HydrophobicContact CG-CD1 4.16Å; R484-Y497 HydrophobicContact CG-CD2 4.35Å; R484-Y497 HydrophobicContact CG-CE1 3.88Å; R484-Y497 HydrophobicContact CG-CE2 4.08Å; R484-Y497 HydrophobicContact CG-CG 4.4Å
485	C	90.5	Very high	81.7	Confident	0 Å²	0	76 Å²	76	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	153.7	-171.6	-60.1	0	0	0	0	112	V430 F466 I467 G495 V496 F498	V430-C485 HydrophobicContact CG1-CB 4.37Å; V430-C485 WeakPolarHBondContact CG1-SG 3.44Å; F466-C485 HydrophobicContact CB-CB 4.12Å; F466-C485 HydrophobicContact CD1-CB 3.92Å; F466-C485 HydrophobicContact CG-CB 4.35Å; I467-C485 CarbonylContact O-C 3.59Å; I467-C485 VanDerWaalsContact O-CA 3.28Å; I467-C485 WeakPolarHBondContact O-CA 3.39Å; C485-G495 CarbonylContact O-C 3.23Å; C485-G495 VanDerWaalsContact O-CA 3.29Å; C485-G495 WeakPolarHBondContact O-CA 3.38Å; C485-V496 PolarHBondContact N-O 3.24Å; C485-V496 PolarHBondContact O-N 3.38Å; C485-F498 HydrophobicContact CB-CD2 4.1Å; C485-F498 HydrophobicContact CB-CE2 4.11Å
486	V	90.5	Very high	82.5	Confident	16 Å²	16	75.8 Å²	75.8	10%	0.097	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.6	166.4	-167.3	0	0	0	0	108.4	I467 L469 Q490	I467-V486 PolarHBondContact N-O 3.35Å; I467-V486 PolarHBondContact O-N 3.5Å; L469-V486 HydrophobicContact CD1-CG2 3.37Å; L469-V486 HydrophobicContact CG-CG2 4.01Å; V486-Q490 WeakPolarHBondContact CG1-O 3.47Å
487	H	86.9	Confident	83.7	Confident	50 Å²	50	72.9 Å²	72.9	23%	0.231	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	136.4	177.3	-165.1	-86.5	0	0	0	110.1	E465 F466 T489 Q490	E465-H487 IonicContact OE2-NE2 2.59Å; F466-H487 HydrophobicContact CD1-CB 4.4Å; F466-H487 HydrophobicContact CE1-CB 4.17Å; F466-H487 AromaticContact CE1-CD2 3.99Å; F466-H487 AromaticContact CZ-CD2 3.89Å; H487-T489 PolarHBondContact CE1-OG1 3.36Å; H487-T489 PolarHBondContact ND1-N 3.1Å; H487-T489 PolarHBondContact ND1-OG1 3.28Å; H487-T489 PolarHBondContact O-N 3.22Å; H487-T489 VanDerWaalsContact O-N 3.13Å; H487-Q490 HydrophobicContact CB-CB 4.31Å; H487-Q490 CarbonylContact O-C 3.59Å; H487-Q490 PolarHBondContact O-N 3.43Å
488	R	82.9	Confident	84.7	Confident	143 Å²	143	64.4 Å²	64.4	54%	0.54	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-36.9	-175.6	-86	-172.1	172.4	167.2	-3.6	113.2	Q464 E465 I467	Q464-R488 WeakPolarHBondContact O-CD 3.44Å; Q464-R488 PolarHBondContact O-NE 3.12Å; Q464-R488 PolarHBondContact O-NH1 3.14Å; E465-R488 WeakPolarHBondContact O-CB 3.37Å; E465-R488 WeakPolarHBondContact O-CG 3.36Å; E465-R488 PolarHBondContact O-N 3.39Å; I467-R488 HydrophobicContact CD1-CG 3.9Å; I467-R488 HydrophobicContact CG1-CG 3.6Å
489	T	78.3	Confident	85.4	Confident	112 Å²	112	60.3 Å²	60.3	69%	0.687	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-8.1	179.9	61.8	0	0	0	0	114.3	H487	H487-T489 PolarHBondContact CE1-OG1 3.36Å; H487-T489 PolarHBondContact ND1-N 3.1Å; H487-T489 PolarHBondContact ND1-OG1 3.28Å; H487-T489 PolarHBondContact O-N 3.22Å; H487-T489 VanDerWaalsContact O-N 3.13Å
490	Q	76.2	Confident	85.8	Confident	88 Å²	88	55.7 Å²	55.7	41%	0.411	28%	0.278	S	S	.	.			trans	-131.7	53	-173.9	-58.8	-177.9	11.3	0	0	111.3	V486 H487 D492 K493	V486-Q490 WeakPolarHBondContact CG1-O 3.47Å; H487-Q490 HydrophobicContact CB-CB 4.31Å; H487-Q490 CarbonylContact O-C 3.59Å; H487-Q490 PolarHBondContact O-N 3.43Å; Q490-D492 PolarHBondContact O-N 3.12Å; Q490-K493 HydrophobicContact CB-CD 4.38Å; Q490-K493 HydrophobicContact CB-CG 4.47Å; Q490-K493 PolarHBondContact O-N 2.81Å; Q490-K493 VanDerWaalsContact OE1-CD 3.27Å; Q490-K493 VanDerWaalsContact OE1-CE 3.25Å
491	Q	67.4	Low	85.8	Confident	137 Å²	137	54.4 Å²	54.4	64%	0.64	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.7	-178.3	-69.2	-175.1	-10.1	0	0	113.7	K493	Q491-K493 VanDerWaalsContact C-N 3.33Å; Q491-K493 PolarHBondContact O-N 2.92Å
492	D	65.5	Low	85.9	Confident	174 Å²	174	55.9 Å²	55.9	93%	0.93	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.7	-179.5	-70.5	-27.2	0	0	0	114.7	Q490	Q490-D492 PolarHBondContact O-N 3.12Å
493	K	71.8	Confident	85.9	Confident	133 Å²	133	57 Å²	57	58%	0.578	29%	0.291	S	S	*	.	S	Bend	trans	-88.1	154.5	178.8	-75.1	-169.2	-174.7	169.8	0	112.3	Q490 Q491 G495	Q490-K493 HydrophobicContact CB-CD 4.38Å; Q490-K493 HydrophobicContact CB-CG 4.47Å; Q490-K493 PolarHBondContact O-N 2.81Å; Q490-K493 VanDerWaalsContact OE1-CD 3.27Å; Q490-K493 VanDerWaalsContact OE1-CE 3.25Å; Q491-K493 VanDerWaalsContact C-N 3.33Å; Q491-K493 PolarHBondContact O-N 2.92Å; K493-G495 PolarHBondContact O-N 2.79Å
494	S	75.1	Confident	85.8	Confident	100 Å²	100	62.7 Å²	62.7	70%	0.699	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-59.2	133.6	171.9	55.7	0	0	0	0	110.7
495	G	83	Confident	85.8	Confident	10 Å²	10	61.6 Å²	61.6	10%	0.103	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60.2	151.2	-179	0	0	0	0	0	113.4	C485 K493	C485-G495 CarbonylContact O-C 3.23Å; C485-G495 VanDerWaalsContact O-CA 3.29Å; C485-G495 WeakPolarHBondContact O-CA 3.38Å; K493-G495 PolarHBondContact O-N 2.79Å
496	V	91.3	Very high	86	Confident	52 Å²	52	61.6 Å²	61.6	32%	0.315	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.1	177.8	-178.7	0	0	0	0	108.6	C485 F498 G550	C485-V496 PolarHBondContact N-O 3.24Å; C485-V496 PolarHBondContact O-N 3.38Å; V496-F498 HydrophobicContact CB-CE2 4.44Å; V496-F498 HydrophobicContact CG1-CE1 4.28Å; V496-F498 HydrophobicContact CG1-CE2 4.21Å; V496-F498 HydrophobicContact CG1-CZ 4.06Å; V496-G550 CarbonylContact C-O 3.48Å
497	Y	94.3	Very high	86.1	Confident	39 Å²	39	61.7 Å²	61.7	15%	0.153	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.6	169.3	-71.2	-88.5	0	0	0	110.2	V483 R484 S549 G550 S551	V483-Y497 CarbonylContact O-C 3.52Å; V483-Y497 WeakPolarHBondContact O-CA 3.4Å; R484-Y497 HydrophobicContact CB-CD1 3.92Å; R484-Y497 HydrophobicContact CB-CE1 3.75Å; R484-Y497 VanDerWaalsContact CD-OH 3.3Å; R484-Y497 WeakPolarHBondContact CD-OH 3.3Å; R484-Y497 HydrophobicContact CG-CD1 4.16Å; R484-Y497 HydrophobicContact CG-CD2 4.35Å; R484-Y497 HydrophobicContact CG-CE1 3.88Å; R484-Y497 HydrophobicContact CG-CE2 4.08Å; R484-Y497 HydrophobicContact CG-CG 4.4Å; Y497-S549 CarbonylContact O-C 3.55Å; Y497-S549 WeakPolarHBondContact O-CA 3.23Å; Y497-G550 PolarHBondContact N-O 3.25Å; Y497-G550 PolarHBondContact O-N 3.44Å; Y497-S551 WeakPolarHBondContact CD2-O 3.46Å
498	F	95.1	Very high	86.4	Confident	8 Å²	8	67.7 Å²	67.7	4%	0.035	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.1	170.1	-70.5	-67	0	0	0	108.6	E426 V427 V430 C431 F466 A482 V483 C485 V496	E426-F498 HydrophobicContact CG-CE1 4.31Å; E426-F498 HydrophobicContact CG-CZ 4.33Å; V427-F498 HydrophobicContact CB-CD1 4.11Å; V427-F498 HydrophobicContact CG1-CB 4.05Å; V427-F498 HydrophobicContact CG1-CD1 4.2Å; V427-F498 HydrophobicContact CG2-CD1 3.51Å; V427-F498 HydrophobicContact CG2-CE1 3.99Å; V430-F498 HydrophobicContact CB-CD2 4.16Å; V430-F498 HydrophobicContact CB-CE2 4.37Å; V430-F498 HydrophobicContact CG1-CD2 3.61Å; V430-F498 HydrophobicContact CG1-CE2 3.89Å; V430-F498 HydrophobicContact CG1-CG 4.37Å; C431-F498 HydrophobicContact CB-CB 4.04Å; C431-F498 PolarHBondContact SG-O 3.22Å; C431-F498 VanDerWaalsContact SG-O 3.37Å; F466-F498 HydrophobicContact CD1-CE2 4.19Å; F466-F498 HydrophobicContact CE1-CE2 4Å; F466-F498 HydrophobicContact CE1-CZ 4.2Å; F466-F498 HydrophobicContact CZ-CE2 4.27Å; F466-F498 HydrophobicContact CZ-CZ 4.1Å; A482-F498 CarbonylContact C-O 3.57Å; A482-F498 WeakPolarHBondContact CA-O 3.3Å; V483-F498 HydrophobicContact CG2-CB 3.95Å; V483-F498 PolarHBondContact N-O 3.49Å; V483-F498 PolarHBondContact O-N 2.89Å; C485-F498 HydrophobicContact CB-CD2 4.1Å; C485-F498 HydrophobicContact CB-CE2 4.11Å; V496-F498 HydrophobicContact CB-CE2 4.44Å; V496-F498 HydrophobicContact CG1-CE1 4.28Å; V496-F498 HydrophobicContact CG1-CE2 4.21Å; V496-F498 HydrophobicContact CG1-CZ 4.06Å
499	M	95.1	Very high	86.8	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.6	-176.4	177	-176.6	-85.6	0	0	110.9	V427 W480 M481 A482 V506 F509 F547 A548 M553 L556	V427-M499 WeakPolarHBondContact CG1-O 3.15Å; W480-M499 HydrophobicContact CD2-CE 3.95Å; W480-M499 HydrophobicContact CE3-CE 3.62Å; W480-M499 HydrophobicContact CZ3-CE 3.94Å; M481-M499 WeakPolarHBondContact O-CA 3.22Å; A482-M499 HydrophobicContact CB-CB 4.18Å; A482-M499 HydrophobicContact CB-CE 4.27Å; A482-M499 HydrophobicContact CB-CG 4.42Å; M499-V506 HydrophobicContact CG-CG1 4.46Å; M499-V506 HydrophobicContact CG-CG2 4.23Å; M499-V506 HydrophobicContact SD-CB 4.33Å; M499-V506 HydrophobicContact SD-CG1 4.09Å; M499-V506 HydrophobicContact SD-CG2 4.14Å; M499-F509 HydrophobicContact CE-CB 4.37Å; M499-F509 HydrophobicContact CE-CD2 3.76Å; M499-F509 HydrophobicContact CE-CE2 4.2Å; M499-F509 HydrophobicContact CE-CG 4.02Å; M499-F509 HydrophobicContact SD-CB 4.28Å; M499-F509 HydrophobicContact SD-CD2 3.97Å; M499-F509 HydrophobicContact SD-CG 4.37Å; M499-F547 WeakPolarHBondContact O-CA 3.01Å; M499-A548 HydrophobicContact CB-CB 4.49Å; M499-A548 PolarHBondContact N-O 2.61Å; M499-A548 PolarHBondContact O-N 3.34Å; M499-M553 HydrophobicContact CE-CE 3.13Å; M499-M553 HydrophobicContact CE-SD 3.68Å; M499-L556 HydrophobicContact CB-CD1 4.04Å; M499-L556 HydrophobicContact CE-CD1 4.09Å; M499-L556 HydrophobicContact SD-CD1 3.84Å
500	K	95.4	Very high	87.6	Confident	10 Å²	10	58.3 Å²	58.3	4%	0.043	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	151.8	168.5	71.1	-178.9	-175.8	-167.7	0	110.9	C431 E447 L450 W480 M481 A546 F547	C431-K500 VanDerWaalsContact O-CD 3.29Å; C431-K500 WeakPolarHBondContact O-CD 3.5Å; C431-K500 WeakPolarHBondContact O-CE 3.46Å; C431-K500 PolarHBondContact O-NZ 2.97Å; E447-K500 VanDerWaalsContact CG-NZ 3.34Å; E447-K500 WeakPolarHBondContact OE1-CE 3.49Å; E447-K500 IonicContact OE1-NZ 3.29Å; E447-K500 PolarHBondContact OE1-NZ 2.83Å; L450-K500 HydrophobicContact CD1-CD 4.13Å; W480-K500 CarbonylContact C-O 3.55Å; W480-K500 WeakPolarHBondContact CA-O 3.5Å; M481-K500 HydrophobicContact CB-CG 4.18Å; M481-K500 PolarHBondContact N-O 2.99Å; M481-K500 PolarHBondContact O-N 3.37Å; M481-K500 VanDerWaalsContact O-O 3.14Å; M481-K500 WeakPolarHBondContact SD-CE 3.47Å; K500-A546 CarbonylContact C-O 3.55Å; K500-A546 VanDerWaalsContact CA-O 3.27Å; K500-A546 WeakPolarHBondContact CA-O 3.39Å; K500-F547 HydrophobicContact CB-CD1 3.81Å; K500-F547 HydrophobicContact CB-CE1 3.71Å; K500-F547 HydrophobicContact CB-CZ 4.41Å; K500-F547 HydrophobicContact CD-CE1 4.37Å
501	G	93.5	Very high	88.3	Confident	3 Å²	3	56.7 Å²	56.7	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.3	-164.1	177.2	0	0	0	0	0	114.5	K479 A546	K479-G501 WeakPolarHBondContact O-CA 3.42Å; G501-A546 PolarHBondContact N-O 2.9Å; G501-A546 PolarHBondContact O-N 3.09Å
502	A	92.5	Very high	89.6	Confident	33 Å²	33	51.7 Å²	51.7	27%	0.273	27%	0.268	S	S	.	.			trans	-64.9	134.9	170.9	0	0	0	0	0	110.5	K479 E504 Q505 V506	K479-A502 HydrophobicContact CB-CB 4.01Å; K479-A502 PolarHBondContact O-N 3.21Å; A502-E504 VanDerWaalsContact C-N 3.31Å; A502-E504 PolarHBondContact O-N 3.47Å; A502-Q505 PolarHBondContact O-N 3.24Å; A502-V506 WeakPolarHBondContact O-CG2 3.47Å; A502-V506 PolarHBondContact O-N 2.78Å
503	Y	92.6	Very high	90.9	Very high	22 Å²	22	44.9 Å²	44.9	9%	0.086	23%	0.23	C	C	.	.	H	α-helix	trans	-51.2	-47.1	-177.3	170.1	-104.9	0	0	0	113.3	Q505 V506 I507 R527 Y530 I534 A546 F558 L561	Y503-Q505 PolarHBondContact O-N 2.81Å; Y503-Q505 VanDerWaalsContact O-N 3.09Å; Y503-V506 PolarHBondContact O-N 2.84Å; Y503-I507 HydrophobicContact CD2-CB 4.31Å; Y503-I507 HydrophobicContact CE1-CG2 4.44Å; Y503-I507 HydrophobicContact CE2-CB 3.99Å; Y503-I507 HydrophobicContact CE2-CD1 3.89Å; Y503-I507 HydrophobicContact CE2-CG1 3.93Å; Y503-I507 WeakPolarHBondContact O-CB 3.43Å; Y503-I507 VanDerWaalsContact O-CG2 3.26Å; Y503-I507 WeakPolarHBondContact O-CG2 3.48Å; Y503-I507 PolarHBondContact O-N 2.9Å; Y503-R527 PolarHBondContact OH-O 3Å; Y503-Y530 HydrophobicContact CE2-CD2 4.47Å; Y503-I534 VanDerWaalsContact CB-CD1 3.45Å; Y503-I534 HydrophobicContact CD1-CD1 3.2Å; Y503-I534 HydrophobicContact CD2-CD1 3.59Å; Y503-I534 HydrophobicContact CE1-CD1 3.72Å; Y503-I534 HydrophobicContact CE2-CD1 4.07Å; Y503-I534 HydrophobicContact CG-CD1 3.11Å; Y503-A546 HydrophobicContact CD2-CB 4.3Å; Y503-F558 HydrophobicContact CD2-CE2 4.14Å; Y503-F558 HydrophobicContact CD2-CZ 4.36Å; Y503-F558 HydrophobicContact CE2-CE2 4.23Å; Y503-F558 HydrophobicContact CE2-CZ 4.27Å; Y503-L561 HydrophobicContact CD2-CD2 4.09Å
504	E	91.3	Very high	91.9	Very high	121 Å²	121	38.6 Å²	38.6	57%	0.565	20%	0.203	S	C	*	.	H	α-helix	trans	-58	-26.6	-178	-64.3	178.3	174.8	0	0	113.9	A502 R508	A502-E504 VanDerWaalsContact C-N 3.31Å; A502-E504 PolarHBondContact O-N 3.47Å; E504-R508 WeakPolarHBondContact O-CD 3.35Å; E504-R508 WeakPolarHBondContact O-CG 3.3Å; E504-R508 PolarHBondContact O-NE 3.46Å
505	Q	93.1	Very high	92.5	Very high	43 Å²	43	35.2 Å²	35.2	20%	0.201	18%	0.179	C	C	.	.	H	α-helix	trans	-91.6	-48.3	178.3	-60.4	-59.5	-27.3	0	0	110.7	K479 A502 Y503 I507 R508 F509	K479-Q505 HydrophobicContact CB-CG 4.28Å; A502-Q505 PolarHBondContact O-N 3.24Å; Y503-Q505 PolarHBondContact O-N 2.81Å; Y503-Q505 VanDerWaalsContact O-N 3.09Å; Q505-I507 VanDerWaalsContact C-N 3.34Å; Q505-I507 PolarHBondContact O-N 3.34Å; Q505-R508 WeakPolarHBondContact O-CB 3.4Å; Q505-R508 PolarHBondContact O-N 2.87Å; Q505-F509 VanDerWaalsContact O-CD2 3.27Å; Q505-F509 WeakPolarHBondContact O-CD2 3.24Å
506	V	93.4	Very high	92.5	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-43.5	-178.2	176	0	0	0	0	111.3	W480 M499 A502 Y503 R508 F509 C510 A546 A548	W480-V506 HydrophobicContact CB-CG2 4.48Å; M499-V506 HydrophobicContact CG-CG1 4.46Å; M499-V506 HydrophobicContact CG-CG2 4.23Å; M499-V506 HydrophobicContact SD-CB 4.33Å; M499-V506 HydrophobicContact SD-CG1 4.09Å; M499-V506 HydrophobicContact SD-CG2 4.14Å; A502-V506 WeakPolarHBondContact O-CG2 3.47Å; A502-V506 PolarHBondContact O-N 2.78Å; Y503-V506 PolarHBondContact O-N 2.84Å; V506-R508 PolarHBondContact O-N 3.16Å; V506-R508 VanDerWaalsContact O-N 3.16Å; V506-F509 PolarHBondContact O-N 3.38Å; V506-C510 PolarHBondContact O-SG 2.93Å; V506-C510 VanDerWaalsContact O-SG 3.37Å; V506-A546 HydrophobicContact CB-CB 3.97Å; V506-A546 HydrophobicContact CG1-CB 4.14Å; V506-A546 HydrophobicContact CG2-CB 4.17Å; V506-A548 HydrophobicContact CG1-CB 3.73Å
507	I	93.4	Very high	91.8	Very high	18 Å²	18	44.3 Å²	44.3	9%	0.092	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-64	-23.4	-176.9	-158.5	63.8	0	0	0	113.1	Y503 Q505 F509 C510 L522 F558	Y503-I507 HydrophobicContact CD2-CB 4.31Å; Y503-I507 HydrophobicContact CE1-CG2 4.44Å; Y503-I507 HydrophobicContact CE2-CB 3.99Å; Y503-I507 HydrophobicContact CE2-CD1 3.89Å; Y503-I507 HydrophobicContact CE2-CG1 3.93Å; Y503-I507 WeakPolarHBondContact O-CB 3.43Å; Y503-I507 VanDerWaalsContact O-CG2 3.26Å; Y503-I507 WeakPolarHBondContact O-CG2 3.48Å; Y503-I507 PolarHBondContact O-N 2.9Å; Q505-I507 VanDerWaalsContact C-N 3.34Å; Q505-I507 PolarHBondContact O-N 3.34Å; I507-F509 VanDerWaalsContact C-N 3.26Å; I507-F509 PolarHBondContact O-N 3.01Å; I507-C510 HydrophobicContact CD1-CB 4.31Å; I507-C510 PolarHBondContact O-N 2.96Å; I507-L522 HydrophobicContact CD1-CD1 4.29Å; I507-L522 HydrophobicContact CD1-CD2 3.7Å; I507-L522 HydrophobicContact CG1-CD2 4.09Å; I507-F558 HydrophobicContact CD1-CB 4.44Å; I507-F558 HydrophobicContact CD1-CD2 3.97Å; I507-F558 HydrophobicContact CD1-CE2 4.43Å; I507-F558 HydrophobicContact CD1-CG 4.17Å
508	R	92.5	Very high	91.4	Very high	176 Å²	176	45.4 Å²	45.4	66%	0.664	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-69	-26.7	176.9	-63.8	175.3	-173.9	-157.4	-3.6	112.3	E504 Q505 V506 C510	E504-R508 WeakPolarHBondContact O-CD 3.35Å; E504-R508 WeakPolarHBondContact O-CG 3.3Å; E504-R508 PolarHBondContact O-NE 3.46Å; Q505-R508 WeakPolarHBondContact O-CB 3.4Å; Q505-R508 PolarHBondContact O-N 2.87Å; V506-R508 PolarHBondContact O-N 3.16Å; V506-R508 VanDerWaalsContact O-N 3.16Å; R508-C510 VanDerWaalsContact C-N 3.35Å
509	F	93.1	Very high	91.1	Very high	52 Å²	52	49.6 Å²	49.6	23%	0.228	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-90.1	-1.3	176.8	-62.1	-79	0	0	0	112.8	W480 M499 Q505 V506 I507 M553 G554 S555 L556	W480-F509 HydrophobicContact CZ2-CZ 4.34Å; W480-F509 AromaticContact NE1-CE2 3.94Å; M499-F509 HydrophobicContact CE-CB 4.37Å; M499-F509 HydrophobicContact CE-CD2 3.76Å; M499-F509 HydrophobicContact CE-CE2 4.2Å; M499-F509 HydrophobicContact CE-CG 4.02Å; M499-F509 HydrophobicContact SD-CB 4.28Å; M499-F509 HydrophobicContact SD-CD2 3.97Å; M499-F509 HydrophobicContact SD-CG 4.37Å; Q505-F509 VanDerWaalsContact O-CD2 3.27Å; Q505-F509 WeakPolarHBondContact O-CD2 3.24Å; V506-F509 PolarHBondContact O-N 3.38Å; I507-F509 VanDerWaalsContact C-N 3.26Å; I507-F509 PolarHBondContact O-N 3.01Å; F509-M553 HydrophobicContact CD1-CE 4.45Å; F509-M553 HydrophobicContact CD1-CG 4.36Å; F509-M553 HydrophobicContact CE1-CE 4.35Å; F509-G554 CarbonylContact O-C 3.58Å; F509-G554 VanDerWaalsContact O-C 3.23Å; F509-S555 PolarHBondContact O-N 2.99Å; F509-L556 HydrophobicContact CB-CD1 3.92Å; F509-L556 HydrophobicContact CB-CG 4.41Å; F509-L556 WeakPolarHBondContact O-CB 3.23Å; F509-L556 PolarHBondContact O-N 3.41Å
510	C	93.6	Very high	91	Very high	6 Å²	6	52.8 Å²	52.8	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124.7	-176.5	-64.7	0	0	0	0	112.5	V506 I507 R508 A548 L556 F558	V506-C510 PolarHBondContact O-SG 2.93Å; V506-C510 VanDerWaalsContact O-SG 3.37Å; I507-C510 HydrophobicContact CD1-CB 4.31Å; I507-C510 PolarHBondContact O-N 2.96Å; R508-C510 VanDerWaalsContact C-N 3.35Å; C510-A548 VanDerWaalsContact SG-CB 3.6Å; C510-L556 CarbonylContact C-O 3.57Å; C510-L556 WeakPolarHBondContact CA-O 3.32Å; C510-F558 HydrophobicContact CB-CB 4.2Å
511	S	92.1	Very high	90.8	Very high	54 Å²	54	56.8 Å²	56.8	38%	0.378	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-28.6	171.7	57.8	0	0	0	0	112.6	L522 S555 L556	S511-L522 WeakPolarHBondContact O-CB 3.33Å; S511-L522 PolarHBondContact O-N 2.75Å; S511-S555 WeakPolarHBondContact OG-CA 3.49Å; S511-L556 PolarHBondContact N-O 3.1Å
512	C	93.7	Very high	90.7	Very high	32 Å²	32	57.7 Å²	57.7	22%	0.216	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	167.7	-177	-62.3	0	0	0	0	111	N519 L520 L556 T557 F558	C512-N519 HydrophobicContact CB-CB 4.33Å; C512-L520 CarbonylContact C-O 3.57Å; C512-L520 WeakPolarHBondContact CA-O 3.44Å; C512-L520 WeakPolarHBondContact CB-O 3.23Å; C512-L556 PolarHBondContact N-O 2.88Å; C512-T557 HydrophobicContact CB-CG2 4.33Å; C512-T557 CarbonylContact O-C 3.56Å; C512-T557 VanDerWaalsContact O-CA 3.31Å; C512-T557 WeakPolarHBondContact O-CA 3.24Å; C512-F558 PolarHBondContact O-N 3.32Å
513	Y	93.5	Very high	90.7	Very high	30 Å²	30	59.3 Å²	59.3	12%	0.118	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	155.4	166	75.1	-79.7	0	0	0	110.2	L520 P521 L522 Q526 Y530 F558	Y513-L520 HydrophobicContact CD1-CB 4.05Å; Y513-L520 WeakPolarHBondContact CD1-O 3.38Å; Y513-L520 HydrophobicContact CE1-CB 3.52Å; Y513-L520 HydrophobicContact CE1-CD1 4.45Å; Y513-L520 HydrophobicContact CE2-CD1 4.48Å; Y513-L520 PolarHBondContact N-O 3.36Å; Y513-L520 PolarHBondContact O-N 2.79Å; Y513-L520 WeakPolarHBondContact OH-CD1 3.27Å; Y513-P521 WeakPolarHBondContact CE1-O 3.44Å; Y513-L522 HydrophobicContact CD1-CD1 4.36Å; Y513-L522 HydrophobicContact CG-CD1 4.47Å; Y513-Q526 HydrophobicContact CE1-CG 4.16Å; Y513-Q526 PolarHBondContact OH-NE2 2.88Å; Y513-Y530 WeakPolarHBondContact CD2-OH 3.45Å; Y513-F558 CarbonylContact C-O 3.47Å; Y513-F558 WeakPolarHBondContact CA-O 3.48Å
514	N	91.5	Very high	90.6	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.011	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	132.5	179.6	-162	-97.9	0	0	0	110.7	S388 K423 G517 S518 N519 T557 F558 L559	S388-N514 WeakPolarHBondContact CB-O 3.37Å; S388-N514 PolarHBondContact OG-N 2.69Å; S388-N514 PolarHBondContact OG-O 3.44Å; K423-N514 PolarHBondContact NZ-ND2 3.44Å; N514-G517 PolarHBondContact ND2-O 2.96Å; N514-G517 WeakPolarHBondContact OD1-CA 3.32Å; N514-G517 PolarHBondContact OD1-N 2.96Å; N514-G517 VanDerWaalsContact OD1-N 3.13Å; N514-S518 CarbonylContact C-O 3.07Å; N514-S518 WeakPolarHBondContact CA-O 3.49Å; N514-S518 PolarHBondContact ND2-O 2.91Å; N514-N519 PolarHBondContact ND2-OD1 3.24Å; N514-T557 HydrophobicContact CB-CG2 3.9Å; N514-F558 PolarHBondContact N-O 3.04Å; N514-L559 HydrophobicContact CB-CD2 3.78Å
515	S	88.7	Confident	90.6	Very high	28 Å²	28	66 Å²	66	20%	0.196	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	109	173.6	-176	0	0	0	0	109.7	G517 S518	S515-G517 PolarHBondContact O-N 2.82Å; S515-G517 VanDerWaalsContact O-N 3.08Å; S515-S518 PolarHBondContact N-O 2.85Å; S515-S518 PolarHBondContact O-N 3.42Å; S515-S518 PolarHBondContact O-OG 3.11Å
516	R	82.9	Confident	90.5	Very high	217 Å²	217	65.9 Å²	65.9	82%	0.819	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	40.5	-178.9	-57.6	-178.9	-179.1	180	-1.2	113.3	D389	D389-R516 PolarHBondContact OD2-N 2.78Å
517	G	77.2	Confident	90.4	Very high	36 Å²	36	71.2 Å²	71.2	37%	0.371	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-18.4	-179	0	0	0	0	0	115.7	N514 S515	N514-G517 PolarHBondContact ND2-O 2.96Å; N514-G517 WeakPolarHBondContact OD1-CA 3.32Å; N514-G517 PolarHBondContact OD1-N 2.96Å; N514-G517 VanDerWaalsContact OD1-N 3.13Å; S515-G517 PolarHBondContact O-N 2.82Å; S515-G517 VanDerWaalsContact O-N 3.08Å
518	S	85.8	Confident	90.3	Very high	63 Å²	63	75.1 Å²	75.1	44%	0.441	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	150.1	175.4	68.8	0	0	0	0	112.3	N514 S515	N514-S518 CarbonylContact C-O 3.07Å; N514-S518 WeakPolarHBondContact CA-O 3.49Å; N514-S518 PolarHBondContact ND2-O 2.91Å; S515-S518 PolarHBondContact N-O 2.85Å; S515-S518 PolarHBondContact O-N 3.42Å; S515-S518 PolarHBondContact O-OG 3.11Å
519	N	89.4	Confident	90.4	Very high	96 Å²	96	70.4 Å²	70.4	51%	0.513	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.6	178.2	-65.8	-11.1	0	0	0	109.7	C512 N514 T557	C512-N519 HydrophobicContact CB-CB 4.33Å; N514-N519 PolarHBondContact ND2-OD1 3.24Å; N519-T557 PolarHBondContact ND2-OG1 3.15Å
520	L	91.3	Very high	90.4	Very high	67 Å²	67	68 Å²	68	35%	0.351	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	150.6	179.5	-67	177	0	0	0	110.8	C512 Y513	C512-L520 CarbonylContact C-O 3.57Å; C512-L520 WeakPolarHBondContact CA-O 3.44Å; C512-L520 WeakPolarHBondContact CB-O 3.23Å; Y513-L520 HydrophobicContact CD1-CB 4.05Å; Y513-L520 WeakPolarHBondContact CD1-O 3.38Å; Y513-L520 HydrophobicContact CE1-CB 3.52Å; Y513-L520 HydrophobicContact CE1-CD1 4.45Å; Y513-L520 HydrophobicContact CE2-CD1 4.48Å; Y513-L520 PolarHBondContact N-O 3.36Å; Y513-L520 PolarHBondContact O-N 2.79Å; Y513-L520 WeakPolarHBondContact OH-CD1 3.27Å
521	P	92.6	Very high	90.3	Very high	93 Å²	93	72.8 Å²	72.8	60%	0.604	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	139.3	-179.7	27.4	-34.3	0	0	0	111.5	Y513 T523	Y513-P521 WeakPolarHBondContact CE1-O 3.44Å; P521-T523 PolarHBondContact O-N 3.11Å
522	L	91.1	Very high	90.3	Very high	23 Å²	23	76.7 Å²	76.7	12%	0.12	39%	0.386	C	S	.	.			trans	-76.8	111.4	-178.6	-164.3	85.8	0	0	0	110.7	I507 S511 Y513 R527 Y530 F558	I507-L522 HydrophobicContact CD1-CD1 4.29Å; I507-L522 HydrophobicContact CD1-CD2 3.7Å; I507-L522 HydrophobicContact CG1-CD2 4.09Å; S511-L522 WeakPolarHBondContact O-CB 3.33Å; S511-L522 PolarHBondContact O-N 2.75Å; Y513-L522 HydrophobicContact CD1-CD1 4.36Å; Y513-L522 HydrophobicContact CG-CD1 4.47Å; L522-R527 HydrophobicContact CD2-CG 3.89Å; L522-R527 VanDerWaalsContact CD2-NE 3.3Å; L522-R527 HydrophobicContact CG-CG 4.25Å; L522-Y530 HydrophobicContact CD1-CE2 3.98Å; L522-F558 HydrophobicContact CD1-CB 4.49Å
523	T	92.4	Very high	90.3	Very high	66 Å²	66	76.1 Å²	76.1	41%	0.405	38%	0.38	S	S	.	.			trans	-92.1	163.6	178.9	63.3	0	0	0	0	112.4	P521 Q525 Q526 R527	P521-T523 PolarHBondContact O-N 3.11Å; T523-Q525 VanDerWaalsContact C-N 3.3Å; T523-Q525 PolarHBondContact O-N 3.21Å; T523-Q526 PolarHBondContact O-N 3.04Å; T523-R527 PolarHBondContact O-N 3.31Å
524	H	90.1	Very high	90.2	Very high	130 Å²	130	76.6 Å²	76.6	60%	0.602	38%	0.384	S	S	*	.	H	α-helix	trans	-60.2	-39.1	176.4	-164.8	-86.4	0	0	0	112.5	Q526 R527 E528	H524-Q526 VanDerWaalsContact C-N 3.32Å; H524-Q526 PolarHBondContact O-N 2.9Å; H524-R527 WeakPolarHBondContact O-CB 3.5Å; H524-R527 PolarHBondContact O-N 3.2Å; H524-E528 IonicContact CE1-OE1 3.76Å; H524-E528 PolarHBondContact CE1-OE1 2.91Å; H524-E528 IonicContact ND1-OE1 3.84Å; H524-E528 PolarHBondContact ND1-OE1 2.83Å; H524-E528 VanDerWaalsContact ND1-OE1 3.1Å; H524-E528 PolarHBondContact O-N 2.82Å
525	Q	91.3	Very high	90.1	Very high	154 Å²	154	80 Å²	80	72%	0.72	41%	0.408	S	S	*	.	H	α-helix	trans	-60	-40.6	176.9	-69.9	176	-22.3	0	0	112.2	T523 E528 L529	T523-Q525 VanDerWaalsContact C-N 3.3Å; T523-Q525 PolarHBondContact O-N 3.21Å; Q525-E528 PolarHBondContact O-N 2.84Å; Q525-L529 PolarHBondContact O-N 3.36Å
526	Q	90.5	Very high	90.2	Very high	40 Å²	40	84.6 Å²	84.6	19%	0.187	42%	0.422	C	S	.	.	H	α-helix	trans	-66.4	-39.8	176.4	-72.8	-69.3	1.6	0	0	111.9	Y513 T523 H524 E528 L529 Y530	Y513-Q526 HydrophobicContact CE1-CG 4.16Å; Y513-Q526 PolarHBondContact OH-NE2 2.88Å; T523-Q526 PolarHBondContact O-N 3.04Å; H524-Q526 VanDerWaalsContact C-N 3.32Å; H524-Q526 PolarHBondContact O-N 2.9Å; Q526-E528 VanDerWaalsContact C-N 3.33Å; Q526-E528 PolarHBondContact O-N 3.05Å; Q526-L529 PolarHBondContact O-N 3.4Å; Q526-Y530 HydrophobicContact CB-CE2 4.1Å; Q526-Y530 WeakPolarHBondContact O-CD2 3.5Å; Q526-Y530 PolarHBondContact O-N 3.19Å; Q526-Y530 PolarHBondContact OE1-OH 3.37Å
527	R	91.9	Very high	90.5	Very high	112 Å²	112	74.3 Å²	74.3	42%	0.423	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-41.9	176.1	-69.3	-179.2	177.1	-178.4	-1.5	112.1	Y503 L522 T523 H524 Q531	Y503-R527 PolarHBondContact OH-O 3Å; L522-R527 HydrophobicContact CD2-CG 3.89Å; L522-R527 VanDerWaalsContact CD2-NE 3.3Å; L522-R527 HydrophobicContact CG-CG 4.25Å; T523-R527 PolarHBondContact O-N 3.31Å; H524-R527 WeakPolarHBondContact O-CB 3.5Å; H524-R527 PolarHBondContact O-N 3.2Å; R527-Q531 WeakPolarHBondContact O-CB 3.28Å; R527-Q531 PolarHBondContact O-N 3.04Å
528	E	92.2	Very high	90.8	Very high	101 Å²	101	73.8 Å²	73.8	47%	0.472	38%	0.378	S	S	.	.	H	α-helix	trans	-63.8	-43.5	174.7	-76.2	177.2	-177	0	0	111.7	H524 Q525 Q526 Y530 Q531 Q532	H524-E528 IonicContact CE1-OE1 3.76Å; H524-E528 PolarHBondContact CE1-OE1 2.91Å; H524-E528 IonicContact ND1-OE1 3.84Å; H524-E528 PolarHBondContact ND1-OE1 2.83Å; H524-E528 VanDerWaalsContact ND1-OE1 3.1Å; H524-E528 PolarHBondContact O-N 2.82Å; Q525-E528 PolarHBondContact O-N 2.84Å; Q526-E528 VanDerWaalsContact C-N 3.33Å; Q526-E528 PolarHBondContact O-N 3.05Å; E528-Y530 PolarHBondContact O-N 3.4Å; E528-Q531 PolarHBondContact O-N 2.85Å; E528-Q532 WeakPolarHBondContact O-CG 3.27Å; E528-Q532 PolarHBondContact O-N 3.07Å
529	L	93.3	Very high	90.6	Very high	77 Å²	77	75.8 Å²	75.8	40%	0.403	39%	0.388	S	S	.	.	H	α-helix	trans	-59.4	-46.9	177.4	-176.3	148.6	0	0	0	111.7	F386 Q525 Q526 Q531 Q532 Q533	F386-L529 HydrophobicContact CE1-CD2 4.32Å; F386-L529 HydrophobicContact CZ-CD2 3.8Å; Q525-L529 PolarHBondContact O-N 3.36Å; Q526-L529 PolarHBondContact O-N 3.4Å; L529-Q531 VanDerWaalsContact C-N 3.3Å; L529-Q531 PolarHBondContact O-N 3.12Å; L529-Q532 PolarHBondContact O-N 3.04Å; L529-Q533 WeakPolarHBondContact O-CB 3.44Å; L529-Q533 PolarHBondContact O-N 2.93Å
530	Y	93.9	Very high	90.3	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-64.9	-35.2	177.2	-57.4	-29.7	0	0	0	112.2	F386 S388 Y503 Y513 L522 Q526 E528 Q533 I534 F558	F386-Y530 AromaticContact CE1-CD1 3.76Å; F386-Y530 HydrophobicContact CE1-CD1 3.76Å; F386-Y530 HydrophobicContact CE1-CE1 4.01Å; F386-Y530 HydrophobicContact CZ-CD1 4.46Å; S388-Y530 PolarHBondContact O-OH 2.84Å; Y503-Y530 HydrophobicContact CE2-CD2 4.47Å; Y513-Y530 WeakPolarHBondContact CD2-OH 3.45Å; L522-Y530 HydrophobicContact CD1-CE2 3.98Å; Q526-Y530 HydrophobicContact CB-CE2 4.1Å; Q526-Y530 WeakPolarHBondContact O-CD2 3.5Å; Q526-Y530 PolarHBondContact O-N 3.19Å; Q526-Y530 PolarHBondContact OE1-OH 3.37Å; E528-Y530 PolarHBondContact O-N 3.4Å; Y530-Q533 PolarHBondContact O-N 2.98Å; Y530-I534 WeakPolarHBondContact O-CD1 3.44Å; Y530-I534 VanDerWaalsContact O-CG1 3.25Å; Y530-I534 WeakPolarHBondContact O-CG1 3.38Å; Y530-I534 PolarHBondContact O-N 3.48Å; Y530-F558 HydrophobicContact CD1-CE1 4.14Å; Y530-F558 AromaticContact CD2-CD1 3.91Å; Y530-F558 HydrophobicContact CD2-CD1 3.91Å; Y530-F558 AromaticContact CD2-CE1 3.6Å; Y530-F558 HydrophobicContact CD2-CE1 3.6Å; Y530-F558 HydrophobicContact CD2-CZ 4.24Å; Y530-F558 HydrophobicContact CE1-CE1 4.1Å; Y530-F558 AromaticContact CE2-CD1 3.46Å; Y530-F558 HydrophobicContact CE2-CD1 3.46Å; Y530-F558 VanDerWaalsContact CE2-CD1 3.46Å; Y530-F558 AromaticContact CE2-CE1 3.55Å; Y530-F558 HydrophobicContact CE2-CE1 3.55Å; Y530-F558 HydrophobicContact CE2-CG 4.44Å; Y530-F558 AromaticContact CG-CE1 3.91Å; Y530-F558 HydrophobicContact CG-CE1 3.91Å; Y530-F558 HydrophobicContact CG-CZ 4.41Å; Y530-F558 AromaticContact CZ-CD1 3.84Å; Y530-F558 AromaticContact CZ-CE1 3.82Å
531	Q	91.9	Very high	90	Very high	107 Å²	107	69.5 Å²	69.5	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-70.2	-38	177.1	-166.9	137.3	-1.6	0	0	112.8	R527 E528 L529 Q533 I534 S535	R527-Q531 WeakPolarHBondContact O-CB 3.28Å; R527-Q531 PolarHBondContact O-N 3.04Å; E528-Q531 PolarHBondContact O-N 2.85Å; L529-Q531 VanDerWaalsContact C-N 3.3Å; L529-Q531 PolarHBondContact O-N 3.12Å; Q531-Q533 VanDerWaalsContact C-N 3.31Å; Q531-I534 PolarHBondContact O-N 2.85Å; Q531-S535 PolarHBondContact O-N 3Å; Q531-S535 VanDerWaalsContact O-N 3.09Å; Q531-S535 PolarHBondContact O-OG 3.39Å
532	Q	92.3	Very high	89.8	Confident	136 Å²	136	65.4 Å²	65.4	64%	0.636	33%	0.331	S	S	*	.	H	α-helix	trans	-61.2	-43	169.9	-72.6	175.5	1.7	0	0	110.7	E528 L529 I534 S535 Y536	E528-Q532 WeakPolarHBondContact O-CG 3.27Å; E528-Q532 PolarHBondContact O-N 3.07Å; L529-Q532 PolarHBondContact O-N 3.04Å; Q532-I534 PolarHBondContact O-N 3.45Å; Q532-S535 WeakPolarHBondContact O-CB 3.46Å; Q532-S535 PolarHBondContact O-N 3.33Å; Q532-S535 VanDerWaalsContact O-N 3.15Å; Q532-Y536 PolarHBondContact O-N 3.35Å
533	Q	93.2	Very high	89.6	Confident	21 Å²	21	69.5 Å²	69.5	10%	0.098	35%	0.345	C	S	.	.	H	α-helix	trans	-65.6	-38.8	179.1	-174	54.6	24.1	0	0	112.8	F386 H392 L529 Y530 Q531 S535 Y536 M537 L561	F386-Q533 HydrophobicContact CB-CG 4.31Å; F386-Q533 HydrophobicContact CD1-CG 3.77Å; F386-Q533 HydrophobicContact CD2-CG 3.86Å; F386-Q533 HydrophobicContact CE1-CB 4.36Å; F386-Q533 HydrophobicContact CE1-CG 3.99Å; F386-Q533 HydrophobicContact CE2-CG 4.06Å; F386-Q533 HydrophobicContact CG-CG 3.68Å; F386-Q533 HydrophobicContact CZ-CB 4.48Å; F386-Q533 HydrophobicContact CZ-CG 4.12Å; H392-Q533 PolarHBondContact CE1-NE2 3.43Å; H392-Q533 PolarHBondContact CE1-OE1 2.92Å; L529-Q533 WeakPolarHBondContact O-CB 3.44Å; L529-Q533 PolarHBondContact O-N 2.93Å; Y530-Q533 PolarHBondContact O-N 2.98Å; Q531-Q533 VanDerWaalsContact C-N 3.31Å; Q533-S535 VanDerWaalsContact C-N 3.29Å; Q533-S535 PolarHBondContact O-N 3.04Å; Q533-Y536 WeakPolarHBondContact O-CB 3.39Å; Q533-Y536 PolarHBondContact O-N 3.37Å; Q533-M537 HydrophobicContact CG-SD 4.17Å; Q533-M537 VanDerWaalsContact O-CG 3.31Å; Q533-M537 WeakPolarHBondContact O-CG 3.24Å; Q533-M537 PolarHBondContact O-N 3.23Å; Q533-L561 HydrophobicContact CB-CD1 4.42Å; Q533-L561 HydrophobicContact CG-CD1 4.25Å
534	I	91.1	Very high	89.6	Confident	39 Å²	39	67.6 Å²	67.6	20%	0.2	33%	0.333	C	S	.	.	H	α-helix	trans	-60.9	-42	172.6	-70	160.6	0	0	0	110.8	Y503 Y530 Q531 Q532 Y536 M537 G538 V544 L561	Y503-I534 VanDerWaalsContact CB-CD1 3.45Å; Y503-I534 HydrophobicContact CD1-CD1 3.2Å; Y503-I534 HydrophobicContact CD2-CD1 3.59Å; Y503-I534 HydrophobicContact CE1-CD1 3.72Å; Y503-I534 HydrophobicContact CE2-CD1 4.07Å; Y503-I534 HydrophobicContact CG-CD1 3.11Å; Y530-I534 WeakPolarHBondContact O-CD1 3.44Å; Y530-I534 VanDerWaalsContact O-CG1 3.25Å; Y530-I534 WeakPolarHBondContact O-CG1 3.38Å; Y530-I534 PolarHBondContact O-N 3.48Å; Q531-I534 PolarHBondContact O-N 2.85Å; Q532-I534 PolarHBondContact O-N 3.45Å; I534-Y536 VanDerWaalsContact C-N 3.34Å; I534-M537 PolarHBondContact O-N 3.36Å; I534-G538 PolarHBondContact O-N 3.3Å; I534-V544 HydrophobicContact CG1-CG1 4.17Å; I534-L561 HydrophobicContact CD1-CD1 4.26Å; I534-L561 HydrophobicContact CD1-CD2 4.27Å; I534-L561 HydrophobicContact CG1-CD1 3.63Å; I534-L561 HydrophobicContact CG1-CD2 4.23Å
535	S	89	Confident	89.8	Confident	73 Å²	73	62.5 Å²	62.5	51%	0.51	31%	0.31	S	S	.	.	H	α-helix	trans	-64.6	-40.6	177.7	-53.7	0	0	0	0	111.2	Q531 Q532 Q533 G538 T539	Q531-S535 PolarHBondContact O-N 3Å; Q531-S535 VanDerWaalsContact O-N 3.09Å; Q531-S535 PolarHBondContact O-OG 3.39Å; Q532-S535 WeakPolarHBondContact O-CB 3.46Å; Q532-S535 PolarHBondContact O-N 3.33Å; Q532-S535 VanDerWaalsContact O-N 3.15Å; Q533-S535 VanDerWaalsContact C-N 3.29Å; Q533-S535 PolarHBondContact O-N 3.04Å; S535-G538 PolarHBondContact O-N 2.76Å; S535-T539 WeakPolarHBondContact O-CG2 3.47Å; S535-T539 PolarHBondContact O-N 2.94Å; S535-T539 PolarHBondContact O-OG1 3.43Å
536	Y	89.9	Confident	90.1	Very high	126 Å²	126	55.1 Å²	55.1	49%	0.494	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-46.7	173.9	174.4	-95.3	0	0	0	112.7	Q532 Q533 I534 G538 T539 S540	Q532-Y536 PolarHBondContact O-N 3.35Å; Q533-Y536 WeakPolarHBondContact O-CB 3.39Å; Q533-Y536 PolarHBondContact O-N 3.37Å; I534-Y536 VanDerWaalsContact C-N 3.34Å; Y536-G538 VanDerWaalsContact C-N 3.34Å; Y536-G538 PolarHBondContact O-N 3.01Å; Y536-T539 PolarHBondContact O-N 3.01Å; Y536-T539 PolarHBondContact O-OG1 3.2Å; Y536-S540 PolarHBondContact O-N 3.04Å; Y536-S540 PolarHBondContact O-OG 2.99Å; Y536-S540 VanDerWaalsContact O-OG 3.12Å
537	M	89.8	Confident	90.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-37.7	177.5	-66.5	175.9	80.6	0	0	111.4	Q384 F386 Q533 I534 S540 G541 L542 V544 L561 G563	Q384-M537 HydrophobicContact CB-CE 3.86Å; F386-M537 HydrophobicContact CB-SD 4.42Å; Q533-M537 HydrophobicContact CG-SD 4.17Å; Q533-M537 VanDerWaalsContact O-CG 3.31Å; Q533-M537 WeakPolarHBondContact O-CG 3.24Å; Q533-M537 PolarHBondContact O-N 3.23Å; I534-M537 PolarHBondContact O-N 3.36Å; M537-S540 CarbonylContact O-C 3.54Å; M537-S540 WeakPolarHBondContact O-CA 3.33Å; M537-S540 WeakPolarHBondContact O-CB 3.35Å; M537-S540 PolarHBondContact O-N 3.42Å; M537-G541 PolarHBondContact O-N 3.28Å; M537-L542 HydrophobicContact CB-CB 4.34Å; M537-L542 HydrophobicContact CB-CD1 4.2Å; M537-L542 HydrophobicContact CE-CD1 4.22Å; M537-L542 HydrophobicContact CG-CD1 4.46Å; M537-L542 VanDerWaalsContact O-CB 3.27Å; M537-L542 WeakPolarHBondContact O-CB 3.31Å; M537-L542 WeakPolarHBondContact O-CG 3.29Å; M537-L542 PolarHBondContact O-N 3.45Å; M537-V544 HydrophobicContact CB-CG2 3.55Å; M537-V544 HydrophobicContact SD-CG1 4.34Å; M537-V544 HydrophobicContact SD-CG2 4.32Å; M537-L561 HydrophobicContact SD-CB 4.37Å; M537-G563 VanDerWaalsContact CE-N 3.25Å
538	G	84.1	Confident	90.6	Very high	26 Å²	26	47.9 Å²	47.9	27%	0.268	25%	0.247	S	C	.	.	H	α-helix	trans	-64.2	-43.7	176.2	0	0	0	0	0	113.1	I534 S535 Y536 S540 G541	I534-G538 PolarHBondContact O-N 3.3Å; S535-G538 PolarHBondContact O-N 2.76Å; Y536-G538 VanDerWaalsContact C-N 3.34Å; Y536-G538 PolarHBondContact O-N 3.01Å; G538-S540 PolarHBondContact O-N 3.29Å; G538-G541 WeakPolarHBondContact O-CA 3.42Å; G538-G541 PolarHBondContact O-N 3.1Å
539	T	82.4	Confident	90.7	Very high	104 Å²	104	44.1 Å²	44.1	64%	0.638	23%	0.231	S	C	*	.	H	α-helix	trans	-63.6	-26.1	173.2	53	0	0	0	0	112.7	S535 Y536 G541	S535-T539 WeakPolarHBondContact O-CG2 3.47Å; S535-T539 PolarHBondContact O-N 2.94Å; S535-T539 PolarHBondContact O-OG1 3.43Å; Y536-T539 PolarHBondContact O-N 3.01Å; Y536-T539 PolarHBondContact O-OG1 3.2Å; T539-G541 PolarHBondContact O-N 3.28Å
540	S	83	Confident	90.6	Very high	27 Å²	27	41 Å²	41	19%	0.189	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	3.4	170.9	-58.8	0	0	0	0	113.5	Y536 M537 G538 L542 S599 R603	Y536-S540 PolarHBondContact O-N 3.04Å; Y536-S540 PolarHBondContact O-OG 2.99Å; Y536-S540 VanDerWaalsContact O-OG 3.12Å; M537-S540 CarbonylContact O-C 3.54Å; M537-S540 WeakPolarHBondContact O-CA 3.33Å; M537-S540 WeakPolarHBondContact O-CB 3.35Å; M537-S540 PolarHBondContact O-N 3.42Å; G538-S540 PolarHBondContact O-N 3.29Å; S540-L542 VanDerWaalsContact C-N 3.32Å; S540-S599 PolarHBondContact O-OG 3.41Å; S540-R603 PolarHBondContact O-NH2 2.91Å
541	G	83.1	Confident	90.3	Very high	4 Å²	4	44.3 Å²	44.3	4%	0.041	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	14.7	-179.7	0	0	0	0	0	114.1	M537 G538 T539 S599	M537-G541 PolarHBondContact O-N 3.28Å; G538-G541 WeakPolarHBondContact O-CA 3.42Å; G538-G541 PolarHBondContact O-N 3.1Å; T539-G541 PolarHBondContact O-N 3.28Å; G541-S599 PolarHBondContact N-OG 2.95Å
542	L	88.6	Confident	90.1	Very high	8 Å²	8	45.4 Å²	45.4	4%	0.042	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-87	133.6	-178	-51.1	179	0	0	0	110.2	T383 Q384 M537 S540 I565	T383-L542 WeakPolarHBondContact OG1-CD2 3.43Å; Q384-L542 HydrophobicContact CB-CD1 4Å; Q384-L542 HydrophobicContact CG-CD1 3.9Å; M537-L542 HydrophobicContact CB-CB 4.34Å; M537-L542 HydrophobicContact CB-CD1 4.2Å; M537-L542 HydrophobicContact CE-CD1 4.22Å; M537-L542 HydrophobicContact CG-CD1 4.46Å; M537-L542 VanDerWaalsContact O-CB 3.27Å; M537-L542 WeakPolarHBondContact O-CB 3.31Å; M537-L542 WeakPolarHBondContact O-CG 3.29Å; M537-L542 PolarHBondContact O-N 3.45Å; S540-L542 VanDerWaalsContact C-N 3.32Å; L542-I565 HydrophobicContact CD2-CB 3.73Å; L542-I565 HydrophobicContact CD2-CD1 4.06Å; L542-I565 HydrophobicContact CD2-CG1 4.41Å; L542-I565 HydrophobicContact CD2-CG2 4.01Å
543	R	88.4	Confident	89.6	Confident	108 Å²	108	42 Å²	42	41%	0.408	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119.4	163.8	-176.4	177.2	-178.7	164.4	0.5	108.8	H213 I564	H213-R543 PolarHBondContact CE1-NH1 2.99Å; H213-R543 PolarHBondContact NE2-NH1 3.11Å; R543-I564 WeakPolarHBondContact CB-O 3.45Å; R543-I564 PolarHBondContact N-O 2.96Å; R543-I564 PolarHBondContact O-N 2.98Å
544	V	91.9	Very high	89.2	Confident	26 Å²	26	43.1 Å²	43.1	16%	0.158	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.8	-174.7	-170.4	0	0	0	0	111.3	I534 M537 L561 V562	I534-V544 HydrophobicContact CG1-CG1 4.17Å; M537-V544 HydrophobicContact CB-CG2 3.55Å; M537-V544 HydrophobicContact SD-CG1 4.34Å; M537-V544 HydrophobicContact SD-CG2 4.32Å; V544-L561 HydrophobicContact CG1-CB 3.86Å; V544-L561 HydrophobicContact CG1-CD1 4.36Å; V544-L561 HydrophobicContact CG1-CD2 4Å; V544-L561 HydrophobicContact CG1-CG 4.29Å; V544-V562 CarbonylContact C-O 3.52Å; V544-V562 WeakPolarHBondContact CA-O 3.39Å
545	L	94.6	Very high	89.1	Confident	23 Å²	23	43.5 Å²	43.5	12%	0.12	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.5	169.4	-70	-177.1	0	0	0	110.6	T446 L450 F547 L561 V562 I564	T446-L545 HydrophobicContact CG2-CD1 3.68Å; T446-L545 HydrophobicContact CG2-CG 4.47Å; L450-L545 HydrophobicContact CD1-CD1 4.29Å; L545-F547 HydrophobicContact CB-CE2 3.7Å; L545-F547 HydrophobicContact CB-CZ 4.01Å; L545-F547 HydrophobicContact CD1-CZ 4.39Å; L545-F547 WeakPolarHBondContact O-CE2 3.46Å; L545-L561 CarbonylContact O-C 3.52Å; L545-L561 WeakPolarHBondContact O-CA 3.36Å; L545-V562 PolarHBondContact N-O 3.48Å; L545-V562 PolarHBondContact O-N 3.28Å; L545-I564 HydrophobicContact CD1-CD1 3.73Å; L545-I564 HydrophobicContact CG-CD1 4.26Å
546	A	96.3	Very high	89.3	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	144.8	175.3	0	0	0	0	0	111.4	K500 G501 Y503 V506 F558 L561	K500-A546 CarbonylContact C-O 3.55Å; K500-A546 VanDerWaalsContact CA-O 3.27Å; K500-A546 WeakPolarHBondContact CA-O 3.39Å; G501-A546 PolarHBondContact N-O 2.9Å; G501-A546 PolarHBondContact O-N 3.09Å; Y503-A546 HydrophobicContact CD2-CB 4.3Å; V506-A546 HydrophobicContact CB-CB 3.97Å; V506-A546 HydrophobicContact CG1-CB 4.14Å; V506-A546 HydrophobicContact CG2-CB 4.17Å; A546-F558 HydrophobicContact CB-CE2 4.05Å; A546-L561 HydrophobicContact CB-CD2 3.88Å
547	F	96.5	Very high	89.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	138.4	-177.4	-63	-95.9	0	0	0	111.1	V424 V427 L450 M499 K500 L545 L559 G560 V562	V424-F547 HydrophobicContact CG1-CB 4.36Å; V424-F547 HydrophobicContact CG1-CD2 3.97Å; V424-F547 HydrophobicContact CG1-CG 4.1Å; V427-F547 HydrophobicContact CB-CB 4.45Å; V427-F547 HydrophobicContact CB-CD1 3.96Å; V427-F547 HydrophobicContact CG1-CB 4.3Å; V427-F547 HydrophobicContact CG1-CD1 3.75Å; L450-F547 HydrophobicContact CD1-CE1 3.95Å; L450-F547 HydrophobicContact CD1-CZ 3.81Å; L450-F547 HydrophobicContact CD2-CE1 4.41Å; L450-F547 HydrophobicContact CD2-CZ 3.73Å; L450-F547 HydrophobicContact CG-CZ 4.44Å; M499-F547 WeakPolarHBondContact O-CA 3.01Å; K500-F547 HydrophobicContact CB-CD1 3.81Å; K500-F547 HydrophobicContact CB-CE1 3.71Å; K500-F547 HydrophobicContact CB-CZ 4.41Å; K500-F547 HydrophobicContact CD-CE1 4.37Å; L545-F547 HydrophobicContact CB-CE2 3.7Å; L545-F547 HydrophobicContact CB-CZ 4.01Å; L545-F547 HydrophobicContact CD1-CZ 4.39Å; L545-F547 WeakPolarHBondContact O-CE2 3.46Å; F547-L559 PolarHBondContact O-N 3.33Å; F547-G560 PolarHBondContact N-O 3.12Å; F547-V562 HydrophobicContact CD2-CB 4.45Å; F547-V562 HydrophobicContact CD2-CG2 3.83Å; F547-V562 HydrophobicContact CE2-CB 3.6Å; F547-V562 HydrophobicContact CE2-CG2 3.32Å; F547-V562 HydrophobicContact CZ-CB 4.26Å; F547-V562 HydrophobicContact CZ-CG2 3.99Å
548	A	96.1	Very high	89.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	153.9	178	0	0	0	0	0	111.5	M499 V506 C510 L556 T557	M499-A548 HydrophobicContact CB-CB 4.49Å; M499-A548 PolarHBondContact N-O 2.61Å; M499-A548 PolarHBondContact O-N 3.34Å; V506-A548 HydrophobicContact CG1-CB 3.73Å; C510-A548 VanDerWaalsContact SG-CB 3.6Å; A548-L556 HydrophobicContact CB-CB 4.15Å; A548-L556 HydrophobicContact CB-CD1 4.28Å; A548-T557 VanDerWaalsContact CA-O 3.26Å; A548-T557 WeakPolarHBondContact CA-O 3.45Å
549	S	94.9	Very high	90.4	Very high	21 Å²	21	33.3 Å²	33.3	15%	0.147	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	152.4	173.6	66	0	0	0	0	112	Y497 T557	Y497-S549 CarbonylContact O-C 3.55Å; Y497-S549 WeakPolarHBondContact O-CA 3.23Å; S549-T557 PolarHBondContact N-O 3.25Å; S549-T557 WeakPolarHBondContact O-CA 3.43Å; S549-T557 WeakPolarHBondContact O-CB 3.36Å; S549-T557 PolarHBondContact O-N 3.32Å
550	G	92.2	Very high	91	Very high	13 Å²	13	28.4 Å²	28.4	13%	0.134	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179	175.3	177.8	0	0	0	0	0	113.3	V496 Y497	V496-G550 CarbonylContact C-O 3.48Å; Y497-G550 PolarHBondContact N-O 3.25Å; Y497-G550 PolarHBondContact O-N 3.44Å
551	S	86.5	Confident	91.6	Very high	68 Å²	68	27.1 Å²	27.1	48%	0.476	16%	0.157	S	C	.	.	S	Bend	trans	-84.6	-24.4	-178.9	49.9	0	0	0	0	113.7	Y497	Y497-S551 WeakPolarHBondContact CD2-O 3.46Å
552	Q	87.6	Confident	92.3	Very high	130 Å²	130	27 Å²	27	61%	0.607	16%	0.155	S	C	*	.	S	Bend	trans	-136.8	142.4	-177.7	-67	-179.4	-1.8	0	0	111	G554 S555 L556	Q552-G554 PolarHBondContact O-N 3.2Å; Q552-S555 PolarHBondContact O-N 2.93Å; Q552-L556 VanDerWaalsContact O-CD2 3.32Å; Q552-L556 WeakPolarHBondContact O-CD2 3.47Å
553	M	83.3	Confident	92.5	Very high	66 Å²	66	26.6 Å²	26.6	33%	0.325	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	126.1	175.3	-161.7	65.8	156.6	0	0	109.9	W480 A482 M499 F509 L556	W480-M553 HydrophobicContact CE3-CE 4.29Å; W480-M553 HydrophobicContact CH2-CE 3.37Å; W480-M553 HydrophobicContact CZ2-CE 4.05Å; W480-M553 HydrophobicContact CZ3-CE 3.51Å; A482-M553 HydrophobicContact CB-CE 4.4Å; M499-M553 HydrophobicContact CE-CE 3.13Å; M499-M553 HydrophobicContact CE-SD 3.68Å; F509-M553 HydrophobicContact CD1-CE 4.45Å; F509-M553 HydrophobicContact CD1-CG 4.36Å; F509-M553 HydrophobicContact CE1-CE 4.35Å; M553-L556 HydrophobicContact SD-CD1 4.32Å
554	G	83.3	Confident	92.7	Very high	43 Å²	43	21.4 Å²	21.4	44%	0.443	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	-10.5	-176.6	0	0	0	0	0	115.5	F509 Q552	F509-G554 CarbonylContact O-C 3.58Å; F509-G554 VanDerWaalsContact O-C 3.23Å; Q552-G554 PolarHBondContact O-N 3.2Å
555	S	89.3	Confident	92.5	Very high	47 Å²	47	20.5 Å²	20.5	33%	0.329	13%	0.128	S	C	.	.	S	Bend	trans	-127.8	46.8	171.2	69.9	0	0	0	0	110.9	F509 S511 Q552	F509-S555 PolarHBondContact O-N 2.99Å; S511-S555 WeakPolarHBondContact OG-CA 3.49Å; Q552-S555 PolarHBondContact O-N 2.93Å
556	L	94	Very high	92.2	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	159.8	-179.7	-57	178	0	0	0	111.1	M499 F509 C510 S511 C512 A548 Q552 M553	M499-L556 HydrophobicContact CB-CD1 4.04Å; M499-L556 HydrophobicContact CE-CD1 4.09Å; M499-L556 HydrophobicContact SD-CD1 3.84Å; F509-L556 HydrophobicContact CB-CD1 3.92Å; F509-L556 HydrophobicContact CB-CG 4.41Å; F509-L556 WeakPolarHBondContact O-CB 3.23Å; F509-L556 PolarHBondContact O-N 3.41Å; C510-L556 CarbonylContact C-O 3.57Å; C510-L556 WeakPolarHBondContact CA-O 3.32Å; S511-L556 PolarHBondContact N-O 3.1Å; C512-L556 PolarHBondContact N-O 2.88Å; A548-L556 HydrophobicContact CB-CB 4.15Å; A548-L556 HydrophobicContact CB-CD1 4.28Å; Q552-L556 VanDerWaalsContact O-CD2 3.32Å; Q552-L556 WeakPolarHBondContact O-CD2 3.47Å; M553-L556 HydrophobicContact SD-CD1 4.32Å
557	T	94.7	Very high	91.8	Very high	8 Å²	8	20.5 Å²	20.5	5%	0.049	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.6	171.1	-59.7	0	0	0	0	108.9	C512 N514 N519 A548 S549	C512-T557 HydrophobicContact CB-CG2 4.33Å; C512-T557 CarbonylContact O-C 3.56Å; C512-T557 VanDerWaalsContact O-CA 3.31Å; C512-T557 WeakPolarHBondContact O-CA 3.24Å; N514-T557 HydrophobicContact CB-CG2 3.9Å; N519-T557 PolarHBondContact ND2-OG1 3.15Å; A548-T557 VanDerWaalsContact CA-O 3.26Å; A548-T557 WeakPolarHBondContact CA-O 3.45Å; S549-T557 PolarHBondContact N-O 3.25Å; S549-T557 WeakPolarHBondContact O-CA 3.43Å; S549-T557 WeakPolarHBondContact O-CB 3.36Å; S549-T557 PolarHBondContact O-N 3.32Å
558	F	96.2	Very high	91.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	131.6	172.1	-175.9	-104.9	0	0	0	110.6	S388 Y503 I507 C510 C512 Y513 N514 L522 Y530 A546 L561	S388-F558 PolarHBondContact OG-O 2.91Å; Y503-F558 HydrophobicContact CD2-CE2 4.14Å; Y503-F558 HydrophobicContact CD2-CZ 4.36Å; Y503-F558 HydrophobicContact CE2-CE2 4.23Å; Y503-F558 HydrophobicContact CE2-CZ 4.27Å; I507-F558 HydrophobicContact CD1-CB 4.44Å; I507-F558 HydrophobicContact CD1-CD2 3.97Å; I507-F558 HydrophobicContact CD1-CE2 4.43Å; I507-F558 HydrophobicContact CD1-CG 4.17Å; C510-F558 HydrophobicContact CB-CB 4.2Å; C512-F558 PolarHBondContact O-N 3.32Å; Y513-F558 CarbonylContact C-O 3.47Å; Y513-F558 WeakPolarHBondContact CA-O 3.48Å; N514-F558 PolarHBondContact N-O 3.04Å; L522-F558 HydrophobicContact CD1-CB 4.49Å; Y530-F558 HydrophobicContact CD1-CE1 4.14Å; Y530-F558 AromaticContact CD2-CD1 3.91Å; Y530-F558 HydrophobicContact CD2-CD1 3.91Å; Y530-F558 AromaticContact CD2-CE1 3.6Å; Y530-F558 HydrophobicContact CD2-CE1 3.6Å; Y530-F558 HydrophobicContact CD2-CZ 4.24Å; Y530-F558 HydrophobicContact CE1-CE1 4.1Å; Y530-F558 AromaticContact CE2-CD1 3.46Å; Y530-F558 HydrophobicContact CE2-CD1 3.46Å; Y530-F558 VanDerWaalsContact CE2-CD1 3.46Å; Y530-F558 AromaticContact CE2-CE1 3.55Å; Y530-F558 HydrophobicContact CE2-CE1 3.55Å; Y530-F558 HydrophobicContact CE2-CG 4.44Å; Y530-F558 AromaticContact CG-CE1 3.91Å; Y530-F558 HydrophobicContact CG-CE1 3.91Å; Y530-F558 HydrophobicContact CG-CZ 4.41Å; Y530-F558 AromaticContact CZ-CD1 3.84Å; Y530-F558 AromaticContact CZ-CE1 3.82Å; A546-F558 HydrophobicContact CB-CE2 4.05Å; F558-L561 HydrophobicContact CE2-CD2 4.27Å; F558-L561 HydrophobicContact CZ-CD2 3.79Å; F558-L561 HydrophobicContact CZ-CG 4Å
559	L	95.3	Very high	90.8	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-35.6	-174.4	-61.8	176.4	0	0	0	113.3	S388 K423 V424 V427 N514 F547	S388-L559 WeakPolarHBondContact CB-O 3.41Å; S388-L559 PolarHBondContact N-O 2.87Å; S388-L559 PolarHBondContact OG-O 2.92Å; S388-L559 VanDerWaalsContact OG-O 3.11Å; K423-L559 HydrophobicContact CB-CD1 4.31Å; K423-L559 HydrophobicContact CB-CD2 4.36Å; K423-L559 HydrophobicContact CD-CD2 4.21Å; V424-L559 HydrophobicContact CG2-CB 3.92Å; V424-L559 WeakPolarHBondContact CG2-O 3.02Å; V427-L559 HydrophobicContact CG2-CD1 3.28Å; N514-L559 HydrophobicContact CB-CD2 3.78Å; F547-L559 PolarHBondContact O-N 3.33Å
560	G	95.2	Very high	90.3	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.9	-175.2	-177	0	0	0	0	0	114.6	F386 F547	F386-G560 CarbonylContact O-C 3.57Å; F386-G560 WeakPolarHBondContact O-CA 3.23Å; F547-G560 PolarHBondContact N-O 3.12Å
561	L	96.3	Very high	90	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.9	-179.5	-57	171	0	0	0	109.5	F386 Y503 Q533 I534 M537 V544 L545 A546 F558	F386-L561 HydrophobicContact CB-CB 4.31Å; F386-L561 HydrophobicContact CD1-CB 4.46Å; F386-L561 HydrophobicContact CD1-CD1 4Å; F386-L561 HydrophobicContact CD1-CG 4.32Å; F386-L561 PolarHBondContact N-O 2.81Å; F386-L561 PolarHBondContact O-N 3.22Å; Y503-L561 HydrophobicContact CD2-CD2 4.09Å; Q533-L561 HydrophobicContact CB-CD1 4.42Å; Q533-L561 HydrophobicContact CG-CD1 4.25Å; I534-L561 HydrophobicContact CD1-CD1 4.26Å; I534-L561 HydrophobicContact CD1-CD2 4.27Å; I534-L561 HydrophobicContact CG1-CD1 3.63Å; I534-L561 HydrophobicContact CG1-CD2 4.23Å; M537-L561 HydrophobicContact SD-CB 4.37Å; V544-L561 HydrophobicContact CG1-CB 3.86Å; V544-L561 HydrophobicContact CG1-CD1 4.36Å; V544-L561 HydrophobicContact CG1-CD2 4Å; V544-L561 HydrophobicContact CG1-CG 4.29Å; L545-L561 CarbonylContact O-C 3.52Å; L545-L561 WeakPolarHBondContact O-CA 3.36Å; A546-L561 HydrophobicContact CB-CD2 3.88Å; F558-L561 HydrophobicContact CE2-CD2 4.27Å; F558-L561 HydrophobicContact CZ-CD2 3.79Å; F558-L561 HydrophobicContact CZ-CG 4Å
562	V	96.4	Very high	90.2	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.5	172.5	-179.4	0	0	0	0	109	V382 V385 V424 L450 V544 L545 F547 I564	V382-V562 HydrophobicContact CB-CG1 4.18Å; V382-V562 HydrophobicContact CG1-CG1 3.36Å; V382-V562 HydrophobicContact CG2-CG1 3.75Å; V385-V562 HydrophobicContact CG1-CG2 4.41Å; V385-V562 HydrophobicContact CG2-CG1 4.48Å; V385-V562 HydrophobicContact CG2-CG2 4.35Å; V424-V562 HydrophobicContact CG1-CG2 3.6Å; L450-V562 HydrophobicContact CD2-CB 4.48Å; L450-V562 HydrophobicContact CD2-CG1 4.06Å; V544-V562 CarbonylContact C-O 3.52Å; V544-V562 WeakPolarHBondContact CA-O 3.39Å; L545-V562 PolarHBondContact N-O 3.48Å; L545-V562 PolarHBondContact O-N 3.28Å; F547-V562 HydrophobicContact CD2-CB 4.45Å; F547-V562 HydrophobicContact CD2-CG2 3.83Å; F547-V562 HydrophobicContact CE2-CB 3.6Å; F547-V562 HydrophobicContact CE2-CG2 3.32Å; F547-V562 HydrophobicContact CZ-CB 4.26Å; F547-V562 HydrophobicContact CZ-CG2 3.99Å; V562-I564 HydrophobicContact CG1-CG1 4.16Å
563	G	93.9	Very high	90.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.3	176.3	0	0	0	0	0	110.9	T383 Q384 M537	T383-G563 PolarHBondContact N-O 2.94Å; Q384-G563 PolarHBondContact N-O 3.13Å; Q384-G563 PolarHBondContact O-N 3.46Å; M537-G563 VanDerWaalsContact CE-N 3.25Å
564	I	92	Very high	90.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.7	-177.1	-43.7	-178.4	0	0	0	108.3	M380 T381 V382 T446 A449 L450 R543 L545 V562	M380-I564 HydrophobicContact CB-CG2 4.01Å; M380-I564 HydrophobicContact CE-CB 4.28Å; M380-I564 HydrophobicContact CE-CG2 3.75Å; T381-I564 WeakPolarHBondContact O-CA 3.4Å; T381-I564 WeakPolarHBondContact O-CG2 3.22Å; V382-I564 HydrophobicContact CG2-CG1 4.17Å; T446-I564 HydrophobicContact CG2-CD1 3.64Å; A449-I564 HydrophobicContact CB-CD1 4.5Å; A449-I564 HydrophobicContact CB-CG2 3.84Å; L450-I564 HydrophobicContact CD2-CD1 4.2Å; R543-I564 WeakPolarHBondContact CB-O 3.45Å; R543-I564 PolarHBondContact N-O 2.96Å; R543-I564 PolarHBondContact O-N 2.98Å; L545-I564 HydrophobicContact CD1-CD1 3.73Å; L545-I564 HydrophobicContact CG-CD1 4.26Å; V562-I564 HydrophobicContact CG1-CG1 4.16Å
565	I	88.8	Confident	91.1	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	157.7	177.9	-166	169.9	0	0	0	109.7	T381 T383 L542 P567 I600	T381-I565 PolarHBondContact N-O 3.3Å; T381-I565 PolarHBondContact O-N 3.37Å; T383-I565 HydrophobicContact CG2-CG2 3.53Å; L542-I565 HydrophobicContact CD2-CB 3.73Å; L542-I565 HydrophobicContact CD2-CD1 4.06Å; L542-I565 HydrophobicContact CD2-CG1 4.41Å; L542-I565 HydrophobicContact CD2-CG2 4.01Å; I565-P567 WeakPolarHBondContact O-CD 3.48Å; I565-I600 HydrophobicContact CD1-CD1 3.67Å; I565-I600 HydrophobicContact CG1-CD1 4.08Å
566	D	87.4	Confident	91.2	Very high	13 Å²	13	26.4 Å²	26.4	7%	0.07	13%	0.131	C	C	.	.			trans	-87	103.4	162.5	178.7	20	0	0	0	108.4	K371 T376 N378 E379 M380	K371-D566 IonicContact NZ-OD2 3.2Å; T376-D566 VanDerWaalsContact CB-CG 3.4Å; T376-D566 WeakPolarHBondContact CB-OD1 3.49Å; T376-D566 WeakPolarHBondContact CB-OD2 3.42Å; T376-D566 VanDerWaalsContact OG1-CG 3.26Å; T376-D566 PolarHBondContact OG1-OD1 3.43Å; T376-D566 PolarHBondContact OG1-OD2 3.11Å; N378-D566 WeakPolarHBondContact CA-OD1 3.11Å; N378-D566 PolarHBondContact N-OD1 3.18Å; E379-D566 PolarHBondContact N-OD1 3.15Å; M380-D566 HydrophobicContact SD-CB 4.05Å
567	P	87.3	Confident	91.1	Very high	10 Å²	10	28.5 Å²	28.5	7%	0.065	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-75.7	149.7	-170.2	30	-31	0	0	0	111.9	T376 K377 E379 V398 I565	T376-P567 VanDerWaalsContact CA-O 3.3Å; T376-P567 WeakPolarHBondContact CA-O 3.19Å; T376-P567 WeakPolarHBondContact CB-O 3.4Å; K377-P567 PolarHBondContact N-O 2.95Å; K377-P567 VanDerWaalsContact N-O 3.09Å; E379-P567 WeakPolarHBondContact O-CD 3.36Å; V398-P567 HydrophobicContact CB-CG 4.46Å; V398-P567 HydrophobicContact CG1-CB 4.3Å; V398-P567 HydrophobicContact CG1-CG 3.42Å; V398-P567 VanDerWaalsContact CG1-CG 3.42Å; V398-P567 HydrophobicContact CG2-CB 4.36Å; V398-P567 HydrophobicContact CG2-CG 4.25Å; I565-P567 WeakPolarHBondContact O-CD 3.48Å
568	P	87.4	Confident	90.9	Very high	37 Å²	37	30.8 Å²	30.8	24%	0.24	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-62.5	148.9	172.3	28.2	-34.1	0	0	0	110.8	L375 L604	L375-P568 WeakPolarHBondContact O-CA 3.33Å; P568-L604 HydrophobicContact CB-CD2 3.63Å; P568-L604 HydrophobicContact CB-CG 4.34Å; P568-L604 HydrophobicContact CG-CD2 4.47Å
569	R	85.3	Confident	90.6	Very high	41 Å²	41	30.8 Å²	30.8	16%	0.155	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-64.3	149.4	172.3	-72.4	169.9	-174.3	-91.6	-1.7	110.4	G373 T374 L375 T376 K377 V572 D700	G373-R569 PolarHBondContact O-NE 3.03Å; G373-R569 PolarHBondContact O-NH2 3.45Å; T374-R569 WeakPolarHBondContact O-CD 3.43Å; T374-R569 PolarHBondContact O-NE 2.93Å; L375-R569 PolarHBondContact O-N 2.6Å; T376-R569 PolarHBondContact O-NE 3.44Å; K377-R569 HydrophobicContact CB-CG 4.45Å; K377-R569 HydrophobicContact CG-CB 4.4Å; K377-R569 HydrophobicContact CG-CG 3.55Å; R569-V572 HydrophobicContact CB-CG2 3.48Å; R569-V572 VanDerWaalsContact CB-CG2 3.48Å; R569-D700 WeakPolarHBondContact CD-O 3.2Å; R569-D700 PolarHBondContact NE-O 3.06Å; R569-D700 PolarHBondContact NH1-O 3.29Å
570	E	84.4	Confident	90.4	Very high	143 Å²	143	33.9 Å²	33.9	67%	0.668	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	143.9	175	-75.5	160	-124.8	0	0	110.1	K377 V572	K377-E570 IonicContact NZ-OE1 3.1Å; K377-E570 PolarHBondContact NZ-OE1 2.8Å; E570-V572 PolarHBondContact O-N 3.42Å
571	G	85.3	Confident	90.1	Very high	22 Å²	22	40.8 Å²	40.8	23%	0.227	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	-14.3	177.4	0	0	0	0	0	116.6	K573 E574 A575 Q703	G571-K573 VanDerWaalsContact C-N 3.33Å; G571-K573 PolarHBondContact O-N 3.4Å; G571-E574 PolarHBondContact O-N 3.28Å; G571-A575 PolarHBondContact O-N 2.9Å; G571-A575 VanDerWaalsContact O-N 3.09Å; G571-Q703 PolarHBondContact O-NE2 3.03Å
572	V	90.6	Very high	89.7	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-41.4	178.5	176.3	0	0	0	0	111.9	L375 R569 E570 E574 A575 I576 L604 F702	L375-V572 HydrophobicContact CD2-CG1 3.83Å; R569-V572 HydrophobicContact CB-CG2 3.48Å; R569-V572 VanDerWaalsContact CB-CG2 3.48Å; E570-V572 PolarHBondContact O-N 3.42Å; V572-E574 VanDerWaalsContact C-N 3.3Å; V572-E574 PolarHBondContact O-N 2.87Å; V572-A575 PolarHBondContact O-N 3.37Å; V572-I576 HydrophobicContact CG1-CD1 3.65Å; V572-I576 HydrophobicContact CG1-CG1 4.19Å; V572-I576 WeakPolarHBondContact O-CB 3.46Å; V572-I576 VanDerWaalsContact O-CG1 3.31Å; V572-I576 WeakPolarHBondContact O-CG1 3.49Å; V572-I576 PolarHBondContact O-N 3.23Å; V572-L604 HydrophobicContact CB-CD2 4.28Å; V572-L604 HydrophobicContact CG1-CD2 3.88Å; V572-F702 HydrophobicContact CG1-CB 4.38Å; V572-F702 HydrophobicContact CG1-CD1 4.32Å; V572-F702 HydrophobicContact CG1-CG 4.36Å; V572-F702 HydrophobicContact CG2-CB 3.9Å
573	K	90.6	Very high	89.4	Confident	130 Å²	130	43.4 Å²	43.4	57%	0.565	24%	0.242	S	C	*	.	H	α-helix	trans	-58.7	-41.7	178	-175.6	-179.6	-179.3	177.3	0	112.2	G571 A577	G571-K573 VanDerWaalsContact C-N 3.33Å; G571-K573 PolarHBondContact O-N 3.4Å; K573-A577 WeakPolarHBondContact O-CB 3.41Å; K573-A577 PolarHBondContact O-N 3.19Å
574	E	90.8	Very high	89.3	Confident	136 Å²	136	43.5 Å²	43.5	64%	0.636	24%	0.242	S	C	*	.	H	α-helix	trans	-70.8	-39.7	179.7	-62.7	178.3	178.9	0	0	111.6	G571 V572 A577 T578	G571-E574 PolarHBondContact O-N 3.28Å; V572-E574 VanDerWaalsContact C-N 3.3Å; V572-E574 PolarHBondContact O-N 2.87Å; E574-A577 PolarHBondContact O-N 3.13Å; E574-T578 WeakPolarHBondContact O-CB 3.33Å; E574-T578 PolarHBondContact O-N 2.89Å; E574-T578 PolarHBondContact O-OG1 3.49Å
575	A	90.9	Very high	89.3	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-45.8	174.5	0	0	0	0	0	111.7	G571 V572 A577 T578 L579 F702 Q703 M706	G571-A575 PolarHBondContact O-N 2.9Å; G571-A575 VanDerWaalsContact O-N 3.09Å; V572-A575 PolarHBondContact O-N 3.37Å; A575-A577 PolarHBondContact O-N 3.09Å; A575-T578 PolarHBondContact O-N 3.03Å; A575-L579 WeakPolarHBondContact O-CB 3.39Å; A575-L579 VanDerWaalsContact O-CG 3.32Å; A575-L579 WeakPolarHBondContact O-CG 3.48Å; A575-L579 PolarHBondContact O-N 3.13Å; A575-F702 HydrophobicContact CB-CD1 3.95Å; A575-F702 HydrophobicContact CB-CE1 4.39Å; A575-Q703 HydrophobicContact CB-CG 4.24Å; A575-M706 HydrophobicContact CB-SD 4.37Å
576	I	92.3	Very high	89.5	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-49.8	174.6	-74.5	172.2	0	0	0	110.5	L375 V572 T578 L579 L580 I586 L604 L606 F702	L375-I576 HydrophobicContact CD2-CD1 4.38Å; V572-I576 HydrophobicContact CG1-CD1 3.65Å; V572-I576 HydrophobicContact CG1-CG1 4.19Å; V572-I576 WeakPolarHBondContact O-CB 3.46Å; V572-I576 VanDerWaalsContact O-CG1 3.31Å; V572-I576 WeakPolarHBondContact O-CG1 3.49Å; V572-I576 PolarHBondContact O-N 3.23Å; I576-T578 VanDerWaalsContact C-N 3.3Å; I576-T578 PolarHBondContact O-N 2.75Å; I576-L579 PolarHBondContact O-N 2.96Å; I576-L580 HydrophobicContact CG2-CD1 3.68Å; I576-L580 HydrophobicContact CG2-CG 4.27Å; I576-L580 WeakPolarHBondContact O-CB 3.36Å; I576-L580 VanDerWaalsContact O-CG 3.29Å; I576-L580 WeakPolarHBondContact O-CG 3.47Å; I576-L580 PolarHBondContact O-N 3.46Å; I576-I586 HydrophobicContact CB-CD1 4.1Å; I576-I586 HydrophobicContact CG1-CD1 3.83Å; I576-I586 HydrophobicContact CG2-CD1 4.08Å; I576-L604 HydrophobicContact CD1-CB 3.91Å; I576-L604 HydrophobicContact CD1-CD1 4.2Å; I576-L604 HydrophobicContact CD1-CD2 4.23Å; I576-L604 HydrophobicContact CD1-CG 4.34Å; I576-L606 HydrophobicContact CD1-CD1 3.99Å; I576-L606 HydrophobicContact CD1-CD2 4.17Å; I576-L606 HydrophobicContact CD1-CG 4.06Å; I576-L606 HydrophobicContact CG1-CD2 4.47Å; I576-L606 HydrophobicContact CG2-CD2 3.53Å; I576-L606 HydrophobicContact CG2-CG 4.11Å; I576-F702 HydrophobicContact CG1-CE1 3.99Å
577	A	91.4	Very high	89.8	Confident	44 Å²	44	45.4 Å²	45.4	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-59.7	-41.6	179.1	0	0	0	0	0	112	K573 E574 A575 N581	K573-A577 WeakPolarHBondContact O-CB 3.41Å; K573-A577 PolarHBondContact O-N 3.19Å; E574-A577 PolarHBondContact O-N 3.13Å; A575-A577 PolarHBondContact O-N 3.09Å; A577-N581 VanDerWaalsContact O-CB 3.32Å; A577-N581 WeakPolarHBondContact O-CB 3.34Å; A577-N581 PolarHBondContact O-N 3.26Å; A577-N581 PolarHBondContact O-ND2 3.36Å; A577-N581 VanDerWaalsContact O-ND2 3.14Å
578	T	90.5	Very high	90.1	Very high	56 Å²	56	44.9 Å²	44.9	34%	0.344	26%	0.255	S	S	.	.	H	α-helix	trans	-65.8	-42.9	178.2	-57	0	0	0	0	111.9	E574 A575 I576 N581 S582 M706 I779	E574-T578 WeakPolarHBondContact O-CB 3.33Å; E574-T578 PolarHBondContact O-N 2.89Å; E574-T578 PolarHBondContact O-OG1 3.49Å; A575-T578 PolarHBondContact O-N 3.03Å; I576-T578 VanDerWaalsContact C-N 3.3Å; I576-T578 PolarHBondContact O-N 2.75Å; T578-N581 PolarHBondContact O-N 2.92Å; T578-S582 PolarHBondContact O-N 3.27Å; T578-M706 HydrophobicContact CG2-SD 3.88Å; T578-I779 HydrophobicContact CG2-CG1 4.35Å
579	L	90.9	Very high	90.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.2	-43.5	178.6	-73.4	168.5	0	0	0	112	I367 A575 I576 N581 S582 G583 V584 I586 F702 M706 I709	I367-L579 HydrophobicContact CD1-CD1 3.95Å; A575-L579 WeakPolarHBondContact O-CB 3.39Å; A575-L579 VanDerWaalsContact O-CG 3.32Å; A575-L579 WeakPolarHBondContact O-CG 3.48Å; A575-L579 PolarHBondContact O-N 3.13Å; I576-L579 PolarHBondContact O-N 2.96Å; L579-N581 PolarHBondContact O-N 3.01Å; L579-S582 CarbonylContact O-C 3.58Å; L579-S582 WeakPolarHBondContact O-CA 3.25Å; L579-S582 PolarHBondContact O-N 3.42Å; L579-S582 VanDerWaalsContact O-N 3.1Å; L579-S582 PolarHBondContact O-OG 3.01Å; L579-G583 PolarHBondContact O-N 3.43Å; L579-V584 HydrophobicContact CB-CB 4.28Å; L579-V584 HydrophobicContact CD2-CG2 4.35Å; L579-V584 PolarHBondContact O-N 3Å; L579-I586 HydrophobicContact CB-CD1 3.99Å; L579-I586 HydrophobicContact CD1-CD1 4.11Å; L579-F702 HydrophobicContact CD1-CE1 3.76Å; L579-F702 HydrophobicContact CD1-CZ 4.26Å; L579-M706 HydrophobicContact CD1-CB 4.48Å; L579-M706 HydrophobicContact CD2-CG 4.36Å; L579-M706 HydrophobicContact CG-CG 4.47Å; L579-I709 HydrophobicContact CD2-CD1 3.91Å
580	L	90.6	Very high	90.4	Very high	70 Å²	70	41.2 Å²	41.2	37%	0.366	24%	0.236	S	C	.	.	H	α-helix	trans	-60.4	-45	174.3	-71.3	171.8	0	0	0	111.5	I576 S582 G583	I576-L580 HydrophobicContact CG2-CD1 3.68Å; I576-L580 HydrophobicContact CG2-CG 4.27Å; I576-L580 WeakPolarHBondContact O-CB 3.36Å; I576-L580 VanDerWaalsContact O-CG 3.29Å; I576-L580 WeakPolarHBondContact O-CG 3.47Å; I576-L580 PolarHBondContact O-N 3.46Å; L580-S582 PolarHBondContact O-N 3.12Å; L580-G583 PolarHBondContact O-N 2.83Å
581	N	89.9	Confident	90.3	Very high	144 Å²	144	36.9 Å²	36.9	77%	0.77	23%	0.229	S	C	*	.	H	α-helix	trans	-63.8	-28.5	175.5	-74.2	-24.9	0	0	0	112.8	A577 T578 L579 G583	A577-N581 VanDerWaalsContact O-CB 3.32Å; A577-N581 WeakPolarHBondContact O-CB 3.34Å; A577-N581 PolarHBondContact O-N 3.26Å; A577-N581 PolarHBondContact O-ND2 3.36Å; A577-N581 VanDerWaalsContact O-ND2 3.14Å; T578-N581 PolarHBondContact O-N 2.92Å; L579-N581 PolarHBondContact O-N 3.01Å; N581-G583 VanDerWaalsContact C-N 3.26Å
582	S	87.8	Confident	90.1	Very high	6 Å²	6	37.9 Å²	37.9	4%	0.042	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-6.4	172.2	81.2	0	0	0	0	113.1	T578 L579 L580 I779 P782 P783	T578-S582 PolarHBondContact O-N 3.27Å; L579-S582 CarbonylContact O-C 3.58Å; L579-S582 WeakPolarHBondContact O-CA 3.25Å; L579-S582 PolarHBondContact O-N 3.42Å; L579-S582 VanDerWaalsContact O-N 3.1Å; L579-S582 PolarHBondContact O-OG 3.01Å; L580-S582 PolarHBondContact O-N 3.12Å; S582-I779 VanDerWaalsContact CB-O 3.24Å; S582-I779 WeakPolarHBondContact CB-O 3.41Å; S582-P782 VanDerWaalsContact O-CA 3.22Å; S582-P782 WeakPolarHBondContact O-CA 3.37Å; S582-P783 VanDerWaalsContact O-CD 3.28Å; S582-P783 WeakPolarHBondContact O-CD 3.19Å
583	G	88.9	Confident	89.7	Confident	50 Å²	50	39.6 Å²	39.6	52%	0.515	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	17	-179.3	0	0	0	0	0	115	L579 L580 N581	L579-G583 PolarHBondContact O-N 3.43Å; L580-G583 PolarHBondContact O-N 2.83Å; N581-G583 VanDerWaalsContact C-N 3.26Å
584	V	91.8	Very high	89.5	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.012	23%	0.234	C	C	.	.			trans	-88.9	122	168.6	-179.7	0	0	0	0	108.4	I367 L579 P783	I367-V584 HydrophobicContact CD1-CG1 3.84Å; I367-V584 HydrophobicContact CG1-CG1 3.84Å; L579-V584 HydrophobicContact CB-CB 4.28Å; L579-V584 HydrophobicContact CD2-CG2 4.35Å; L579-V584 PolarHBondContact O-N 3Å; V584-P783 HydrophobicContact CG2-CG 3.54Å
585	A	91.9	Very high	89.2	Confident	40 Å²	40	36.5 Å²	36.5	33%	0.331	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140.5	174.6	0	0	0	0	0	110.5	N365 V366 I367	N365-A585 PolarHBondContact O-N 2.9Å; V366-A585 CarbonylContact C-O 3.59Å; V366-A585 VanDerWaalsContact CA-O 3.28Å; V366-A585 WeakPolarHBondContact CA-O 3.14Å; V366-A585 HydrophobicContact CG2-CB 4.33Å; I367-A585 PolarHBondContact N-O 2.9Å
586	I	93.3	Very high	88.7	Confident	11 Å²	11	38.2 Å²	38.2	6%	0.056	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.7	177.9	-58.2	178	0	0	0	108.4	I367 I576 L579 L606 F702	I367-I586 HydrophobicContact CB-CG1 4.4Å; I367-I586 CarbonylContact O-C 3.48Å; I367-I586 WeakPolarHBondContact O-CA 3.22Å; I576-I586 HydrophobicContact CB-CD1 4.1Å; I576-I586 HydrophobicContact CG1-CD1 3.83Å; I576-I586 HydrophobicContact CG2-CD1 4.08Å; L579-I586 HydrophobicContact CB-CD1 3.99Å; L579-I586 HydrophobicContact CD1-CD1 4.11Å; I586-L606 HydrophobicContact CB-CD2 3.62Å; I586-L606 HydrophobicContact CG2-CD1 4.3Å; I586-L606 HydrophobicContact CG2-CD2 3.58Å; I586-F702 HydrophobicContact CD1-CE1 4.45Å; I586-F702 HydrophobicContact CD1-CZ 4.28Å
587	K	93.6	Very high	88.4	Confident	8 Å²	8	38.2 Å²	38.2	4%	0.035	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120.3	-178.9	-63.7	-178	-176.7	-68.2	0	109	V366 I367 C368 S369 V631 S632 V634 G635 F637 L652	V366-K587 HydrophobicContact CG1-CD 3.95Å; V366-K587 HydrophobicContact CG1-CG 4.26Å; I367-K587 PolarHBondContact O-N 2.83Å; C368-K587 CarbonylContact C-O 3.12Å; C368-K587 WeakPolarHBondContact CA-O 3.33Å; S369-K587 PolarHBondContact N-O 3.43Å; K587-V631 WeakPolarHBondContact CE-O 3.44Å; K587-V631 PolarHBondContact NZ-O 3.12Å; K587-S632 PolarHBondContact NZ-O 3.34Å; K587-S632 VanDerWaalsContact NZ-O 3.16Å; K587-V634 PolarHBondContact NZ-O 3.45Å; K587-G635 WeakPolarHBondContact CA-O 3.4Å; K587-F637 HydrophobicContact CD-CE2 4.44Å; K587-L652 HydrophobicContact CD-CD1 4.06Å; K587-L652 HydrophobicContact CD-CD2 4.26Å
588	M	93.3	Very high	88.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.7	175.5	-176.3	-173	-64.1	0	0	109.4	S369 K371 L375 I600 A601 L604 L606 G635 V636 F637	S369-M588 WeakPolarHBondContact O-CA 3.31Å; K371-M588 HydrophobicContact CB-CG 4.12Å; K371-M588 HydrophobicContact CB-SD 4.17Å; K371-M588 HydrophobicContact CG-SD 4.03Å; L375-M588 HydrophobicContact CD1-CE 3.84Å; L375-M588 HydrophobicContact CD1-CG 4.17Å; M588-I600 HydrophobicContact CE-CB 4.47Å; M588-I600 HydrophobicContact CE-CG2 3.89Å; M588-A601 HydrophobicContact CE-CB 3.84Å; M588-A601 HydrophobicContact SD-CB 4.35Å; M588-L604 HydrophobicContact CE-CD1 3.94Å; M588-L606 HydrophobicContact CB-CD1 4.39Å; M588-L606 HydrophobicContact CE-CD1 3.78Å; M588-G635 PolarHBondContact N-O 3.39Å; M588-V636 HydrophobicContact CB-CG2 4.48Å; M588-V636 CarbonylContact O-C 3.59Å; M588-V636 WeakPolarHBondContact O-CA 3.43Å; M588-V636 HydrophobicContact SD-CG1 4.48Å; M588-F637 PolarHBondContact O-N 2.68Å
589	I	92.3	Very high	88	Confident	0 Å²	0	35 Å²	35	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.7	173.5	-51.2	173.7	0	0	0	107.4	C368 S369 D370 K371 F637 A640 K645 I648 M661	C368-I589 HydrophobicContact CB-CD1 3.9Å; S369-I589 PolarHBondContact O-N 2.95Å; D370-I589 WeakPolarHBondContact CA-O 3.49Å; K371-I589 PolarHBondContact N-O 3.31Å; I589-F637 HydrophobicContact CB-CB 4.47Å; I589-F637 HydrophobicContact CG1-CB 4.33Å; I589-F637 HydrophobicContact CG1-CD2 4.03Å; I589-F637 HydrophobicContact CG2-CB 4.13Å; I589-A640 HydrophobicContact CG2-CB 3.48Å; I589-A640 VanDerWaalsContact CG2-CB 3.48Å; I589-K645 HydrophobicContact CG2-CG 3.79Å; I589-I648 HydrophobicContact CD1-CB 4.46Å; I589-I648 HydrophobicContact CD1-CD1 4.08Å; I589-I648 HydrophobicContact CD1-CG2 4.06Å; I589-I648 HydrophobicContact CG1-CD1 4.44Å; I589-I648 HydrophobicContact CG2-CD1 4.41Å; I589-M661 HydrophobicContact CD1-SD 4.4Å
590	T	87.3	Confident	87.9	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	22%	0.216	C	C	.	.			trans	-145.1	153.1	-177.8	-177.4	0	0	0	0	112.1	D592 A597 F637 Y638 R639 A640	T590-D592 VanDerWaalsContact C-N 3.3Å; T590-D592 HydrophobicContact CG2-CB 4.11Å; T590-D592 PolarHBondContact OG1-N 3.46Å; T590-D592 VanDerWaalsContact OG1-N 3.12Å; T590-D592 PolarHBondContact OG1-OD2 2.92Å; T590-A597 HydrophobicContact CG2-CB 3.58Å; T590-F637 PolarHBondContact N-O 2.95Å; T590-Y638 CarbonylContact O-C 3.42Å; T590-Y638 VanDerWaalsContact O-C 3.31Å; T590-Y638 WeakPolarHBondContact O-CA 3.27Å; T590-R639 PolarHBondContact O-N 3.38Å; T590-A640 PolarHBondContact O-N 3.21Å
591	G	82.4	Confident	87.8	Confident	51 Å²	51	31.8 Å²	31.8	53%	0.526	20%	0.199	S	C	.	.	S	Bend	trans	-78.8	-10.5	168.8	0	0	0	0	0	114
592	D	82	Confident	87.7	Confident	44 Å²	44	28.6 Å²	28.6	24%	0.235	18%	0.182	C	C	.	.	S	Bend	trans	-67.8	170.2	-175.7	-67.7	-28.9	0	0	0	113.9	K371 T590 T596 R639	K371-D592 VanDerWaalsContact CD-OD2 3.24Å; K371-D592 WeakPolarHBondContact CD-OD2 3.42Å; K371-D592 WeakPolarHBondContact CE-OD2 3.34Å; K371-D592 IonicContact NZ-OD1 3.37Å; K371-D592 IonicContact NZ-OD2 2.84Å; K371-D592 PolarHBondContact NZ-OD2 3.41Å; T590-D592 VanDerWaalsContact C-N 3.3Å; T590-D592 HydrophobicContact CG2-CB 4.11Å; T590-D592 PolarHBondContact OG1-N 3.46Å; T590-D592 VanDerWaalsContact OG1-N 3.12Å; T590-D592 PolarHBondContact OG1-OD2 2.92Å; D592-T596 HydrophobicContact CB-CG2 4.31Å; D592-R639 PolarHBondContact O-N 3.22Å
593	S	81.9	Confident	87.7	Confident	35 Å²	35	32.9 Å²	32.9	25%	0.245	20%	0.197	C	C	.	.			trans	-66.6	161	170.4	82.1	0	0	0	0	112.3	E595 T596 A597	S593-E595 VanDerWaalsContact C-N 3.31Å; S593-E595 VanDerWaalsContact CB-OE2 3.26Å; S593-E595 WeakPolarHBondContact CB-OE2 3.41Å; S593-E595 PolarHBondContact O-N 3.48Å; S593-E595 PolarHBondContact OG-OE2 3.46Å; S593-T596 PolarHBondContact O-N 2.9Å; S593-A597 WeakPolarHBondContact O-CB 3.44Å; S593-A597 PolarHBondContact O-N 3.38Å
594	Q	86.3	Confident	87.7	Confident	88 Å²	88	30.7 Å²	30.7	41%	0.411	17%	0.173	S	C	.	.	H	α-helix	trans	-58.2	-42	-179.3	-173.4	-178.6	1.9	0	0	112.2	A597 V598 Y638	Q594-A597 PolarHBondContact O-N 2.85Å; Q594-V598 HydrophobicContact CG-CG2 4.2Å; Q594-V598 WeakPolarHBondContact O-CB 3.39Å; Q594-V598 VanDerWaalsContact O-CG2 3.26Å; Q594-V598 WeakPolarHBondContact O-CG2 3.43Å; Q594-V598 PolarHBondContact O-N 3.19Å; Q594-Y638 HydrophobicContact CB-CD1 4.31Å; Q594-Y638 HydrophobicContact CB-CD2 3.89Å; Q594-Y638 HydrophobicContact CB-CE1 4.27Å; Q594-Y638 HydrophobicContact CB-CE2 3.83Å; Q594-Y638 HydrophobicContact CB-CG 4.13Å; Q594-Y638 HydrophobicContact CG-CD1 4.19Å; Q594-Y638 HydrophobicContact CG-CE1 3.95Å; Q594-Y638 HydrophobicContact CG-CE2 4.36Å
595	E	83.2	Confident	87.5	Confident	113 Å²	113	32.6 Å²	32.6	53%	0.528	19%	0.194	S	C	.	.	H	α-helix	trans	-64.3	-45	-176.2	-53.9	84.9	178.5	0	0	111.5	S593 S599	S593-E595 VanDerWaalsContact C-N 3.31Å; S593-E595 VanDerWaalsContact CB-OE2 3.26Å; S593-E595 WeakPolarHBondContact CB-OE2 3.41Å; S593-E595 PolarHBondContact O-N 3.48Å; S593-E595 PolarHBondContact OG-OE2 3.46Å; E595-S599 VanDerWaalsContact O-CB 3.3Å; E595-S599 WeakPolarHBondContact O-CB 3.29Å; E595-S599 PolarHBondContact O-N 3.31Å
596	T	81.5	Confident	87.1	Confident	39 Å²	39	31.6 Å²	31.6	24%	0.239	18%	0.183	C	C	.	.	H	α-helix	trans	-66	-47	177.5	-58	0	0	0	0	111	D592 S593 V598 S599 I600	D592-T596 HydrophobicContact CB-CG2 4.31Å; S593-T596 PolarHBondContact O-N 2.9Å; T596-V598 PolarHBondContact O-N 2.97Å; T596-S599 PolarHBondContact O-N 3.33Å; T596-I600 WeakPolarHBondContact O-CG1 3.34Å; T596-I600 PolarHBondContact O-N 3.07Å
597	A	85.6	Confident	86.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.2	-47.2	-179.6	0	0	0	0	0	111.8	T590 S593 Q594 A601 V636	T590-A597 HydrophobicContact CG2-CB 3.58Å; S593-A597 WeakPolarHBondContact O-CB 3.44Å; S593-A597 PolarHBondContact O-N 3.38Å; Q594-A597 PolarHBondContact O-N 2.85Å; A597-A601 VanDerWaalsContact O-CB 3.22Å; A597-A601 WeakPolarHBondContact O-CB 3.3Å; A597-A601 PolarHBondContact O-N 3.01Å; A597-V636 HydrophobicContact CB-CG1 3.77Å
598	V	87.9	Confident	85.4	Confident	23 Å²	23	36.6 Å²	36.6	14%	0.139	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-38.6	178.9	171.5	0	0	0	0	111.6	Q594 T596 A601 N602 Y607	Q594-V598 HydrophobicContact CG-CG2 4.2Å; Q594-V598 WeakPolarHBondContact O-CB 3.39Å; Q594-V598 VanDerWaalsContact O-CG2 3.26Å; Q594-V598 WeakPolarHBondContact O-CG2 3.43Å; Q594-V598 PolarHBondContact O-N 3.19Å; T596-V598 PolarHBondContact O-N 2.97Å; V598-A601 PolarHBondContact O-N 3.48Å; V598-N602 WeakPolarHBondContact CG1-ND2 3.43Å; V598-N602 WeakPolarHBondContact O-CB 3.32Å; V598-N602 PolarHBondContact O-N 3.04Å; V598-N602 PolarHBondContact O-ND2 3.3Å; V598-Y607 HydrophobicContact CG1-CD1 3.88Å; V598-Y607 HydrophobicContact CG1-CE1 3.76Å; V598-Y607 HydrophobicContact CG1-CG 4.42Å
599	S	86.3	Confident	84	Confident	11 Å²	11	46.8 Å²	46.8	8%	0.077	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-48.3	176.3	177.5	0	0	0	0	112.2	S540 G541 E595 T596 N602 R603	S540-S599 PolarHBondContact O-OG 3.41Å; G541-S599 PolarHBondContact N-OG 2.95Å; E595-S599 VanDerWaalsContact O-CB 3.3Å; E595-S599 WeakPolarHBondContact O-CB 3.29Å; E595-S599 PolarHBondContact O-N 3.31Å; T596-S599 PolarHBondContact O-N 3.33Å; S599-N602 PolarHBondContact O-N 3.03Å; S599-R603 WeakPolarHBondContact O-CG 3.42Å; S599-R603 PolarHBondContact O-N 3.19Å; S599-R603 VanDerWaalsContact O-N 3.1Å
600	I	87.9	Confident	82.6	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-43.6	177.6	-63.6	-67.4	0	0	0	110.5	K371 T376 I565 M588 T596 N602 R603 L604	K371-I600 HydrophobicContact CG-CG2 4.23Å; T376-I600 HydrophobicContact CG2-CG2 4.32Å; I565-I600 HydrophobicContact CD1-CD1 3.67Å; I565-I600 HydrophobicContact CG1-CD1 4.08Å; M588-I600 HydrophobicContact CE-CB 4.47Å; M588-I600 HydrophobicContact CE-CG2 3.89Å; T596-I600 WeakPolarHBondContact O-CG1 3.34Å; T596-I600 PolarHBondContact O-N 3.07Å; I600-N602 VanDerWaalsContact C-N 3.33Å; I600-N602 PolarHBondContact O-N 3.27Å; I600-R603 PolarHBondContact O-N 2.89Å; I600-L604 HydrophobicContact CG2-CD1 3.9Å; I600-L604 HydrophobicContact CG2-CG 4.43Å; I600-L604 WeakPolarHBondContact O-CG 3.41Å; I600-L604 PolarHBondContact O-N 3.26Å
601	A	89.2	Confident	81.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.3	-39.7	177.8	0	0	0	0	0	112.6	M588 A597 V598 L604 G605 L606 Y607 V636	M588-A601 HydrophobicContact CE-CB 3.84Å; M588-A601 HydrophobicContact SD-CB 4.35Å; A597-A601 VanDerWaalsContact O-CB 3.22Å; A597-A601 WeakPolarHBondContact O-CB 3.3Å; A597-A601 PolarHBondContact O-N 3.01Å; V598-A601 PolarHBondContact O-N 3.48Å; A601-L604 PolarHBondContact O-N 2.91Å; A601-G605 PolarHBondContact O-N 2.96Å; A601-G605 VanDerWaalsContact O-N 3.07Å; A601-L606 HydrophobicContact CB-CB 4.16Å; A601-L606 PolarHBondContact O-N 2.94Å; A601-Y607 PolarHBondContact O-N 3.5Å; A601-V636 HydrophobicContact CB-CG2 3.53Å
602	N	88.7	Confident	82	Confident	76 Å²	76	54.9 Å²	54.9	41%	0.406	31%	0.306	S	S	.	.	H	α-helix	trans	-61.2	-45.9	173.3	-84.2	-48.1	0	0	0	112.1	V598 S599 I600 L604 G605 Y607	V598-N602 WeakPolarHBondContact CG1-ND2 3.43Å; V598-N602 WeakPolarHBondContact O-CB 3.32Å; V598-N602 PolarHBondContact O-N 3.04Å; V598-N602 PolarHBondContact O-ND2 3.3Å; S599-N602 PolarHBondContact O-N 3.03Å; I600-N602 VanDerWaalsContact C-N 3.33Å; I600-N602 PolarHBondContact O-N 3.27Å; N602-L604 VanDerWaalsContact C-N 3.27Å; N602-L604 PolarHBondContact O-N 3.44Å; N602-G605 PolarHBondContact O-N 2.77Å; N602-G605 VanDerWaalsContact O-N 3.12Å; N602-Y607 WeakPolarHBondContact OD1-CD1 3.44Å; N602-Y607 PolarHBondContact OD1-O 2.75Å
603	R	87.4	Confident	82.4	Confident	96 Å²	96	53.9 Å²	53.9	36%	0.362	30%	0.302	S	S	.	.	H	α-helix	trans	-62.7	-35.6	179.7	-69.9	178.5	-173.8	-141.4	4.8	112.4	S540 S599 I600 G605	S540-R603 PolarHBondContact O-NH2 2.91Å; S599-R603 WeakPolarHBondContact O-CG 3.42Å; S599-R603 PolarHBondContact O-N 3.19Å; S599-R603 VanDerWaalsContact O-N 3.1Å; I600-R603 PolarHBondContact O-N 2.89Å; R603-G605 VanDerWaalsContact C-N 3.34Å
604	L	88.9	Confident	83	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-80.7	-10.1	177.6	-69.3	177.9	0	0	0	113.9	L375 P568 V572 I576 M588 I600 A601 N602 L606	L375-L604 HydrophobicContact CB-CD1 4.05Å; L375-L604 HydrophobicContact CD1-CD1 4.05Å; L375-L604 HydrophobicContact CG-CD1 4.46Å; P568-L604 HydrophobicContact CB-CD2 3.63Å; P568-L604 HydrophobicContact CB-CG 4.34Å; P568-L604 HydrophobicContact CG-CD2 4.47Å; V572-L604 HydrophobicContact CB-CD2 4.28Å; V572-L604 HydrophobicContact CG1-CD2 3.88Å; I576-L604 HydrophobicContact CD1-CB 3.91Å; I576-L604 HydrophobicContact CD1-CD1 4.2Å; I576-L604 HydrophobicContact CD1-CD2 4.23Å; I576-L604 HydrophobicContact CD1-CG 4.34Å; M588-L604 HydrophobicContact CE-CD1 3.94Å; I600-L604 HydrophobicContact CG2-CD1 3.9Å; I600-L604 HydrophobicContact CG2-CG 4.43Å; I600-L604 WeakPolarHBondContact O-CG 3.41Å; I600-L604 PolarHBondContact O-N 3.26Å; A601-L604 PolarHBondContact O-N 2.91Å; N602-L604 VanDerWaalsContact C-N 3.27Å; N602-L604 PolarHBondContact O-N 3.44Å; L604-L606 HydrophobicContact CB-CD1 4.18Å; L604-L606 HydrophobicContact CB-CG 4.16Å; L604-L606 HydrophobicContact CD1-CD1 4.24Å
605	G	86.4	Confident	83.3	Confident	43 Å²	43	49.4 Å²	49.4	44%	0.443	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	19.3	-176.6	0	0	0	0	0	114.3	A601 N602 R603	A601-G605 PolarHBondContact O-N 2.96Å; A601-G605 VanDerWaalsContact O-N 3.07Å; N602-G605 PolarHBondContact O-N 2.77Å; N602-G605 VanDerWaalsContact O-N 3.12Å; R603-G605 VanDerWaalsContact C-N 3.34Å
606	L	84.1	Confident	83.5	Confident	18 Å²	18	44 Å²	44	9%	0.094	25%	0.254	C	S	.	.			trans	-87.8	-17.7	177.3	-67.2	174.2	0	0	0	113.2	L375 I576 I586 M588 A601 L604	L375-L606 HydrophobicContact CD1-CD1 4.4Å; I576-L606 HydrophobicContact CD1-CD1 3.99Å; I576-L606 HydrophobicContact CD1-CD2 4.17Å; I576-L606 HydrophobicContact CD1-CG 4.06Å; I576-L606 HydrophobicContact CG1-CD2 4.47Å; I576-L606 HydrophobicContact CG2-CD2 3.53Å; I576-L606 HydrophobicContact CG2-CG 4.11Å; I586-L606 HydrophobicContact CB-CD2 3.62Å; I586-L606 HydrophobicContact CG2-CD1 4.3Å; I586-L606 HydrophobicContact CG2-CD2 3.58Å; M588-L606 HydrophobicContact CB-CD1 4.39Å; M588-L606 HydrophobicContact CE-CD1 3.78Å; A601-L606 HydrophobicContact CB-CB 4.16Å; A601-L606 PolarHBondContact O-N 2.94Å; L604-L606 HydrophobicContact CB-CD1 4.18Å; L604-L606 HydrophobicContact CB-CG 4.16Å; L604-L606 HydrophobicContact CD1-CD1 4.24Å
607	Y	78.8	Confident	83.8	Confident	46 Å²	46	48.3 Å²	48.3	18%	0.18	27%	0.272	C	S	.	.			trans	-126.5	134.8	-178.2	-170.3	-93.3	0	0	0	110.3	V598 A601 N602 C611 C613 V636	V598-Y607 HydrophobicContact CG1-CD1 3.88Å; V598-Y607 HydrophobicContact CG1-CE1 3.76Å; V598-Y607 HydrophobicContact CG1-CG 4.42Å; A601-Y607 PolarHBondContact O-N 3.5Å; N602-Y607 WeakPolarHBondContact OD1-CD1 3.44Å; N602-Y607 PolarHBondContact OD1-O 2.75Å; Y607-C611 HydrophobicContact CD2-CB 3.55Å; Y607-C611 HydrophobicContact CE2-CB 3.54Å; Y607-C611 VanDerWaalsContact CE2-O 3.23Å; Y607-C611 WeakPolarHBondContact CE2-O 3.23Å; Y607-C611 HydrophobicContact CG-CB 4.29Å; Y607-C611 PolarHBondContact OH-O 3.39Å; Y607-C613 WeakPolarHBondContact CE2-SG 3.24Å; Y607-V636 HydrophobicContact CD2-CG2 4.27Å
608	S	73.2	Confident	84	Confident	79 Å²	79	52.6 Å²	52.6	55%	0.552	29%	0.292	S	S	*	.			trans	-124.4	155.7	170.9	-67.9	0	0	0	0	108.9	G610 C611	S608-G610 PolarHBondContact O-N 3Å; S608-C611 WeakPolarHBondContact O-CB 3.41Å; S608-C611 PolarHBondContact O-N 3.4Å
609	K	63.3	Low	84.1	Confident	214 Å²	214	51.5 Å²	51.5	93%	0.93	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	107.6	176.3	-71.9	-176.1	178.2	179.5	0	109.4
610	G	62.2	Low	84.1	Confident	75 Å²	75	55.4 Å²	55.4	77%	0.773	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	122	-12.1	-175.6	0	0	0	0	0	114.9	S608	S608-G610 PolarHBondContact O-N 3Å
611	C	72.7	Confident	84.2	Confident	47 Å²	47	63 Å²	63	32%	0.318	34%	0.34	S	S	.	.			trans	-68.4	141.9	171.2	-69.8	0	0	0	0	111.1	Y607 S608	Y607-C611 HydrophobicContact CD2-CB 3.55Å; Y607-C611 HydrophobicContact CE2-CB 3.54Å; Y607-C611 VanDerWaalsContact CE2-O 3.23Å; Y607-C611 WeakPolarHBondContact CE2-O 3.23Å; Y607-C611 HydrophobicContact CG-CB 4.29Å; Y607-C611 PolarHBondContact OH-O 3.39Å; S608-C611 WeakPolarHBondContact O-CB 3.41Å; S608-C611 PolarHBondContact O-N 3.4Å
612	Q	85.6	Confident	84.3	Confident	99 Å²	99	64.7 Å²	64.7	46%	0.463	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	139.9	176	-73	-178.3	-35.4	0	0	110.8	V634 G635	Q612-V634 HydrophobicContact CB-CG2 4.2Å; Q612-V634 WeakPolarHBondContact O-CA 3.47Å; Q612-G635 PolarHBondContact O-N 3.42Å
613	C	90.3	Very high	84.3	Confident	23 Å²	23	66.6 Å²	66.6	16%	0.155	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.1	168.1	-61.4	0	0	0	0	109	Y607 V636 Y638	Y607-C613 WeakPolarHBondContact CE2-SG 3.24Å; C613-V636 VanDerWaalsContact CA-O 3.28Å; C613-V636 WeakPolarHBondContact CA-O 3.47Å; C613-Y638 HydrophobicContact CB-CD1 4.17Å; C613-Y638 HydrophobicContact CB-CE1 3.98Å
614	L	92.8	Very high	84.3	Confident	20 Å²	20	65.5 Å²	65.5	11%	0.105	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.5	175.9	-79.2	168.3	0	0	0	111.1	E618 V619 L627 I630 V634 V636 F637 Y638	L614-E618 WeakPolarHBondContact CA-OE2 3.33Å; L614-E618 HydrophobicContact CD2-CB 4.05Å; L614-E618 WeakPolarHBondContact CD2-OE2 3.21Å; L614-V619 HydrophobicContact CB-CG2 4.24Å; L614-L627 HydrophobicContact CD1-CD1 4.38Å; L614-I630 HydrophobicContact CD1-CG2 4.33Å; L614-V634 HydrophobicContact CB-CG1 4.26Å; L614-V634 HydrophobicContact CD1-CB 4.37Å; L614-V634 HydrophobicContact CD1-CG1 4.17Å; L614-V634 HydrophobicContact CD1-CG2 3.52Å; L614-V634 HydrophobicContact CG-CG1 4.25Å; L614-V634 HydrophobicContact CG-CG2 4.01Å; L614-V636 PolarHBondContact N-O 3.05Å; L614-V636 VanDerWaalsContact N-O 3.13Å; L614-F637 HydrophobicContact CB-CD1 3.88Å; L614-F637 HydrophobicContact CB-CE1 3.98Å; L614-F637 HydrophobicContact CD1-CE1 3.84Å; L614-F637 WeakPolarHBondContact O-CA 3.39Å; L614-Y638 VanDerWaalsContact O-CD1 3.26Å; L614-Y638 WeakPolarHBondContact O-CD1 3.27Å; L614-Y638 WeakPolarHBondContact O-CE1 3.4Å; L614-Y638 PolarHBondContact O-N 3.44Å; L614-Y638 VanDerWaalsContact O-N 3.08Å
615	S	92.4	Very high	84.3	Confident	9 Å²	9	73 Å²	73	6%	0.063	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	152.5	169.8	179	0	0	0	0	110.8	E617 E618 V619 Y638	S615-E617 VanDerWaalsContact C-N 3.25Å; S615-E617 PolarHBondContact O-N 3.34Å; S615-E617 PolarHBondContact OG-N 2.84Å; S615-E618 PolarHBondContact N-OE2 3.21Å; S615-E618 PolarHBondContact O-N 3.21Å; S615-V619 WeakPolarHBondContact O-CG2 3.34Å; S615-V619 PolarHBondContact O-N 3.38Å; S615-Y638 CarbonylContact C-O 3.6Å; S615-Y638 WeakPolarHBondContact CB-OH 3.31Å
616	G	87.7	Confident	84.5	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.01	40%	0.396	C	S	.	.	H	α-helix	trans	-53.8	-40.3	168.2	0	0	0	0	0	113.7	E618 V619 D620 Y638 H644	G616-E618 VanDerWaalsContact C-N 3.35Å; G616-E618 PolarHBondContact O-N 3.46Å; G616-V619 WeakPolarHBondContact O-CB 3.34Å; G616-V619 PolarHBondContact O-N 3.3Å; G616-D620 PolarHBondContact O-N 3.19Å; G616-Y638 PolarHBondContact N-O 2.95Å; G616-H644 VanDerWaalsContact C-CE1 3.48Å; G616-H644 WeakPolarHBondContact CA-ND1 3.45Å; G616-H644 PolarHBondContact O-CE1 3.11Å; G616-H644 VanDerWaalsContact O-CE1 3.26Å
617	E	87.8	Confident	84.8	Confident	129 Å²	129	74.7 Å²	74.7	60%	0.603	39%	0.391	S	S	*	.	H	α-helix	trans	-64.9	-38.8	177.9	-66.7	176.4	-179.8	0	0	111.9	S615 V619 D620 H621	S615-E617 VanDerWaalsContact C-N 3.25Å; S615-E617 PolarHBondContact O-N 3.34Å; S615-E617 PolarHBondContact OG-N 2.84Å; E617-V619 VanDerWaalsContact C-N 3.32Å; E617-V619 PolarHBondContact O-N 3.07Å; E617-D620 PolarHBondContact O-N 3.03Å; E617-H621 PolarHBondContact O-CD2 2.89Å; E617-H621 PolarHBondContact O-N 3.09Å
618	E	90	Very high	85.4	Confident	89 Å²	89	73 Å²	73	42%	0.416	39%	0.386	S	S	.	.	H	α-helix	trans	-66.5	-37.1	175.8	-65.8	170.2	156.1	0	0	111	L614 S615 G616 D620 H621 L622	L614-E618 WeakPolarHBondContact CA-OE2 3.33Å; L614-E618 HydrophobicContact CD2-CB 4.05Å; L614-E618 WeakPolarHBondContact CD2-OE2 3.21Å; S615-E618 PolarHBondContact N-OE2 3.21Å; S615-E618 PolarHBondContact O-N 3.21Å; G616-E618 VanDerWaalsContact C-N 3.35Å; G616-E618 PolarHBondContact O-N 3.46Å; E618-D620 VanDerWaalsContact C-N 3.29Å; E618-D620 PolarHBondContact O-N 3.02Å; E618-H621 PolarHBondContact O-N 3.35Å; E618-L622 WeakPolarHBondContact O-CG 3.49Å; E618-L622 PolarHBondContact O-N 3.28Å
619	V	90	Very high	86.1	Confident	1 Å²	1	75 Å²	75	1%	0.006	39%	0.39	C	S	.	.	H	α-helix	trans	-65	-33.3	175.4	172.5	0	0	0	0	111.7	L614 S615 G616 E617 L622 L627 F637 H644 K647	L614-V619 HydrophobicContact CB-CG2 4.24Å; S615-V619 WeakPolarHBondContact O-CG2 3.34Å; S615-V619 PolarHBondContact O-N 3.38Å; G616-V619 WeakPolarHBondContact O-CB 3.34Å; G616-V619 PolarHBondContact O-N 3.3Å; E617-V619 VanDerWaalsContact C-N 3.32Å; E617-V619 PolarHBondContact O-N 3.07Å; V619-L622 PolarHBondContact O-N 3.06Å; V619-L627 HydrophobicContact CG1-CD2 4.07Å; V619-L627 HydrophobicContact CG2-CD1 4.44Å; V619-F637 HydrophobicContact CG2-CD1 3.96Å; V619-F637 HydrophobicContact CG2-CE1 4.11Å; V619-H644 HydrophobicContact CG1-CB 4.21Å; V619-K647 HydrophobicContact CG1-CD 4.11Å; V619-K647 PolarHBondContact O-NZ 3.42Å
620	D	87.6	Confident	87.4	Confident	93 Å²	93	67.6 Å²	67.6	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-66.9	-38.9	176.2	-85.1	-22.2	0	0	0	112.5	G616 E617 E618 L622 H644 K647	G616-D620 PolarHBondContact O-N 3.19Å; E617-D620 PolarHBondContact O-N 3.03Å; E618-D620 VanDerWaalsContact C-N 3.29Å; E618-D620 PolarHBondContact O-N 3.02Å; D620-L622 VanDerWaalsContact C-N 3.29Å; D620-L622 PolarHBondContact O-N 2.88Å; D620-H644 IonicContact OD1-CD2 3.36Å; D620-H644 PolarHBondContact OD1-CD2 2.94Å; D620-H644 IonicContact OD1-NE2 3.88Å; D620-H644 PolarHBondContact OD1-NE2 3.16Å; D620-H644 IonicContact OD2-CE1 2.99Å; D620-H644 IonicContact OD2-NE2 3.92Å; D620-H644 PolarHBondContact OD2-NE2 3.21Å; D620-H644 VanDerWaalsContact OD2-NE2 3.1Å; D620-K647 PolarHBondContact O-NZ 2.96Å
621	H	89.6	Confident	88.7	Confident	162 Å²	162	64 Å²	64	75%	0.75	32%	0.323	S	S	*	.	H	α-helix	trans	-71.2	-20.6	178.9	-71.3	-57	0	0	0	114.4	E617 E618	E617-H621 PolarHBondContact O-CD2 2.89Å; E617-H621 PolarHBondContact O-N 3.09Å; E618-H621 PolarHBondContact O-N 3.35Å
622	L	90	Very high	89.3	Confident	34 Å²	34	65.2 Å²	65.2	18%	0.178	33%	0.332	C	S	.	.	S	Bend	trans	-89.5	133.7	-179	-67.5	169.7	0	0	0	111.5	E618 V619 D620 E626 L627 K647	E618-L622 WeakPolarHBondContact O-CG 3.49Å; E618-L622 PolarHBondContact O-N 3.28Å; V619-L622 PolarHBondContact O-N 3.06Å; D620-L622 VanDerWaalsContact C-N 3.29Å; D620-L622 PolarHBondContact O-N 2.88Å; L622-E626 HydrophobicContact CD2-CB 4.2Å; L622-L627 HydrophobicContact CB-CB 4.38Å; L622-L627 HydrophobicContact CD1-CD1 4.19Å; L622-K647 WeakPolarHBondContact O-CE 3.35Å; L622-K647 PolarHBondContact O-NZ 3.04Å
623	D	90.3	Very high	89.4	Confident	117 Å²	117	69.4 Å²	69.4	63%	0.626	34%	0.344	S	S	*	.			trans	-71	161.4	170.5	-88.6	-14.6	0	0	0	111.8	Q625 E626 L627	D623-Q625 PolarHBondContact O-N 3.4Å; D623-E626 HydrophobicContact CB-CG 4.33Å; D623-E626 PolarHBondContact N-OE2 3.23Å; D623-E626 PolarHBondContact O-N 3.01Å; D623-E626 VanDerWaalsContact O-N 3.11Å; D623-L627 WeakPolarHBondContact O-CB 3.49Å; D623-L627 PolarHBondContact O-N 2.92Å
624	L	87.3	Confident	89.4	Confident	73 Å²	73	68.4 Å²	68.4	38%	0.382	34%	0.337	S	S	.	.	H	α-helix	trans	-54.9	-38.1	-178.3	-90.6	163.4	0	0	0	113.1	S628 K647 K650	L624-S628 WeakPolarHBondContact O-CB 3.43Å; L624-S628 PolarHBondContact O-N 3.44Å; L624-S628 PolarHBondContact O-OG 3.46Å; L624-K647 HydrophobicContact CD2-CG 3.91Å; L624-K647 HydrophobicContact CG-CG 4.39Å; L624-K650 HydrophobicContact CD2-CB 4.22Å
625	Q	88.4	Confident	89.2	Confident	160 Å²	160	68 Å²	68	75%	0.748	34%	0.337	S	S	*	.	H	α-helix	trans	-72	-40.5	178.2	-73	-179.9	-7.3	0	0	112.3	D623 S628 N629	D623-Q625 PolarHBondContact O-N 3.4Å; Q625-S628 WeakPolarHBondContact O-CB 3.29Å; Q625-S628 PolarHBondContact O-N 3.02Å; Q625-N629 PolarHBondContact O-N 3.01Å; Q625-N629 PolarHBondContact O-ND2 3.32Å
626	E	90.1	Very high	89.3	Confident	98 Å²	98	67.5 Å²	67.5	46%	0.458	33%	0.334	S	S	.	.	H	α-helix	trans	-65.8	-45.2	177.6	-61.1	-178.9	149.7	0	0	110.7	L622 D623 S628 N629 I630	L622-E626 HydrophobicContact CD2-CB 4.2Å; D623-E626 HydrophobicContact CB-CG 4.33Å; D623-E626 PolarHBondContact N-OE2 3.23Å; D623-E626 PolarHBondContact O-N 3.01Å; D623-E626 VanDerWaalsContact O-N 3.11Å; E626-S628 VanDerWaalsContact C-N 3.3Å; E626-S628 PolarHBondContact O-N 3.16Å; E626-N629 PolarHBondContact O-N 2.85Å; E626-N629 VanDerWaalsContact O-N 3.14Å; E626-I630 PolarHBondContact O-N 3.32Å
627	L	91.3	Very high	89.5	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.8	-42.9	174.7	-175	62.4	0	0	0	110.8	L614 V619 L622 D623 N629 I630 V631 K647	L614-L627 HydrophobicContact CD1-CD1 4.38Å; V619-L627 HydrophobicContact CG1-CD2 4.07Å; V619-L627 HydrophobicContact CG2-CD1 4.44Å; L622-L627 HydrophobicContact CB-CB 4.38Å; L622-L627 HydrophobicContact CD1-CD1 4.19Å; D623-L627 WeakPolarHBondContact O-CB 3.49Å; D623-L627 PolarHBondContact O-N 2.92Å; L627-N629 PolarHBondContact O-N 3.24Å; L627-I630 PolarHBondContact O-N 2.92Å; L627-I630 VanDerWaalsContact O-N 3.09Å; L627-V631 WeakPolarHBondContact O-CB 3.38Å; L627-V631 PolarHBondContact O-N 3.45Å; L627-K647 HydrophobicContact CD2-CD 4.32Å; L627-K647 HydrophobicContact CD2-CG 3.94Å
628	S	90.7	Very high	89.6	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-58.4	-32.1	178.4	-58.5	0	0	0	0	112.8	L624 Q625 E626 S651 L655	L624-S628 WeakPolarHBondContact O-CB 3.43Å; L624-S628 PolarHBondContact O-N 3.44Å; L624-S628 PolarHBondContact O-OG 3.46Å; Q625-S628 WeakPolarHBondContact O-CB 3.29Å; Q625-S628 PolarHBondContact O-N 3.02Å; E626-S628 VanDerWaalsContact C-N 3.3Å; E626-S628 PolarHBondContact O-N 3.16Å; S628-S651 PolarHBondContact OG-O 3.33Å; S628-L655 WeakPolarHBondContact O-CD1 3.45Å
629	N	88.1	Confident	89.5	Confident	122 Å²	122	65.6 Å²	65.6	65%	0.652	32%	0.317	S	S	*	.	H	α-helix	trans	-74.1	-30.8	178.6	-69	-31.8	0	0	0	113.1	Q625 E626 L627	Q625-N629 PolarHBondContact O-N 3.01Å; Q625-N629 PolarHBondContact O-ND2 3.32Å; E626-N629 PolarHBondContact O-N 2.85Å; E626-N629 VanDerWaalsContact O-N 3.14Å; L627-N629 PolarHBondContact O-N 3.24Å
630	I	89.6	Confident	89.3	Confident	58 Å²	58	66.2 Å²	66.2	30%	0.297	32%	0.323	S	S	.	.	H	α-helix	trans	-97.3	-32.3	-173.6	-56.5	171.6	0	0	0	111.2	L614 E626 L627 S632 R633 V634	L614-I630 HydrophobicContact CD1-CG2 4.33Å; E626-I630 PolarHBondContact O-N 3.32Å; L627-I630 PolarHBondContact O-N 2.92Å; L627-I630 VanDerWaalsContact O-N 3.09Å; I630-S632 PolarHBondContact O-N 3.44Å; I630-R633 PolarHBondContact O-N 3.09Å; I630-V634 HydrophobicContact CG2-CG2 3.87Å
631	V	90.7	Very high	89	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-54.2	-32.3	-171.4	73.6	0	0	0	0	112.7	K587 L627 R633 V634 F637 I648 L652 L655	K587-V631 WeakPolarHBondContact CE-O 3.44Å; K587-V631 PolarHBondContact NZ-O 3.12Å; L627-V631 WeakPolarHBondContact O-CB 3.38Å; L627-V631 PolarHBondContact O-N 3.45Å; V631-R633 VanDerWaalsContact C-N 3.3Å; V631-R633 PolarHBondContact O-N 3.34Å; V631-V634 PolarHBondContact O-N 2.92Å; V631-F637 HydrophobicContact CG2-CZ 3.89Å; V631-I648 HydrophobicContact CG2-CG2 4.24Å; V631-L652 HydrophobicContact CB-CD2 4.39Å; V631-L652 HydrophobicContact CG1-CD2 3.68Å; V631-L652 HydrophobicContact CG1-CG 4.18Å; V631-L652 HydrophobicContact CG2-CD1 4.41Å; V631-L652 HydrophobicContact CG2-CD2 3.84Å; V631-L652 HydrophobicContact CG2-CG 3.9Å; V631-L655 HydrophobicContact CG1-CD1 3.82Å
632	S	85.8	Confident	88.6	Confident	72 Å²	72	58.4 Å²	58.4	50%	0.503	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-37	178.5	61.6	0	0	0	0	113	K587 I630	K587-S632 PolarHBondContact NZ-O 3.34Å; K587-S632 VanDerWaalsContact NZ-O 3.16Å; I630-S632 PolarHBondContact O-N 3.44Å
633	R	87.1	Confident	88.3	Confident	188 Å²	188	66.7 Å²	66.7	71%	0.709	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-13.6	-177	-59.6	-178.6	-177.6	-175.9	0.2	114	I630 V631	I630-R633 PolarHBondContact O-N 3.09Å; V631-R633 VanDerWaalsContact C-N 3.3Å; V631-R633 PolarHBondContact O-N 3.34Å
634	V	90.8	Very high	88.3	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.5	-174.9	-179.8	0	0	0	0	109.7	K587 Q612 L614 I630 V631 F637	K587-V634 PolarHBondContact NZ-O 3.45Å; Q612-V634 HydrophobicContact CB-CG2 4.2Å; Q612-V634 WeakPolarHBondContact O-CA 3.47Å; L614-V634 HydrophobicContact CB-CG1 4.26Å; L614-V634 HydrophobicContact CD1-CB 4.37Å; L614-V634 HydrophobicContact CD1-CG1 4.17Å; L614-V634 HydrophobicContact CD1-CG2 3.52Å; L614-V634 HydrophobicContact CG-CG1 4.25Å; L614-V634 HydrophobicContact CG-CG2 4.01Å; I630-V634 HydrophobicContact CG2-CG2 3.87Å; V631-V634 PolarHBondContact O-N 2.92Å; V634-F637 HydrophobicContact CB-CE1 4.39Å; V634-F637 HydrophobicContact CB-CE2 4.22Å; V634-F637 HydrophobicContact CB-CZ 3.79Å; V634-F637 HydrophobicContact CG1-CD1 4.21Å; V634-F637 HydrophobicContact CG1-CD2 4.19Å; V634-F637 HydrophobicContact CG1-CE1 3.74Å; V634-F637 HydrophobicContact CG1-CE2 3.69Å; V634-F637 HydrophobicContact CG1-CG 4.42Å; V634-F637 HydrophobicContact CG1-CZ 3.43Å; V634-F637 VanDerWaalsContact CG1-CZ 3.43Å
635	G	88.8	Confident	88.4	Confident	11 Å²	11	58.9 Å²	58.9	11%	0.113	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-29.3	179.1	0	0	0	0	0	113.7	K587 M588 Q612	K587-G635 WeakPolarHBondContact CA-O 3.4Å; M588-G635 PolarHBondContact N-O 3.39Å; Q612-G635 PolarHBondContact O-N 3.42Å
636	V	93.2	Very high	88.5	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	127.7	-172.2	-175.9	0	0	0	0	110.5	M588 A597 A601 Y607 C613 L614	M588-V636 HydrophobicContact CB-CG2 4.48Å; M588-V636 CarbonylContact O-C 3.59Å; M588-V636 WeakPolarHBondContact O-CA 3.43Å; M588-V636 HydrophobicContact SD-CG1 4.48Å; A597-V636 HydrophobicContact CB-CG1 3.77Å; A601-V636 HydrophobicContact CB-CG2 3.53Å; Y607-V636 HydrophobicContact CD2-CG2 4.27Å; C613-V636 VanDerWaalsContact CA-O 3.28Å; C613-V636 WeakPolarHBondContact CA-O 3.47Å; L614-V636 PolarHBondContact N-O 3.05Å; L614-V636 VanDerWaalsContact N-O 3.13Å
637	F	93.1	Very high	88.6	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.6	169.2	-62.5	-90.5	0	0	0	108.7	K587 M588 I589 T590 L614 V619 V631 V634 I648	K587-F637 HydrophobicContact CD-CE2 4.44Å; M588-F637 PolarHBondContact O-N 2.68Å; I589-F637 HydrophobicContact CB-CB 4.47Å; I589-F637 HydrophobicContact CG1-CB 4.33Å; I589-F637 HydrophobicContact CG1-CD2 4.03Å; I589-F637 HydrophobicContact CG2-CB 4.13Å; T590-F637 PolarHBondContact N-O 2.95Å; L614-F637 HydrophobicContact CB-CD1 3.88Å; L614-F637 HydrophobicContact CB-CE1 3.98Å; L614-F637 HydrophobicContact CD1-CE1 3.84Å; L614-F637 WeakPolarHBondContact O-CA 3.39Å; V619-F637 HydrophobicContact CG2-CD1 3.96Å; V619-F637 HydrophobicContact CG2-CE1 4.11Å; V631-F637 HydrophobicContact CG2-CZ 3.89Å; V634-F637 HydrophobicContact CB-CE1 4.39Å; V634-F637 HydrophobicContact CB-CE2 4.22Å; V634-F637 HydrophobicContact CB-CZ 3.79Å; V634-F637 HydrophobicContact CG1-CD1 4.21Å; V634-F637 HydrophobicContact CG1-CD2 4.19Å; V634-F637 HydrophobicContact CG1-CE1 3.74Å; V634-F637 HydrophobicContact CG1-CE2 3.69Å; V634-F637 HydrophobicContact CG1-CG 4.42Å; V634-F637 HydrophobicContact CG1-CZ 3.43Å; V634-F637 VanDerWaalsContact CG1-CZ 3.43Å; F637-I648 HydrophobicContact CB-CD1 4.15Å; F637-I648 HydrophobicContact CD1-CD1 3.62Å; F637-I648 HydrophobicContact CD1-CG1 4.26Å; F637-I648 HydrophobicContact CD2-CD1 4.02Å; F637-I648 HydrophobicContact CE1-CD1 3.96Å; F637-I648 HydrophobicContact CE1-CG1 4.09Å; F637-I648 HydrophobicContact CE2-CD1 4.35Å; F637-I648 HydrophobicContact CE2-CG2 4.18Å; F637-I648 HydrophobicContact CG-CD1 3.65Å; F637-I648 HydrophobicContact CZ-CD1 4.33Å; F637-I648 HydrophobicContact CZ-CG1 4.31Å; F637-I648 HydrophobicContact CZ-CG2 4.32Å
638	Y	90.1	Very high	88.7	Confident	25 Å²	25	50.3 Å²	50.3	10%	0.098	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	157.7	-177.3	64.8	-88.5	0	0	0	110.7	T590 Q594 C613 L614 S615 G616 A640	T590-Y638 CarbonylContact O-C 3.42Å; T590-Y638 VanDerWaalsContact O-C 3.31Å; T590-Y638 WeakPolarHBondContact O-CA 3.27Å; Q594-Y638 HydrophobicContact CB-CD1 4.31Å; Q594-Y638 HydrophobicContact CB-CD2 3.89Å; Q594-Y638 HydrophobicContact CB-CE1 4.27Å; Q594-Y638 HydrophobicContact CB-CE2 3.83Å; Q594-Y638 HydrophobicContact CB-CG 4.13Å; Q594-Y638 HydrophobicContact CG-CD1 4.19Å; Q594-Y638 HydrophobicContact CG-CE1 3.95Å; Q594-Y638 HydrophobicContact CG-CE2 4.36Å; C613-Y638 HydrophobicContact CB-CD1 4.17Å; C613-Y638 HydrophobicContact CB-CE1 3.98Å; L614-Y638 VanDerWaalsContact O-CD1 3.26Å; L614-Y638 WeakPolarHBondContact O-CD1 3.27Å; L614-Y638 WeakPolarHBondContact O-CE1 3.4Å; L614-Y638 PolarHBondContact O-N 3.44Å; L614-Y638 VanDerWaalsContact O-N 3.08Å; S615-Y638 CarbonylContact C-O 3.6Å; S615-Y638 WeakPolarHBondContact CB-OH 3.31Å; G616-Y638 PolarHBondContact N-O 2.95Å; Y638-A640 PolarHBondContact O-N 2.87Å
639	R	86.1	Confident	88.8	Confident	151 Å²	151	49.9 Å²	49.9	57%	0.57	24%	0.236	S	C	*	.	S	Bend	trans	47.6	38.5	-169.7	-64.9	-176	176.6	-176.7	1.9	113.4	T590 D592	T590-R639 PolarHBondContact O-N 3.38Å; D592-R639 PolarHBondContact O-N 3.22Å
640	A	86	Confident	89	Confident	14 Å²	14	47.1 Å²	47.1	12%	0.116	22%	0.218	C	C	.	.			trans	-83.1	131	-177.2	0	0	0	0	0	112	I589 T590 Y638 H644	I589-A640 HydrophobicContact CG2-CB 3.48Å; I589-A640 VanDerWaalsContact CG2-CB 3.48Å; T590-A640 PolarHBondContact O-N 3.21Å; Y638-A640 PolarHBondContact O-N 2.87Å; A640-H644 HydrophobicContact CB-CB 4.31Å
641	S	82.9	Confident	89.2	Confident	37 Å²	37	44.3 Å²	44.3	26%	0.259	20%	0.204	S	C	.	.			trans	-87.6	166.6	173.8	79.4	0	0	0	0	111.3	R643 H644 K645	S641-R643 PolarHBondContact O-N 3.09Å; S641-R643 PolarHBondContact OG-N 3.34Å; S641-H644 PolarHBondContact N-ND1 3.38Å; S641-H644 WeakPolarHBondContact O-CB 3.49Å; S641-H644 PolarHBondContact O-N 3.47Å; S641-H644 PolarHBondContact OG-CD2 2.85Å; S641-H644 PolarHBondContact OG-CE1 3.45Å; S641-H644 VanDerWaalsContact OG-CE1 3.28Å; S641-H644 VanDerWaalsContact OG-CG 3.28Å; S641-H644 PolarHBondContact OG-N 3.38Å; S641-H644 PolarHBondContact OG-ND1 3.39Å; S641-H644 PolarHBondContact OG-NE2 3.49Å; S641-K645 PolarHBondContact O-N 3.41Å; S641-K645 VanDerWaalsContact O-N 3.07Å
642	P	81.3	Confident	89.4	Confident	54 Å²	54	44.5 Å²	44.5	35%	0.351	21%	0.205	S	C	.	.	H	α-helix	trans	-51.8	-39.2	172.6	-29.6	37.1	0	0	0	113.4	H644 K645 L646 N667	P642-H644 VanDerWaalsContact C-N 3.33Å; P642-H644 PolarHBondContact O-N 2.88Å; P642-K645 WeakPolarHBondContact O-CB 3.47Å; P642-K645 PolarHBondContact O-N 3.35Å; P642-L646 PolarHBondContact O-N 2.83Å; P642-N667 HydrophobicContact CB-CB 4.46Å; P642-N667 WeakPolarHBondContact CB-O 3.31Å; P642-N667 HydrophobicContact CG-CB 3.74Å; P642-N667 WeakPolarHBondContact CG-OD1 3.24Å
643	R	83.5	Confident	89.7	Confident	208 Å²	208	43.3 Å²	43.3	79%	0.785	19%	0.192	S	C	*	.	H	α-helix	trans	-65.4	-37.7	177.8	-65.5	-178.7	178.5	167.2	0.1	111.5	S641 L646 K647	S641-R643 PolarHBondContact O-N 3.09Å; S641-R643 PolarHBondContact OG-N 3.34Å; R643-L646 PolarHBondContact O-N 3.33Å; R643-K647 WeakPolarHBondContact O-CB 3.36Å; R643-K647 PolarHBondContact O-N 3.24Å
644	H	88.9	Confident	89.8	Confident	13 Å²	13	39.6 Å²	39.6	6%	0.06	19%	0.186	C	C	.	.	H	α-helix	trans	-67.5	-41	177.3	-51.9	161.2	0	0	0	110.6	G616 V619 D620 A640 S641 P642 L646 K647 I648	G616-H644 VanDerWaalsContact C-CE1 3.48Å; G616-H644 WeakPolarHBondContact CA-ND1 3.45Å; G616-H644 PolarHBondContact O-CE1 3.11Å; G616-H644 VanDerWaalsContact O-CE1 3.26Å; V619-H644 HydrophobicContact CG1-CB 4.21Å; D620-H644 IonicContact OD1-CD2 3.36Å; D620-H644 PolarHBondContact OD1-CD2 2.94Å; D620-H644 IonicContact OD1-NE2 3.88Å; D620-H644 PolarHBondContact OD1-NE2 3.16Å; D620-H644 IonicContact OD2-CE1 2.99Å; D620-H644 IonicContact OD2-NE2 3.92Å; D620-H644 PolarHBondContact OD2-NE2 3.21Å; D620-H644 VanDerWaalsContact OD2-NE2 3.1Å; A640-H644 HydrophobicContact CB-CB 4.31Å; S641-H644 PolarHBondContact N-ND1 3.38Å; S641-H644 WeakPolarHBondContact O-CB 3.49Å; S641-H644 PolarHBondContact O-N 3.47Å; S641-H644 PolarHBondContact OG-CD2 2.85Å; S641-H644 PolarHBondContact OG-CE1 3.45Å; S641-H644 VanDerWaalsContact OG-CE1 3.28Å; S641-H644 VanDerWaalsContact OG-CG 3.28Å; S641-H644 PolarHBondContact OG-N 3.38Å; S641-H644 PolarHBondContact OG-ND1 3.39Å; S641-H644 PolarHBondContact OG-NE2 3.49Å; P642-H644 VanDerWaalsContact C-N 3.33Å; P642-H644 PolarHBondContact O-N 2.88Å; H644-L646 PolarHBondContact O-N 2.88Å; H644-K647 PolarHBondContact O-N 3.41Å; H644-I648 WeakPolarHBondContact O-CB 3.26Å; H644-I648 WeakPolarHBondContact O-CD1 3.46Å; H644-I648 WeakPolarHBondContact O-CG1 3.33Å; H644-I648 PolarHBondContact O-N 2.99Å
645	K	90.8	Very high	89.8	Confident	14 Å²	14	43.9 Å²	43.9	6%	0.061	21%	0.208	C	C	.	.	H	α-helix	trans	-55.4	-50	175.8	-69.6	178.5	173.7	-174.4	0	111.2	D370 I589 S641 P642 K647 I648 V649 M661 D668 A671	D370-K645 WeakPolarHBondContact OD1-CE 3.26Å; D370-K645 IonicContact OD1-NZ 2.83Å; D370-K645 PolarHBondContact OD1-NZ 3.2Å; I589-K645 HydrophobicContact CG2-CG 3.79Å; S641-K645 PolarHBondContact O-N 3.41Å; S641-K645 VanDerWaalsContact O-N 3.07Å; P642-K645 WeakPolarHBondContact O-CB 3.47Å; P642-K645 PolarHBondContact O-N 3.35Å; K645-K647 PolarHBondContact O-N 2.77Å; K645-I648 PolarHBondContact O-N 2.99Å; K645-V649 WeakPolarHBondContact O-CG2 3.45Å; K645-V649 PolarHBondContact O-N 2.98Å; K645-M661 HydrophobicContact CB-CE 4.35Å; K645-M661 HydrophobicContact CD-CE 3.9Å; K645-M661 HydrophobicContact CG-CE 4.24Å; K645-D668 WeakPolarHBondContact CD-OD1 3.45Å; K645-D668 WeakPolarHBondContact CE-OD1 3.24Å; K645-D668 IonicContact NZ-OD1 3.51Å; K645-D668 PolarHBondContact NZ-OD1 3.38Å; K645-D668 IonicContact NZ-OD2 3.45Å; K645-A671 HydrophobicContact CB-CB 3.87Å
646	L	89.7	Confident	89.7	Confident	36 Å²	36	45.4 Å²	45.4	19%	0.188	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-45.7	175.6	-178.2	64.1	0	0	0	112.5	P642 R643 H644 I648 V649 K650 V670 A674	P642-L646 PolarHBondContact O-N 2.83Å; R643-L646 PolarHBondContact O-N 3.33Å; H644-L646 PolarHBondContact O-N 2.88Å; L646-I648 VanDerWaalsContact C-N 3.33Å; L646-I648 PolarHBondContact O-N 2.84Å; L646-V649 PolarHBondContact O-N 3.31Å; L646-K650 HydrophobicContact CD1-CD 4.35Å; L646-K650 HydrophobicContact CD1-CG 4.46Å; L646-K650 HydrophobicContact CG-CD 4.35Å; L646-K650 PolarHBondContact O-N 3.43Å; L646-V670 HydrophobicContact CD1-CG1 4.28Å; L646-V670 HydrophobicContact CD2-CG1 3.96Å; L646-A674 HydrophobicContact CD1-CB 3.33Å
647	K	91.3	Very high	89.7	Confident	41 Å²	41	46 Å²	46	18%	0.178	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-40.1	179.7	-165.9	178.5	-177.7	-179.1	0	111.8	V619 D620 L622 L624 L627 R643 H644 K645 S651	V619-K647 HydrophobicContact CG1-CD 4.11Å; V619-K647 PolarHBondContact O-NZ 3.42Å; D620-K647 PolarHBondContact O-NZ 2.96Å; L622-K647 WeakPolarHBondContact O-CE 3.35Å; L622-K647 PolarHBondContact O-NZ 3.04Å; L624-K647 HydrophobicContact CD2-CG 3.91Å; L624-K647 HydrophobicContact CG-CG 4.39Å; L627-K647 HydrophobicContact CD2-CD 4.32Å; L627-K647 HydrophobicContact CD2-CG 3.94Å; R643-K647 WeakPolarHBondContact O-CB 3.36Å; R643-K647 PolarHBondContact O-N 3.24Å; H644-K647 PolarHBondContact O-N 3.41Å; K645-K647 PolarHBondContact O-N 2.77Å; K647-S651 WeakPolarHBondContact O-CB 3.24Å; K647-S651 PolarHBondContact O-N 3.34Å; K647-S651 PolarHBondContact O-OG 2.91Å
648	I	93.5	Very high	89.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-49.2	176.1	-67.9	160.4	0	0	0	110.2	I589 V631 F637 H644 K645 L646 K650 S651 L652	I589-I648 HydrophobicContact CD1-CB 4.46Å; I589-I648 HydrophobicContact CD1-CD1 4.08Å; I589-I648 HydrophobicContact CD1-CG2 4.06Å; I589-I648 HydrophobicContact CG1-CD1 4.44Å; I589-I648 HydrophobicContact CG2-CD1 4.41Å; V631-I648 HydrophobicContact CG2-CG2 4.24Å; F637-I648 HydrophobicContact CB-CD1 4.15Å; F637-I648 HydrophobicContact CD1-CD1 3.62Å; F637-I648 HydrophobicContact CD1-CG1 4.26Å; F637-I648 HydrophobicContact CD2-CD1 4.02Å; F637-I648 HydrophobicContact CE1-CD1 3.96Å; F637-I648 HydrophobicContact CE1-CG1 4.09Å; F637-I648 HydrophobicContact CE2-CD1 4.35Å; F637-I648 HydrophobicContact CE2-CG2 4.18Å; F637-I648 HydrophobicContact CG-CD1 3.65Å; F637-I648 HydrophobicContact CZ-CD1 4.33Å; F637-I648 HydrophobicContact CZ-CG1 4.31Å; F637-I648 HydrophobicContact CZ-CG2 4.32Å; H644-I648 WeakPolarHBondContact O-CB 3.26Å; H644-I648 WeakPolarHBondContact O-CD1 3.46Å; H644-I648 WeakPolarHBondContact O-CG1 3.33Å; H644-I648 PolarHBondContact O-N 2.99Å; K645-I648 PolarHBondContact O-N 2.99Å; L646-I648 VanDerWaalsContact C-N 3.33Å; L646-I648 PolarHBondContact O-N 2.84Å; I648-K650 PolarHBondContact O-N 2.96Å; I648-S651 PolarHBondContact O-N 2.87Å; I648-S651 PolarHBondContact O-OG 3.47Å; I648-L652 HydrophobicContact CG2-CD1 4Å; I648-L652 WeakPolarHBondContact O-CG 3.4Å; I648-L652 PolarHBondContact O-N 3.46Å
649	V	94.2	Very high	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.2	-49.9	177.4	171.9	0	0	0	0	110.9	K645 L646 S651 L652 Q653 V659 M661 A675	K645-V649 WeakPolarHBondContact O-CG2 3.45Å; K645-V649 PolarHBondContact O-N 2.98Å; L646-V649 PolarHBondContact O-N 3.31Å; V649-S651 VanDerWaalsContact C-N 3.33Å; V649-S651 PolarHBondContact O-N 3.28Å; V649-L652 PolarHBondContact O-N 3.07Å; V649-Q653 HydrophobicContact CG1-CG 4.5Å; V649-Q653 WeakPolarHBondContact O-CG 3.49Å; V649-Q653 PolarHBondContact O-N 2.9Å; V649-V659 HydrophobicContact CG1-CB 4.47Å; V649-V659 HydrophobicContact CG1-CG1 4.25Å; V649-V659 HydrophobicContact CG2-CG1 4.27Å; V649-M661 HydrophobicContact CG2-CB 4.48Å; V649-M661 HydrophobicContact CG2-SD 4.37Å; V649-A675 HydrophobicContact CG1-CB 4.14Å
650	K	92.3	Very high	90.3	Very high	64 Å²	64	38 Å²	38	28%	0.278	20%	0.2	S	C	.	.	H	α-helix	trans	-61.9	-37.9	178.2	-72.3	-173.5	173.5	-178.1	0	112.7	E271 L624 L646 I648 L652 Q653 N654	E271-K650 WeakPolarHBondContact OE1-CE 3.43Å; E271-K650 IonicContact OE1-NZ 2.74Å; E271-K650 PolarHBondContact OE1-NZ 2.9Å; E271-K650 IonicContact OE2-NZ 3.82Å; L624-K650 HydrophobicContact CD2-CB 4.22Å; L646-K650 HydrophobicContact CD1-CD 4.35Å; L646-K650 HydrophobicContact CD1-CG 4.46Å; L646-K650 HydrophobicContact CG-CD 4.35Å; L646-K650 PolarHBondContact O-N 3.43Å; I648-K650 PolarHBondContact O-N 2.96Å; K650-L652 VanDerWaalsContact C-N 3.35Å; K650-L652 PolarHBondContact O-N 3.25Å; K650-Q653 PolarHBondContact O-N 3.35Å; K650-N654 WeakPolarHBondContact O-CB 3.24Å; K650-N654 VanDerWaalsContact O-CG 3.24Å; K650-N654 PolarHBondContact O-N 2.98Å; K650-N654 PolarHBondContact O-ND2 2.76Å
651	S	93.8	Very high	90.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.2	-36.6	176.8	73.6	0	0	0	0	112.9	S628 K647 I648 V649 L655	S628-S651 PolarHBondContact OG-O 3.33Å; K647-S651 WeakPolarHBondContact O-CB 3.24Å; K647-S651 PolarHBondContact O-N 3.34Å; K647-S651 PolarHBondContact O-OG 2.91Å; I648-S651 PolarHBondContact O-N 2.87Å; I648-S651 PolarHBondContact O-OG 3.47Å; V649-S651 VanDerWaalsContact C-N 3.33Å; V649-S651 PolarHBondContact O-N 3.28Å; S651-L655 PolarHBondContact O-N 3.39Å
652	L	93.7	Very high	91.3	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-72	-41.5	176.1	-71	163.3	0	0	0	111.5	V366 C368 K587 V631 I648 V649 K650 N654 L655 A657 V659	V366-L652 HydrophobicContact CG1-CD1 3.95Å; V366-L652 HydrophobicContact CG1-CD2 4.37Å; V366-L652 HydrophobicContact CG2-CD2 4.48Å; C368-L652 WeakPolarHBondContact SG-CD1 3.43Å; K587-L652 HydrophobicContact CD-CD1 4.06Å; K587-L652 HydrophobicContact CD-CD2 4.26Å; V631-L652 HydrophobicContact CB-CD2 4.39Å; V631-L652 HydrophobicContact CG1-CD2 3.68Å; V631-L652 HydrophobicContact CG1-CG 4.18Å; V631-L652 HydrophobicContact CG2-CD1 4.41Å; V631-L652 HydrophobicContact CG2-CD2 3.84Å; V631-L652 HydrophobicContact CG2-CG 3.9Å; I648-L652 HydrophobicContact CG2-CD1 4Å; I648-L652 WeakPolarHBondContact O-CG 3.4Å; I648-L652 PolarHBondContact O-N 3.46Å; V649-L652 PolarHBondContact O-N 3.07Å; K650-L652 VanDerWaalsContact C-N 3.35Å; K650-L652 PolarHBondContact O-N 3.25Å; L652-N654 VanDerWaalsContact C-N 3.28Å; L652-N654 PolarHBondContact O-N 3.5Å; L652-L655 WeakPolarHBondContact O-CB 3.46Å; L652-L655 PolarHBondContact O-N 3.38Å; L652-L655 VanDerWaalsContact O-N 3.11Å; L652-A657 HydrophobicContact CB-CB 4.45Å; L652-A657 VanDerWaalsContact O-CB 3.3Å; L652-A657 WeakPolarHBondContact O-CB 3.25Å; L652-A657 PolarHBondContact O-N 2.95Å; L652-V659 HydrophobicContact CB-CG2 3.46Å; L652-V659 VanDerWaalsContact CB-CG2 3.46Å; L652-V659 HydrophobicContact CD1-CG1 4.35Å; L652-V659 HydrophobicContact CD1-CG2 4.32Å
653	Q	92.2	Very high	91.5	Very high	47 Å²	47	33 Å²	33	22%	0.22	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-36.2	174.5	-72.4	172.7	-32.6	0	0	112	V649 K650 L655 G656 V659 A674 D676	V649-Q653 HydrophobicContact CG1-CG 4.5Å; V649-Q653 WeakPolarHBondContact O-CG 3.49Å; V649-Q653 PolarHBondContact O-N 2.9Å; K650-Q653 PolarHBondContact O-N 3.35Å; Q653-L655 PolarHBondContact O-N 2.8Å; Q653-G656 WeakPolarHBondContact O-CA 3.35Å; Q653-G656 PolarHBondContact O-N 3.35Å; Q653-V659 HydrophobicContact CG-CB 4.49Å; Q653-V659 HydrophobicContact CG-CG2 3.95Å; Q653-A674 PolarHBondContact NE2-O 3.08Å; Q653-D676 PolarHBondContact NE2-OD2 3.28Å
654	N	90.6	Very high	91.5	Very high	110 Å²	110	24.2 Å²	24.2	59%	0.588	13%	0.134	S	C	*	.	H	α-helix	trans	-62.4	-27.9	174.7	-77.3	-19.2	0	0	0	113.4	K650 L652 G656	K650-N654 WeakPolarHBondContact O-CB 3.24Å; K650-N654 VanDerWaalsContact O-CG 3.24Å; K650-N654 PolarHBondContact O-N 2.98Å; K650-N654 PolarHBondContact O-ND2 2.76Å; L652-N654 VanDerWaalsContact C-N 3.28Å; L652-N654 PolarHBondContact O-N 3.5Å; N654-G656 PolarHBondContact O-N 2.7Å
655	L	89.8	Confident	90.8	Very high	90 Å²	90	23.9 Å²	23.9	47%	0.471	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-5.9	171.1	-64	173.9	0	0	0	113	S628 V631 S651 L652 Q653	S628-L655 WeakPolarHBondContact O-CD1 3.45Å; V631-L655 HydrophobicContact CG1-CD1 3.82Å; S651-L655 PolarHBondContact O-N 3.39Å; L652-L655 WeakPolarHBondContact O-CB 3.46Å; L652-L655 PolarHBondContact O-N 3.38Å; L652-L655 VanDerWaalsContact O-N 3.11Å; Q653-L655 PolarHBondContact O-N 2.8Å
656	G	87.8	Confident	89.8	Confident	43 Å²	43	23.3 Å²	23.3	44%	0.443	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	20.7	-172.7	0	0	0	0	0	113.7	Q653 N654	Q653-G656 WeakPolarHBondContact O-CA 3.35Å; Q653-G656 PolarHBondContact O-N 3.35Å; N654-G656 PolarHBondContact O-N 2.7Å
657	A	91.4	Very high	89.2	Confident	14 Å²	14	23.4 Å²	23.4	12%	0.116	13%	0.133	C	C	.	.			trans	-75.5	149	170.2	0	0	0	0	0	110.9	N365 V366 L652 V659	N365-A657 WeakPolarHBondContact OD1-CA 3.43Å; N365-A657 WeakPolarHBondContact OD1-CB 3.24Å; V366-A657 HydrophobicContact CG2-CB 3.94Å; L652-A657 HydrophobicContact CB-CB 4.45Å; L652-A657 VanDerWaalsContact O-CB 3.3Å; L652-A657 WeakPolarHBondContact O-CB 3.25Å; L652-A657 PolarHBondContact O-N 2.95Å; A657-V659 HydrophobicContact CB-CG2 4.3Å
658	V	93.3	Very high	88.8	Confident	6 Å²	6	21.6 Å²	21.6	4%	0.036	13%	0.125	C	C	.	.			trans	-97.5	109.6	170	179.2	0	0	0	0	106.8	T360 C363 N365 V366 D676 V786	T360-V658 HydrophobicContact CG2-CG1 3.72Å; C363-V658 HydrophobicContact CB-CG2 4.07Å; C363-V658 WeakPolarHBondContact O-CB 3.35Å; N365-V658 PolarHBondContact N-O 3.45Å; N365-V658 PolarHBondContact OD1-N 2.84Å; N365-V658 PolarHBondContact OD1-O 2.99Å; N365-V658 VanDerWaalsContact OD1-O 3.04Å; V366-V658 PolarHBondContact N-O 2.96Å; V658-D676 HydrophobicContact CG1-CB 3.82Å; V658-V786 HydrophobicContact CG2-CG1 3.25Å
659	V	95.1	Very high	88.3	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.6	-168.7	-173.6	0	0	0	0	109.7	V366 C368 V649 L652 Q653 A657 D676 I677	V366-V659 WeakPolarHBondContact O-CA 3.15Å; C368-V659 HydrophobicContact CB-CG1 4.42Å; V649-V659 HydrophobicContact CG1-CB 4.47Å; V649-V659 HydrophobicContact CG1-CG1 4.25Å; V649-V659 HydrophobicContact CG2-CG1 4.27Å; L652-V659 HydrophobicContact CB-CG2 3.46Å; L652-V659 VanDerWaalsContact CB-CG2 3.46Å; L652-V659 HydrophobicContact CD1-CG1 4.35Å; L652-V659 HydrophobicContact CD1-CG2 4.32Å; Q653-V659 HydrophobicContact CG-CB 4.49Å; Q653-V659 HydrophobicContact CG-CG2 3.95Å; A657-V659 HydrophobicContact CB-CG2 4.3Å; V659-D676 PolarHBondContact N-OD2 3.47Å; V659-D676 PolarHBondContact O-N 3.28Å; V659-I677 PolarHBondContact O-N 3.28Å
660	A	95.4	Very high	87.8	Confident	3 Å²	3	23.1 Å²	23.1	3%	0.025	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131	161.9	0	0	0	0	0	109.3	C364 V366 I367 C368 I677	C364-A660 VanDerWaalsContact SG-CB 3.59Å; V366-A660 PolarHBondContact O-N 2.98Å; I367-A660 CarbonylContact C-O 3.53Å; I367-A660 WeakPolarHBondContact CA-O 3.37Å; I367-A660 HydrophobicContact CG1-CB 4.28Å; C368-A660 PolarHBondContact N-O 3.14Å; A660-I677 CarbonylContact C-O 3.58Å; A660-I677 VanDerWaalsContact CA-O 3.27Å; A660-I677 WeakPolarHBondContact CA-O 3.33Å; A660-I677 HydrophobicContact CB-CB 4.03Å; A660-I677 HydrophobicContact CB-CD1 4.5Å
661	M	94.9	Very high	87.7	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.5	172.8	-179.5	67.3	-173.2	0	0	108.5	C368 I589 K645 V649 A671 L672 A675 I677 V679	C368-M661 HydrophobicContact CB-SD 3.54Å; C368-M661 VanDerWaalsContact CB-SD 3.54Å; C368-M661 CarbonylContact O-C 3.6Å; C368-M661 VanDerWaalsContact O-CA 3.3Å; C368-M661 WeakPolarHBondContact O-CA 3.13Å; I589-M661 HydrophobicContact CD1-SD 4.4Å; K645-M661 HydrophobicContact CB-CE 4.35Å; K645-M661 HydrophobicContact CD-CE 3.9Å; K645-M661 HydrophobicContact CG-CE 4.24Å; V649-M661 HydrophobicContact CG2-CB 4.48Å; V649-M661 HydrophobicContact CG2-SD 4.37Å; M661-A671 HydrophobicContact CE-CB 4.46Å; M661-A671 HydrophobicContact CG-CB 4.28Å; M661-L672 HydrophobicContact CB-CD2 4.21Å; M661-L672 HydrophobicContact CG-CD2 4.02Å; M661-L672 HydrophobicContact CG-CG 4.46Å; M661-L672 WeakPolarHBondContact O-CD2 3.48Å; M661-A675 HydrophobicContact CB-CB 3.68Å; M661-I677 PolarHBondContact N-O 3.25Å; M661-V679 PolarHBondContact O-N 3.09Å
662	T	93.2	Very high	87.5	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	142.9	171.1	62.9	0	0	0	0	110.4	I367 C368 S369 D370 T374 V679 I705	I367-T662 HydrophobicContact CG2-CG2 4.46Å; C368-T662 PolarHBondContact O-N 2.83Å; S369-T662 WeakPolarHBondContact CA-OG1 3.41Å; S369-T662 WeakPolarHBondContact CB-OG1 3.11Å; S369-T662 PolarHBondContact OG-OG1 2.95Å; D370-T662 PolarHBondContact N-O 3.4Å; T374-T662 WeakPolarHBondContact CG2-OG1 3.24Å; T662-V679 VanDerWaalsContact CA-O 3.29Å; T662-V679 WeakPolarHBondContact CA-O 3.22Å; T662-V679 HydrophobicContact CG2-CB 3.78Å; T662-V679 HydrophobicContact CG2-CG1 4.06Å; T662-V679 HydrophobicContact CG2-CG2 4.32Å; T662-I705 HydrophobicContact CG2-CD1 3.45Å; T662-I705 VanDerWaalsContact CG2-CD1 3.45Å
663	G	86.9	Confident	87.2	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	166	178.3	0	0	0	0	0	113	D668 V679 A680 M681	G663-D668 WeakPolarHBondContact CA-OD2 3.45Å; G663-V679 PolarHBondContact N-O 3.3Å; G663-V679 VanDerWaalsContact N-O 3.1Å; G663-A680 WeakPolarHBondContact O-CA 3.36Å; G663-M681 PolarHBondContact O-N 2.97Å
664	D	82.1	Confident	87	Confident	22 Å²	22	20 Å²	20	12%	0.118	12%	0.121	C	C	.	.			trans	-129	-33.8	-176.8	63.9	-18.5	0	0	0	112.9	D668 M681 G685 T686 C689	D664-D668 PolarHBondContact N-OD2 2.97Å; D664-M681 HydrophobicContact CB-CB 3.97Å; D664-M681 HydrophobicContact CB-CG 3.7Å; D664-G685 WeakPolarHBondContact O-CA 3.34Å; D664-T686 WeakPolarHBondContact O-CG2 3.46Å; D664-T686 PolarHBondContact O-N 3.35Å; D664-T686 PolarHBondContact O-OG1 2.7Å; D664-C689 PolarHBondContact O-SG 3.12Å
665	G	74.6	Confident	87.1	Confident	7 Å²	7	14.8 Å²	14.8	7%	0.072	9%	0.093	C	C	.	.	S	Bend	trans	-89.1	152.4	179.1	0	0	0	0	0	114.2	N667 D668 C689	G665-N667 PolarHBondContact O-N 3.1Å; G665-D668 VanDerWaalsContact O-CB 3.29Å; G665-D668 WeakPolarHBondContact O-CB 3.27Å; G665-D668 PolarHBondContact O-N 3.49Å; G665-C689 PolarHBondContact O-SG 3.13Å
666	V	71.1	Confident	87.2	Confident	2 Å²	2	12 Å²	12	1%	0.012	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-52.2	-30	-179.4	179.8	0	0	0	0	112.7	S207 L208 F261 V264 D668 A669 T686 V688	S207-V666 WeakPolarHBondContact O-CA 3.44Å; S207-V666 WeakPolarHBondContact O-CB 3.38Å; S207-V666 WeakPolarHBondContact O-CG2 3.4Å; S207-V666 PolarHBondContact O-N 3.19Å; L208-V666 HydrophobicContact CD1-CG1 4.28Å; F261-V666 HydrophobicContact CD2-CG2 4.04Å; F261-V666 HydrophobicContact CE2-CG1 4.44Å; F261-V666 HydrophobicContact CE2-CG2 3.41Å; F261-V666 VanDerWaalsContact CE2-CG2 3.41Å; F261-V666 HydrophobicContact CZ-CG2 4.25Å; V264-V666 HydrophobicContact CB-CG1 4.16Å; V264-V666 HydrophobicContact CG1-CG1 3.68Å; V264-V666 HydrophobicContact CG2-CG1 4.43Å; V666-D668 PolarHBondContact O-N 2.94Å; V666-D668 VanDerWaalsContact O-N 3.11Å; V666-A669 WeakPolarHBondContact O-CB 3.32Å; V666-A669 PolarHBondContact O-N 2.91Å; V666-T686 HydrophobicContact CG2-CG2 4.11Å; V666-V688 HydrophobicContact CG1-CG1 4.06Å; V666-V688 HydrophobicContact CG2-CB 4.46Å
667	N	75.3	Confident	87.5	Confident	37 Å²	37	10 Å²	10	20%	0.198	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-51.5	-27.5	170	-80.2	-14.9	0	0	0	114.6	L208 T209 G210 P642 G665	L208-N667 PolarHBondContact O-OD1 3.31Å; T209-N667 PolarHBondContact O-ND2 3.28Å; G210-N667 VanDerWaalsContact CA-ND2 3.29Å; G210-N667 WeakPolarHBondContact CA-ND2 3.33Å; G210-N667 PolarHBondContact N-ND2 3.3Å; G210-N667 VanDerWaalsContact N-ND2 3.11Å; P642-N667 HydrophobicContact CB-CB 4.46Å; P642-N667 WeakPolarHBondContact CB-O 3.31Å; P642-N667 HydrophobicContact CG-CB 3.74Å; P642-N667 WeakPolarHBondContact CG-OD1 3.24Å; G665-N667 PolarHBondContact O-N 3.1Å
668	D	84.1	Confident	87.6	Confident	3 Å²	3	9.3 Å²	9.3	2%	0.016	5%	0.052	C	C	.	.	G	3₁₀ helix	trans	-89.1	-18.5	179	-62.7	-43.7	0	0	0	112.7	K645 G663 D664 G665 V666 V670 A671 L672	K645-D668 WeakPolarHBondContact CD-OD1 3.45Å; K645-D668 WeakPolarHBondContact CE-OD1 3.24Å; K645-D668 IonicContact NZ-OD1 3.51Å; K645-D668 PolarHBondContact NZ-OD1 3.38Å; K645-D668 IonicContact NZ-OD2 3.45Å; G663-D668 WeakPolarHBondContact CA-OD2 3.45Å; D664-D668 PolarHBondContact N-OD2 2.97Å; G665-D668 VanDerWaalsContact O-CB 3.29Å; G665-D668 WeakPolarHBondContact O-CB 3.27Å; G665-D668 PolarHBondContact O-N 3.49Å; V666-D668 PolarHBondContact O-N 2.94Å; V666-D668 VanDerWaalsContact O-N 3.11Å; D668-V670 VanDerWaalsContact C-N 3.32Å; D668-V670 PolarHBondContact O-N 3.11Å; D668-A671 CarbonylContact O-C 3.58Å; D668-A671 WeakPolarHBondContact O-CA 3.11Å; D668-A671 PolarHBondContact O-N 3.49Å; D668-L672 HydrophobicContact CB-CD1 3.9Å; D668-L672 HydrophobicContact CB-CG 4.08Å; D668-L672 WeakPolarHBondContact O-CB 3.28Å; D668-L672 VanDerWaalsContact O-CG 3.27Å; D668-L672 WeakPolarHBondContact O-CG 3.22Å; D668-L672 PolarHBondContact O-N 3.48Å
669	A	81.8	Confident	87.7	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-56.1	-42.9	-169.7	0	0	0	0	0	113.3	V666 L672 K673 V688 A692	V666-A669 WeakPolarHBondContact O-CB 3.32Å; V666-A669 PolarHBondContact O-N 2.91Å; A669-L672 PolarHBondContact O-N 3.45Å; A669-K673 WeakPolarHBondContact O-CB 3.21Å; A669-K673 PolarHBondContact O-N 3.29Å; A669-V688 HydrophobicContact CB-CG1 3.52Å; A669-A692 HydrophobicContact CB-CB 3.94Å; A669-A692 WeakPolarHBondContact O-CB 3.4Å
670	V	85.6	Confident	87.4	Confident	32 Å²	32	9 Å²	9	19%	0.194	5%	0.051	C	C	.	.	H	α-helix	trans	-67.4	-40.7	177.9	-174.8	0	0	0	0	111.1	V264 L646 D668 A674	V264-V670 HydrophobicContact CG1-CG2 4.38Å; L646-V670 HydrophobicContact CD1-CG1 4.28Å; L646-V670 HydrophobicContact CD2-CG1 3.96Å; D668-V670 VanDerWaalsContact C-N 3.32Å; D668-V670 PolarHBondContact O-N 3.11Å; V670-A674 WeakPolarHBondContact O-CB 3.41Å; V670-A674 PolarHBondContact O-N 3.45Å; V670-A674 VanDerWaalsContact O-N 3.07Å
671	A	89.6	Confident	87.1	Confident	1 Å²	1	9 Å²	9	1%	0.008	5%	0.05	C	C	.	.	H	α-helix	trans	-70.8	-36.6	177.6	0	0	0	0	0	112.2	K645 M661 D668 A674 A675	K645-A671 HydrophobicContact CB-CB 3.87Å; M661-A671 HydrophobicContact CE-CB 4.46Å; M661-A671 HydrophobicContact CG-CB 4.28Å; D668-A671 CarbonylContact O-C 3.58Å; D668-A671 WeakPolarHBondContact O-CA 3.11Å; D668-A671 PolarHBondContact O-N 3.49Å; A671-A674 PolarHBondContact O-N 3.48Å; A671-A675 WeakPolarHBondContact O-CB 3.32Å; A671-A675 PolarHBondContact O-N 3.34Å
672	L	89.8	Confident	86.5	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62	-44.8	174.3	-73.8	170.7	0	0	0	110.9	M661 D668 A669 G678 V679 C689 A692	M661-L672 HydrophobicContact CB-CD2 4.21Å; M661-L672 HydrophobicContact CG-CD2 4.02Å; M661-L672 HydrophobicContact CG-CG 4.46Å; M661-L672 WeakPolarHBondContact O-CD2 3.48Å; D668-L672 HydrophobicContact CB-CD1 3.9Å; D668-L672 HydrophobicContact CB-CG 4.08Å; D668-L672 WeakPolarHBondContact O-CB 3.28Å; D668-L672 VanDerWaalsContact O-CG 3.27Å; D668-L672 WeakPolarHBondContact O-CG 3.22Å; D668-L672 PolarHBondContact O-N 3.48Å; A669-L672 PolarHBondContact O-N 3.45Å; L672-G678 VanDerWaalsContact O-CA 3.31Å; L672-G678 WeakPolarHBondContact O-CA 3.35Å; L672-V679 WeakPolarHBondContact CD2-O 3.41Å; L672-C689 HydrophobicContact CD1-CB 4.02Å; L672-A692 HydrophobicContact CB-CB 4.47Å
673	K	86	Confident	85.8	Confident	42 Å²	42	16.5 Å²	16.5	18%	0.183	9%	0.089	C	C	.	.	H	α-helix	trans	-68.3	-37.4	178.8	-174.6	65.7	173	-141.5	0	113.1	M268 E271 A669 A692	M268-K673 HydrophobicContact CG-CB 3.89Å; M268-K673 HydrophobicContact CG-CD 4.43Å; M268-K673 HydrophobicContact CG-CG 3.99Å; M268-K673 HydrophobicContact SD-CB 4.48Å; M268-K673 HydrophobicContact SD-CD 3.92Å; M268-K673 HydrophobicContact SD-CG 4.07Å; E271-K673 HydrophobicContact CB-CG 4.37Å; A669-K673 WeakPolarHBondContact O-CB 3.21Å; A669-K673 PolarHBondContact O-N 3.29Å; K673-A692 HydrophobicContact CB-CB 4.5Å
674	A	88.9	Confident	85.2	Confident	6 Å²	6	19.3 Å²	19.3	5%	0.05	11%	0.107	C	C	.	.	H	α-helix	trans	-77	-24	179.6	0	0	0	0	0	113.3	E271 L646 Q653 V670 A671	E271-A674 HydrophobicContact CG-CB 4.18Å; L646-A674 HydrophobicContact CD1-CB 3.33Å; Q653-A674 PolarHBondContact NE2-O 3.08Å; V670-A674 WeakPolarHBondContact O-CB 3.41Å; V670-A674 PolarHBondContact O-N 3.45Å; V670-A674 VanDerWaalsContact O-N 3.07Å; A671-A674 PolarHBondContact O-N 3.48Å
675	A	92.8	Very high	84.9	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.008	10%	0.102	C	C	.	.	S	Bend	trans	-63.5	156.7	176.4	0	0	0	0	0	111.4	V649 M661 A671 I677	V649-A675 HydrophobicContact CG1-CB 4.14Å; M661-A675 HydrophobicContact CB-CB 3.68Å; A671-A675 WeakPolarHBondContact O-CB 3.32Å; A671-A675 PolarHBondContact O-N 3.34Å; A675-I677 PolarHBondContact O-N 3.4Å
676	D	92.6	Very high	84.7	Confident	32 Å²	32	18.6 Å²	18.6	17%	0.171	10%	0.102	C	C	.	.	S	Bend	trans	-67.1	-25.6	172.5	-59.7	-79.3	0	0	0	111.3	T360 Q653 V658 V659	T360-D676 HydrophobicContact CG2-CB 4.12Å; Q653-D676 PolarHBondContact NE2-OD2 3.28Å; V658-D676 HydrophobicContact CG1-CB 3.82Å; V659-D676 PolarHBondContact N-OD2 3.47Å; V659-D676 PolarHBondContact O-N 3.28Å
677	I	94.3	Very high	84.7	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	105.3	175.9	-47.8	176.3	0	0	0	108.7	I357 T360 L361 C364 V659 A660 M661 A675 V679	I357-I677 HydrophobicContact CG2-CG1 4.35Å; I357-I677 HydrophobicContact CG2-CG2 3.88Å; T360-I677 HydrophobicContact CG2-CD1 3.91Å; T360-I677 HydrophobicContact CG2-CG1 3.66Å; L361-I677 HydrophobicContact CB-CD1 4.34Å; L361-I677 HydrophobicContact CD2-CD1 3.74Å; L361-I677 HydrophobicContact CD2-CG2 3.94Å; L361-I677 HydrophobicContact CG-CD1 4Å; C364-I677 HydrophobicContact CB-CD1 4.04Å; V659-I677 PolarHBondContact O-N 3.28Å; A660-I677 CarbonylContact C-O 3.58Å; A660-I677 VanDerWaalsContact CA-O 3.27Å; A660-I677 WeakPolarHBondContact CA-O 3.33Å; A660-I677 HydrophobicContact CB-CB 4.03Å; A660-I677 HydrophobicContact CB-CD1 4.5Å; M661-I677 PolarHBondContact N-O 3.25Å; A675-I677 PolarHBondContact O-N 3.4Å; I677-V679 HydrophobicContact CG2-CG2 4.03Å
678	G	93.4	Very high	84.4	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.5	168.4	0	0	0	0	0	111.5	L672 D694 M695	L672-G678 VanDerWaalsContact O-CA 3.31Å; L672-G678 WeakPolarHBondContact O-CA 3.35Å; G678-D694 PolarHBondContact N-OD2 3.46Å; G678-D694 VanDerWaalsContact N-OD2 3.09Å; G678-D694 PolarHBondContact O-N 3.39Å; G678-M695 PolarHBondContact O-N 2.74Å
679	V	93.8	Very high	84	Confident	1 Å²	1	20 Å²	20	1%	0.006	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	117.4	177.7	-175.8	0	0	0	0	110.2	M661 T662 G663 L672 I677 M695 L697 I705	M661-V679 PolarHBondContact O-N 3.09Å; T662-V679 VanDerWaalsContact CA-O 3.29Å; T662-V679 WeakPolarHBondContact CA-O 3.22Å; T662-V679 HydrophobicContact CG2-CB 3.78Å; T662-V679 HydrophobicContact CG2-CG1 4.06Å; T662-V679 HydrophobicContact CG2-CG2 4.32Å; G663-V679 PolarHBondContact N-O 3.3Å; G663-V679 VanDerWaalsContact N-O 3.1Å; L672-V679 WeakPolarHBondContact CD2-O 3.41Å; I677-V679 HydrophobicContact CG2-CG2 4.03Å; V679-M695 CarbonylContact C-O 3.57Å; V679-M695 WeakPolarHBondContact CA-O 3.47Å; V679-M695 HydrophobicContact CG1-SD 4.47Å; V679-M695 HydrophobicContact CG2-CB 4.4Å; V679-M695 HydrophobicContact CG2-SD 4.46Å; V679-L697 HydrophobicContact CG1-CD1 3.73Å; V679-L697 HydrophobicContact CG1-CD2 3.95Å; V679-L697 HydrophobicContact CG1-CG 3.65Å; V679-I705 HydrophobicContact CG1-CD1 4.25Å; V679-I705 HydrophobicContact CG1-CG1 4.31Å
680	A	90.5	Very high	83.9	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	149.3	177	0	0	0	0	0	112.6	G663 C689 K690 A693 M695 I696 L697	G663-A680 WeakPolarHBondContact O-CA 3.36Å; A680-C689 HydrophobicContact CB-CB 4.27Å; A680-C689 WeakPolarHBondContact CB-O 3.26Å; A680-K690 HydrophobicContact CB-CG 4.27Å; A680-A693 HydrophobicContact CB-CB 3.46Å; A680-A693 VanDerWaalsContact CB-CB 3.46Å; A680-M695 PolarHBondContact N-O 3.37Å; A680-I696 WeakPolarHBondContact O-CA 3.26Å; A680-L697 PolarHBondContact O-N 3.06Å
681	M	88.8	Confident	83.5	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	137.5	169.6	-51.6	-53.7	-78.9	0	0	110.1	G373 T374 G663 D664 T684 G685 K690 L697 D700	G373-M681 WeakPolarHBondContact O-CE 3.32Å; T374-M681 HydrophobicContact CG2-CE 4.47Å; T374-M681 HydrophobicContact CG2-SD 4Å; G663-M681 PolarHBondContact O-N 2.97Å; D664-M681 HydrophobicContact CB-CB 3.97Å; D664-M681 HydrophobicContact CB-CG 3.7Å; M681-T684 WeakPolarHBondContact CB-OG1 3.39Å; M681-G685 WeakPolarHBondContact O-CA 3.49Å; M681-G685 PolarHBondContact O-N 2.98Å; M681-K690 VanDerWaalsContact O-CE 3.28Å; M681-K690 WeakPolarHBondContact O-CE 3.35Å; M681-L697 HydrophobicContact SD-CD1 4Å; M681-D700 VanDerWaalsContact CE-C 3.46Å; M681-D700 HydrophobicContact CE-CB 3.43Å; M681-D700 VanDerWaalsContact CE-CB 3.43Å; M681-D700 VanDerWaalsContact CE-O 3.27Å; M681-D700 WeakPolarHBondContact CE-O 3.22Å
682	G	82.1	Confident	82.9	Confident	16 Å²	16	23.9 Å²	23.9	17%	0.165	13%	0.125	C	C	.	.	S	Bend	trans	-83	-37.8	-174.6	0	0	0	0	0	113.6	K690 L697 D700	G682-K690 WeakPolarHBondContact O-CE 3.48Å; G682-K690 PolarHBondContact O-NZ 3.39Å; G682-L697 WeakPolarHBondContact CA-O 3.45Å; G682-L697 PolarHBondContact N-O 3.25Å; G682-D700 PolarHBondContact N-OD1 3.05Å
683	Q	77.9	Confident	82.8	Confident	143 Å²	143	24 Å²	24	67%	0.668	13%	0.126	S	C	*	.	S	Bend	trans	-95.3	-53.2	-179.7	-46.7	179	10.3	0	0	111.1	V698 D700	Q683-V698 WeakPolarHBondContact CG-O 3.18Å; Q683-V698 PolarHBondContact NE2-O 3.45Å; Q683-D700 VanDerWaalsContact CB-OD2 3.26Å; Q683-D700 WeakPolarHBondContact CB-OD2 3.31Å; Q683-D700 PolarHBondContact N-OD1 2.94Å; Q683-D700 PolarHBondContact N-OD2 3.18Å
684	T	74.1	Confident	82.9	Confident	60 Å²	60	22.2 Å²	22.2	37%	0.368	12%	0.118	S	C	.	.	S	Bend	trans	-78.4	-22.6	179.7	60.8	0	0	0	0	113.7	M681 D700	M681-T684 WeakPolarHBondContact CB-OG1 3.39Å; T684-D700 WeakPolarHBondContact CG2-OD2 3.11Å; T684-D700 PolarHBondContact N-OD2 3.4Å; T684-D700 PolarHBondContact OG1-OD2 3.3Å
685	G	75.3	Confident	82.9	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.01	12%	0.116	C	C	.	.	S	Bend	trans	-69.3	141.2	-175.4	0	0	0	0	0	113.6	D664 M681 K690	D664-G685 WeakPolarHBondContact O-CA 3.34Å; M681-G685 WeakPolarHBondContact O-CA 3.49Å; M681-G685 PolarHBondContact O-N 2.98Å; G685-K690 WeakPolarHBondContact O-CE 3.29Å; G685-K690 PolarHBondContact O-NZ 2.97Å; G685-K690 VanDerWaalsContact O-NZ 3.1Å
686	T	71.9	Confident	82.8	Confident	12 Å²	12	23.1 Å²	23.1	7%	0.074	12%	0.122	C	C	.	.			trans	-69.5	154.7	174	64.7	0	0	0	0	111.1	S207 D664 V666 V688 C689 K690	S207-T686 VanDerWaalsContact CB-CG2 3.42Å; S207-T686 VanDerWaalsContact OG-CG2 3.25Å; S207-T686 WeakPolarHBondContact OG-CG2 3.23Å; D664-T686 WeakPolarHBondContact O-CG2 3.46Å; D664-T686 PolarHBondContact O-N 3.35Å; D664-T686 PolarHBondContact O-OG1 2.7Å; V666-T686 HydrophobicContact CG2-CG2 4.11Å; T686-V688 PolarHBondContact O-N 2.88Å; T686-C689 PolarHBondContact O-N 3.16Å; T686-C689 WeakPolarHBondContact OG1-CB 3.41Å; T686-C689 PolarHBondContact OG1-N 2.87Å; T686-C689 PolarHBondContact OG1-SG 3.5Å; T686-K690 PolarHBondContact O-N 3.48Å
687	D	70.7	Confident	82.8	Confident	66 Å²	66	21.6 Å²	21.6	35%	0.353	11%	0.114	S	C	.	.	H	α-helix	trans	-64.8	-29.8	-178.3	-58.3	-41.5	0	0	0	111.7	R188 K690 E691	R188-D687 IonicContact CZ-OD2 3.8Å; R188-D687 IonicContact NH1-OD2 3.29Å; R188-D687 PolarHBondContact NH1-OD2 3.25Å; D687-K690 PolarHBondContact O-N 2.93Å; D687-K690 IonicContact OD1-NZ 2.81Å; D687-E691 VanDerWaalsContact O-CB 3.31Å; D687-E691 WeakPolarHBondContact O-CB 3.33Å; D687-E691 PolarHBondContact O-N 3.11Å
688	V	68.3	Low	82.5	Confident	5 Å²	5	24.6 Å²	24.6	3%	0.03	13%	0.132	C	C	.	.	H	α-helix	trans	-69.1	-36.7	171.6	157.1	0	0	0	0	112.9	F261 F265 V666 A669 T686 E691 A692	F261-V688 HydrophobicContact CD1-CG2 4Å; F261-V688 HydrophobicContact CE1-CB 4.03Å; F261-V688 HydrophobicContact CE1-CG2 3.02Å; F261-V688 HydrophobicContact CE2-CB 4.3Å; F261-V688 HydrophobicContact CE2-CG2 4.12Å; F261-V688 HydrophobicContact CZ-CB 3.57Å; F261-V688 HydrophobicContact CZ-CG2 3.09Å; F265-V688 HydrophobicContact CD2-CG2 4.17Å; V666-V688 HydrophobicContact CG1-CG1 4.06Å; V666-V688 HydrophobicContact CG2-CB 4.46Å; A669-V688 HydrophobicContact CB-CG1 3.52Å; T686-V688 PolarHBondContact O-N 2.88Å; V688-E691 PolarHBondContact O-N 2.85Å; V688-A692 VanDerWaalsContact O-CB 3.25Å; V688-A692 WeakPolarHBondContact O-CB 3.08Å; V688-A692 PolarHBondContact O-N 3.38Å
689	C	76.7	Confident	82.2	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.3	-43.9	173.1	-75.4	0	0	0	0	112.1	D664 G665 L672 A680 T686 E691 A692 A693	D664-C689 PolarHBondContact O-SG 3.12Å; G665-C689 PolarHBondContact O-SG 3.13Å; L672-C689 HydrophobicContact CD1-CB 4.02Å; A680-C689 HydrophobicContact CB-CB 4.27Å; A680-C689 WeakPolarHBondContact CB-O 3.26Å; T686-C689 PolarHBondContact O-N 3.16Å; T686-C689 WeakPolarHBondContact OG1-CB 3.41Å; T686-C689 PolarHBondContact OG1-N 2.87Å; T686-C689 PolarHBondContact OG1-SG 3.5Å; C689-E691 PolarHBondContact O-N 3.37Å; C689-A692 PolarHBondContact O-N 2.84Å; C689-A693 WeakPolarHBondContact O-CB 3.21Å; C689-A693 PolarHBondContact O-N 3.32Å
690	K	79.2	Confident	81.9	Confident	32 Å²	32	26.2 Å²	26.2	14%	0.139	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-34.8	174.4	-67.6	172.3	-169.2	164.3	0	111.5	A680 M681 G682 G685 T686 D687 I696	A680-K690 HydrophobicContact CB-CG 4.27Å; M681-K690 VanDerWaalsContact O-CE 3.28Å; M681-K690 WeakPolarHBondContact O-CE 3.35Å; G682-K690 WeakPolarHBondContact O-CE 3.48Å; G682-K690 PolarHBondContact O-NZ 3.39Å; G685-K690 WeakPolarHBondContact O-CE 3.29Å; G685-K690 PolarHBondContact O-NZ 2.97Å; G685-K690 VanDerWaalsContact O-NZ 3.1Å; T686-K690 PolarHBondContact O-N 3.48Å; D687-K690 PolarHBondContact O-N 2.93Å; D687-K690 IonicContact OD1-NZ 2.81Å; K690-I696 HydrophobicContact CB-CD1 3.93Å; K690-I696 HydrophobicContact CB-CG1 4.4Å; K690-I696 HydrophobicContact CG-CD1 4.3Å; K690-I696 HydrophobicContact CG-CG2 4.39Å
691	E	77.1	Confident	81.7	Confident	82 Å²	82	28 Å²	28	38%	0.383	15%	0.15	S	C	.	.	H	α-helix	trans	-73.4	-43.8	177.6	-169.7	48.9	-135.5	0	0	112.5	F265 K353 D687 V688 C689 A693	F265-E691 HydrophobicContact CE2-CG 4.24Å; K353-E691 PolarHBondContact NZ-O 2.92Å; K353-E691 IonicContact NZ-OE1 3.56Å; K353-E691 PolarHBondContact NZ-OE1 3.11Å; K353-E691 IonicContact NZ-OE2 3.37Å; K353-E691 PolarHBondContact NZ-OE2 2.84Å; D687-E691 VanDerWaalsContact O-CB 3.31Å; D687-E691 WeakPolarHBondContact O-CB 3.33Å; D687-E691 PolarHBondContact O-N 3.11Å; V688-E691 PolarHBondContact O-N 2.85Å; C689-E691 PolarHBondContact O-N 3.37Å; E691-A693 VanDerWaalsContact C-N 3.34Å; E691-A693 PolarHBondContact O-N 3.02Å
692	A	78.1	Confident	81.8	Confident	1 Å²	1	28 Å²	28	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-68.8	-30.9	178.6	0	0	0	0	0	113.3	M268 A669 L672 K673 V688 C689	M268-A692 HydrophobicContact CG-CB 3.91Å; M268-A692 HydrophobicContact SD-CB 4.29Å; A669-A692 HydrophobicContact CB-CB 3.94Å; A669-A692 WeakPolarHBondContact O-CB 3.4Å; L672-A692 HydrophobicContact CB-CB 4.47Å; K673-A692 HydrophobicContact CB-CB 4.5Å; V688-A692 VanDerWaalsContact O-CB 3.25Å; V688-A692 WeakPolarHBondContact O-CB 3.08Å; V688-A692 PolarHBondContact O-N 3.38Å; C689-A692 PolarHBondContact O-N 2.84Å
693	A	86.5	Confident	82.2	Confident	2 Å²	2	30.3 Å²	30.3	2%	0.017	16%	0.157	C	C	.	.			trans	-73.5	153.5	-178.2	0	0	0	0	0	113.1	K353 A680 C689 E691 M695	K353-A693 WeakPolarHBondContact CD-O 3.36Å; A680-A693 HydrophobicContact CB-CB 3.46Å; A680-A693 VanDerWaalsContact CB-CB 3.46Å; C689-A693 WeakPolarHBondContact O-CB 3.21Å; C689-A693 PolarHBondContact O-N 3.32Å; E691-A693 VanDerWaalsContact C-N 3.34Å; E691-A693 PolarHBondContact O-N 3.02Å; A693-M695 WeakPolarHBondContact CB-O 3.23Å
694	D	88.1	Confident	82.8	Confident	5 Å²	5	23.9 Å²	23.9	3%	0.027	13%	0.127	C	C	.	.	S	Bend	trans	-90.8	-22.3	172.5	-62.2	-59.6	0	0	0	112.5	K353 K354 I357 G678	K353-D694 PolarHBondContact N-O 3.12Å; K354-D694 WeakPolarHBondContact CD-OD1 3.44Å; K354-D694 WeakPolarHBondContact CE-OD1 3.21Å; K354-D694 IonicContact NZ-OD1 2.86Å; K354-D694 PolarHBondContact NZ-OD1 2.68Å; I357-D694 HydrophobicContact CB-CB 4.36Å; I357-D694 HydrophobicContact CD1-CB 4.22Å; I357-D694 HydrophobicContact CG1-CB 3.86Å; I357-D694 HydrophobicContact CG2-CB 3.94Å; G678-D694 PolarHBondContact N-OD2 3.46Å; G678-D694 VanDerWaalsContact N-OD2 3.09Å; G678-D694 PolarHBondContact O-N 3.39Å
695	M	89.9	Confident	83.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	142.7	178.3	179.7	-172.6	-68.4	0	0	110.8	A350 I351 V352 L361 G678 V679 A680 A693 L697 A708	A350-M695 HydrophobicContact CB-SD 4.37Å; I351-M695 CarbonylContact O-C 3.54Å; I351-M695 VanDerWaalsContact O-CA 3.24Å; I351-M695 WeakPolarHBondContact O-CA 3.28Å; I351-M695 WeakPolarHBondContact O-CG 3.25Å; V352-M695 HydrophobicContact CG2-CE 3.92Å; V352-M695 HydrophobicContact CG2-CG 4.39Å; L361-M695 HydrophobicContact CD1-CE 3.23Å; L361-M695 HydrophobicContact CD2-CE 3.57Å; L361-M695 HydrophobicContact CG-CE 3.96Å; G678-M695 PolarHBondContact O-N 2.74Å; V679-M695 CarbonylContact C-O 3.57Å; V679-M695 WeakPolarHBondContact CA-O 3.47Å; V679-M695 HydrophobicContact CG1-SD 4.47Å; V679-M695 HydrophobicContact CG2-CB 4.4Å; V679-M695 HydrophobicContact CG2-SD 4.46Å; A680-M695 PolarHBondContact N-O 3.37Å; A693-M695 WeakPolarHBondContact CB-O 3.23Å; M695-L697 HydrophobicContact CG-CD2 4.48Å; M695-L697 HydrophobicContact SD-CD2 4.04Å; M695-A708 HydrophobicContact CE-CB 3.65Å; M695-A708 HydrophobicContact SD-CB 4.09Å
696	I	90.4	Very high	84.4	Confident	27 Å²	27	23.1 Å²	23.1	14%	0.138	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.8	176.5	-55.2	169.4	0	0	0	109.2	I351 K353 A680 K690	I351-I696 HydrophobicContact CB-CB 4.38Å; I351-I696 PolarHBondContact N-O 2.83Å; I351-I696 PolarHBondContact O-N 3.38Å; K353-I696 HydrophobicContact CD-CD1 4.29Å; A680-I696 WeakPolarHBondContact O-CA 3.26Å; K690-I696 HydrophobicContact CB-CD1 3.93Å; K690-I696 HydrophobicContact CB-CG1 4.4Å; K690-I696 HydrophobicContact CG-CD1 4.3Å; K690-I696 HydrophobicContact CG-CG2 4.39Å
697	L	91.5	Very high	85.3	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	105.7	176.3	-52.6	179	0	0	0	109.6	V679 A680 M681 G682 M695 D699 D700 T704 I705	V679-L697 HydrophobicContact CG1-CD1 3.73Å; V679-L697 HydrophobicContact CG1-CD2 3.95Å; V679-L697 HydrophobicContact CG1-CG 3.65Å; A680-L697 PolarHBondContact O-N 3.06Å; M681-L697 HydrophobicContact SD-CD1 4Å; G682-L697 WeakPolarHBondContact CA-O 3.45Å; G682-L697 PolarHBondContact N-O 3.25Å; M695-L697 HydrophobicContact CG-CD2 4.48Å; M695-L697 HydrophobicContact SD-CD2 4.04Å; L697-D699 PolarHBondContact O-N 3.3Å; L697-D700 PolarHBondContact O-N 2.94Å; L697-T704 HydrophobicContact CD2-CG2 3.71Å; L697-I705 HydrophobicContact CD1-CD1 3.95Å; L697-I705 HydrophobicContact CD1-CG1 3.69Å; L697-I705 HydrophobicContact CD2-CG1 3.98Å; L697-I705 HydrophobicContact CG-CG1 4.46Å
698	V	88.4	Confident	86.4	Confident	62 Å²	62	20.9 Å²	20.9	38%	0.376	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-27.3	-172.5	-179	0	0	0	0	112.7	R349 I351 Q683	R349-V698 HydrophobicContact CB-CB 4.2Å; R349-V698 WeakPolarHBondContact O-CB 3.42Å; R349-V698 WeakPolarHBondContact O-CG2 3.35Å; R349-V698 PolarHBondContact O-N 2.92Å; I351-V698 HydrophobicContact CD1-CG2 3.43Å; I351-V698 VanDerWaalsContact CD1-CG2 3.43Å; I351-V698 HydrophobicContact CG1-CG2 3.66Å; Q683-V698 WeakPolarHBondContact CG-O 3.18Å; Q683-V698 PolarHBondContact NE2-O 3.45Å
699	D	86.9	Confident	87.5	Confident	32 Å²	32	20.7 Å²	20.7	17%	0.171	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	5	-178.1	55.7	-0.8	0	0	0	115.1	R349 L697 D701 T704	R349-D699 WeakPolarHBondContact CD-OD2 3.48Å; R349-D699 IonicContact NH1-OD2 3.02Å; R349-D699 PolarHBondContact NH1-OD2 3.07Å; L697-D699 PolarHBondContact O-N 3.3Å; D699-D701 PolarHBondContact O-N 3.16Å; D699-D701 VanDerWaalsContact O-N 3.16Å; D699-D701 PolarHBondContact OD1-N 3.16Å; D699-T704 PolarHBondContact OD1-OG1 3.43Å; D699-T704 PolarHBondContact OD2-OG1 2.88Å
700	D	86.7	Confident	88.2	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.016	12%	0.119	C	C	.	.			trans	56	29.3	-178.8	-65.8	-0.6	0	0	0	113.4	R569 M681 G682 Q683 T684 L697	R569-D700 WeakPolarHBondContact CD-O 3.2Å; R569-D700 PolarHBondContact NE-O 3.06Å; R569-D700 PolarHBondContact NH1-O 3.29Å; M681-D700 VanDerWaalsContact CE-C 3.46Å; M681-D700 HydrophobicContact CE-CB 3.43Å; M681-D700 VanDerWaalsContact CE-CB 3.43Å; M681-D700 VanDerWaalsContact CE-O 3.27Å; M681-D700 WeakPolarHBondContact CE-O 3.22Å; G682-D700 PolarHBondContact N-OD1 3.05Å; Q683-D700 VanDerWaalsContact CB-OD2 3.26Å; Q683-D700 WeakPolarHBondContact CB-OD2 3.31Å; Q683-D700 PolarHBondContact N-OD1 2.94Å; Q683-D700 PolarHBondContact N-OD2 3.18Å; T684-D700 WeakPolarHBondContact CG2-OD2 3.11Å; T684-D700 PolarHBondContact N-OD2 3.4Å; T684-D700 PolarHBondContact OG1-OD2 3.3Å; L697-D700 PolarHBondContact O-N 2.94Å
701	D	88.1	Confident	88.8	Confident	38 Å²	38	22.1 Å²	22.1	20%	0.203	12%	0.116	C	C	.	.			trans	-104.2	127.7	-179.6	-168.4	-5.3	0	0	0	112	D699 Q703 T704	D699-D701 PolarHBondContact O-N 3.16Å; D699-D701 VanDerWaalsContact O-N 3.16Å; D699-D701 PolarHBondContact OD1-N 3.16Å; D701-Q703 PolarHBondContact O-N 3.46Å; D701-Q703 WeakPolarHBondContact OD1-CG 3.41Å; D701-Q703 PolarHBondContact OD1-N 2.98Å; D701-T704 VanDerWaalsContact O-CB 3.23Å; D701-T704 WeakPolarHBondContact O-CB 3.14Å; D701-T704 PolarHBondContact O-N 2.92Å; D701-T704 VanDerWaalsContact O-N 3.15Å
702	F	89.3	Confident	89.5	Confident	1 Å²	1	18.2 Å²	18.2	0%	0.004	10%	0.098	C	C	.	.	H	α-helix	trans	-63.4	-27.3	174.1	-166.8	-94	0	0	0	112.4	I367 L375 V572 A575 I576 L579 I586 T704 I705	I367-F702 HydrophobicContact CG2-CE2 4.34Å; I367-F702 HydrophobicContact CG2-CZ 4.39Å; L375-F702 HydrophobicContact CD2-CD2 3.89Å; L375-F702 HydrophobicContact CD2-CE2 3.98Å; L375-F702 HydrophobicContact CD2-CG 4.43Å; V572-F702 HydrophobicContact CG1-CB 4.38Å; V572-F702 HydrophobicContact CG1-CD1 4.32Å; V572-F702 HydrophobicContact CG1-CG 4.36Å; V572-F702 HydrophobicContact CG2-CB 3.9Å; A575-F702 HydrophobicContact CB-CD1 3.95Å; A575-F702 HydrophobicContact CB-CE1 4.39Å; I576-F702 HydrophobicContact CG1-CE1 3.99Å; L579-F702 HydrophobicContact CD1-CE1 3.76Å; L579-F702 HydrophobicContact CD1-CZ 4.26Å; I586-F702 HydrophobicContact CD1-CE1 4.45Å; I586-F702 HydrophobicContact CD1-CZ 4.28Å; F702-T704 PolarHBondContact O-N 3.43Å; F702-I705 HydrophobicContact CD2-CD1 3.7Å; F702-I705 HydrophobicContact CE2-CD1 3.87Å; F702-I705 HydrophobicContact CG-CD1 4.35Å; F702-I705 WeakPolarHBondContact O-CB 3.41Å; F702-I705 PolarHBondContact O-N 2.84Å; F702-I705 VanDerWaalsContact O-N 3.1Å
703	Q	90.3	Very high	90	Very high	65 Å²	65	19 Å²	19	30%	0.304	10%	0.101	S	C	.	.	H	α-helix	trans	-61.3	-28.4	175	-62.2	-164.9	-13.7	0	0	112.7	G571 A575 D701 I705 M706 S707	G571-Q703 PolarHBondContact O-NE2 3.03Å; A575-Q703 HydrophobicContact CB-CG 4.24Å; D701-Q703 PolarHBondContact O-N 3.46Å; D701-Q703 WeakPolarHBondContact OD1-CG 3.41Å; D701-Q703 PolarHBondContact OD1-N 2.98Å; Q703-I705 VanDerWaalsContact C-N 3.27Å; Q703-I705 PolarHBondContact O-N 3.21Å; Q703-M706 WeakPolarHBondContact O-CB 3.27Å; Q703-M706 PolarHBondContact O-N 2.99Å; Q703-S707 PolarHBondContact O-N 3.39Å; Q703-S707 PolarHBondContact O-OG 2.82Å
704	T	92.2	Very high	90.2	Very high	7 Å²	7	18.9 Å²	18.9	4%	0.043	10%	0.1	C	C	.	.	H	α-helix	trans	-63.7	-34.4	176.7	-60.2	0	0	0	0	111	K348 A350 L697 D699 D701 F702 S707 A708	K348-T704 WeakPolarHBondContact O-CG2 3.44Å; A350-T704 HydrophobicContact CB-CG2 3.66Å; L697-T704 HydrophobicContact CD2-CG2 3.71Å; D699-T704 PolarHBondContact OD1-OG1 3.43Å; D699-T704 PolarHBondContact OD2-OG1 2.88Å; D701-T704 VanDerWaalsContact O-CB 3.23Å; D701-T704 WeakPolarHBondContact O-CB 3.14Å; D701-T704 PolarHBondContact O-N 2.92Å; D701-T704 VanDerWaalsContact O-N 3.15Å; F702-T704 PolarHBondContact O-N 3.43Å; T704-S707 PolarHBondContact O-N 3.42Å; T704-A708 WeakPolarHBondContact O-CB 3.35Å; T704-A708 PolarHBondContact O-N 3.23Å
705	I	92.4	Very high	90.3	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.015	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-46.2	173.5	-55.6	176	0	0	0	110.6	I367 T662 V679 L697 F702 Q703 S707 A708 I709	I367-I705 HydrophobicContact CD1-CG2 4.34Å; T662-I705 HydrophobicContact CG2-CD1 3.45Å; T662-I705 VanDerWaalsContact CG2-CD1 3.45Å; V679-I705 HydrophobicContact CG1-CD1 4.25Å; V679-I705 HydrophobicContact CG1-CG1 4.31Å; L697-I705 HydrophobicContact CD1-CD1 3.95Å; L697-I705 HydrophobicContact CD1-CG1 3.69Å; L697-I705 HydrophobicContact CD2-CG1 3.98Å; L697-I705 HydrophobicContact CG-CG1 4.46Å; F702-I705 HydrophobicContact CD2-CD1 3.7Å; F702-I705 HydrophobicContact CE2-CD1 3.87Å; F702-I705 HydrophobicContact CG-CD1 4.35Å; F702-I705 WeakPolarHBondContact O-CB 3.41Å; F702-I705 PolarHBondContact O-N 2.84Å; F702-I705 VanDerWaalsContact O-N 3.1Å; Q703-I705 VanDerWaalsContact C-N 3.27Å; Q703-I705 PolarHBondContact O-N 3.21Å; I705-S707 VanDerWaalsContact C-N 3.3Å; I705-S707 PolarHBondContact O-N 3.29Å; I705-A708 PolarHBondContact O-N 3.41Å; I705-A708 VanDerWaalsContact O-N 3.16Å; I705-I709 HydrophobicContact CG2-CD1 4.1Å; I705-I709 WeakPolarHBondContact O-CG1 3.36Å; I705-I709 PolarHBondContact O-N 2.92Å
706	M	90.8	Very high	90.2	Very high	42 Å²	42	19.5 Å²	19.5	21%	0.207	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-44.5	176.7	179.9	-173.9	69.2	0	0	111.1	A575 T578 L579 Q703 A708 I709 E710 I779	A575-M706 HydrophobicContact CB-SD 4.37Å; T578-M706 HydrophobicContact CG2-SD 3.88Å; L579-M706 HydrophobicContact CD1-CB 4.48Å; L579-M706 HydrophobicContact CD2-CG 4.36Å; L579-M706 HydrophobicContact CG-CG 4.47Å; Q703-M706 WeakPolarHBondContact O-CB 3.27Å; Q703-M706 PolarHBondContact O-N 2.99Å; M706-A708 VanDerWaalsContact C-N 3.31Å; M706-A708 PolarHBondContact O-N 3.21Å; M706-I709 PolarHBondContact O-N 3.16Å; M706-E710 PolarHBondContact O-N 3.29Å; M706-I779 HydrophobicContact CG-CD1 4.22Å
707	S	90.6	Very high	90.1	Very high	31 Å²	31	20.7 Å²	20.7	22%	0.217	11%	0.109	C	C	.	.	H	α-helix	trans	-63.4	-35.8	176.6	-64.3	0	0	0	0	112.7	Q703 T704 I705 E710 E711	Q703-S707 PolarHBondContact O-N 3.39Å; Q703-S707 PolarHBondContact O-OG 2.82Å; T704-S707 PolarHBondContact O-N 3.42Å; I705-S707 VanDerWaalsContact C-N 3.3Å; I705-S707 PolarHBondContact O-N 3.29Å; S707-E710 WeakPolarHBondContact O-CB 3.42Å; S707-E710 PolarHBondContact O-N 2.86Å; S707-E711 WeakPolarHBondContact O-CG 3.25Å; S707-E711 PolarHBondContact O-N 3.44Å; S707-E711 VanDerWaalsContact O-N 3.11Å
708	A	92.3	Very high	90	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-71.1	-38.5	175.8	0	0	0	0	0	112.1	M345 A350 L361 M695 T704 I705 M706 E710 E711 G712	M345-A708 WeakPolarHBondContact CE-O 3.38Å; A350-A708 HydrophobicContact CB-CB 4.4Å; L361-A708 HydrophobicContact CD1-CB 4.26Å; M695-A708 HydrophobicContact CE-CB 3.65Å; M695-A708 HydrophobicContact SD-CB 4.09Å; T704-A708 WeakPolarHBondContact O-CB 3.35Å; T704-A708 PolarHBondContact O-N 3.23Å; I705-A708 PolarHBondContact O-N 3.41Å; I705-A708 VanDerWaalsContact O-N 3.16Å; M706-A708 VanDerWaalsContact C-N 3.31Å; M706-A708 PolarHBondContact O-N 3.21Å; A708-E710 VanDerWaalsContact C-N 3.34Å; A708-E711 PolarHBondContact O-N 3.49Å; A708-G712 PolarHBondContact O-N 2.73Å
709	I	92.4	Very high	90.1	Very high	1 Å²	1	18 Å²	18	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-63	-41.1	172.6	-68.6	170	0	0	0	110.6	L361 I367 L579 I705 M706 G712 K713	L361-I709 HydrophobicContact CD2-CG1 4.44Å; I367-I709 HydrophobicContact CD1-CD1 4.08Å; L579-I709 HydrophobicContact CD2-CD1 3.91Å; I705-I709 HydrophobicContact CG2-CD1 4.1Å; I705-I709 WeakPolarHBondContact O-CG1 3.36Å; I705-I709 PolarHBondContact O-N 2.92Å; M706-I709 PolarHBondContact O-N 3.16Å; I709-G712 PolarHBondContact O-N 2.96Å; I709-K713 HydrophobicContact CG2-CD 4.31Å; I709-K713 HydrophobicContact CG2-CG 4.46Å; I709-K713 WeakPolarHBondContact O-CG 3.47Å; I709-K713 PolarHBondContact O-N 3.46Å
710	E	91.2	Very high	90.1	Very high	46 Å²	46	18.1 Å²	18.1	22%	0.215	9%	0.092	C	C	.	.	H	α-helix	trans	-57.7	-51	174.7	-173.2	-171.5	-157.2	0	0	111.5	K348 M706 S707 A708 K713 G714 V774 I779	K348-E710 IonicContact NZ-OE2 3.41Å; K348-E710 PolarHBondContact NZ-OE2 3.36Å; M706-E710 PolarHBondContact O-N 3.29Å; S707-E710 WeakPolarHBondContact O-CB 3.42Å; S707-E710 PolarHBondContact O-N 2.86Å; A708-E710 VanDerWaalsContact C-N 3.34Å; E710-K713 PolarHBondContact O-N 3Å; E710-G714 PolarHBondContact O-N 3.34Å; E710-V774 HydrophobicContact CG-CG1 4.23Å; E710-I779 HydrophobicContact CB-CD1 4.19Å; E710-I779 HydrophobicContact CG-CB 4.47Å
711	E	91.4	Very high	90.2	Very high	16 Å²	16	18.1 Å²	18.1	8%	0.075	9%	0.092	C	C	.	.	H	α-helix	trans	-62.7	-42.8	177.4	-71.2	-63.8	153.6	0	0	111.7	M345 K348 S707 A708 K713 G714 I715 V774	M345-E711 HydrophobicContact CE-CB 3.52Å; M345-E711 HydrophobicContact CG-CB 4.01Å; M345-E711 HydrophobicContact CG-CG 4.24Å; K348-E711 HydrophobicContact CD-CG 4.48Å; K348-E711 WeakPolarHBondContact CE-OE1 3.25Å; K348-E711 IonicContact NZ-OE1 2.69Å; K348-E711 PolarHBondContact NZ-OE1 3.45Å; S707-E711 WeakPolarHBondContact O-CG 3.25Å; S707-E711 PolarHBondContact O-N 3.44Å; S707-E711 VanDerWaalsContact O-N 3.11Å; A708-E711 PolarHBondContact O-N 3.49Å; E711-K713 PolarHBondContact O-N 3.09Å; E711-G714 WeakPolarHBondContact O-CA 3.45Å; E711-G714 PolarHBondContact O-N 3.12Å; E711-G714 VanDerWaalsContact O-N 3.12Å; E711-I715 WeakPolarHBondContact O-CD1 3.46Å; E711-I715 VanDerWaalsContact O-CG1 3.28Å; E711-I715 WeakPolarHBondContact O-CG1 3.06Å; E711-I715 PolarHBondContact O-N 3.22Å; E711-V774 WeakPolarHBondContact OE2-CG2 3.48Å
712	G	91.6	Very high	90.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.6	-46	177.5	0	0	0	0	0	112.4	V358 A708 I709 G714 I715 Y716	V358-G712 VanDerWaalsContact O-CA 3.25Å; V358-G712 WeakPolarHBondContact O-CA 3.45Å; A708-G712 PolarHBondContact O-N 2.73Å; I709-G712 PolarHBondContact O-N 2.96Å; G712-G714 VanDerWaalsContact C-N 3.32Å; G712-G714 PolarHBondContact O-N 3.41Å; G712-I715 PolarHBondContact O-N 2.93Å; G712-Y716 PolarHBondContact O-N 3.36Å
713	K	90.1	Very high	90.3	Very high	16 Å²	16	16.4 Å²	16.4	7%	0.07	8%	0.083	C	C	.	.	H	α-helix	trans	-63.2	-37.5	174.1	-69.1	179.6	-178.6	178.5	0	111.9	I709 E710 E711 N717 V778 I779 K781	I709-K713 HydrophobicContact CG2-CD 4.31Å; I709-K713 HydrophobicContact CG2-CG 4.46Å; I709-K713 WeakPolarHBondContact O-CG 3.47Å; I709-K713 PolarHBondContact O-N 3.46Å; E710-K713 PolarHBondContact O-N 3Å; E711-K713 PolarHBondContact O-N 3.09Å; K713-N717 PolarHBondContact O-N 3.19Å; K713-N717 VanDerWaalsContact O-N 3.16Å; K713-V778 HydrophobicContact CB-CG1 3.19Å; K713-V778 HydrophobicContact CD-CG1 3.96Å; K713-V778 HydrophobicContact CG-CG1 4.19Å; K713-I779 PolarHBondContact NZ-O 3.44Å; K713-K781 PolarHBondContact NZ-O 3.02Å
714	G	89.7	Confident	90.3	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.01	7%	0.069	C	C	.	.	H	α-helix	trans	-62	-48.6	174.8	0	0	0	0	0	112.7	E710 E711 G712 Y716 N717 N718	E710-G714 PolarHBondContact O-N 3.34Å; E711-G714 WeakPolarHBondContact O-CA 3.45Å; E711-G714 PolarHBondContact O-N 3.12Å; E711-G714 VanDerWaalsContact O-N 3.12Å; G712-G714 VanDerWaalsContact C-N 3.32Å; G712-G714 PolarHBondContact O-N 3.41Å; G714-Y716 PolarHBondContact O-N 3.35Å; G714-N717 WeakPolarHBondContact O-CB 3.18Å; G714-N717 PolarHBondContact O-N 3.32Å; G714-N717 VanDerWaalsContact O-N 3.16Å; G714-N718 PolarHBondContact O-N 2.9Å; G714-N718 PolarHBondContact O-OD1 2.93Å
715	I	89.9	Confident	90.3	Very high	3 Å²	3	13.1 Å²	13.1	2%	0.015	7%	0.067	C	C	.	.	H	α-helix	trans	-62.5	-43.3	179.6	-70	161	0	0	0	111	T337 L338 G341 M345 V358 E711 G712 N717 N718 I719	T337-I715 HydrophobicContact CG2-CG2 4.2Å; L338-I715 HydrophobicContact CD2-CG2 3.92Å; G341-I715 VanDerWaalsContact CA-CD1 3.46Å; M345-I715 HydrophobicContact CE-CD1 4.3Å; V358-I715 HydrophobicContact CG1-CB 4.37Å; V358-I715 HydrophobicContact CG1-CD1 3.26Å; V358-I715 HydrophobicContact CG1-CG1 4.4Å; V358-I715 HydrophobicContact CG1-CG2 4.24Å; E711-I715 WeakPolarHBondContact O-CD1 3.46Å; E711-I715 VanDerWaalsContact O-CG1 3.28Å; E711-I715 WeakPolarHBondContact O-CG1 3.06Å; E711-I715 PolarHBondContact O-N 3.22Å; G712-I715 PolarHBondContact O-N 2.93Å; I715-N717 VanDerWaalsContact C-N 3.3Å; I715-N717 PolarHBondContact O-N 3.47Å; I715-N718 CarbonylContact O-C 3.53Å; I715-N718 WeakPolarHBondContact O-CB 3.37Å; I715-N718 PolarHBondContact O-N 2.92Å; I715-N718 VanDerWaalsContact O-N 3.11Å; I715-I719 HydrophobicContact CG2-CD1 4.08Å; I715-I719 HydrophobicContact CG2-CG1 4.49Å; I715-I719 WeakPolarHBondContact O-CG1 3.48Å; I715-I719 PolarHBondContact O-N 3.16Å
716	Y	88.4	Confident	90.2	Very high	14 Å²	14	13.3 Å²	13.3	6%	0.055	7%	0.067	C	C	.	.	H	α-helix	trans	-61.4	-38.5	175.6	-179.7	-100.1	0	0	0	112.6	E359 G712 G714 N718 I719 K720 R784 I790	E359-Y716 HydrophobicContact CG-CD2 3.83Å; G712-Y716 PolarHBondContact O-N 3.36Å; G714-Y716 PolarHBondContact O-N 3.35Å; Y716-N718 VanDerWaalsContact C-N 3.33Å; Y716-I719 PolarHBondContact O-N 3.37Å; Y716-K720 HydrophobicContact CE1-CD 3.87Å; Y716-K720 HydrophobicContact CE1-CG 4.32Å; Y716-K720 VanDerWaalsContact CZ-CE 3.42Å; Y716-K720 PolarHBondContact O-N 3.4Å; Y716-K720 WeakPolarHBondContact OH-CE 3.46Å; Y716-K720 PolarHBondContact OH-NZ 3.45Å; Y716-R784 VanDerWaalsContact OH-CD 3.24Å; Y716-R784 WeakPolarHBondContact OH-CD 3.19Å; Y716-I790 HydrophobicContact CE2-CG1 4.23Å
717	N	88.2	Confident	90.1	Very high	53 Å²	53	11.8 Å²	11.8	28%	0.283	6%	0.06	S	C	.	.	H	α-helix	trans	-64.6	-39.1	174.2	-170.2	48.8	0	0	0	111.7	K713 G714 I715 I719 K720 N721	K713-N717 PolarHBondContact O-N 3.19Å; K713-N717 VanDerWaalsContact O-N 3.16Å; G714-N717 WeakPolarHBondContact O-CB 3.18Å; G714-N717 PolarHBondContact O-N 3.32Å; G714-N717 VanDerWaalsContact O-N 3.16Å; I715-N717 VanDerWaalsContact C-N 3.3Å; I715-N717 PolarHBondContact O-N 3.47Å; N717-I719 VanDerWaalsContact C-N 3.35Å; N717-K720 PolarHBondContact O-N 2.8Å; N717-N721 PolarHBondContact O-N 3.4Å; N717-N721 VanDerWaalsContact O-N 3.12Å; N717-N721 PolarHBondContact O-ND2 3.39Å
718	N	89.6	Confident	90.1	Very high	4 Å²	4	10.3 Å²	10.3	2%	0.021	5%	0.05	C	C	.	.	H	α-helix	trans	-65.4	-38.4	174.3	-66	-3.4	0	0	0	111.7	G714 I715 Y716 K720 N721 F722 G770 E772	G714-N718 PolarHBondContact O-N 2.9Å; G714-N718 PolarHBondContact O-OD1 2.93Å; I715-N718 CarbonylContact O-C 3.53Å; I715-N718 WeakPolarHBondContact O-CB 3.37Å; I715-N718 PolarHBondContact O-N 2.92Å; I715-N718 VanDerWaalsContact O-N 3.11Å; Y716-N718 VanDerWaalsContact C-N 3.33Å; N718-K720 VanDerWaalsContact C-N 3.34Å; N718-K720 PolarHBondContact O-N 3.16Å; N718-N721 WeakPolarHBondContact O-CB 3.47Å; N718-N721 PolarHBondContact O-N 3.46Å; N718-N721 VanDerWaalsContact O-N 3.08Å; N718-F722 WeakPolarHBondContact O-CD1 3.49Å; N718-F722 PolarHBondContact O-N 3.32Å; N718-F722 VanDerWaalsContact O-N 3.09Å; N718-G770 PolarHBondContact ND2-O 2.79Å; N718-E772 PolarHBondContact ND2-O 2.85Å
719	I	89.4	Confident	89.9	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-57.3	-47	172.4	-67.2	168	0	0	0	111	L278 L338 I715 Y716 N717 N721 F722 V723	L278-I719 HydrophobicContact CD1-CD1 4.45Å; L278-I719 HydrophobicContact CD2-CD1 4.22Å; L338-I719 HydrophobicContact CD2-CD1 4.46Å; I715-I719 HydrophobicContact CG2-CD1 4.08Å; I715-I719 HydrophobicContact CG2-CG1 4.49Å; I715-I719 WeakPolarHBondContact O-CG1 3.48Å; I715-I719 PolarHBondContact O-N 3.16Å; Y716-I719 PolarHBondContact O-N 3.37Å; N717-I719 VanDerWaalsContact C-N 3.35Å; I719-N721 VanDerWaalsContact C-N 3.26Å; I719-N721 PolarHBondContact O-N 2.96Å; I719-F722 HydrophobicContact CB-CE1 4Å; I719-F722 HydrophobicContact CB-CZ 4.05Å; I719-F722 HydrophobicContact CG1-CE1 3.71Å; I719-F722 HydrophobicContact CG1-CZ 3.82Å; I719-F722 HydrophobicContact CG2-CE1 4.4Å; I719-F722 HydrophobicContact CG2-CE2 4.49Å; I719-F722 HydrophobicContact CG2-CZ 3.95Å; I719-F722 PolarHBondContact O-N 2.89Å; I719-V723 HydrophobicContact CG2-CG2 3.96Å; I719-V723 VanDerWaalsContact O-CB 3.27Å; I719-V723 WeakPolarHBondContact O-CB 3.15Å; I719-V723 WeakPolarHBondContact O-CG2 3.42Å; I719-V723 PolarHBondContact O-N 2.99Å
720	K	88.4	Confident	89.7	Confident	36 Å²	36	10.7 Å²	10.7	16%	0.157	5%	0.052	C	C	.	.	H	α-helix	trans	-59.7	-36.4	175.1	-77.1	-175.1	168.4	173	0	113.2	Y716 N717 N718 R724 L795	Y716-K720 HydrophobicContact CE1-CD 3.87Å; Y716-K720 HydrophobicContact CE1-CG 4.32Å; Y716-K720 VanDerWaalsContact CZ-CE 3.42Å; Y716-K720 PolarHBondContact O-N 3.4Å; Y716-K720 WeakPolarHBondContact OH-CE 3.46Å; Y716-K720 PolarHBondContact OH-NZ 3.45Å; N717-K720 PolarHBondContact O-N 2.8Å; N718-K720 VanDerWaalsContact C-N 3.34Å; N718-K720 PolarHBondContact O-N 3.16Å; K720-R724 WeakPolarHBondContact O-CB 3.36Å; K720-R724 PolarHBondContact O-N 2.8Å; K720-L795 HydrophobicContact CB-CD1 4.37Å
721	N	88.9	Confident	89.6	Confident	3 Å²	3	10.3 Å²	10.3	2%	0.016	5%	0.052	C	C	.	.	H	α-helix	trans	-66.3	-49	-179.7	-70.8	-21	0	0	0	112.3	N717 N718 I719 R724 F725 S846 R847 Q849	N717-N721 PolarHBondContact O-N 3.4Å; N717-N721 VanDerWaalsContact O-N 3.12Å; N717-N721 PolarHBondContact O-ND2 3.39Å; N718-N721 WeakPolarHBondContact O-CB 3.47Å; N718-N721 PolarHBondContact O-N 3.46Å; N718-N721 VanDerWaalsContact O-N 3.08Å; I719-N721 VanDerWaalsContact C-N 3.26Å; I719-N721 PolarHBondContact O-N 2.96Å; N721-R724 WeakPolarHBondContact O-CB 3.38Å; N721-F725 PolarHBondContact O-N 3.11Å; N721-S846 VanDerWaalsContact CB-O 3.27Å; N721-S846 WeakPolarHBondContact CB-O 3.39Å; N721-R847 PolarHBondContact ND2-O 3.12Å; N721-Q849 WeakPolarHBondContact OD1-CG 3.37Å; N721-Q849 PolarHBondContact OD1-NE2 3.22Å
722	F	89.7	Confident	89.5	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-76.8	-31.8	179	72.5	-111.9	0	0	0	113	L330 V333 V334 T337 N718 I719 R724 F725 Q726 A766 L769	L330-F722 HydrophobicContact CD1-CD2 4.18Å; L330-F722 HydrophobicContact CD1-CE2 3.67Å; V333-F722 HydrophobicContact CB-CE2 4.23Å; V333-F722 HydrophobicContact CB-CZ 4.48Å; V333-F722 HydrophobicContact CG1-CD1 4.01Å; V333-F722 HydrophobicContact CG1-CD2 3.73Å; V333-F722 HydrophobicContact CG1-CE1 3.88Å; V333-F722 HydrophobicContact CG1-CE2 3.67Å; V333-F722 HydrophobicContact CG1-CG 3.93Å; V333-F722 HydrophobicContact CG1-CZ 3.76Å; V334-F722 HydrophobicContact CB-CZ 4.41Å; V334-F722 HydrophobicContact CG2-CE2 3.9Å; V334-F722 HydrophobicContact CG2-CZ 3.59Å; T337-F722 HydrophobicContact CG2-CE1 4.37Å; N718-F722 WeakPolarHBondContact O-CD1 3.49Å; N718-F722 PolarHBondContact O-N 3.32Å; N718-F722 VanDerWaalsContact O-N 3.09Å; I719-F722 HydrophobicContact CB-CE1 4Å; I719-F722 HydrophobicContact CB-CZ 4.05Å; I719-F722 HydrophobicContact CG1-CE1 3.71Å; I719-F722 HydrophobicContact CG1-CZ 3.82Å; I719-F722 HydrophobicContact CG2-CE1 4.4Å; I719-F722 HydrophobicContact CG2-CE2 4.49Å; I719-F722 HydrophobicContact CG2-CZ 3.95Å; I719-F722 PolarHBondContact O-N 2.89Å; F722-R724 VanDerWaalsContact C-N 3.28Å; F722-R724 PolarHBondContact O-N 2.95Å; F722-F725 WeakPolarHBondContact O-CB 3.47Å; F722-F725 PolarHBondContact O-N 3.05Å; F722-F725 VanDerWaalsContact O-N 3.15Å; F722-Q726 PolarHBondContact O-N 3.06Å; F722-A766 HydrophobicContact CB-CB 4.16Å; F722-A766 WeakPolarHBondContact CB-O 3.49Å; F722-L769 HydrophobicContact CB-CB 3.89Å; F722-L769 HydrophobicContact CB-CD1 4.19Å
723	V	89.3	Confident	89.3	Confident	3 Å²	3	9.8 Å²	9.8	2%	0.018	5%	0.05	C	C	.	.	H	α-helix	trans	-59.4	-42.8	172.3	168	0	0	0	0	110	L330 I719 F725 L727 I790 L791	L330-V723 HydrophobicContact CD1-CG2 3.67Å; I719-V723 HydrophobicContact CG2-CG2 3.96Å; I719-V723 VanDerWaalsContact O-CB 3.27Å; I719-V723 WeakPolarHBondContact O-CB 3.15Å; I719-V723 WeakPolarHBondContact O-CG2 3.42Å; I719-V723 PolarHBondContact O-N 2.99Å; V723-F725 VanDerWaalsContact C-N 3.33Å; V723-F725 PolarHBondContact O-N 3.03Å; V723-L727 WeakPolarHBondContact O-CB 3.41Å; V723-L727 PolarHBondContact O-N 3.43Å; V723-I790 HydrophobicContact CG1-CG2 4.36Å; V723-L791 HydrophobicContact CG1-CD2 4.27Å
724	R	90.7	Very high	89.1	Confident	3 Å²	3	9.7 Å²	9.7	1%	0.011	5%	0.05	C	C	.	.	H	α-helix	trans	-56.9	-48.8	174.6	172.8	-176.4	173.1	156.7	-3.5	111.3	K720 N721 F722 S728 L795 V799 S912	K720-R724 WeakPolarHBondContact O-CB 3.36Å; K720-R724 PolarHBondContact O-N 2.8Å; N721-R724 WeakPolarHBondContact O-CB 3.38Å; F722-R724 VanDerWaalsContact C-N 3.28Å; F722-R724 PolarHBondContact O-N 2.95Å; R724-S728 WeakPolarHBondContact O-CB 3.25Å; R724-S728 PolarHBondContact O-N 3.45Å; R724-S728 PolarHBondContact O-OG 2.88Å; R724-L795 HydrophobicContact CB-CD1 4.16Å; R724-L795 HydrophobicContact CB-CG 4.35Å; R724-V799 HydrophobicContact CB-CG2 4.33Å; R724-V799 HydrophobicContact CG-CG2 3.81Å; R724-S912 PolarHBondContact NH2-OG 3.32Å
725	F	91.1	Very high	89.1	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-59.4	-58.5	-179.6	165.8	-116.5	0	0	0	110.9	N721 F722 V723 L727 S728 T729 D762 P765 A766 L769 D839 A843	N721-F725 PolarHBondContact O-N 3.11Å; F722-F725 WeakPolarHBondContact O-CB 3.47Å; F722-F725 PolarHBondContact O-N 3.05Å; F722-F725 VanDerWaalsContact O-N 3.15Å; V723-F725 VanDerWaalsContact C-N 3.33Å; V723-F725 PolarHBondContact O-N 3.03Å; F725-L727 PolarHBondContact O-N 3.08Å; F725-S728 PolarHBondContact O-N 3.09Å; F725-S728 PolarHBondContact O-OG 3.38Å; F725-T729 PolarHBondContact O-N 3.06Å; F725-T729 VanDerWaalsContact O-N 3.14Å; F725-T729 PolarHBondContact O-OG1 3.44Å; F725-D762 HydrophobicContact CE1-CB 4.45Å; F725-D762 WeakPolarHBondContact CZ-OD1 3.45Å; F725-P765 HydrophobicContact CE1-CB 4.27Å; F725-A766 HydrophobicContact CD1-CB 4.09Å; F725-A766 HydrophobicContact CE1-CB 4.22Å; F725-L769 HydrophobicContact CB-CD1 3.96Å; F725-L769 HydrophobicContact CD1-CD1 4.03Å; F725-L769 HydrophobicContact CG-CD1 4.11Å; F725-D839 HydrophobicContact CE2-CB 4.21Å; F725-D839 WeakPolarHBondContact CE2-O 3.5Å; F725-A843 HydrophobicContact CD2-CB 3.79Å; F725-A843 HydrophobicContact CE1-CB 4.49Å; F725-A843 HydrophobicContact CE2-CB 3.63Å; F725-A843 HydrophobicContact CG-CB 4.32Å; F725-A843 HydrophobicContact CZ-CB 4.01Å
726	Q	89.6	Confident	89	Confident	7 Å²	7	12.5 Å²	12.5	3%	0.033	7%	0.067	C	C	.	.	H	α-helix	trans	-58.5	-45.5	-178.8	-72.3	179.4	-35.9	0	0	112.4	F722 S728 T729 S730 A766	F722-Q726 PolarHBondContact O-N 3.06Å; Q726-S728 VanDerWaalsContact C-N 3.31Å; Q726-S728 PolarHBondContact O-N 3.3Å; Q726-T729 PolarHBondContact O-N 2.85Å; Q726-S730 PolarHBondContact O-N 2.98Å; Q726-S730 PolarHBondContact O-OG 3.01Å; Q726-S730 VanDerWaalsContact O-OG 3.11Å; Q726-A766 HydrophobicContact CG-CB 3.96Å
727	L	89.1	Confident	88.8	Confident	10 Å²	10	12.3 Å²	12.3	5%	0.052	7%	0.067	C	C	.	.	H	α-helix	trans	-68.4	-32.3	-177.1	-152.3	127	0	0	0	111.9	L289 V723 F725 I731 L791 V799	L289-L727 HydrophobicContact CD1-CD1 4.16Å; L289-L727 HydrophobicContact CD2-CD1 4.29Å; V723-L727 WeakPolarHBondContact O-CB 3.41Å; V723-L727 PolarHBondContact O-N 3.43Å; F725-L727 PolarHBondContact O-N 3.08Å; L727-I731 HydrophobicContact CD2-CD1 3.49Å; L727-I731 VanDerWaalsContact CD2-CD1 3.49Å; L727-I731 HydrophobicContact CD2-CG1 4.3Å; L727-I731 HydrophobicContact CG-CD1 4.33Å; L727-I731 VanDerWaalsContact O-CB 3.3Å; L727-I731 WeakPolarHBondContact O-CB 3.19Å; L727-I731 WeakPolarHBondContact O-CG1 3.38Å; L727-I731 PolarHBondContact O-N 3.45Å; L727-L791 HydrophobicContact CD1-CD1 4.28Å; L727-L791 HydrophobicContact CD1-CD2 4.15Å; L727-L791 HydrophobicContact CD2-CD2 4.31Å; L727-V799 HydrophobicContact CD2-CG1 3.8Å
728	S	90.9	Very high	88.6	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-67.9	-36.8	172.7	56.7	0	0	0	0	113.2	R724 F725 Q726 A732 N842	R724-S728 WeakPolarHBondContact O-CB 3.25Å; R724-S728 PolarHBondContact O-N 3.45Å; R724-S728 PolarHBondContact O-OG 2.88Å; F725-S728 PolarHBondContact O-N 3.09Å; F725-S728 PolarHBondContact O-OG 3.38Å; Q726-S728 VanDerWaalsContact C-N 3.31Å; Q726-S728 PolarHBondContact O-N 3.3Å; S728-A732 WeakPolarHBondContact O-CB 3.3Å; S728-A732 PolarHBondContact O-N 2.9Å; S728-N842 PolarHBondContact OG-ND2 3.21Å
729	T	89.1	Confident	88.4	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-71.3	-46.7	177.2	-60.4	0	0	0	0	111.2	F725 Q726 I731 A732 A733 I757 D762 F835 D839	F725-T729 PolarHBondContact O-N 3.06Å; F725-T729 VanDerWaalsContact O-N 3.14Å; F725-T729 PolarHBondContact O-OG1 3.44Å; Q726-T729 PolarHBondContact O-N 2.85Å; T729-I731 PolarHBondContact O-N 3.11Å; T729-A732 PolarHBondContact O-N 3.18Å; T729-A733 WeakPolarHBondContact O-CB 3.36Å; T729-A733 PolarHBondContact O-N 3.34Å; T729-I757 HydrophobicContact CG2-CG2 4.07Å; T729-D762 WeakPolarHBondContact CG2-OD2 3.46Å; T729-F835 HydrophobicContact CG2-CE1 3.74Å; T729-F835 HydrophobicContact CG2-CZ 4.06Å; T729-D839 WeakPolarHBondContact CG2-OD1 3.25Å; T729-D839 WeakPolarHBondContact CG2-OD2 3.21Å; T729-D839 PolarHBondContact OG1-OD1 2.87Å
730	S	87.1	Confident	88.1	Confident	10 Å²	10	13.6 Å²	13.6	7%	0.07	8%	0.075	C	C	.	.	H	α-helix	trans	-62.5	-42.4	176.4	-51.7	0	0	0	0	112.5	Q726 A733 L734	Q726-S730 PolarHBondContact O-N 2.98Å; Q726-S730 PolarHBondContact O-OG 3.01Å; Q726-S730 VanDerWaalsContact O-OG 3.11Å; S730-A733 PolarHBondContact O-N 2.96Å; S730-L734 VanDerWaalsContact O-CB 3.25Å; S730-L734 WeakPolarHBondContact O-CB 3.47Å; S730-L734 PolarHBondContact O-N 3.48Å
731	I	89.2	Confident	87.7	Confident	38 Å²	38	12 Å²	12	20%	0.195	7%	0.068	C	C	.	.	H	α-helix	trans	-65.4	-40.1	175.3	-70.5	178.7	0	0	0	110.9	L727 T729 T735 V799 L800 A803	L727-I731 HydrophobicContact CD2-CD1 3.49Å; L727-I731 VanDerWaalsContact CD2-CD1 3.49Å; L727-I731 HydrophobicContact CD2-CG1 4.3Å; L727-I731 HydrophobicContact CG-CD1 4.33Å; L727-I731 VanDerWaalsContact O-CB 3.3Å; L727-I731 WeakPolarHBondContact O-CB 3.19Å; L727-I731 WeakPolarHBondContact O-CG1 3.38Å; L727-I731 PolarHBondContact O-N 3.45Å; T729-I731 PolarHBondContact O-N 3.11Å; I731-T735 VanDerWaalsContact O-CB 3.24Å; I731-T735 WeakPolarHBondContact O-CB 3.38Å; I731-T735 PolarHBondContact O-N 3.41Å; I731-T735 PolarHBondContact O-OG1 3.06Å; I731-V799 HydrophobicContact CD1-CG1 3.98Å; I731-L800 HydrophobicContact CG2-CD2 4.5Å; I731-A803 HydrophobicContact CB-CB 4.35Å; I731-A803 HydrophobicContact CG2-CB 3.92Å
732	A	90.4	Very high	87.4	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.8	-47.5	176.9	0	0	0	0	0	111.5	S728 T729 T735 L736 A803 I806 V807 F835	S728-A732 WeakPolarHBondContact O-CB 3.3Å; S728-A732 PolarHBondContact O-N 2.9Å; T729-A732 PolarHBondContact O-N 3.18Å; A732-T735 PolarHBondContact O-N 3.38Å; A732-L736 WeakPolarHBondContact O-CB 3.14Å; A732-L736 PolarHBondContact O-N 2.92Å; A732-A803 HydrophobicContact CB-CB 4.17Å; A732-I806 HydrophobicContact CB-CB 4.01Å; A732-I806 HydrophobicContact CB-CD1 4.39Å; A732-I806 HydrophobicContact CB-CG2 3.81Å; A732-V807 HydrophobicContact CB-CG2 4.07Å; A732-V807 WeakPolarHBondContact O-CG2 3.5Å; A732-F835 HydrophobicContact CB-CE2 4.28Å; A732-F835 HydrophobicContact CB-CZ 4.3Å
733	A	86.6	Confident	87	Confident	4 Å²	4	20.7 Å²	20.7	3%	0.033	11%	0.112	C	C	.	.	H	α-helix	trans	-60.5	-48.4	177.5	0	0	0	0	0	111.9	T729 S730 T735 L736 I737 F835	T729-A733 WeakPolarHBondContact O-CB 3.36Å; T729-A733 PolarHBondContact O-N 3.34Å; S730-A733 PolarHBondContact O-N 2.96Å; A733-T735 VanDerWaalsContact C-N 3.35Å; A733-T735 PolarHBondContact O-N 2.9Å; A733-L736 PolarHBondContact O-N 3.45Å; A733-I737 WeakPolarHBondContact O-CG1 3.32Å; A733-I737 PolarHBondContact O-N 2.94Å; A733-I737 VanDerWaalsContact O-N 3.09Å; A733-F835 HydrophobicContact CB-CE2 4.36Å; A733-F835 HydrophobicContact CB-CZ 3.92Å
734	L	86.5	Confident	86.5	Confident	15 Å²	15	25.5 Å²	25.5	8%	0.079	14%	0.138	C	C	.	.	H	α-helix	trans	-59	-45.2	177.5	179.8	61.2	0	0	0	111.7	I296 L321 A325 S730 S738	I296-L734 HydrophobicContact CD1-CD2 3.81Å; I296-L734 HydrophobicContact CD1-CG 4.47Å; I296-L734 HydrophobicContact CG2-CD1 4.13Å; I296-L734 HydrophobicContact CG2-CG 4.47Å; L321-L734 HydrophobicContact CD1-CD1 3.42Å; L321-L734 VanDerWaalsContact CD1-CD1 3.42Å; L321-L734 HydrophobicContact CD2-CD1 3.68Å; L321-L734 HydrophobicContact CG-CD1 3.4Å; L321-L734 VanDerWaalsContact CG-CD1 3.4Å; A325-L734 HydrophobicContact CB-CD1 4.2Å; A325-L734 HydrophobicContact CB-CD2 4.22Å; S730-L734 VanDerWaalsContact O-CB 3.25Å; S730-L734 WeakPolarHBondContact O-CB 3.47Å; S730-L734 PolarHBondContact O-N 3.48Å; L734-S738 WeakPolarHBondContact O-CB 3.31Å; L734-S738 PolarHBondContact O-N 3.12Å
735	T	88.8	Confident	85.9	Confident	62 Å²	62	28 Å²	28	38%	0.38	15%	0.149	S	C	.	.	H	α-helix	trans	-70.2	-39	-179.5	-54.5	0	0	0	0	111.6	I731 A732 A733 S738 L739 V807	I731-T735 VanDerWaalsContact O-CB 3.24Å; I731-T735 WeakPolarHBondContact O-CB 3.38Å; I731-T735 PolarHBondContact O-N 3.41Å; I731-T735 PolarHBondContact O-OG1 3.06Å; A732-T735 PolarHBondContact O-N 3.38Å; A733-T735 VanDerWaalsContact C-N 3.35Å; A733-T735 PolarHBondContact O-N 2.9Å; T735-S738 PolarHBondContact O-N 3.01Å; T735-L739 VanDerWaalsContact O-CB 3.29Å; T735-L739 WeakPolarHBondContact O-CB 3.27Å; T735-L739 PolarHBondContact O-N 3.13Å; T735-V807 HydrophobicContact CG2-CG1 4.33Å; T735-V807 HydrophobicContact CG2-CG2 4.2Å
736	L	88.3	Confident	85.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-50.4	177.6	177.1	65.2	0	0	0	111.2	A732 A733 L739 A740 P748 L749 V807 L811 F835	A732-L736 WeakPolarHBondContact O-CB 3.14Å; A732-L736 PolarHBondContact O-N 2.92Å; A733-L736 PolarHBondContact O-N 3.45Å; L736-L739 PolarHBondContact O-N 3.15Å; L736-A740 WeakPolarHBondContact O-CB 3.34Å; L736-A740 PolarHBondContact O-N 3.29Å; L736-P748 HydrophobicContact CD1-CG 4.26Å; L736-P748 HydrophobicContact CD2-CG 4.16Å; L736-P748 HydrophobicContact CG-CG 3.87Å; L736-L749 HydrophobicContact CD2-CD1 3.93Å; L736-L749 HydrophobicContact CD2-CG 4.48Å; L736-V807 HydrophobicContact CB-CG2 4.5Å; L736-L811 HydrophobicContact CD1-CD1 4.39Å; L736-L811 HydrophobicContact CD1-CD2 3.58Å; L736-L811 HydrophobicContact CD1-CG 3.55Å; L736-F835 HydrophobicContact CD2-CD2 3.94Å; L736-F835 HydrophobicContact CD2-CE2 4.14Å
737	I	83.7	Confident	84.6	Confident	11 Å²	11	32.9 Å²	32.9	6%	0.056	18%	0.178	C	C	.	.	H	α-helix	trans	-67.6	-41.5	-180	-62.5	164.9	0	0	0	110.8	L321 A733 A740 T741 I754	L321-I737 HydrophobicContact CD1-CB 3.89Å; L321-I737 HydrophobicContact CD1-CD1 3.88Å; L321-I737 HydrophobicContact CD1-CG2 3.89Å; A733-I737 WeakPolarHBondContact O-CG1 3.32Å; A733-I737 PolarHBondContact O-N 2.94Å; A733-I737 VanDerWaalsContact O-N 3.09Å; I737-A740 PolarHBondContact O-N 3.42Å; I737-T741 WeakPolarHBondContact O-CB 3.09Å; I737-T741 PolarHBondContact O-N 3.2Å; I737-T741 PolarHBondContact O-OG1 3.4Å; I737-I754 HydrophobicContact CD1-CD1 3.66Å
738	S	83.8	Confident	84.1	Confident	21 Å²	21	32.4 Å²	32.4	15%	0.147	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-50	175.5	-178.4	0	0	0	0	111.4	L734 T735 T741 L742	L734-S738 WeakPolarHBondContact O-CB 3.31Å; L734-S738 PolarHBondContact O-N 3.12Å; T735-S738 PolarHBondContact O-N 3.01Å; S738-T741 PolarHBondContact O-N 3.15Å; S738-L742 WeakPolarHBondContact O-CB 3.33Å; S738-L742 VanDerWaalsContact O-CG 3.27Å; S738-L742 WeakPolarHBondContact O-CG 3.35Å; S738-L742 PolarHBondContact O-N 2.94Å
739	L	86.3	Confident	83.7	Confident	63 Å²	63	32.9 Å²	32.9	33%	0.33	18%	0.178	S	C	.	.	H	α-helix	trans	-67.6	-39.7	-177.7	-165.5	63.2	0	0	0	111.9	T735 L736 T741 L742 M743 L811	T735-L739 VanDerWaalsContact O-CB 3.29Å; T735-L739 WeakPolarHBondContact O-CB 3.27Å; T735-L739 PolarHBondContact O-N 3.13Å; L736-L739 PolarHBondContact O-N 3.15Å; L739-T741 VanDerWaalsContact C-N 3.32Å; L739-T741 PolarHBondContact O-N 3.38Å; L739-L742 PolarHBondContact O-N 3.07Å; L739-M743 HydrophobicContact CD1-CG 4.43Å; L739-M743 HydrophobicContact CD1-SD 4.36Å; L739-M743 HydrophobicContact CG-CG 4.45Å; L739-M743 HydrophobicContact CG-SD 4.03Å; L739-M743 WeakPolarHBondContact O-CB 3.45Å; L739-M743 VanDerWaalsContact O-CG 3.31Å; L739-M743 WeakPolarHBondContact O-CG 3.48Å; L739-M743 PolarHBondContact O-N 3.35Å; L739-L811 HydrophobicContact CD2-CD1 3.31Å; L739-L811 HydrophobicContact CG-CD1 4.24Å
740	A	83.1	Confident	83.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.5	-44.8	173.2	0	0	0	0	0	111.5	L736 I737 M743 N744 F745 P748	L736-A740 WeakPolarHBondContact O-CB 3.34Å; L736-A740 PolarHBondContact O-N 3.29Å; I737-A740 PolarHBondContact O-N 3.42Å; A740-M743 PolarHBondContact O-N 3.43Å; A740-N744 PolarHBondContact O-N 2.8Å; A740-F745 HydrophobicContact CB-CB 4.39Å; A740-F745 PolarHBondContact O-N 3.29Å; A740-P748 HydrophobicContact CB-CG 4.18Å
741	T	79.9	Confident	82.5	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-66.6	-42.6	179.2	-52.9	0	0	0	0	112.1	I300 Q307 I737 S738 L739 N744	I300-T741 HydrophobicContact CG2-CG2 3.78Å; Q307-T741 PolarHBondContact NE2-O 3.04Å; Q307-T741 PolarHBondContact OE1-O 3.39Å; I737-T741 WeakPolarHBondContact O-CB 3.09Å; I737-T741 PolarHBondContact O-N 3.2Å; I737-T741 PolarHBondContact O-OG1 3.4Å; S738-T741 PolarHBondContact O-N 3.15Å; L739-T741 VanDerWaalsContact C-N 3.32Å; L739-T741 PolarHBondContact O-N 3.38Å; T741-N744 PolarHBondContact O-N 3.42Å; T741-N744 VanDerWaalsContact O-N 3.16Å
742	L	81.7	Confident	81.8	Confident	80 Å²	80	38.8 Å²	38.8	42%	0.419	21%	0.214	S	C	.	.	H	α-helix	trans	-63.8	-40	177.9	-71.8	173.6	0	0	0	112.3	V303 Q307 S738 L739 N744	V303-L742 HydrophobicContact CB-CD2 4.3Å; V303-L742 HydrophobicContact CG1-CD2 3.89Å; V303-L742 HydrophobicContact CG2-CD2 4.21Å; Q307-L742 PolarHBondContact NE2-O 2.91Å; S738-L742 WeakPolarHBondContact O-CB 3.33Å; S738-L742 VanDerWaalsContact O-CG 3.27Å; S738-L742 WeakPolarHBondContact O-CG 3.35Å; S738-L742 PolarHBondContact O-N 2.94Å; L739-L742 PolarHBondContact O-N 3.07Å; L742-N744 PolarHBondContact O-N 3.42Å
743	M	81.7	Confident	81.5	Confident	106 Å²	106	38.9 Å²	38.9	52%	0.522	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.5	176.9	-66	-176.1	72.4	0	0	113.4	L739 A740 F745	L739-M743 HydrophobicContact CD1-CG 4.43Å; L739-M743 HydrophobicContact CD1-SD 4.36Å; L739-M743 HydrophobicContact CG-CG 4.45Å; L739-M743 HydrophobicContact CG-SD 4.03Å; L739-M743 WeakPolarHBondContact O-CB 3.45Å; L739-M743 VanDerWaalsContact O-CG 3.31Å; L739-M743 WeakPolarHBondContact O-CG 3.48Å; L739-M743 PolarHBondContact O-N 3.35Å; A740-M743 PolarHBondContact O-N 3.43Å; M743-F745 HydrophobicContact CB-CD2 3.75Å; M743-F745 HydrophobicContact CB-CE2 3.93Å; M743-F745 HydrophobicContact CB-CG 4.35Å; M743-F745 HydrophobicContact CE-CD2 4.45Å; M743-F745 HydrophobicContact CE-CE2 3.55Å; M743-F745 HydrophobicContact CE-CZ 4.07Å; M743-F745 PolarHBondContact O-N 3.34Å; M743-F745 HydrophobicContact SD-CD2 4.35Å; M743-F745 HydrophobicContact SD-CE2 3.95Å
744	N	78.6	Confident	81.2	Confident	103 Å²	103	39.3 Å²	39.3	55%	0.551	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	29.8	-174.8	-158.9	37.5	0	0	0	113.8	K309 A740 T741 L742	K309-N744 WeakPolarHBondContact CE-OD1 3.06Å; K309-N744 PolarHBondContact NZ-OD1 3.44Å; A740-N744 PolarHBondContact O-N 2.8Å; T741-N744 PolarHBondContact O-N 3.42Å; T741-N744 VanDerWaalsContact O-N 3.16Å; L742-N744 PolarHBondContact O-N 3.42Å
745	F	79.6	Confident	80.7	Confident	55 Å²	55	40.4 Å²	40.4	24%	0.241	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-80	154.2	168	-70	-41.3	0	0	0	110.8	A740 M743 F814 L818	A740-F745 HydrophobicContact CB-CB 4.39Å; A740-F745 PolarHBondContact O-N 3.29Å; M743-F745 HydrophobicContact CB-CD2 3.75Å; M743-F745 HydrophobicContact CB-CE2 3.93Å; M743-F745 HydrophobicContact CB-CG 4.35Å; M743-F745 HydrophobicContact CE-CD2 4.45Å; M743-F745 HydrophobicContact CE-CE2 3.55Å; M743-F745 HydrophobicContact CE-CZ 4.07Å; M743-F745 PolarHBondContact O-N 3.34Å; M743-F745 HydrophobicContact SD-CD2 4.35Å; M743-F745 HydrophobicContact SD-CE2 3.95Å; F745-F814 HydrophobicContact CB-CE1 4.14Å; F745-F814 HydrophobicContact CG-CE1 4.45Å; F745-L818 HydrophobicContact CD1-CD2 4.32Å
746	P	76.6	Confident	80.5	Confident	48 Å²	48	39.5 Å²	39.5	31%	0.312	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-61.1	155.5	167.6	-16.9	29.9	0	0	0	111.7	P748 I823	P746-P748 WeakPolarHBondContact O-CD 3.32Å; P746-I823 HydrophobicContact CB-CD1 3.11Å; P746-I823 HydrophobicContact CB-CG1 3.78Å; P746-I823 HydrophobicContact CG-CD1 3.45Å; P746-I823 VanDerWaalsContact CG-CD1 3.45Å; P746-I823 HydrophobicContact CG-CG1 3.71Å
747	N	75.4	Confident	80.4	Confident	63 Å²	63	39.7 Å²	39.7	34%	0.337	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-62.9	124	179.7	-72	-20.8	0	0	0	110.2	I317 L749	I317-N747 WeakPolarHBondContact CD1-ND2 3.47Å; N747-L749 VanDerWaalsContact C-N 3.26Å; N747-L749 PolarHBondContact O-N 2.93Å
748	P	79.6	Confident	80.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-72.9	-19.9	-174.8	26.6	-33.5	0	0	0	113.2	L736 A740 P746 F814 T831	L736-P748 HydrophobicContact CD1-CG 4.26Å; L736-P748 HydrophobicContact CD2-CG 4.16Å; L736-P748 HydrophobicContact CG-CG 3.87Å; A740-P748 HydrophobicContact CB-CG 4.18Å; P746-P748 WeakPolarHBondContact O-CD 3.32Å; P748-F814 HydrophobicContact CB-CD2 3.97Å; P748-F814 HydrophobicContact CB-CE2 4Å; P748-F814 HydrophobicContact CB-CG 4.22Å; P748-F814 HydrophobicContact CB-CZ 4.29Å; P748-T831 HydrophobicContact CB-CG2 4.03Å
749	L	82.4	Confident	79.9	Confident	10 Å²	10	42.5 Å²	42.5	5%	0.052	23%	0.226	C	C	.	.	S	Bend	trans	-133.7	142.6	-177	-62.4	173.4	0	0	0	110.4	L736 N747 I754 I757 F832 F835	L736-L749 HydrophobicContact CD2-CD1 3.93Å; L736-L749 HydrophobicContact CD2-CG 4.48Å; N747-L749 VanDerWaalsContact C-N 3.26Å; N747-L749 PolarHBondContact O-N 2.93Å; L749-I754 HydrophobicContact CB-CD1 4.5Å; L749-I754 HydrophobicContact CB-CG1 4.14Å; L749-I757 HydrophobicContact CD1-CD1 4.25Å; L749-F832 HydrophobicContact CD2-CB 3.95Å; L749-F832 HydrophobicContact CD2-CD2 4.3Å; L749-F835 HydrophobicContact CD1-CD2 4.38Å
750	N	77.1	Confident	79.8	Confident	67 Å²	67	42.6 Å²	42.6	36%	0.358	23%	0.226	S	C	.	.			trans	-86	157.4	174.1	-167.1	4.3	0	0	0	111.6	M752 Q753 I754	N750-M752 VanDerWaalsContact C-N 3.28Å; N750-M752 PolarHBondContact O-N 2.91Å; N750-Q753 HydrophobicContact CB-CG 4.3Å; N750-Q753 WeakPolarHBondContact O-CB 3.27Å; N750-Q753 PolarHBondContact O-N 2.91Å; N750-I754 WeakPolarHBondContact O-CG1 3.17Å; N750-I754 PolarHBondContact O-N 3.2Å
751	A	72.7	Confident	79.9	Confident	47 Å²	47	42.6 Å²	42.6	39%	0.388	23%	0.226	S	C	.	.	H	α-helix	trans	-54.2	-41.4	178.1	0	0	0	0	0	112.8	Q753 I754 L755	A751-Q753 VanDerWaalsContact C-N 3.34Å; A751-Q753 PolarHBondContact O-N 3.23Å; A751-I754 PolarHBondContact O-N 3.02Å; A751-L755 PolarHBondContact O-N 3.15Å
752	M	75.3	Confident	80.2	Confident	58 Å²	58	42.8 Å²	42.8	29%	0.286	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-35.1	176.2	-67.7	-58.7	-67.1	0	0	113.1	N750 W756 V887 F888	N750-M752 VanDerWaalsContact C-N 3.28Å; N750-M752 PolarHBondContact O-N 2.91Å; M752-W756 WeakPolarHBondContact O-CB 3.49Å; M752-W756 PolarHBondContact O-N 3.47Å; M752-V887 HydrophobicContact CE-CG1 4.21Å; M752-F888 HydrophobicContact CB-CD1 4.16Å; M752-F888 HydrophobicContact CB-CE1 4.31Å
753	Q	83.4	Confident	80.4	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-71.3	-38	177.6	-67.8	170.3	-13.3	0	0	111.1	N750 A751 W756 I757 F832 F888	N750-Q753 HydrophobicContact CB-CG 4.3Å; N750-Q753 WeakPolarHBondContact O-CB 3.27Å; N750-Q753 PolarHBondContact O-N 2.91Å; A751-Q753 VanDerWaalsContact C-N 3.34Å; A751-Q753 PolarHBondContact O-N 3.23Å; Q753-W756 WeakPolarHBondContact O-CB 3.48Å; Q753-W756 PolarHBondContact O-N 2.99Å; Q753-I757 WeakPolarHBondContact O-CG1 3.46Å; Q753-I757 PolarHBondContact O-N 3.28Å; Q753-F832 HydrophobicContact CB-CD2 3.71Å; Q753-F832 HydrophobicContact CB-CE2 3.72Å; Q753-F832 HydrophobicContact CB-CG 4.41Å; Q753-F832 HydrophobicContact CB-CZ 4.44Å; Q753-F832 HydrophobicContact CG-CD2 4.02Å; Q753-F832 HydrophobicContact CG-CE2 4.1Å; Q753-F832 HydrophobicContact CG-CG 4.24Å; Q753-F832 HydrophobicContact CG-CZ 4.4Å; Q753-F888 PolarHBondContact NE2-O 3.13Å
754	I	79.8	Confident	80.7	Confident	12 Å²	12	36.7 Å²	36.7	6%	0.062	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-45	173.7	-64.3	167.5	0	0	0	110.6	A324 I737 L749 N750 A751 W756 I757 N758	A324-I754 HydrophobicContact CB-CG2 3.77Å; I737-I754 HydrophobicContact CD1-CD1 3.66Å; L749-I754 HydrophobicContact CB-CD1 4.5Å; L749-I754 HydrophobicContact CB-CG1 4.14Å; N750-I754 WeakPolarHBondContact O-CG1 3.17Å; N750-I754 PolarHBondContact O-N 3.2Å; A751-I754 PolarHBondContact O-N 3.02Å; I754-W756 VanDerWaalsContact C-N 3.29Å; I754-W756 PolarHBondContact O-N 3.2Å; I754-I757 PolarHBondContact O-N 2.84Å; I754-N758 PolarHBondContact O-N 3.06Å
755	L	76.9	Confident	81.2	Confident	39 Å²	39	31.8 Å²	31.8	20%	0.204	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-42	176.5	-172.2	70.6	0	0	0	111.6	A129 V133 A751 N758 I759	A129-L755 HydrophobicContact CB-CD2 4.06Å; V133-L755 HydrophobicContact CG2-CD1 4.26Å; A751-L755 PolarHBondContact O-N 3.15Å; L755-N758 PolarHBondContact O-N 3.47Å; L755-I759 HydrophobicContact CD1-CD1 3.56Å; L755-I759 HydrophobicContact CD1-CG1 4.27Å; L755-I759 HydrophobicContact CG-CD1 3.86Å; L755-I759 WeakPolarHBondContact O-CB 3.41Å; L755-I759 WeakPolarHBondContact O-CG1 3.41Å; L755-I759 PolarHBondContact O-N 3.3Å
756	W	84.9	Confident	81.6	Confident	43 Å²	43	29.2 Å²	29.2	16%	0.163	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-42.1	176.1	179	-95.7	0	0	0	112.7	M752 Q753 I754 I760 M761 F832 V878 F888	M752-W756 WeakPolarHBondContact O-CB 3.49Å; M752-W756 PolarHBondContact O-N 3.47Å; Q753-W756 WeakPolarHBondContact O-CB 3.48Å; Q753-W756 PolarHBondContact O-N 2.99Å; I754-W756 VanDerWaalsContact C-N 3.29Å; I754-W756 PolarHBondContact O-N 3.2Å; W756-I760 HydrophobicContact CD2-CB 4.11Å; W756-I760 HydrophobicContact CD2-CG1 4.24Å; W756-I760 HydrophobicContact CD2-CG2 4.43Å; W756-I760 HydrophobicContact CE3-CB 4.13Å; W756-I760 HydrophobicContact CE3-CG1 3.75Å; W756-I760 HydrophobicContact CE3-CG2 4.49Å; W756-I760 HydrophobicContact CH2-CB 4.38Å; W756-I760 HydrophobicContact CH2-CG1 4.29Å; W756-I760 HydrophobicContact CH2-CG2 3.86Å; W756-I760 HydrophobicContact CZ2-CB 4.36Å; W756-I760 HydrophobicContact CZ2-CG2 3.78Å; W756-I760 HydrophobicContact CZ3-CB 4.27Å; W756-I760 HydrophobicContact CZ3-CG1 3.78Å; W756-I760 HydrophobicContact CZ3-CG2 4.22Å; W756-I760 WeakPolarHBondContact O-CB 3.47Å; W756-I760 PolarHBondContact O-N 2.95Å; W756-M761 HydrophobicContact CZ2-CE 3.75Å; W756-M761 PolarHBondContact O-N 2.61Å; W756-F832 AromaticContact CD1-CE2 3.9Å; W756-F832 AromaticContact CD1-CZ 3.4Å; W756-F832 VanDerWaalsContact CD1-CZ 3.4Å; W756-F832 HydrophobicContact CG-CZ 4.14Å; W756-F832 AromaticContact NE1-CZ 3.9Å; W756-V878 HydrophobicContact CD2-CG2 4.39Å; W756-V878 HydrophobicContact CH2-CG2 3.84Å; W756-V878 HydrophobicContact CZ2-CG2 3.52Å; W756-V878 HydrophobicContact CZ3-CG2 4.38Å; W756-F888 HydrophobicContact CB-CE1 3.84Å; W756-F888 HydrophobicContact CB-CZ 4.46Å; W756-F888 HydrophobicContact CD2-CE1 4.34Å; W756-F888 HydrophobicContact CD2-CZ 4.18Å; W756-F888 HydrophobicContact CE3-CE1 4.15Å; W756-F888 HydrophobicContact CE3-CE2 4.27Å; W756-F888 AromaticContact CE3-CZ 3.6Å; W756-F888 HydrophobicContact CE3-CZ 3.6Å; W756-F888 HydrophobicContact CG-CE1 4.27Å; W756-F888 HydrophobicContact CZ3-CZ 4.2Å
757	I	85.8	Confident	82.2	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.015	16%	0.162	C	C	.	.	I	π-helix	trans	-59.5	-55.2	175.1	-70.1	160.8	0	0	0	109.7	T729 L749 Q753 I754 I759 M761 D762 F832 F835 V836	T729-I757 HydrophobicContact CG2-CG2 4.07Å; L749-I757 HydrophobicContact CD1-CD1 4.25Å; Q753-I757 WeakPolarHBondContact O-CG1 3.46Å; Q753-I757 PolarHBondContact O-N 3.28Å; I754-I757 PolarHBondContact O-N 2.84Å; I757-I759 PolarHBondContact O-N 3.1Å; I757-M761 CarbonylContact O-C 3.59Å; I757-M761 WeakPolarHBondContact O-CB 3.33Å; I757-M761 PolarHBondContact O-N 3.44Å; I757-D762 PolarHBondContact O-N 3.21Å; I757-F832 HydrophobicContact CD1-CD2 4.15Å; I757-F832 HydrophobicContact CD1-CE2 4.15Å; I757-F832 HydrophobicContact CG1-CD2 4.48Å; I757-F832 HydrophobicContact CG1-CE2 4.02Å; I757-F835 HydrophobicContact CD1-CD1 3.65Å; I757-F835 HydrophobicContact CD1-CE1 4.03Å; I757-F835 HydrophobicContact CD1-CG 4.29Å; I757-F835 HydrophobicContact CG1-CD1 4.28Å; I757-F835 HydrophobicContact CG2-CD1 4.23Å; I757-F835 HydrophobicContact CG2-CE1 3.79Å; I757-V836 HydrophobicContact CG1-CG2 4.16Å
758	N	79.4	Confident	82.9	Confident	31 Å²	31	26.9 Å²	26.9	17%	0.166	15%	0.148	C	C	.	.	I	π-helix	trans	-65.3	-34.9	-173.4	-73.2	-1.3	0	0	0	113.8	I754 L755	I754-N758 PolarHBondContact O-N 3.06Å; L755-N758 PolarHBondContact O-N 3.47Å
759	I	78.3	Confident	83.4	Confident	61 Å²	61	26.9 Å²	26.9	31%	0.313	15%	0.148	S	C	.	.	I	π-helix	trans	-92.4	-51.6	-176.2	-61.4	180	0	0	0	111.8	V133 L755 I757 G763	V133-I759 HydrophobicContact CG2-CD1 3.89Å; L755-I759 HydrophobicContact CD1-CD1 3.56Å; L755-I759 HydrophobicContact CD1-CG1 4.27Å; L755-I759 HydrophobicContact CG-CD1 3.86Å; L755-I759 WeakPolarHBondContact O-CB 3.41Å; L755-I759 WeakPolarHBondContact O-CG1 3.41Å; L755-I759 PolarHBondContact O-N 3.3Å; I757-I759 PolarHBondContact O-N 3.1Å; I759-G763 PolarHBondContact O-N 3.24Å
760	I	83.3	Confident	83.5	Confident	65 Å²	65	26.6 Å²	26.6	33%	0.333	15%	0.147	S	C	.	.	I	π-helix	trans	-96.2	-36.7	-168.1	-60.5	-66	0	0	0	112.3	W756 P764	W756-I760 HydrophobicContact CD2-CB 4.11Å; W756-I760 HydrophobicContact CD2-CG1 4.24Å; W756-I760 HydrophobicContact CD2-CG2 4.43Å; W756-I760 HydrophobicContact CE3-CB 4.13Å; W756-I760 HydrophobicContact CE3-CG1 3.75Å; W756-I760 HydrophobicContact CE3-CG2 4.49Å; W756-I760 HydrophobicContact CH2-CB 4.38Å; W756-I760 HydrophobicContact CH2-CG1 4.29Å; W756-I760 HydrophobicContact CH2-CG2 3.86Å; W756-I760 HydrophobicContact CZ2-CB 4.36Å; W756-I760 HydrophobicContact CZ2-CG2 3.78Å; W756-I760 HydrophobicContact CZ3-CB 4.27Å; W756-I760 HydrophobicContact CZ3-CG1 3.78Å; W756-I760 HydrophobicContact CZ3-CG2 4.22Å; W756-I760 WeakPolarHBondContact O-CB 3.47Å; W756-I760 PolarHBondContact O-N 2.95Å; I760-P764 WeakPolarHBondContact O-CD 3.38Å
761	M	86.4	Confident	84	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-86.9	-33.3	-179.1	-61.2	-62.6	166	0	0	112.3	W756 I757 P765 V836 M840 S871 Q875	W756-M761 HydrophobicContact CZ2-CE 3.75Å; W756-M761 PolarHBondContact O-N 2.61Å; I757-M761 CarbonylContact O-C 3.59Å; I757-M761 WeakPolarHBondContact O-CB 3.33Å; I757-M761 PolarHBondContact O-N 3.44Å; M761-P765 VanDerWaalsContact O-CD 3.23Å; M761-P765 WeakPolarHBondContact O-CD 3.36Å; M761-P765 WeakPolarHBondContact O-CG 3.44Å; M761-V836 HydrophobicContact CE-CG1 4.15Å; M761-V836 HydrophobicContact CG-CG1 3.92Å; M761-V836 HydrophobicContact CG-CG2 4.06Å; M761-V836 HydrophobicContact SD-CG1 3.59Å; M761-V836 VanDerWaalsContact SD-CG1 3.59Å; M761-M840 HydrophobicContact CB-CE 4.36Å; M761-M840 WeakPolarHBondContact O-CE 3.48Å; M761-S871 VanDerWaalsContact CE-O 3.31Å; M761-S871 WeakPolarHBondContact CE-O 3.23Å; M761-Q875 HydrophobicContact CE-CB 3.78Å
762	D	85.8	Confident	84.7	Confident	6 Å²	6	22.9 Å²	22.9	3%	0.032	12%	0.122	C	C	.	.	S	Bend	trans	-88.3	-44.1	178	-80.2	-0.6	0	0	0	112.6	F725 T729 I757 A766	F725-D762 HydrophobicContact CE1-CB 4.45Å; F725-D762 WeakPolarHBondContact CZ-OD1 3.45Å; T729-D762 WeakPolarHBondContact CG2-OD2 3.46Å; I757-D762 PolarHBondContact O-N 3.21Å; D762-A766 WeakPolarHBondContact O-CB 3.2Å; D762-A766 PolarHBondContact O-N 3.44Å
763	G	85.4	Confident	85.1	Confident	10 Å²	10	23.2 Å²	23.2	10%	0.103	13%	0.128	C	C	.	.	H	α-helix	trans	-57.2	-68	-170.9	0	0	0	0	0	114.1	I759 A766 Q767	I759-G763 PolarHBondContact O-N 3.24Å; G763-A766 PolarHBondContact O-N 3.03Å; G763-Q767 WeakPolarHBondContact O-CG 3.29Å; G763-Q767 PolarHBondContact O-N 3Å
764	P	87.4	Confident	85.1	Confident	48 Å²	48	24.6 Å²	24.6	31%	0.312	14%	0.137	S	C	.	.	H	α-helix	trans	-59	-44	-177.2	-18.2	27.6	0	0	0	114	I760 Q767 S768 A867	I760-P764 WeakPolarHBondContact O-CD 3.38Å; P764-Q767 PolarHBondContact O-N 3.21Å; P764-S768 WeakPolarHBondContact O-CB 3.41Å; P764-S768 PolarHBondContact O-N 3.36Å; P764-A867 HydrophobicContact CB-CB 4.39Å
765	P	89.6	Confident	85.1	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-42.5	173.9	-28.9	41.4	0	0	0	113.1	F725 M761 Q767 S768 L769 M840	F725-P765 HydrophobicContact CE1-CB 4.27Å; M761-P765 VanDerWaalsContact O-CD 3.23Å; M761-P765 WeakPolarHBondContact O-CD 3.36Å; M761-P765 WeakPolarHBondContact O-CG 3.44Å; P765-Q767 PolarHBondContact O-N 3.01Å; P765-S768 WeakPolarHBondContact CA-OG 3.35Å; P765-S768 PolarHBondContact O-N 2.85Å; P765-S768 VanDerWaalsContact O-N 3.16Å; P765-S768 PolarHBondContact O-OG 2.7Å; P765-L769 WeakPolarHBondContact O-CG 3.32Å; P765-L769 PolarHBondContact O-N 2.94Å; P765-M840 HydrophobicContact CG-CE 4.15Å; P765-M840 HydrophobicContact CG-SD 4.41Å
766	A	88.9	Confident	85.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-42.4	174.9	0	0	0	0	0	112.2	V333 F722 F725 Q726 D762 G763 S768 L769 G770	V333-A766 HydrophobicContact CG1-CB 4.17Å; V333-A766 HydrophobicContact CG2-CB 4.13Å; F722-A766 HydrophobicContact CB-CB 4.16Å; F722-A766 WeakPolarHBondContact CB-O 3.49Å; F725-A766 HydrophobicContact CD1-CB 4.09Å; F725-A766 HydrophobicContact CE1-CB 4.22Å; Q726-A766 HydrophobicContact CG-CB 3.96Å; D762-A766 WeakPolarHBondContact O-CB 3.2Å; D762-A766 PolarHBondContact O-N 3.44Å; G763-A766 PolarHBondContact O-N 3.03Å; A766-S768 VanDerWaalsContact C-N 3.34Å; A766-S768 PolarHBondContact O-N 3.17Å; A766-L769 WeakPolarHBondContact O-CB 3.43Å; A766-L769 PolarHBondContact O-N 3.26Å; A766-G770 PolarHBondContact O-N 2.99Å
767	Q	88.4	Confident	84.8	Confident	56 Å²	56	35.5 Å²	35.5	26%	0.262	18%	0.183	S	C	.	.	H	α-helix	trans	-59.9	-44.8	173.1	-69.4	-178.4	-10.7	0	0	111.4	V333 G763 P764 P765 L769 G770 V771	V333-Q767 HydrophobicContact CB-CG 4.39Å; V333-Q767 HydrophobicContact CG1-CG 4.28Å; V333-Q767 HydrophobicContact CG2-CG 3.76Å; G763-Q767 WeakPolarHBondContact O-CG 3.29Å; G763-Q767 PolarHBondContact O-N 3Å; P764-Q767 PolarHBondContact O-N 3.21Å; P765-Q767 PolarHBondContact O-N 3.01Å; Q767-L769 VanDerWaalsContact C-N 3.3Å; Q767-L769 PolarHBondContact O-N 3.3Å; Q767-G770 WeakPolarHBondContact O-CA 3.21Å; Q767-G770 PolarHBondContact O-N 3.39Å; Q767-V771 WeakPolarHBondContact O-CG2 3.39Å; Q767-V771 PolarHBondContact O-N 2.73Å
768	S	90.1	Very high	84.7	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-30.5	-179.3	77.2	0	0	0	0	113.6	P764 P765 A766 G770 V771 N861 F864	P764-S768 WeakPolarHBondContact O-CB 3.41Å; P764-S768 PolarHBondContact O-N 3.36Å; P765-S768 WeakPolarHBondContact CA-OG 3.35Å; P765-S768 PolarHBondContact O-N 2.85Å; P765-S768 VanDerWaalsContact O-N 3.16Å; P765-S768 PolarHBondContact O-OG 2.7Å; A766-S768 VanDerWaalsContact C-N 3.34Å; A766-S768 PolarHBondContact O-N 3.17Å; S768-G770 VanDerWaalsContact C-N 3.29Å; S768-V771 PolarHBondContact O-N 3.36Å; S768-V771 VanDerWaalsContact O-N 3.16Å; S768-N861 PolarHBondContact O-ND2 3.22Å; S768-F864 WeakPolarHBondContact OG-CA 3.5Å; S768-F864 VanDerWaalsContact OG-CD2 3.29Å; S768-F864 WeakPolarHBondContact OG-CD2 3.24Å
769	L	89.3	Confident	84.8	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-31	170.2	-71.6	173.8	0	0	0	111.9	F722 F725 P765 A766 Q767 V771 E772 R847 F864	F722-L769 HydrophobicContact CB-CB 3.89Å; F722-L769 HydrophobicContact CB-CD1 4.19Å; F725-L769 HydrophobicContact CB-CD1 3.96Å; F725-L769 HydrophobicContact CD1-CD1 4.03Å; F725-L769 HydrophobicContact CG-CD1 4.11Å; P765-L769 WeakPolarHBondContact O-CG 3.32Å; P765-L769 PolarHBondContact O-N 2.94Å; A766-L769 WeakPolarHBondContact O-CB 3.43Å; A766-L769 PolarHBondContact O-N 3.26Å; Q767-L769 VanDerWaalsContact C-N 3.3Å; Q767-L769 PolarHBondContact O-N 3.3Å; L769-V771 PolarHBondContact O-N 3.37Å; L769-E772 PolarHBondContact O-N 3.45Å; L769-R847 HydrophobicContact CD2-CB 4.22Å; L769-R847 HydrophobicContact CD2-CG 3.5Å; L769-R847 VanDerWaalsContact CD2-CG 3.5Å; L769-F864 HydrophobicContact CD2-CD2 3.9Å; L769-F864 HydrophobicContact CD2-CE2 3.8Å; L769-F864 HydrophobicContact CG-CD2 4.2Å; L769-F864 HydrophobicContact CG-CE2 4.17Å
770	G	86.4	Confident	85.1	Confident	4 Å²	4	41.9 Å²	41.9	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-28.9	170	0	0	0	0	0	113.5	T337 N718 A766 Q767 S768	T337-G770 WeakPolarHBondContact CG2-O 3.11Å; N718-G770 PolarHBondContact ND2-O 2.79Å; A766-G770 PolarHBondContact O-N 2.99Å; Q767-G770 WeakPolarHBondContact O-CA 3.21Å; Q767-G770 PolarHBondContact O-N 3.39Å; S768-G770 VanDerWaalsContact C-N 3.29Å
771	V	86.3	Confident	85.2	Confident	30 Å²	30	43.7 Å²	43.7	18%	0.182	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	7.1	-174.8	-166.3	0	0	0	0	112.7	L340 R344 Q767 S768 L769	L340-V771 HydrophobicContact CD1-CG2 3.54Å; R344-V771 PolarHBondContact NH2-O 2.81Å; Q767-V771 WeakPolarHBondContact O-CG2 3.39Å; Q767-V771 PolarHBondContact O-N 2.73Å; S768-V771 PolarHBondContact O-N 3.36Å; S768-V771 VanDerWaalsContact O-N 3.16Å; L769-V771 PolarHBondContact O-N 3.37Å
772	E	87.8	Confident	85.3	Confident	5 Å²	5	48.3 Å²	48.3	2%	0.023	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-58	142.1	178.4	-159.2	68.1	-154.2	0	0	111.2	R344 N718 L769 R847 M856 N861	R344-E772 PolarHBondContact NH1-O 2.82Å; N718-E772 PolarHBondContact ND2-O 2.85Å; L769-E772 PolarHBondContact O-N 3.45Å; E772-R847 IonicContact OE1-CZ 3.76Å; E772-R847 IonicContact OE1-NE 2.74Å; E772-R847 PolarHBondContact OE1-NE 3Å; E772-R847 IonicContact OE1-NH2 2.91Å; E772-R847 PolarHBondContact OE1-NH2 3.49Å; E772-R847 IonicContact OE2-NE 3.67Å; E772-R847 PolarHBondContact OE2-NE 3.09Å; E772-R847 IonicContact OE2-NH2 2.77Å; E772-M856 HydrophobicContact CG-CE 4.25Å; E772-M856 VanDerWaalsContact OE1-CE 3.24Å; E772-M856 WeakPolarHBondContact OE1-CE 3.36Å; E772-N861 WeakPolarHBondContact OE2-CB 3.33Å; E772-N861 PolarHBondContact OE2-ND2 3.4Å
773	P	84.4	Confident	85.5	Confident	66 Å²	66	49.1 Å²	49.1	43%	0.429	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-63.5	146.4	178.6	24.3	-35.1	0	0	0	112.4
774	V	82.4	Confident	85.5	Confident	31 Å²	31	50 Å²	50	19%	0.188	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-68.2	133.3	178.6	-175.1	0	0	0	0	110.3	E710 E711	E710-V774 HydrophobicContact CG-CG1 4.23Å; E711-V774 WeakPolarHBondContact OE2-CG2 3.48Å
775	D	79.9	Confident	85.4	Confident	38 Å²	38	51.8 Å²	51.8	20%	0.203	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-76.6	126.8	174.9	179.5	-4	0	0	0	110	D777 V778 R851	D775-D777 PolarHBondContact O-N 3.34Å; D775-D777 VanDerWaalsContact O-N 3.15Å; D775-D777 PolarHBondContact OD1-N 3.36Å; D775-D777 VanDerWaalsContact OD1-N 3.13Å; D775-V778 HydrophobicContact CB-CG2 3.73Å; D775-V778 WeakPolarHBondContact O-CB 3.37Å; D775-V778 WeakPolarHBondContact O-CG2 3.48Å; D775-V778 PolarHBondContact O-N 3.43Å; D775-R851 IonicContact OD1-CZ 3.2Å; D775-R851 IonicContact OD1-NH2 3.78Å; D775-R851 PolarHBondContact OD1-NH2 3.46Å; D775-R851 IonicContact OD2-CZ 3.72Å; D775-R851 IonicContact OD2-NE 3.2Å; D775-R851 PolarHBondContact OD2-NE 3.04Å; D775-R851 IonicContact OD2-NH2 3.22Å; D775-R851 PolarHBondContact OD2-NH2 3.18Å
776	R	76	Confident	85.1	Confident	212 Å²	212	54.2 Å²	54.2	80%	0.8	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.8	-176.6	-64.2	-172.3	177.8	-168.9	-1.6	113.6	V778	R776-V778 PolarHBondContact O-N 2.87Å
777	D	79.9	Confident	84.7	Confident	73 Å²	73	62.8 Å²	62.8	39%	0.39	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-79.9	-3.6	179	-66.9	-46.7	0	0	0	112.9	D775 I779 R780 R851	D775-D777 PolarHBondContact O-N 3.34Å; D775-D777 VanDerWaalsContact O-N 3.15Å; D775-D777 PolarHBondContact OD1-N 3.36Å; D775-D777 VanDerWaalsContact OD1-N 3.13Å; D777-I779 PolarHBondContact O-N 2.96Å; D777-R780 PolarHBondContact O-N 3.14Å; D777-R851 IonicContact OD2-NH2 3.7Å; D777-R851 PolarHBondContact OD2-NH2 3.17Å
778	V	83.4	Confident	84.3	Confident	8 Å²	8	64 Å²	64	5%	0.048	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-68	-35.2	-176.3	171.4	0	0	0	0	112.1	K713 D775 R776 R780 K781	K713-V778 HydrophobicContact CB-CG1 3.19Å; K713-V778 HydrophobicContact CD-CG1 3.96Å; K713-V778 HydrophobicContact CG-CG1 4.19Å; D775-V778 HydrophobicContact CB-CG2 3.73Å; D775-V778 WeakPolarHBondContact O-CB 3.37Å; D775-V778 WeakPolarHBondContact O-CG2 3.48Å; D775-V778 PolarHBondContact O-N 3.43Å; R776-V778 PolarHBondContact O-N 2.87Å; V778-R780 PolarHBondContact O-N 2.83Å; V778-K781 PolarHBondContact O-N 3.19Å; V778-K781 VanDerWaalsContact O-N 3.16Å
779	I	82.3	Confident	83.8	Confident	23 Å²	23	67.2 Å²	67.2	12%	0.118	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-33.5	-179.4	-167.4	60.2	0	0	0	112.2	T578 S582 M706 E710 K713 D777 K781	T578-I779 HydrophobicContact CG2-CG1 4.35Å; S582-I779 VanDerWaalsContact CB-O 3.24Å; S582-I779 WeakPolarHBondContact CB-O 3.41Å; M706-I779 HydrophobicContact CG-CD1 4.22Å; E710-I779 HydrophobicContact CB-CD1 4.19Å; E710-I779 HydrophobicContact CG-CB 4.47Å; K713-I779 PolarHBondContact NZ-O 3.44Å; D777-I779 PolarHBondContact O-N 2.96Å; I779-K781 VanDerWaalsContact C-N 3.26Å; I779-K781 PolarHBondContact O-N 2.74Å
780	R	83.8	Confident	83.4	Confident	197 Å²	197	67.3 Å²	67.3	74%	0.743	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-14	-179.5	-64.8	179.4	176.4	173.9	-4.2	113.7	D777 V778	D777-R780 PolarHBondContact O-N 3.14Å; V778-R780 PolarHBondContact O-N 2.83Å
781	K	85.1	Confident	83.2	Confident	104 Å²	104	68.7 Å²	68.7	45%	0.452	34%	0.337	S	S	.	.	S	Bend	trans	-78.8	144.8	177.7	-66.6	179.1	-177.1	170.2	0	110.1	K713 V778 I779	K713-K781 PolarHBondContact NZ-O 3.02Å; V778-K781 PolarHBondContact O-N 3.19Å; V778-K781 VanDerWaalsContact O-N 3.16Å; I779-K781 VanDerWaalsContact C-N 3.26Å; I779-K781 PolarHBondContact O-N 2.74Å
782	P	89.4	Confident	83.1	Confident	97 Å²	97	69.7 Å²	69.7	63%	0.63	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-60.7	153.5	176.5	26	-34	0	0	0	113	S582	S582-P782 VanDerWaalsContact O-CA 3.22Å; S582-P782 WeakPolarHBondContact O-CA 3.37Å
783	P	89.5	Confident	83	Confident	22 Å²	22	80.2 Å²	80.2	14%	0.143	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-50.3	141.7	168.4	-26.7	35.3	0	0	0	111	C364 N365 S582 V584	C364-P783 WeakPolarHBondContact O-CB 3.37Å; C364-P783 VanDerWaalsContact O-CG 3.3Å; C364-P783 WeakPolarHBondContact O-CG 3.41Å; N365-P783 HydrophobicContact CB-CB 4.03Å; N365-P783 HydrophobicContact CB-CG 4.22Å; S582-P783 VanDerWaalsContact O-CD 3.28Å; S582-P783 WeakPolarHBondContact O-CD 3.19Å; V584-P783 HydrophobicContact CG2-CG 3.54Å
784	R	85.4	Confident	83.1	Confident	29 Å²	29	79.9 Å²	79.9	11%	0.109	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-66.3	140.7	177.7	-176.8	179.5	78.5	92.2	-12.2	110	E359 S362 C363 Y716 V786 D788	E359-R784 IonicContact OE1-CZ 2.76Å; E359-R784 IonicContact OE1-NE 2.99Å; E359-R784 IonicContact OE1-NH2 3.25Å; E359-R784 PolarHBondContact OE1-NH2 3.19Å; S362-R784 PolarHBondContact O-N 3.32Å; C363-R784 PolarHBondContact SG-NE 3.44Å; C363-R784 PolarHBondContact SG-NH2 3.35Å; Y716-R784 VanDerWaalsContact OH-CD 3.24Å; Y716-R784 WeakPolarHBondContact OH-CD 3.19Å; R784-V786 PolarHBondContact O-N 2.96Å; R784-D788 PolarHBondContact NH1-O 2.67Å
785	N	85.4	Confident	83.3	Confident	86 Å²	86	78.6 Å²	78.6	46%	0.46	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-72.5	125.2	167.1	-168	-31.8	0	0	0	109.6	K787 D788	N785-K787 PolarHBondContact O-N 3.19Å; N785-K787 VanDerWaalsContact O-N 3.12Å; N785-K787 WeakPolarHBondContact OD1-CB 3.41Å; N785-K787 PolarHBondContact OD1-N 3.06Å; N785-D788 VanDerWaalsContact O-CB 3.32Å; N785-D788 WeakPolarHBondContact O-CB 3.33Å; N785-D788 PolarHBondContact O-N 2.88Å
786	V	82.8	Confident	83.7	Confident	51 Å²	51	80.2 Å²	80.2	31%	0.309	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.1	178.3	-69	0	0	0	0	113.6	P277 C363 V658 R784 D788	P277-V786 HydrophobicContact CG-CG1 4.18Å; C363-V786 HydrophobicContact CB-CG1 4.07Å; V658-V786 HydrophobicContact CG2-CG1 3.25Å; R784-V786 PolarHBondContact O-N 2.96Å; V786-D788 VanDerWaalsContact C-N 3.28Å
787	K	80.2	Confident	84.4	Confident	179 Å²	179	74.3 Å²	74.3	78%	0.778	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-15.8	176.9	-62.2	-178.5	-178.9	177	0	113.2	N785 T789	N785-K787 PolarHBondContact O-N 3.19Å; N785-K787 VanDerWaalsContact O-N 3.12Å; N785-K787 WeakPolarHBondContact OD1-CB 3.41Å; N785-K787 PolarHBondContact OD1-N 3.06Å; K787-T789 PolarHBondContact O-N 3.02Å
788	D	80.1	Confident	84.9	Confident	83 Å²	83	71.3 Å²	71.3	44%	0.444	35%	0.353	S	S	.	.	S	Bend	trans	-69.6	128.1	177.6	-69.1	-18.3	0	0	0	109.7	R784 N785 V786	R784-D788 PolarHBondContact NH1-O 2.67Å; N785-D788 VanDerWaalsContact O-CB 3.32Å; N785-D788 WeakPolarHBondContact O-CB 3.33Å; N785-D788 PolarHBondContact O-N 2.88Å; V786-D788 VanDerWaalsContact C-N 3.28Å
789	T	80.3	Confident	85.3	Confident	73 Å²	73	71 Å²	71	45%	0.448	35%	0.351	S	S	.	.			trans	-70.8	148.7	174.8	52.9	0	0	0	0	110.8	K787 L791	K787-T789 PolarHBondContact O-N 3.02Å; T789-L791 VanDerWaalsContact C-N 3.26Å; T789-L791 PolarHBondContact O-N 2.86Å; T789-L791 PolarHBondContact OG1-O 3.06Å
790	I	80.9	Confident	85.8	Confident	3 Å²	3	74 Å²	74	2%	0.015	37%	0.367	C	S	.	.	S	Bend	trans	-59.6	-41.5	173.4	-68.8	176.1	0	0	0	110.3	L278 M282 L285 Y716 V723 T792	L278-I790 HydrophobicContact CD1-CD1 3.87Å; M282-I790 HydrophobicContact CE-CD1 3.21Å; L285-I790 HydrophobicContact CD1-CB 4.16Å; L285-I790 HydrophobicContact CD1-CD1 4.44Å; L285-I790 HydrophobicContact CD1-CG2 4.26Å; Y716-I790 HydrophobicContact CE2-CG1 4.23Å; V723-I790 HydrophobicContact CG1-CG2 4.36Å; I790-T792 PolarHBondContact O-N 3.09Å
791	L	81.3	Confident	86.2	Confident	33 Å²	33	66.9 Å²	66.9	17%	0.173	35%	0.346	C	S	.	.	S	Bend	trans	-80.7	89.2	169.3	-64.3	179.5	0	0	0	110.4	L285 V723 L727 T789 L795	L285-L791 HydrophobicContact CD2-CD1 3.36Å; L285-L791 HydrophobicContact CD2-CG 3.79Å; V723-L791 HydrophobicContact CG1-CD2 4.27Å; L727-L791 HydrophobicContact CD1-CD1 4.28Å; L727-L791 HydrophobicContact CD1-CD2 4.15Å; L727-L791 HydrophobicContact CD2-CD2 4.31Å; T789-L791 VanDerWaalsContact C-N 3.26Å; T789-L791 PolarHBondContact O-N 2.86Å; T789-L791 PolarHBondContact OG1-O 3.06Å; L791-L795 HydrophobicContact CD2-CD2 3.49Å; L791-L795 VanDerWaalsContact CD2-CD2 3.49Å
792	T	85.2	Confident	86.6	Confident	50 Å²	50	62 Å²	62	31%	0.307	32%	0.324	S	S	.	.			trans	-72.7	155.6	169.2	63.6	0	0	0	0	110.3	I790 S794 L795 L796	I790-T792 PolarHBondContact O-N 3.09Å; T792-S794 PolarHBondContact O-N 3.25Å; T792-L795 WeakPolarHBondContact O-CB 3.42Å; T792-L795 PolarHBondContact O-N 2.84Å; T792-L795 WeakPolarHBondContact OG1-CB 3.43Å; T792-L795 PolarHBondContact OG1-N 2.76Å; T792-L796 PolarHBondContact O-N 3.34Å
793	R	85.5	Confident	86.8	Confident	227 Å²	227	57.5 Å²	57.5	86%	0.857	30%	0.296	S	S	*	.	H	α-helix	trans	-54.6	-39.1	177.3	-67.9	-175.2	-179.6	-179.2	0.2	112.5	L796 V797	R793-L796 PolarHBondContact O-N 3.39Å; R793-V797 VanDerWaalsContact O-CG2 3.32Å; R793-V797 WeakPolarHBondContact O-CG2 3.07Å; R793-V797 PolarHBondContact O-N 3.41Å
794	S	85.8	Confident	87	Confident	58 Å²	58	63.1 Å²	63.1	41%	0.406	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-43.9	175.5	175.2	0	0	0	0	111.8	T792 V797 K798	T792-S794 PolarHBondContact O-N 3.25Å; S794-V797 PolarHBondContact O-N 3.16Å; S794-K798 WeakPolarHBondContact O-CG 3.33Å; S794-K798 PolarHBondContact O-N 3.39Å; S794-K798 VanDerWaalsContact O-N 3.16Å
795	L	87.1	Confident	87.4	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-63.8	-44.6	177.4	-165.5	112.6	0	0	0	111.2	K720 R724 L791 T792 V797 K798 V799	K720-L795 HydrophobicContact CB-CD1 4.37Å; R724-L795 HydrophobicContact CB-CD1 4.16Å; R724-L795 HydrophobicContact CB-CG 4.35Å; L791-L795 HydrophobicContact CD2-CD2 3.49Å; L791-L795 VanDerWaalsContact CD2-CD2 3.49Å; T792-L795 WeakPolarHBondContact O-CB 3.42Å; T792-L795 PolarHBondContact O-N 2.84Å; T792-L795 WeakPolarHBondContact OG1-CB 3.43Å; T792-L795 PolarHBondContact OG1-N 2.76Å; L795-V797 PolarHBondContact O-N 3.25Å; L795-K798 PolarHBondContact O-N 2.99Å; L795-V799 HydrophobicContact CD2-CG2 4.48Å; L795-V799 WeakPolarHBondContact O-CG2 3.27Å; L795-V799 PolarHBondContact O-N 2.86Å
796	L	89.4	Confident	87.8	Confident	71 Å²	71	59.1 Å²	59.1	37%	0.372	30%	0.298	S	S	.	.	H	α-helix	trans	-61.2	-44	178.9	-174.9	66.1	0	0	0	112.1	T792 R793 K798 V799 L800	T792-L796 PolarHBondContact O-N 3.34Å; R793-L796 PolarHBondContact O-N 3.39Å; L796-K798 VanDerWaalsContact C-N 3.3Å; L796-K798 PolarHBondContact O-N 2.92Å; L796-V799 PolarHBondContact O-N 3.45Å; L796-L800 HydrophobicContact CD1-CG 4.49Å; L796-L800 HydrophobicContact CG-CD1 4.2Å; L796-L800 HydrophobicContact CG-CG 4.48Å; L796-L800 WeakPolarHBondContact O-CG 3.49Å; L796-L800 PolarHBondContact O-N 3.45Å
797	V	90.2	Very high	88.4	Confident	89 Å²	89	57.1 Å²	57.1	54%	0.539	29%	0.286	S	S	.	.	H	α-helix	trans	-59	-44.7	175.8	169.2	0	0	0	0	110.7	R793 S794 L795 V799 L800 V801	R793-V797 VanDerWaalsContact O-CG2 3.32Å; R793-V797 WeakPolarHBondContact O-CG2 3.07Å; R793-V797 PolarHBondContact O-N 3.41Å; S794-V797 PolarHBondContact O-N 3.16Å; L795-V797 PolarHBondContact O-N 3.25Å; V797-V799 PolarHBondContact O-N 3.03Å; V797-L800 PolarHBondContact O-N 2.86Å; V797-V801 HydrophobicContact CG1-CG2 4.48Å; V797-V801 VanDerWaalsContact O-CG2 3.3Å; V797-V801 WeakPolarHBondContact O-CG2 3.28Å; V797-V801 PolarHBondContact O-N 3.18Å
798	K	89.8	Confident	89	Confident	10 Å²	10	51.3 Å²	51.3	4%	0.043	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-38.6	178.8	-67.8	-178	-167.8	-179.8	0	112.4	S794 L795 L796 S802 Q849 E919	S794-K798 WeakPolarHBondContact O-CG 3.33Å; S794-K798 PolarHBondContact O-N 3.39Å; S794-K798 VanDerWaalsContact O-N 3.16Å; L795-K798 PolarHBondContact O-N 2.99Å; L796-K798 VanDerWaalsContact C-N 3.3Å; L796-K798 PolarHBondContact O-N 2.92Å; K798-S802 PolarHBondContact O-N 3.37Å; K798-S802 PolarHBondContact O-OG 3.24Å; K798-Q849 PolarHBondContact NZ-O 3.33Å; K798-E919 VanDerWaalsContact CE-CD 3.47Å; K798-E919 WeakPolarHBondContact CE-OE1 3.41Å; K798-E919 VanDerWaalsContact CE-OE2 3.23Å; K798-E919 WeakPolarHBondContact CE-OE2 3.44Å; K798-E919 IonicContact NZ-OE1 3.93Å; K798-E919 PolarHBondContact NZ-OE1 3.25Å; K798-E919 IonicContact NZ-OE2 3.36Å; K798-E919 PolarHBondContact NZ-OE2 3.21Å
799	V	91.7	Very high	89.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-48.4	174	166.8	0	0	0	0	111.2	R724 L727 I731 L795 L796 V797 V801 S802 A803	R724-V799 HydrophobicContact CB-CG2 4.33Å; R724-V799 HydrophobicContact CG-CG2 3.81Å; L727-V799 HydrophobicContact CD2-CG1 3.8Å; I731-V799 HydrophobicContact CD1-CG1 3.98Å; L795-V799 HydrophobicContact CD2-CG2 4.48Å; L795-V799 WeakPolarHBondContact O-CG2 3.27Å; L795-V799 PolarHBondContact O-N 2.86Å; L796-V799 PolarHBondContact O-N 3.45Å; V797-V799 PolarHBondContact O-N 3.03Å; V799-V801 VanDerWaalsContact C-N 3.34Å; V799-V801 PolarHBondContact O-N 2.7Å; V799-S802 PolarHBondContact O-N 2.92Å; V799-A803 WeakPolarHBondContact O-CB 3.29Å; V799-A803 PolarHBondContact O-N 3.34Å
800	L	92.6	Very high	90.2	Very high	86 Å²	86	44.3 Å²	44.3	45%	0.45	23%	0.23	S	C	.	.	H	α-helix	trans	-64.1	-38.4	179.8	-69.6	174.7	0	0	0	112.2	I731 L796 V797 A803 F804	I731-L800 HydrophobicContact CG2-CD2 4.5Å; L796-L800 HydrophobicContact CD1-CG 4.49Å; L796-L800 HydrophobicContact CG-CD1 4.2Å; L796-L800 HydrophobicContact CG-CG 4.48Å; L796-L800 WeakPolarHBondContact O-CG 3.49Å; L796-L800 PolarHBondContact O-N 3.45Å; V797-L800 PolarHBondContact O-N 2.86Å; L800-A803 PolarHBondContact O-N 3.49Å; L800-F804 VanDerWaalsContact O-CB 3.25Å; L800-F804 WeakPolarHBondContact O-CB 3.24Å; L800-F804 PolarHBondContact O-N 3.25Å
801	V	93.3	Very high	90.6	Very high	49 Å²	49	45.5 Å²	45.5	30%	0.297	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-46.7	175.5	171.8	0	0	0	0	111.2	V797 V799 F804 I805 V911 I915	V797-V801 HydrophobicContact CG1-CG2 4.48Å; V797-V801 VanDerWaalsContact O-CG2 3.3Å; V797-V801 WeakPolarHBondContact O-CG2 3.28Å; V797-V801 PolarHBondContact O-N 3.18Å; V799-V801 VanDerWaalsContact C-N 3.34Å; V799-V801 PolarHBondContact O-N 2.7Å; V801-F804 PolarHBondContact O-N 2.89Å; V801-I805 HydrophobicContact CG1-CD1 4.07Å; V801-I805 WeakPolarHBondContact O-CG1 3.19Å; V801-I805 PolarHBondContact O-N 3.01Å; V801-V911 HydrophobicContact CG1-CG1 4.27Å; V801-I915 HydrophobicContact CG1-CD1 3.91Å
802	S	92.4	Very high	91.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.7	-51.4	174.1	-76.3	0	0	0	0	110.6	K798 V799 F804 I805 I806 N842	K798-S802 PolarHBondContact O-N 3.37Å; K798-S802 PolarHBondContact O-OG 3.24Å; V799-S802 PolarHBondContact O-N 2.92Å; S802-F804 VanDerWaalsContact C-N 3.32Å; S802-F804 PolarHBondContact O-N 3.45Å; S802-I805 PolarHBondContact O-N 2.87Å; S802-I806 VanDerWaalsContact O-CG1 3.26Å; S802-I806 WeakPolarHBondContact O-CG1 3.34Å; S802-I806 PolarHBondContact O-N 2.9Å; S802-N842 PolarHBondContact OG-OD1 3.46Å; S802-N842 VanDerWaalsContact OG-OD1 3.12Å
803	A	93.2	Very high	91.3	Very high	4 Å²	4	46.2 Å²	46.2	3%	0.033	23%	0.233	C	C	.	.	H	α-helix	trans	-59.5	-41	-179.1	0	0	0	0	0	112.4	I731 A732 V799 L800 I805 I806 V807	I731-A803 HydrophobicContact CB-CB 4.35Å; I731-A803 HydrophobicContact CG2-CB 3.92Å; A732-A803 HydrophobicContact CB-CB 4.17Å; V799-A803 WeakPolarHBondContact O-CB 3.29Å; V799-A803 PolarHBondContact O-N 3.34Å; L800-A803 PolarHBondContact O-N 3.49Å; A803-I805 PolarHBondContact O-N 3.36Å; A803-I806 PolarHBondContact O-N 3.41Å; A803-V807 WeakPolarHBondContact O-CB 3.3Å; A803-V807 VanDerWaalsContact O-CG2 3.24Å; A803-V807 WeakPolarHBondContact O-CG2 3.33Å; A803-V807 PolarHBondContact O-N 2.97Å
804	F	94.6	Very high	91.4	Very high	139 Å²	139	35.5 Å²	35.5	61%	0.61	19%	0.193	S	C	*	.	H	α-helix	trans	-59.8	-45.2	176.7	179	-100.6	0	0	0	112.2	L800 V801 S802 V807 C808	L800-F804 VanDerWaalsContact O-CB 3.25Å; L800-F804 WeakPolarHBondContact O-CB 3.24Å; L800-F804 PolarHBondContact O-N 3.25Å; V801-F804 PolarHBondContact O-N 2.89Å; S802-F804 VanDerWaalsContact C-N 3.32Å; S802-F804 PolarHBondContact O-N 3.45Å; F804-V807 PolarHBondContact O-N 3.04Å; F804-C808 VanDerWaalsContact CZ-SG 3.55Å; F804-C808 WeakPolarHBondContact O-CB 3.35Å; F804-C808 PolarHBondContact O-N 3.02Å; F804-C808 PolarHBondContact O-SG 3.22Å; F804-C808 VanDerWaalsContact O-SG 3.33Å
805	I	94.7	Very high	91.5	Very high	31 Å²	31	40.5 Å²	40.5	16%	0.159	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-42.1	179	-61	163.5	0	0	0	110.7	V801 S802 A803 C808 G809 F838 V908 V911	V801-I805 HydrophobicContact CG1-CD1 4.07Å; V801-I805 WeakPolarHBondContact O-CG1 3.19Å; V801-I805 PolarHBondContact O-N 3.01Å; S802-I805 PolarHBondContact O-N 2.87Å; A803-I805 PolarHBondContact O-N 3.36Å; I805-C808 PolarHBondContact O-N 3.47Å; I805-G809 PolarHBondContact O-N 2.69Å; I805-F838 HydrophobicContact CG2-CE1 4.35Å; I805-V908 HydrophobicContact CB-CG2 3.83Å; I805-V908 HydrophobicContact CG2-CB 4.44Å; I805-V908 HydrophobicContact CG2-CG2 3.35Å; I805-V911 HydrophobicContact CD1-CB 3.79Å; I805-V911 HydrophobicContact CD1-CG1 3.77Å; I805-V911 HydrophobicContact CD1-CG2 4Å
806	I	93.9	Very high	91.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-48.6	177.5	-62.1	171.5	0	0	0	110.1	A732 S802 A803 G809 T810 F835 F838 N842 V908	A732-I806 HydrophobicContact CB-CB 4.01Å; A732-I806 HydrophobicContact CB-CD1 4.39Å; A732-I806 HydrophobicContact CB-CG2 3.81Å; S802-I806 VanDerWaalsContact O-CG1 3.26Å; S802-I806 WeakPolarHBondContact O-CG1 3.34Å; S802-I806 PolarHBondContact O-N 2.9Å; A803-I806 PolarHBondContact O-N 3.41Å; I806-G809 PolarHBondContact O-N 3.16Å; I806-T810 HydrophobicContact CG2-CG2 4.33Å; I806-T810 WeakPolarHBondContact O-CB 2.96Å; I806-T810 VanDerWaalsContact O-CG2 3.26Å; I806-T810 WeakPolarHBondContact O-CG2 3.44Å; I806-T810 PolarHBondContact O-N 3.38Å; I806-T810 PolarHBondContact O-OG1 3.2Å; I806-F835 HydrophobicContact CG2-CD2 4.21Å; I806-F835 HydrophobicContact CG2-CE2 4.03Å; I806-F838 HydrophobicContact CG1-CB 4.03Å; I806-F838 HydrophobicContact CG1-CD1 4.33Å; I806-F838 HydrophobicContact CG1-CG 4.24Å; I806-F838 HydrophobicContact CG2-CB 4.06Å; I806-F838 HydrophobicContact CG2-CD2 4.43Å; I806-F838 HydrophobicContact CG2-CG 4.33Å; I806-N842 HydrophobicContact CD1-CB 4.42Å; I806-V908 HydrophobicContact CG1-CG2 4.02Å
807	V	93.4	Very high	91.2	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.055	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-48.2	179.5	171.8	0	0	0	0	111.3	A732 T735 L736 A803 F804 G809 T810 L811	A732-V807 HydrophobicContact CB-CG2 4.07Å; A732-V807 WeakPolarHBondContact O-CG2 3.5Å; T735-V807 HydrophobicContact CG2-CG1 4.33Å; T735-V807 HydrophobicContact CG2-CG2 4.2Å; L736-V807 HydrophobicContact CB-CG2 4.5Å; A803-V807 WeakPolarHBondContact O-CB 3.3Å; A803-V807 VanDerWaalsContact O-CG2 3.24Å; A803-V807 WeakPolarHBondContact O-CG2 3.33Å; A803-V807 PolarHBondContact O-N 2.97Å; F804-V807 PolarHBondContact O-N 3.04Å; V807-G809 VanDerWaalsContact C-N 3.35Å; V807-G809 PolarHBondContact O-N 3.41Å; V807-T810 WeakPolarHBondContact CA-OG1 3.37Å; V807-T810 PolarHBondContact O-N 3.43Å; V807-T810 PolarHBondContact O-OG1 2.94Å; V807-T810 VanDerWaalsContact O-OG1 3.13Å; V807-L811 HydrophobicContact CG1-CD1 3.69Å; V807-L811 HydrophobicContact CG1-CG 4.39Å; V807-L811 VanDerWaalsContact O-CB 3.28Å; V807-L811 WeakPolarHBondContact O-CB 3.18Å; V807-L811 WeakPolarHBondContact O-CG 3.42Å; V807-L811 PolarHBondContact O-N 3.38Å
808	C	93.4	Very high	90.7	Very high	58 Å²	58	38.3 Å²	38.3	39%	0.392	18%	0.182	S	C	.	.	H	α-helix	trans	-62.5	-41.6	178.8	-72.6	0	0	0	0	112.1	F804 I805 F812	F804-C808 VanDerWaalsContact CZ-SG 3.55Å; F804-C808 WeakPolarHBondContact O-CB 3.35Å; F804-C808 PolarHBondContact O-N 3.02Å; F804-C808 PolarHBondContact O-SG 3.22Å; F804-C808 VanDerWaalsContact O-SG 3.33Å; I805-C808 PolarHBondContact O-N 3.47Å; C808-F812 WeakPolarHBondContact O-CB 3.23Å; C808-F812 PolarHBondContact O-N 3.24Å
809	G	92.9	Very high	89.6	Confident	9 Å²	9	45 Å²	45	9%	0.093	21%	0.214	C	C	.	.	H	α-helix	trans	-67.8	-44.2	179	0	0	0	0	0	113	I805 I806 V807 F812 V813	I805-G809 PolarHBondContact O-N 2.69Å; I806-G809 PolarHBondContact O-N 3.16Å; V807-G809 VanDerWaalsContact C-N 3.35Å; V807-G809 PolarHBondContact O-N 3.41Å; G809-F812 PolarHBondContact O-N 2.99Å; G809-V813 WeakPolarHBondContact O-CG2 3.31Å; G809-V813 PolarHBondContact O-N 3.25Å; G809-V813 VanDerWaalsContact O-N 3.09Å
810	T	92.1	Very high	88.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-69.3	-41.1	179.4	50.7	0	0	0	0	112.1	I806 V807 F812 V813 F814 C834 F835 F838	I806-T810 HydrophobicContact CG2-CG2 4.33Å; I806-T810 WeakPolarHBondContact O-CB 2.96Å; I806-T810 VanDerWaalsContact O-CG2 3.26Å; I806-T810 WeakPolarHBondContact O-CG2 3.44Å; I806-T810 PolarHBondContact O-N 3.38Å; I806-T810 PolarHBondContact O-OG1 3.2Å; V807-T810 WeakPolarHBondContact CA-OG1 3.37Å; V807-T810 PolarHBondContact O-N 3.43Å; V807-T810 PolarHBondContact O-OG1 2.94Å; V807-T810 VanDerWaalsContact O-OG1 3.13Å; T810-F812 VanDerWaalsContact C-N 3.34Å; T810-F812 PolarHBondContact O-N 3Å; T810-V813 PolarHBondContact O-N 3.41Å; T810-F814 WeakPolarHBondContact O-CB 3.47Å; T810-F814 PolarHBondContact O-N 2.97Å; T810-C834 HydrophobicContact CG2-CB 4.48Å; T810-F835 HydrophobicContact CG2-CB 3.97Å; T810-F835 HydrophobicContact CG2-CD2 3.9Å; T810-F835 HydrophobicContact CG2-CG 4.35Å; T810-F838 HydrophobicContact CG2-CD2 3.79Å; T810-F838 HydrophobicContact CG2-CE2 4.13Å
811	L	89.6	Confident	87.1	Confident	27 Å²	27	54.5 Å²	54.5	14%	0.141	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-36.2	172.2	-75.8	172.2	0	0	0	112.7	L736 L739 V807 F814 W815	L736-L811 HydrophobicContact CD1-CD1 4.39Å; L736-L811 HydrophobicContact CD1-CD2 3.58Å; L736-L811 HydrophobicContact CD1-CG 3.55Å; L739-L811 HydrophobicContact CD2-CD1 3.31Å; L739-L811 HydrophobicContact CG-CD1 4.24Å; V807-L811 HydrophobicContact CG1-CD1 3.69Å; V807-L811 HydrophobicContact CG1-CG 4.39Å; V807-L811 VanDerWaalsContact O-CB 3.28Å; V807-L811 WeakPolarHBondContact O-CB 3.18Å; V807-L811 WeakPolarHBondContact O-CG 3.42Å; V807-L811 PolarHBondContact O-N 3.38Å; L811-F814 PolarHBondContact O-N 3.09Å; L811-W815 VanDerWaalsContact O-CB 3.24Å; L811-W815 WeakPolarHBondContact O-CB 3.44Å; L811-W815 PolarHBondContact O-N 2.87Å
812	F	91.2	Very high	86	Confident	98 Å²	98	56.8 Å²	56.8	43%	0.43	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-44.4	175.7	172	-104.4	0	0	0	111.6	C808 G809 T810 R816 F900 L904	C808-F812 WeakPolarHBondContact O-CB 3.23Å; C808-F812 PolarHBondContact O-N 3.24Å; G809-F812 PolarHBondContact O-N 2.99Å; T810-F812 VanDerWaalsContact C-N 3.34Å; T810-F812 PolarHBondContact O-N 3Å; F812-R816 WeakPolarHBondContact O-CB 3.23Å; F812-R816 PolarHBondContact O-N 3.24Å; F812-F900 HydrophobicContact CE1-CZ 4.23Å; F812-L904 HydrophobicContact CD1-CD2 4.36Å
813	V	90.9	Very high	85	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-48.7	174.7	174.2	0	0	0	0	110.3	G809 T810 W815 R816 E817 M830 C834 F900 L901 L904	G809-V813 WeakPolarHBondContact O-CG2 3.31Å; G809-V813 PolarHBondContact O-N 3.25Å; G809-V813 VanDerWaalsContact O-N 3.09Å; T810-V813 PolarHBondContact O-N 3.41Å; V813-W815 PolarHBondContact O-N 3.48Å; V813-R816 PolarHBondContact O-N 2.81Å; V813-E817 HydrophobicContact CG1-CG 4.4Å; V813-E817 WeakPolarHBondContact O-CG 3.22Å; V813-E817 PolarHBondContact O-N 3.18Å; V813-M830 HydrophobicContact CG1-CB 4.17Å; V813-C834 HydrophobicContact CG1-CB 4.47Å; V813-C834 HydrophobicContact CG2-CB 4.4Å; V813-F900 HydrophobicContact CG2-CE1 4.11Å; V813-L901 HydrophobicContact CG1-CD2 4.36Å; V813-L901 HydrophobicContact CG2-CD2 4.17Å; V813-L904 HydrophobicContact CG2-CD2 3.53Å
814	F	87.9	Confident	84.4	Confident	2 Å²	2	63 Å²	63	1%	0.009	31%	0.313	C	S	.	.	H	α-helix	trans	-57.3	-47.5	178.8	-176.5	-109.7	0	0	0	112.1	F745 P748 T810 L811 R816 E817 L818 T831	F745-F814 HydrophobicContact CB-CE1 4.14Å; F745-F814 HydrophobicContact CG-CE1 4.45Å; P748-F814 HydrophobicContact CB-CD2 3.97Å; P748-F814 HydrophobicContact CB-CE2 4Å; P748-F814 HydrophobicContact CB-CG 4.22Å; P748-F814 HydrophobicContact CB-CZ 4.29Å; T810-F814 WeakPolarHBondContact O-CB 3.47Å; T810-F814 PolarHBondContact O-N 2.97Å; L811-F814 PolarHBondContact O-N 3.09Å; F814-R816 VanDerWaalsContact C-N 3.33Å; F814-R816 PolarHBondContact O-N 3.5Å; F814-E817 PolarHBondContact O-N 3.26Å; F814-L818 HydrophobicContact CE1-CD1 4.23Å; F814-L818 HydrophobicContact CE1-CD2 4.46Å; F814-L818 HydrophobicContact CE2-CD1 4.01Å; F814-L818 HydrophobicContact CZ-CD1 3.73Å; F814-L818 WeakPolarHBondContact O-CB 3.41Å; F814-L818 PolarHBondContact O-N 3.36Å; F814-T831 HydrophobicContact CB-CG2 4.11Å; F814-T831 HydrophobicContact CD2-CG2 4.32Å; F814-T831 WeakPolarHBondContact CD2-OG1 3.3Å
815	W	86.5	Confident	83.6	Confident	164 Å²	164	59.8 Å²	59.8	62%	0.621	31%	0.306	S	S	*	.	H	α-helix	trans	-63.6	-36.4	178.2	-179.9	68	0	0	0	113	L811 V813	L811-W815 VanDerWaalsContact O-CB 3.24Å; L811-W815 WeakPolarHBondContact O-CB 3.44Å; L811-W815 PolarHBondContact O-N 2.87Å; V813-W815 PolarHBondContact O-N 3.48Å
816	R	86.5	Confident	83.1	Confident	68 Å²	68	63 Å²	63	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-66.9	-41	177.8	-172.5	-173.1	74.7	175.9	0.9	112	F812 V813 F814 Q819 F900	F812-R816 WeakPolarHBondContact O-CB 3.23Å; F812-R816 PolarHBondContact O-N 3.24Å; V813-R816 PolarHBondContact O-N 2.81Å; F814-R816 VanDerWaalsContact C-N 3.33Å; F814-R816 PolarHBondContact O-N 3.5Å; R816-Q819 WeakPolarHBondContact O-CG 3.05Å; R816-F900 VanDerWaalsContact CZ-CE1 3.4Å; R816-F900 VanDerWaalsContact NH1-CE2 3.31Å; R816-F900 VanDerWaalsContact NH2-CE1 3.33Å
817	E	84.4	Confident	82.7	Confident	36 Å²	36	63.5 Å²	63.5	17%	0.168	32%	0.319	C	S	.	.	H	α-helix	trans	-78.6	-28.5	-179.4	-56.3	-58.7	131.3	0	0	111.7	V813 F814 Q819 D827 M830	V813-E817 HydrophobicContact CG1-CG 4.4Å; V813-E817 WeakPolarHBondContact O-CG 3.22Å; V813-E817 PolarHBondContact O-N 3.18Å; F814-E817 PolarHBondContact O-N 3.26Å; E817-Q819 PolarHBondContact O-N 2.89Å; E817-D827 HydrophobicContact CB-CB 4.2Å; E817-D827 WeakPolarHBondContact CB-OD1 3.43Å; E817-M830 HydrophobicContact CG-CB 4.19Å; E817-M830 HydrophobicContact CG-CG 4.37Å
818	L	79.6	Confident	82.3	Confident	14 Å²	14	64.1 Å²	64.1	7%	0.073	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-72.6	16.1	179.3	-148.8	90.7	0	0	0	115.2	F745 F814 D820 N821 I823	F745-L818 HydrophobicContact CD1-CD2 4.32Å; F814-L818 HydrophobicContact CE1-CD1 4.23Å; F814-L818 HydrophobicContact CE1-CD2 4.46Å; F814-L818 HydrophobicContact CE2-CD1 4.01Å; F814-L818 HydrophobicContact CZ-CD1 3.73Å; F814-L818 WeakPolarHBondContact O-CB 3.41Å; F814-L818 PolarHBondContact O-N 3.36Å; L818-D820 PolarHBondContact O-N 2.92Å; L818-D820 VanDerWaalsContact O-N 3.12Å; L818-N821 PolarHBondContact O-N 3.45Å; L818-N821 VanDerWaalsContact O-N 3.07Å; L818-I823 HydrophobicContact CD1-CG1 4.48Å
819	Q	67.1	Low	82.2	Confident	151 Å²	151	61.4 Å²	61.4	71%	0.706	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-59.4	-25.3	-175.4	-83	-178.8	-3.5	0	0	113.9	R816 E817	R816-Q819 WeakPolarHBondContact O-CG 3.05Å; E817-Q819 PolarHBondContact O-N 2.89Å
820	D	66.4	Low	82.1	Confident	141 Å²	141	61 Å²	61	75%	0.754	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-92.6	3.4	-179.8	-65.7	-25.4	0	0	0	113.9	L818 V822	L818-D820 PolarHBondContact O-N 2.92Å; L818-D820 VanDerWaalsContact O-N 3.12Å; D820-V822 PolarHBondContact O-N 3.38Å
821	N	64.9	Low	82	Confident	144 Å²	144	61 Å²	61	77%	0.77	30%	0.3	S	S	*	.	S	Bend	trans	55.4	12.3	-177.3	-76.2	-44.2	0	0	0	116	L818	L818-N821 PolarHBondContact O-N 3.45Å; L818-N821 VanDerWaalsContact O-N 3.07Å
822	V	70.8	Confident	82.1	Confident	97 Å²	97	59.7 Å²	59.7	59%	0.588	29%	0.293	S	S	*	.	S	Bend	trans	-115.7	131.5	173.6	-179.7	0	0	0	0	108.2	D820 T824	D820-V822 PolarHBondContact O-N 3.38Å; V822-T824 PolarHBondContact O-N 2.87Å
823	I	71.9	Confident	82.2	Confident	81 Å²	81	55 Å²	55	42%	0.415	27%	0.273	S	S	.	.			trans	-79.1	112.2	177.1	-50.3	157.6	0	0	0	108.1	P746 L818 T828	P746-I823 HydrophobicContact CB-CD1 3.11Å; P746-I823 HydrophobicContact CB-CG1 3.78Å; P746-I823 HydrophobicContact CG-CD1 3.45Å; P746-I823 VanDerWaalsContact CG-CD1 3.45Å; P746-I823 HydrophobicContact CG-CG1 3.71Å; L818-I823 HydrophobicContact CD1-CG1 4.48Å; I823-T828 HydrophobicContact CG2-CG2 3.78Å
824	T	79.6	Confident	82.4	Confident	54 Å²	54	55 Å²	55	33%	0.331	27%	0.273	S	S	.	.			trans	-96	155	171.1	67.7	0	0	0	0	110.7	V822 R826 D827 T828	V822-T824 PolarHBondContact O-N 2.87Å; T824-R826 PolarHBondContact O-N 2.89Å; T824-D827 PolarHBondContact N-OD2 3.38Å; T824-D827 PolarHBondContact O-N 3.27Å; T824-D827 PolarHBondContact OG1-N 2.92Å; T824-D827 PolarHBondContact OG1-OD1 2.89Å; T824-D827 VanDerWaalsContact OG1-OD1 3.06Å; T824-D827 PolarHBondContact OG1-OD2 3.44Å; T824-T828 PolarHBondContact O-N 3.03Å
825	P	77.9	Confident	82.6	Confident	72 Å²	72	54.9 Å²	54.9	47%	0.468	27%	0.272	S	S	.	.	H	α-helix	trans	-55.8	-27.5	170.6	-25.8	35.6	0	0	0	113	T828 T829 E891	P825-T828 PolarHBondContact O-OG1 3.43Å; P825-T829 WeakPolarHBondContact O-CB 3.44Å; P825-T829 PolarHBondContact O-N 3.48Å; P825-T829 PolarHBondContact O-OG1 3.44Å; P825-E891 HydrophobicContact CB-CB 4.4Å
826	R	84.8	Confident	82.9	Confident	99 Å²	99	47.1 Å²	47.1	37%	0.374	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-45.3	172	-176.3	-177.1	175.7	123.1	7.9	112.6	T824 T828 T829 M830 E891 D897	T824-R826 PolarHBondContact O-N 2.89Å; R826-T828 PolarHBondContact O-N 3.4Å; R826-T829 PolarHBondContact O-N 3.26Å; R826-M830 PolarHBondContact O-N 3.06Å; R826-E891 WeakPolarHBondContact CB-OE2 3.37Å; R826-E891 PolarHBondContact N-OE2 3.43Å; R826-D897 IonicContact NH2-OD1 2.71Å; R826-D897 IonicContact NH2-OD2 3.51Å; R826-D897 PolarHBondContact NH2-OD2 2.98Å
827	D	85.8	Confident	83.3	Confident	9 Å²	9	44.9 Å²	44.9	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-42.3	-175.8	-51.4	-31.6	0	0	0	111.5	E817 T824 T831	E817-D827 HydrophobicContact CB-CB 4.2Å; E817-D827 WeakPolarHBondContact CB-OD1 3.43Å; T824-D827 PolarHBondContact N-OD2 3.38Å; T824-D827 PolarHBondContact O-N 3.27Å; T824-D827 PolarHBondContact OG1-N 2.92Å; T824-D827 PolarHBondContact OG1-OD1 2.89Å; T824-D827 VanDerWaalsContact OG1-OD1 3.06Å; T824-D827 PolarHBondContact OG1-OD2 3.44Å; D827-T831 WeakPolarHBondContact O-CB 3.29Å; D827-T831 PolarHBondContact O-N 3.46Å; D827-T831 PolarHBondContact O-OG1 3.35Å
828	T	84.6	Confident	83.8	Confident	23 Å²	23	43.2 Å²	43.2	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-67.4	-38	175.1	59.8	0	0	0	0	110.6	I823 T824 P825 R826 T831 F832	I823-T828 HydrophobicContact CG2-CG2 3.78Å; T824-T828 PolarHBondContact O-N 3.03Å; P825-T828 PolarHBondContact O-OG1 3.43Å; R826-T828 PolarHBondContact O-N 3.4Å; T828-T831 PolarHBondContact O-N 3.24Å; T828-F832 WeakPolarHBondContact O-CB 3.1Å; T828-F832 PolarHBondContact O-N 3.28Å
829	T	90.6	Very high	84.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.8	-40.8	177.1	-53.4	0	0	0	0	112.8	P825 R826 T833 I879 T890 E891 L893	P825-T829 WeakPolarHBondContact O-CB 3.44Å; P825-T829 PolarHBondContact O-N 3.48Å; P825-T829 PolarHBondContact O-OG1 3.44Å; R826-T829 PolarHBondContact O-N 3.26Å; T829-T833 VanDerWaalsContact O-CB 3.29Å; T829-T833 WeakPolarHBondContact O-CB 3.49Å; T829-T833 PolarHBondContact O-N 3Å; T829-T833 PolarHBondContact O-OG1 3.17Å; T829-I879 HydrophobicContact CG2-CG1 4.1Å; T829-I879 HydrophobicContact CG2-CG2 4.42Å; T829-T890 HydrophobicContact CG2-CG2 4.13Å; T829-T890 WeakPolarHBondContact OG1-CA 3.5Å; T829-E891 WeakPolarHBondContact CG2-O 3.5Å; T829-E891 PolarHBondContact OG1-N 2.91Å; T829-L893 HydrophobicContact CG2-CD1 4.18Å; T829-L893 HydrophobicContact CG2-CD2 4.26Å; T829-L893 HydrophobicContact CG2-CG 4.07Å
830	M	91.1	Very high	85.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-46.5	174.8	-82.7	-66.8	-83.8	0	0	111.1	V813 E817 R826 C834 L893 D897 L901	V813-M830 HydrophobicContact CG1-CB 4.17Å; E817-M830 HydrophobicContact CG-CB 4.19Å; E817-M830 HydrophobicContact CG-CG 4.37Å; R826-M830 PolarHBondContact O-N 3.06Å; M830-C834 WeakPolarHBondContact O-CB 3.35Å; M830-C834 PolarHBondContact O-N 3.38Å; M830-L893 HydrophobicContact CG-CD2 3.67Å; M830-L893 HydrophobicContact SD-CD1 3.98Å; M830-L893 HydrophobicContact SD-CD2 3.52Å; M830-L893 VanDerWaalsContact SD-CD2 3.52Å; M830-L893 HydrophobicContact SD-CG 4.34Å; M830-D897 HydrophobicContact CE-CB 4.02Å; M830-D897 HydrophobicContact SD-CB 3.81Å; M830-L901 HydrophobicContact CE-CD2 4.37Å; M830-L901 HydrophobicContact CE-CG 4.44Å; M830-L901 HydrophobicContact SD-CD1 4.09Å
831	T	91	Very high	86.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.5	-43.7	-180	-53.8	0	0	0	0	111.6	P748 F814 D827 T828 C834 F835	P748-T831 HydrophobicContact CB-CG2 4.03Å; F814-T831 HydrophobicContact CB-CG2 4.11Å; F814-T831 HydrophobicContact CD2-CG2 4.32Å; F814-T831 WeakPolarHBondContact CD2-OG1 3.3Å; D827-T831 WeakPolarHBondContact O-CB 3.29Å; D827-T831 PolarHBondContact O-N 3.46Å; D827-T831 PolarHBondContact O-OG1 3.35Å; T828-T831 PolarHBondContact O-N 3.24Å; T831-C834 WeakPolarHBondContact O-CB 3.36Å; T831-C834 PolarHBondContact O-N 3.48Å; T831-F835 PolarHBondContact O-N 3.28Å
832	F	91.5	Very high	88.2	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.8	-49.4	175.1	172.3	-122.4	0	0	0	112.2	L749 Q753 W756 I757 T828 C834 F835 V836 Q875 V878 T890	L749-F832 HydrophobicContact CD2-CB 3.95Å; L749-F832 HydrophobicContact CD2-CD2 4.3Å; Q753-F832 HydrophobicContact CB-CD2 3.71Å; Q753-F832 HydrophobicContact CB-CE2 3.72Å; Q753-F832 HydrophobicContact CB-CG 4.41Å; Q753-F832 HydrophobicContact CB-CZ 4.44Å; Q753-F832 HydrophobicContact CG-CD2 4.02Å; Q753-F832 HydrophobicContact CG-CE2 4.1Å; Q753-F832 HydrophobicContact CG-CG 4.24Å; Q753-F832 HydrophobicContact CG-CZ 4.4Å; W756-F832 AromaticContact CD1-CE2 3.9Å; W756-F832 AromaticContact CD1-CZ 3.4Å; W756-F832 VanDerWaalsContact CD1-CZ 3.4Å; W756-F832 HydrophobicContact CG-CZ 4.14Å; W756-F832 AromaticContact NE1-CZ 3.9Å; I757-F832 HydrophobicContact CD1-CD2 4.15Å; I757-F832 HydrophobicContact CD1-CE2 4.15Å; I757-F832 HydrophobicContact CG1-CD2 4.48Å; I757-F832 HydrophobicContact CG1-CE2 4.02Å; T828-F832 WeakPolarHBondContact O-CB 3.1Å; T828-F832 PolarHBondContact O-N 3.28Å; F832-C834 VanDerWaalsContact C-N 3.32Å; F832-C834 PolarHBondContact O-N 2.87Å; F832-F835 PolarHBondContact O-N 3.36Å; F832-V836 HydrophobicContact CD2-CG2 4.35Å; F832-V836 HydrophobicContact CE2-CG2 4.1Å; F832-V836 HydrophobicContact CZ-CG2 4.46Å; F832-V836 WeakPolarHBondContact O-CG2 3.24Å; F832-V836 PolarHBondContact O-N 3.29Å; F832-Q875 VanDerWaalsContact CD1-NE2 3.28Å; F832-V878 HydrophobicContact CE1-CG1 3.99Å; F832-T890 HydrophobicContact CD1-CG2 4.26Å; F832-T890 HydrophobicContact CE1-CG2 4.42Å
833	T	93	Very high	89.2	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.5	-35	179.5	-52.6	0	0	0	0	111.8	T829 V836 F837 Q875 I879 L893 L898 L901	T829-T833 VanDerWaalsContact O-CB 3.29Å; T829-T833 WeakPolarHBondContact O-CB 3.49Å; T829-T833 PolarHBondContact O-N 3Å; T829-T833 PolarHBondContact O-OG1 3.17Å; T833-V836 PolarHBondContact O-N 3.47Å; T833-F837 HydrophobicContact CG2-CD2 4.42Å; T833-F837 HydrophobicContact CG2-CE1 4.45Å; T833-F837 HydrophobicContact CG2-CE2 4.14Å; T833-F837 HydrophobicContact CG2-CZ 4.16Å; T833-F837 PolarHBondContact O-N 3.08Å; T833-Q875 HydrophobicContact CG2-CG 4.37Å; T833-Q875 PolarHBondContact OG1-NE2 3.17Å; T833-I879 HydrophobicContact CG2-CD1 3.75Å; T833-I879 WeakPolarHBondContact OG1-CD1 3.08Å; T833-L893 HydrophobicContact CG2-CD1 4.17Å; T833-L898 HydrophobicContact CG2-CD2 4.3Å; T833-L901 HydrophobicContact CG2-CD1 3.89Å
834	C	93.8	Very high	90.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.6	-48.3	172.7	-173.9	0	0	0	0	111.5	T810 V813 M830 T831 F832 F837 F838 L901 T905	T810-C834 HydrophobicContact CG2-CB 4.48Å; V813-C834 HydrophobicContact CG1-CB 4.47Å; V813-C834 HydrophobicContact CG2-CB 4.4Å; M830-C834 WeakPolarHBondContact O-CB 3.35Å; M830-C834 PolarHBondContact O-N 3.38Å; T831-C834 WeakPolarHBondContact O-CB 3.36Å; T831-C834 PolarHBondContact O-N 3.48Å; F832-C834 VanDerWaalsContact C-N 3.32Å; F832-C834 PolarHBondContact O-N 2.87Å; C834-F837 PolarHBondContact O-N 3.39Å; C834-F838 VanDerWaalsContact O-CD2 3.28Å; C834-F838 WeakPolarHBondContact O-CD2 3.18Å; C834-F838 PolarHBondContact O-N 2.86Å; C834-F838 WeakPolarHBondContact SG-CE2 3.44Å; C834-L901 HydrophobicContact CB-CD2 3.64Å; C834-T905 WeakPolarHBondContact O-CG2 3.5Å
835	F	93.3	Very high	90.6	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-59.6	-48.6	178.4	-166.1	-77.2	0	0	0	111.2	T729 A732 A733 L736 L749 I757 I806 T810 T831 F832 F837 F838 D839	T729-F835 HydrophobicContact CG2-CE1 3.74Å; T729-F835 HydrophobicContact CG2-CZ 4.06Å; A732-F835 HydrophobicContact CB-CE2 4.28Å; A732-F835 HydrophobicContact CB-CZ 4.3Å; A733-F835 HydrophobicContact CB-CE2 4.36Å; A733-F835 HydrophobicContact CB-CZ 3.92Å; L736-F835 HydrophobicContact CD2-CD2 3.94Å; L736-F835 HydrophobicContact CD2-CE2 4.14Å; L749-F835 HydrophobicContact CD1-CD2 4.38Å; I757-F835 HydrophobicContact CD1-CD1 3.65Å; I757-F835 HydrophobicContact CD1-CE1 4.03Å; I757-F835 HydrophobicContact CD1-CG 4.29Å; I757-F835 HydrophobicContact CG1-CD1 4.28Å; I757-F835 HydrophobicContact CG2-CD1 4.23Å; I757-F835 HydrophobicContact CG2-CE1 3.79Å; I806-F835 HydrophobicContact CG2-CD2 4.21Å; I806-F835 HydrophobicContact CG2-CE2 4.03Å; T810-F835 HydrophobicContact CG2-CB 3.97Å; T810-F835 HydrophobicContact CG2-CD2 3.9Å; T810-F835 HydrophobicContact CG2-CG 4.35Å; T831-F835 PolarHBondContact O-N 3.28Å; F832-F835 PolarHBondContact O-N 3.36Å; F835-F837 PolarHBondContact O-N 3.44Å; F835-F838 WeakPolarHBondContact O-CB 3.39Å; F835-F838 PolarHBondContact O-N 3.2Å; F835-D839 VanDerWaalsContact CD1-OD2 3.24Å; F835-D839 WeakPolarHBondContact CD1-OD2 3.26Å; F835-D839 WeakPolarHBondContact CE1-OD2 3.45Å; F835-D839 PolarHBondContact O-N 3.41Å
836	V	93.1	Very high	91.2	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.006	5%	0.053	C	C	.	.	H	α-helix	trans	-60.5	-42.1	179.4	172.1	0	0	0	0	112.5	I757 M761 F832 T833 D839 M840 Q875	I757-V836 HydrophobicContact CG1-CG2 4.16Å; M761-V836 HydrophobicContact CE-CG1 4.15Å; M761-V836 HydrophobicContact CG-CG1 3.92Å; M761-V836 HydrophobicContact CG-CG2 4.06Å; M761-V836 HydrophobicContact SD-CG1 3.59Å; M761-V836 VanDerWaalsContact SD-CG1 3.59Å; F832-V836 HydrophobicContact CD2-CG2 4.35Å; F832-V836 HydrophobicContact CE2-CG2 4.1Å; F832-V836 HydrophobicContact CZ-CG2 4.46Å; F832-V836 WeakPolarHBondContact O-CG2 3.24Å; F832-V836 PolarHBondContact O-N 3.29Å; T833-V836 PolarHBondContact O-N 3.47Å; V836-D839 WeakPolarHBondContact O-CB 3.39Å; V836-D839 PolarHBondContact O-N 3.13Å; V836-M840 WeakPolarHBondContact O-CG 3.24Å; V836-M840 PolarHBondContact O-N 2.76Å; V836-M840 VanDerWaalsContact O-N 3.08Å; V836-Q875 HydrophobicContact CG1-CB 4.3Å; V836-Q875 HydrophobicContact CG1-CG 4.05Å
837	F	94.4	Very high	91.4	Very high	20 Å²	20	7.3 Å²	7.3	9%	0.088	4%	0.036	C	C	.	.	H	α-helix	trans	-68.9	-36	177.1	-77.9	-4.2	0	0	0	112.8	T833 C834 F835 D839 M840 F841 L898 L901 T905	T833-F837 HydrophobicContact CG2-CD2 4.42Å; T833-F837 HydrophobicContact CG2-CE1 4.45Å; T833-F837 HydrophobicContact CG2-CE2 4.14Å; T833-F837 HydrophobicContact CG2-CZ 4.16Å; T833-F837 PolarHBondContact O-N 3.08Å; C834-F837 PolarHBondContact O-N 3.39Å; F835-F837 PolarHBondContact O-N 3.44Å; F837-D839 VanDerWaalsContact C-N 3.3Å; F837-D839 PolarHBondContact O-N 3.44Å; F837-M840 PolarHBondContact O-N 3.45Å; F837-F841 WeakPolarHBondContact O-CD2 3.46Å; F837-F841 PolarHBondContact O-N 3.42Å; F837-F841 VanDerWaalsContact O-N 3.1Å; F837-L898 HydrophobicContact CE2-CD2 4.08Å; F837-L898 HydrophobicContact CZ-CD2 4.17Å; F837-L901 HydrophobicContact CD2-CB 4Å; F837-L901 HydrophobicContact CE2-CB 4.36Å; F837-T905 HydrophobicContact CB-CG2 3.67Å
838	F	94.6	Very high	91.4	Very high	1 Å²	1	7.4 Å²	7.4	0%	0.004	4%	0.038	C	C	.	.	H	α-helix	trans	-58.3	-43.6	170.6	-91.4	-55	0	0	0	111.6	I805 I806 T810 C834 F835 M840 F841 N842 L904 T905 V908	I805-F838 HydrophobicContact CG2-CE1 4.35Å; I806-F838 HydrophobicContact CG1-CB 4.03Å; I806-F838 HydrophobicContact CG1-CD1 4.33Å; I806-F838 HydrophobicContact CG1-CG 4.24Å; I806-F838 HydrophobicContact CG2-CB 4.06Å; I806-F838 HydrophobicContact CG2-CD2 4.43Å; I806-F838 HydrophobicContact CG2-CG 4.33Å; T810-F838 HydrophobicContact CG2-CD2 3.79Å; T810-F838 HydrophobicContact CG2-CE2 4.13Å; C834-F838 VanDerWaalsContact O-CD2 3.28Å; C834-F838 WeakPolarHBondContact O-CD2 3.18Å; C834-F838 PolarHBondContact O-N 2.86Å; C834-F838 WeakPolarHBondContact SG-CE2 3.44Å; F835-F838 WeakPolarHBondContact O-CB 3.39Å; F835-F838 PolarHBondContact O-N 3.2Å; F838-M840 PolarHBondContact O-N 3.38Å; F838-F841 PolarHBondContact O-N 3.11Å; F838-N842 WeakPolarHBondContact O-CB 3.49Å; F838-N842 PolarHBondContact O-N 3.48Å; F838-L904 HydrophobicContact CZ-CG 4.17Å; F838-T905 HydrophobicContact CB-CG2 4.37Å; F838-T905 HydrophobicContact CD1-CG2 3.98Å; F838-T905 HydrophobicContact CD2-CG2 3.69Å; F838-T905 VanDerWaalsContact CE1-CA 3.45Å; F838-T905 HydrophobicContact CE1-CG2 4.18Å; F838-T905 HydrophobicContact CE2-CG2 3.88Å; F838-T905 HydrophobicContact CG-CG2 3.74Å; F838-T905 HydrophobicContact CZ-CG2 4.12Å; F838-V908 HydrophobicContact CD1-CB 4.3Å; F838-V908 HydrophobicContact CD1-CG2 3.36Å; F838-V908 HydrophobicContact CE1-CG2 3.58Å; F838-V908 HydrophobicContact CG-CG2 4.5Å
839	D	91.9	Very high	91.2	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-61.2	-43.2	176	-72	-30.5	0	0	0	112	F725 T729 F835 V836 F837 F841 N842 A843	F725-D839 HydrophobicContact CE2-CB 4.21Å; F725-D839 WeakPolarHBondContact CE2-O 3.5Å; T729-D839 WeakPolarHBondContact CG2-OD1 3.25Å; T729-D839 WeakPolarHBondContact CG2-OD2 3.21Å; T729-D839 PolarHBondContact OG1-OD1 2.87Å; F835-D839 VanDerWaalsContact CD1-OD2 3.24Å; F835-D839 WeakPolarHBondContact CD1-OD2 3.26Å; F835-D839 WeakPolarHBondContact CE1-OD2 3.45Å; F835-D839 PolarHBondContact O-N 3.41Å; V836-D839 WeakPolarHBondContact O-CB 3.39Å; V836-D839 PolarHBondContact O-N 3.13Å; F837-D839 VanDerWaalsContact C-N 3.3Å; F837-D839 PolarHBondContact O-N 3.44Å; D839-F841 PolarHBondContact O-N 3.33Å; D839-N842 CarbonylContact O-C 3.57Å; D839-N842 PolarHBondContact O-N 3.49Å; D839-A843 WeakPolarHBondContact O-CB 3.31Å; D839-A843 PolarHBondContact O-N 3.4Å
840	M	93	Very high	90.7	Very high	12 Å²	12	11.4 Å²	11.4	6%	0.059	6%	0.06	C	C	.	.	H	α-helix	trans	-63.3	-42.1	179	-65.4	-55.2	99.3	0	0	112.6	M761 P765 V836 F837 F838 A843 L844 V868 I872	M761-M840 HydrophobicContact CB-CE 4.36Å; M761-M840 WeakPolarHBondContact O-CE 3.48Å; P765-M840 HydrophobicContact CG-CE 4.15Å; P765-M840 HydrophobicContact CG-SD 4.41Å; V836-M840 WeakPolarHBondContact O-CG 3.24Å; V836-M840 PolarHBondContact O-N 2.76Å; V836-M840 VanDerWaalsContact O-N 3.08Å; F837-M840 PolarHBondContact O-N 3.45Å; F838-M840 PolarHBondContact O-N 3.38Å; M840-A843 PolarHBondContact O-N 2.99Å; M840-L844 PolarHBondContact O-N 3.22Å; M840-L844 VanDerWaalsContact O-N 3.11Å; M840-V868 HydrophobicContact SD-CG1 4.2Å; M840-V868 HydrophobicContact SD-CG2 4.45Å; M840-I872 HydrophobicContact CG-CG1 4.4Å
841	F	93.5	Very high	90.2	Very high	50 Å²	50	15.9 Å²	15.9	22%	0.219	8%	0.077	C	C	.	.	H	α-helix	trans	-69.5	-34.7	174.7	-80.9	-67.5	0	0	0	112.4	F837 F838 D839 L844 S845 L902 T905 C909	F837-F841 WeakPolarHBondContact O-CD2 3.46Å; F837-F841 PolarHBondContact O-N 3.42Å; F837-F841 VanDerWaalsContact O-N 3.1Å; F838-F841 PolarHBondContact O-N 3.11Å; D839-F841 PolarHBondContact O-N 3.33Å; F841-L844 PolarHBondContact O-N 3.03Å; F841-S845 PolarHBondContact O-N 3.29Å; F841-L902 HydrophobicContact CE2-CG 4.37Å; F841-L902 HydrophobicContact CZ-CG 4.32Å; F841-T905 WeakPolarHBondContact CD2-OG1 3.38Å; F841-T905 WeakPolarHBondContact CE2-OG1 3.34Å; F841-C909 HydrophobicContact CB-CB 4.29Å; F841-C909 HydrophobicContact CD1-CB 4.19Å
842	N	92.3	Very high	90	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-67.7	-40.4	175.4	-174.8	43.2	0	0	0	111.7	S728 S802 I806 F838 D839 L844 S845 S846 V908	S728-N842 PolarHBondContact OG-ND2 3.21Å; S802-N842 PolarHBondContact OG-OD1 3.46Å; S802-N842 VanDerWaalsContact OG-OD1 3.12Å; I806-N842 HydrophobicContact CD1-CB 4.42Å; F838-N842 WeakPolarHBondContact O-CB 3.49Å; F838-N842 PolarHBondContact O-N 3.48Å; D839-N842 CarbonylContact O-C 3.57Å; D839-N842 PolarHBondContact O-N 3.49Å; N842-L844 VanDerWaalsContact C-N 3.34Å; N842-L844 PolarHBondContact O-N 2.77Å; N842-S845 PolarHBondContact O-N 3.36Å; N842-S845 PolarHBondContact O-OG 3.3Å; N842-S846 WeakPolarHBondContact O-CB 3.38Å; N842-S846 PolarHBondContact O-N 2.86Å; N842-S846 PolarHBondContact O-OG 3.33Å; N842-V908 HydrophobicContact CB-CG1 3.99Å
843	A	91.8	Very high	89.6	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-58.9	-44.9	172.7	0	0	0	0	0	111	F725 D839 M840 S845 S846 R847 F864	F725-A843 HydrophobicContact CD2-CB 3.79Å; F725-A843 HydrophobicContact CE1-CB 4.49Å; F725-A843 HydrophobicContact CE2-CB 3.63Å; F725-A843 HydrophobicContact CG-CB 4.32Å; F725-A843 HydrophobicContact CZ-CB 4.01Å; D839-A843 WeakPolarHBondContact O-CB 3.31Å; D839-A843 PolarHBondContact O-N 3.4Å; M840-A843 PolarHBondContact O-N 2.99Å; A843-S845 VanDerWaalsContact C-N 3.35Å; A843-S845 PolarHBondContact O-N 3.12Å; A843-S846 PolarHBondContact O-N 2.91Å; A843-S846 VanDerWaalsContact O-N 3.13Å; A843-R847 PolarHBondContact O-N 2.79Å; A843-F864 HydrophobicContact CB-CE2 4.17Å; A843-F864 HydrophobicContact CB-CZ 4.31Å
844	L	91.4	Very high	89	Confident	32 Å²	32	27.3 Å²	27.3	17%	0.168	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-44.9	175.6	-177.9	65.2	0	0	0	111.7	M840 F841 N842 S846 R847 V853 L858 F864	M840-L844 PolarHBondContact O-N 3.22Å; M840-L844 VanDerWaalsContact O-N 3.11Å; F841-L844 PolarHBondContact O-N 3.03Å; N842-L844 VanDerWaalsContact C-N 3.34Å; N842-L844 PolarHBondContact O-N 2.77Å; L844-S846 PolarHBondContact O-N 2.77Å; L844-R847 WeakPolarHBondContact O-CG 3.11Å; L844-R847 PolarHBondContact O-N 3.15Å; L844-V853 HydrophobicContact CD1-CG1 4.14Å; L844-V853 HydrophobicContact CG-CG1 4.36Å; L844-V853 HydrophobicContact CG-CG2 4.45Å; L844-L858 HydrophobicContact CD1-CD2 3.96Å; L844-L858 HydrophobicContact CD2-CD2 4.33Å; L844-F864 HydrophobicContact CB-CZ 4.3Å; L844-F864 HydrophobicContact CD1-CE1 3.9Å; L844-F864 HydrophobicContact CD1-CZ 4.32Å
845	S	90.1	Very high	88.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-27.2	177.7	83.4	0	0	0	0	112.9	F841 N842 A843 K916	F841-S845 PolarHBondContact O-N 3.29Å; N842-S845 PolarHBondContact O-N 3.36Å; N842-S845 PolarHBondContact O-OG 3.3Å; A843-S845 VanDerWaalsContact C-N 3.35Å; A843-S845 PolarHBondContact O-N 3.12Å; S845-K916 WeakPolarHBondContact O-CE 3.46Å; S845-K916 PolarHBondContact O-NZ 3.35Å
846	S	89.7	Confident	87.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-84.8	-4.8	-176.8	-63.3	0	0	0	0	114	N721 N842 A843 L844 S848	N721-S846 VanDerWaalsContact CB-O 3.27Å; N721-S846 WeakPolarHBondContact CB-O 3.39Å; N842-S846 WeakPolarHBondContact O-CB 3.38Å; N842-S846 PolarHBondContact O-N 2.86Å; N842-S846 PolarHBondContact O-OG 3.33Å; A843-S846 PolarHBondContact O-N 2.91Å; A843-S846 VanDerWaalsContact O-N 3.13Å; L844-S846 PolarHBondContact O-N 2.77Å; S846-S848 PolarHBondContact O-N 3.45Å
847	R	89.8	Confident	86.8	Confident	5 Å²	5	35 Å²	35	2%	0.019	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-25.1	173.9	-74	-176.8	65.5	-165.3	-8.2	114.6	N721 L769 E772 A843 L844 M856 G857 L858 F864	N721-R847 PolarHBondContact ND2-O 3.12Å; L769-R847 HydrophobicContact CD2-CB 4.22Å; L769-R847 HydrophobicContact CD2-CG 3.5Å; L769-R847 VanDerWaalsContact CD2-CG 3.5Å; E772-R847 IonicContact OE1-CZ 3.76Å; E772-R847 IonicContact OE1-NE 2.74Å; E772-R847 PolarHBondContact OE1-NE 3Å; E772-R847 IonicContact OE1-NH2 2.91Å; E772-R847 PolarHBondContact OE1-NH2 3.49Å; E772-R847 IonicContact OE2-NE 3.67Å; E772-R847 PolarHBondContact OE2-NE 3.09Å; E772-R847 IonicContact OE2-NH2 2.77Å; A843-R847 PolarHBondContact O-N 2.79Å; L844-R847 WeakPolarHBondContact O-CG 3.11Å; L844-R847 PolarHBondContact O-N 3.15Å; R847-M856 HydrophobicContact CB-CE 4.4Å; R847-G857 PolarHBondContact NH1-O 3.21Å; R847-G857 PolarHBondContact NH2-O 3.09Å; R847-L858 PolarHBondContact NH1-O 2.91Å; R847-F864 HydrophobicContact CG-CD2 4.41Å; R847-F864 HydrophobicContact CG-CE2 4.16Å; R847-F864 HydrophobicContact CG-CZ 4.25Å
848	S	85.7	Confident	86	Confident	12 Å²	12	39 Å²	39	8%	0.084	20%	0.198	C	C	.	.			trans	-152.4	141.4	177.2	157.5	0	0	0	0	111.2	S846 T850 R851 M856 K916	S846-S848 PolarHBondContact O-N 3.45Å; S848-T850 PolarHBondContact OG-N 3.44Å; S848-R851 WeakPolarHBondContact OG-CA 3.45Å; S848-R851 WeakPolarHBondContact OG-CB 3.07Å; S848-R851 PolarHBondContact OG-N 3.44Å; S848-R851 PolarHBondContact OG-O 2.91Å; S848-R851 VanDerWaalsContact OG-O 3.09Å; S848-M856 WeakPolarHBondContact CB-SD 3.25Å; S848-K916 WeakPolarHBondContact O-CE 3.39Å; S848-K916 PolarHBondContact O-NZ 2.94Å
849	Q	79.9	Confident	85.3	Confident	22 Å²	22	43.5 Å²	43.5	10%	0.103	23%	0.229	C	C	.	.	S	Bend	trans	-77.4	-26.1	176.1	-61.6	-53.4	-41.4	0	0	114.1	N721 K798	N721-Q849 WeakPolarHBondContact OD1-CG 3.37Å; N721-Q849 PolarHBondContact OD1-NE2 3.22Å; K798-Q849 PolarHBondContact NZ-O 3.33Å
850	T	78.9	Confident	84.9	Confident	84 Å²	84	46.8 Å²	46.8	52%	0.515	25%	0.252	S	S	.	.	S	Bend	trans	-127.8	-43.4	-167	54.7	0	0	0	0	113.7	S848	S848-T850 PolarHBondContact OG-N 3.44Å
851	R	82.6	Confident	84.5	Confident	94 Å²	94	46.5 Å²	46.5	36%	0.355	25%	0.25	S	S	.	.	S	Bend	trans	-77.2	146	177.4	-58.8	-175	-176.6	-136.4	-8.5	111.4	D775 D777 S848 M856	D775-R851 IonicContact OD1-CZ 3.2Å; D775-R851 IonicContact OD1-NH2 3.78Å; D775-R851 PolarHBondContact OD1-NH2 3.46Å; D775-R851 IonicContact OD2-CZ 3.72Å; D775-R851 IonicContact OD2-NE 3.2Å; D775-R851 PolarHBondContact OD2-NE 3.04Å; D775-R851 IonicContact OD2-NH2 3.22Å; D775-R851 PolarHBondContact OD2-NH2 3.18Å; D777-R851 IonicContact OD2-NH2 3.7Å; D777-R851 PolarHBondContact OD2-NH2 3.17Å; S848-R851 WeakPolarHBondContact OG-CA 3.45Å; S848-R851 WeakPolarHBondContact OG-CB 3.07Å; S848-R851 PolarHBondContact OG-N 3.44Å; S848-R851 PolarHBondContact OG-O 2.91Å; S848-R851 VanDerWaalsContact OG-O 3.09Å; R851-M856 HydrophobicContact CB-CG 4.06Å; R851-M856 HydrophobicContact CB-SD 4.14Å
852	M	85.6	Confident	84.3	Confident	49 Å²	49	53.1 Å²	53.1	24%	0.241	27%	0.274	C	S	.	.			trans	-77.6	151.4	176.2	-67.4	-179.7	-64.2	0	0	111.1	H854 E855 M856 E913	M852-H854 VanDerWaalsContact C-N 3.26Å; M852-H854 PolarHBondContact O-N 2.91Å; M852-E855 HydrophobicContact CB-CG 4.33Å; M852-E855 HydrophobicContact CE-CG 4.03Å; M852-E855 WeakPolarHBondContact CE-OE1 3.46Å; M852-E855 PolarHBondContact O-N 3.33Å; M852-E855 VanDerWaalsContact O-N 3.15Å; M852-M856 PolarHBondContact O-N 3.34Å; M852-E913 WeakPolarHBondContact CA-OE2 3.5Å; M852-E913 WeakPolarHBondContact CB-OE2 3.47Å
853	V	83.8	Confident	84.1	Confident	16 Å²	16	56.3 Å²	56.3	10%	0.097	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-35.7	-178.8	173.3	0	0	0	0	111.8	L844 E855 M856 G857 L858 E913	L844-V853 HydrophobicContact CD1-CG1 4.14Å; L844-V853 HydrophobicContact CG-CG1 4.36Å; L844-V853 HydrophobicContact CG-CG2 4.45Å; V853-E855 PolarHBondContact O-N 3.41Å; V853-M856 PolarHBondContact O-N 3.49Å; V853-G857 PolarHBondContact O-N 3.36Å; V853-L858 HydrophobicContact CG1-CD2 3.53Å; V853-L858 HydrophobicContact CG1-CG 4.38Å; V853-E913 WeakPolarHBondContact CG2-OE1 3.26Å; V853-E913 PolarHBondContact N-OE2 2.87Å
854	H	79.9	Confident	84.1	Confident	175 Å²	175	56.8 Å²	56.8	81%	0.81	30%	0.296	S	S	*	.	H	α-helix	trans	-64.5	-37.2	177.6	-176.4	-73.1	0	0	0	112.8	M852 M856	M852-H854 VanDerWaalsContact C-N 3.26Å; M852-H854 PolarHBondContact O-N 2.91Å; H854-M856 VanDerWaalsContact C-N 3.35Å
855	E	79.5	Confident	84	Confident	91 Å²	91	57.4 Å²	57.4	43%	0.425	30%	0.302	S	S	.	.	H	α-helix	trans	-72.9	-29.6	-179.1	-66.5	179.2	151.5	0	0	112.3	M852 V853 R920	M852-E855 HydrophobicContact CB-CG 4.33Å; M852-E855 HydrophobicContact CE-CG 4.03Å; M852-E855 WeakPolarHBondContact CE-OE1 3.46Å; M852-E855 PolarHBondContact O-N 3.33Å; M852-E855 VanDerWaalsContact O-N 3.15Å; V853-E855 PolarHBondContact O-N 3.41Å; E855-R920 IonicContact OE1-CZ 3.73Å; E855-R920 IonicContact OE1-NH1 3.69Å; E855-R920 PolarHBondContact OE1-NH1 3.36Å; E855-R920 IonicContact OE1-NH2 2.86Å; E855-R920 IonicContact OE2-NH1 2.86Å; E855-R920 PolarHBondContact OE2-NH1 3.47Å
856	M	76.5	Confident	84.1	Confident	41 Å²	41	64.9 Å²	64.9	20%	0.202	33%	0.331	C	S	.	.	H	α-helix	trans	-81.6	-26.1	179.7	-67	178.7	61.8	0	0	113.1	E772 R847 S848 R851 M852 V853 H854 S860	E772-M856 HydrophobicContact CG-CE 4.25Å; E772-M856 VanDerWaalsContact OE1-CE 3.24Å; E772-M856 WeakPolarHBondContact OE1-CE 3.36Å; R847-M856 HydrophobicContact CB-CE 4.4Å; S848-M856 WeakPolarHBondContact CB-SD 3.25Å; R851-M856 HydrophobicContact CB-CG 4.06Å; R851-M856 HydrophobicContact CB-SD 4.14Å; M852-M856 PolarHBondContact O-N 3.34Å; V853-M856 PolarHBondContact O-N 3.49Å; H854-M856 VanDerWaalsContact C-N 3.35Å; M856-S860 VanDerWaalsContact O-CB 3.29Å; M856-S860 WeakPolarHBondContact O-CB 3.26Å
857	G	78.7	Confident	84.2	Confident	30 Å²	30	65.5 Å²	65.5	31%	0.309	34%	0.336	S	S	.	.			trans	79.5	131.1	-170.3	0	0	0	0	0	112.5	R847 V853 C859 S860	R847-G857 PolarHBondContact NH1-O 3.21Å; R847-G857 PolarHBondContact NH2-O 3.09Å; V853-G857 PolarHBondContact O-N 3.36Å; G857-C859 VanDerWaalsContact C-N 3.33Å; G857-C859 PolarHBondContact O-N 2.74Å; G857-S860 WeakPolarHBondContact O-CB 3.46Å; G857-S860 PolarHBondContact O-N 3.46Å
858	L	77	Confident	84.3	Confident	104 Å²	104	66.3 Å²	66.3	55%	0.545	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-42.2	-178.4	-71.5	165.6	0	0	0	112	L844 R847 V853	L844-L858 HydrophobicContact CD1-CD2 3.96Å; L844-L858 HydrophobicContact CD2-CD2 4.33Å; R847-L858 PolarHBondContact NH1-O 2.91Å; V853-L858 HydrophobicContact CG1-CD2 3.53Å; V853-L858 HydrophobicContact CG1-CG 4.38Å
859	C	79.9	Confident	84.6	Confident	97 Å²	97	70.5 Å²	70.5	66%	0.655	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	13.6	-176.1	-57.3	0	0	0	0	115	G857 N861	G857-C859 VanDerWaalsContact C-N 3.33Å; G857-C859 PolarHBondContact O-N 2.74Å; C859-N861 VanDerWaalsContact C-N 3.3Å; C859-N861 PolarHBondContact O-N 3.27Å
860	S	82.5	Confident	85.2	Confident	68 Å²	68	72.4 Å²	72.4	48%	0.476	38%	0.382	S	S	.	.	S	Bend	trans	-60.7	-41.5	177.6	179.4	0	0	0	0	111.6	M856 G857	M856-S860 VanDerWaalsContact O-CB 3.29Å; M856-S860 WeakPolarHBondContact O-CB 3.26Å; G857-S860 WeakPolarHBondContact O-CB 3.46Å; G857-S860 PolarHBondContact O-N 3.46Å
861	N	85.9	Confident	85.8	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.032	36%	0.359	C	S	.	.			trans	-101.5	96	173.7	-175.9	-16.7	0	0	0	110.2	S768 E772 C859 T863 F864 C865	S768-N861 PolarHBondContact O-ND2 3.22Å; E772-N861 WeakPolarHBondContact OE2-CB 3.33Å; E772-N861 PolarHBondContact OE2-ND2 3.4Å; C859-N861 VanDerWaalsContact C-N 3.3Å; C859-N861 PolarHBondContact O-N 3.27Å; N861-T863 VanDerWaalsContact C-N 3.32Å; N861-T863 PolarHBondContact O-N 3.08Å; N861-T863 PolarHBondContact OD1-N 3.36Å; N861-T863 PolarHBondContact OD1-OG1 3.44Å; N861-F864 HydrophobicContact CB-CB 3.92Å; N861-F864 VanDerWaalsContact CG-CB 3.48Å; N861-F864 PolarHBondContact O-N 2.87Å; N861-F864 PolarHBondContact OD1-N 3.33Å; N861-C865 PolarHBondContact O-N 3.43Å
862	R	88.8	Confident	86.2	Confident	189 Å²	189	66.8 Å²	66.8	71%	0.713	36%	0.356	S	S	*	.	H	α-helix	trans	-63.2	-37.2	179.2	-64.7	-174.5	-176.9	178.1	0.8	112.5	F864 C865 Y866	R862-F864 VanDerWaalsContact C-N 3.3Å; R862-F864 PolarHBondContact O-N 2.96Å; R862-C865 PolarHBondContact O-N 3.08Å; R862-Y866 HydrophobicContact CB-CE2 4.22Å; R862-Y866 WeakPolarHBondContact O-CD2 3.46Å; R862-Y866 PolarHBondContact O-N 3.37Å
863	T	88.6	Confident	86.6	Confident	68 Å²	68	69.7 Å²	69.7	42%	0.417	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-37.1	177.7	35.6	0	0	0	0	112.2	N861 Y866 A867	N861-T863 VanDerWaalsContact C-N 3.32Å; N861-T863 PolarHBondContact O-N 3.08Å; N861-T863 PolarHBondContact OD1-N 3.36Å; N861-T863 PolarHBondContact OD1-OG1 3.44Å; T863-Y866 PolarHBondContact O-N 3.43Å; T863-A867 WeakPolarHBondContact O-CB 3.2Å; T863-A867 PolarHBondContact O-N 3.16Å
864	F	90.9	Very high	87	Confident	9 Å²	9	69.6 Å²	69.6	4%	0.039	37%	0.372	C	S	.	.	H	α-helix	trans	-64.5	-45.2	173.4	178.1	-89.6	0	0	0	112.1	S768 L769 A843 L844 R847 N861 R862 Y866 A867 V868	S768-F864 WeakPolarHBondContact OG-CA 3.5Å; S768-F864 VanDerWaalsContact OG-CD2 3.29Å; S768-F864 WeakPolarHBondContact OG-CD2 3.24Å; L769-F864 HydrophobicContact CD2-CD2 3.9Å; L769-F864 HydrophobicContact CD2-CE2 3.8Å; L769-F864 HydrophobicContact CG-CD2 4.2Å; L769-F864 HydrophobicContact CG-CE2 4.17Å; A843-F864 HydrophobicContact CB-CE2 4.17Å; A843-F864 HydrophobicContact CB-CZ 4.31Å; L844-F864 HydrophobicContact CB-CZ 4.3Å; L844-F864 HydrophobicContact CD1-CE1 3.9Å; L844-F864 HydrophobicContact CD1-CZ 4.32Å; R847-F864 HydrophobicContact CG-CD2 4.41Å; R847-F864 HydrophobicContact CG-CE2 4.16Å; R847-F864 HydrophobicContact CG-CZ 4.25Å; N861-F864 HydrophobicContact CB-CB 3.92Å; N861-F864 VanDerWaalsContact CG-CB 3.48Å; N861-F864 PolarHBondContact O-N 2.87Å; N861-F864 PolarHBondContact OD1-N 3.33Å; R862-F864 VanDerWaalsContact C-N 3.3Å; R862-F864 PolarHBondContact O-N 2.96Å; F864-Y866 VanDerWaalsContact C-N 3.32Å; F864-Y866 PolarHBondContact O-N 3.08Å; F864-A867 PolarHBondContact O-N 3.34Å; F864-V868 HydrophobicContact CD1-CG2 4.13Å; F864-V868 HydrophobicContact CD2-CG2 4.4Å; F864-V868 HydrophobicContact CE1-CG2 3.65Å; F864-V868 HydrophobicContact CE2-CG2 3.95Å; F864-V868 HydrophobicContact CG-CG2 4.47Å; F864-V868 HydrophobicContact CZ-CG2 3.54Å; F864-V868 WeakPolarHBondContact O-CG2 3.2Å; F864-V868 PolarHBondContact O-N 2.95Å
865	C	90.8	Very high	87.6	Confident	45 Å²	45	61.3 Å²	61.3	30%	0.304	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-42.1	176.8	-64.3	0	0	0	0	112.1	N861 R862 L869	N861-C865 PolarHBondContact O-N 3.43Å; R862-C865 PolarHBondContact O-N 3.08Å; C865-L869 WeakPolarHBondContact O-CB 3.46Å; C865-L869 PolarHBondContact O-N 2.69Å
866	Y	92	Very high	88.2	Confident	157 Å²	157	59.9 Å²	59.9	62%	0.616	33%	0.329	S	S	*	.	H	α-helix	trans	-66.7	-40.9	176.1	-65.9	-47.4	0	0	0	112.6	R862 T863 F864 L869 A870	R862-Y866 HydrophobicContact CB-CE2 4.22Å; R862-Y866 WeakPolarHBondContact O-CD2 3.46Å; R862-Y866 PolarHBondContact O-N 3.37Å; T863-Y866 PolarHBondContact O-N 3.43Å; F864-Y866 VanDerWaalsContact C-N 3.32Å; F864-Y866 PolarHBondContact O-N 3.08Å; Y866-L869 PolarHBondContact O-N 2.87Å; Y866-A870 VanDerWaalsContact O-CB 3.23Å; Y866-A870 WeakPolarHBondContact O-CB 3.28Å; Y866-A870 PolarHBondContact O-N 3.33Å
867	A	91.8	Very high	88.9	Confident	13 Å²	13	62.2 Å²	62.2	11%	0.107	34%	0.342	C	S	.	.	H	α-helix	trans	-61.9	-50.8	177.1	0	0	0	0	0	111.4	P764 T863 F864 L869 A870 S871	P764-A867 HydrophobicContact CB-CB 4.39Å; T863-A867 WeakPolarHBondContact O-CB 3.2Å; T863-A867 PolarHBondContact O-N 3.16Å; F864-A867 PolarHBondContact O-N 3.34Å; A867-L869 PolarHBondContact O-N 3.41Å; A867-A870 PolarHBondContact O-N 3.06Å; A867-S871 WeakPolarHBondContact O-CB 3.32Å; A867-S871 PolarHBondContact O-N 2.72Å; A867-S871 PolarHBondContact O-OG 3.32Å; A867-S871 VanDerWaalsContact O-OG 3.1Å
868	V	91.3	Very high	89.4	Confident	23 Å²	23	60.8 Å²	60.8	14%	0.139	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-42	178.6	173.6	0	0	0	0	111.6	M840 F864 S871 I872	M840-V868 HydrophobicContact SD-CG1 4.2Å; M840-V868 HydrophobicContact SD-CG2 4.45Å; F864-V868 HydrophobicContact CD1-CG2 4.13Å; F864-V868 HydrophobicContact CD2-CG2 4.4Å; F864-V868 HydrophobicContact CE1-CG2 3.65Å; F864-V868 HydrophobicContact CE2-CG2 3.95Å; F864-V868 HydrophobicContact CG-CG2 4.47Å; F864-V868 HydrophobicContact CZ-CG2 3.54Å; F864-V868 WeakPolarHBondContact O-CG2 3.2Å; F864-V868 PolarHBondContact O-N 2.95Å; V868-S871 PolarHBondContact O-N 2.92Å; V868-I872 HydrophobicContact CG1-CD1 3.84Å; V868-I872 HydrophobicContact CG1-CG1 4.46Å; V868-I872 VanDerWaalsContact O-CG1 3.3Å; V868-I872 WeakPolarHBondContact O-CG1 3.35Å; V868-I872 PolarHBondContact O-N 2.95Å
869	L	91.9	Very high	90.2	Very high	100 Å²	100	55.9 Å²	55.9	52%	0.524	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-45	176.7	-175.6	71.4	0	0	0	111.4	C865 Y866 A867 I872 M873	C865-L869 WeakPolarHBondContact O-CB 3.46Å; C865-L869 PolarHBondContact O-N 2.69Å; Y866-L869 PolarHBondContact O-N 2.87Å; A867-L869 PolarHBondContact O-N 3.41Å; L869-I872 PolarHBondContact O-N 2.63Å; L869-M873 HydrophobicContact CG-SD 4.41Å; L869-M873 WeakPolarHBondContact O-CB 3.35Å; L869-M873 WeakPolarHBondContact O-CG 3.29Å; L869-M873 PolarHBondContact O-N 2.94Å
870	A	92	Very high	90.7	Very high	61 Å²	61	56 Å²	56	50%	0.504	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-40.5	177.7	0	0	0	0	0	111.8	Y866 A867 M873 G874	Y866-A870 VanDerWaalsContact O-CB 3.23Å; Y866-A870 WeakPolarHBondContact O-CB 3.28Å; Y866-A870 PolarHBondContact O-N 3.33Å; A867-A870 PolarHBondContact O-N 3.06Å; A870-M873 PolarHBondContact O-N 3.25Å; A870-G874 PolarHBondContact O-N 2.97Å
871	S	91.7	Very high	91.2	Very high	4 Å²	4	57.6 Å²	57.6	3%	0.028	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-46.4	174	-65.9	0	0	0	0	111.5	M761 A867 V868 M873 G874 Q875	M761-S871 VanDerWaalsContact CE-O 3.31Å; M761-S871 WeakPolarHBondContact CE-O 3.23Å; A867-S871 WeakPolarHBondContact O-CB 3.32Å; A867-S871 PolarHBondContact O-N 2.72Å; A867-S871 PolarHBondContact O-OG 3.32Å; A867-S871 VanDerWaalsContact O-OG 3.1Å; V868-S871 PolarHBondContact O-N 2.92Å; S871-M873 PolarHBondContact O-N 3.46Å; S871-G874 PolarHBondContact O-N 3.43Å; S871-Q875 PolarHBondContact O-N 3.18Å
872	I	91.8	Very high	91.3	Very high	57 Å²	57	61.2 Å²	61.2	29%	0.292	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-43.8	176	-67.4	167.6	0	0	0	110.9	M840 V868 L869 G874 Q875 L876	M840-I872 HydrophobicContact CG-CG1 4.4Å; V868-I872 HydrophobicContact CG1-CD1 3.84Å; V868-I872 HydrophobicContact CG1-CG1 4.46Å; V868-I872 VanDerWaalsContact O-CG1 3.3Å; V868-I872 WeakPolarHBondContact O-CG1 3.35Å; V868-I872 PolarHBondContact O-N 2.95Å; L869-I872 PolarHBondContact O-N 2.63Å; I872-G874 VanDerWaalsContact C-N 3.34Å; I872-G874 PolarHBondContact O-N 3.48Å; I872-Q875 PolarHBondContact O-N 2.84Å; I872-L876 HydrophobicContact CG2-CD1 4.2Å; I872-L876 WeakPolarHBondContact O-CG 3.44Å; I872-L876 PolarHBondContact O-N 3.46Å
873	M	93	Very high	91.2	Very high	110 Å²	110	55.5 Å²	55.5	54%	0.542	30%	0.299	S	S	.	.	H	α-helix	trans	-62.5	-40.7	175.9	-74.1	-175.5	69.4	0	0	112.2	L869 A870 S871 Q875 L876 L877	L869-M873 HydrophobicContact CG-SD 4.41Å; L869-M873 WeakPolarHBondContact O-CB 3.35Å; L869-M873 WeakPolarHBondContact O-CG 3.29Å; L869-M873 PolarHBondContact O-N 2.94Å; A870-M873 PolarHBondContact O-N 3.25Å; S871-M873 PolarHBondContact O-N 3.46Å; M873-Q875 VanDerWaalsContact C-N 3.35Å; M873-L876 PolarHBondContact O-N 2.96Å; M873-L877 PolarHBondContact O-N 2.83Å
874	G	91.7	Very high	91	Very high	13 Å²	13	54.7 Å²	54.7	13%	0.134	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-43.2	174	0	0	0	0	0	112	A870 S871 I872 L876 L877 V878	A870-G874 PolarHBondContact O-N 2.97Å; S871-G874 PolarHBondContact O-N 3.43Å; I872-G874 VanDerWaalsContact C-N 3.34Å; I872-G874 PolarHBondContact O-N 3.48Å; G874-L876 PolarHBondContact O-N 3.03Å; G874-L877 WeakPolarHBondContact O-CB 3.42Å; G874-L877 PolarHBondContact O-N 3.04Å; G874-V878 WeakPolarHBondContact O-CG2 3.19Å; G874-V878 PolarHBondContact O-N 2.75Å
875	Q	92.6	Very high	90.8	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-43	175.8	-173.9	61.6	14.6	0	0	111.7	M761 F832 T833 V836 S871 I872 M873 L877 V878 I879	M761-Q875 HydrophobicContact CE-CB 3.78Å; F832-Q875 VanDerWaalsContact CD1-NE2 3.28Å; T833-Q875 HydrophobicContact CG2-CG 4.37Å; T833-Q875 PolarHBondContact OG1-NE2 3.17Å; V836-Q875 HydrophobicContact CG1-CB 4.3Å; V836-Q875 HydrophobicContact CG1-CG 4.05Å; S871-Q875 PolarHBondContact O-N 3.18Å; I872-Q875 PolarHBondContact O-N 2.84Å; M873-Q875 VanDerWaalsContact C-N 3.35Å; Q875-L877 VanDerWaalsContact C-N 3.32Å; Q875-L877 PolarHBondContact O-N 3.29Å; Q875-V878 PolarHBondContact O-N 2.9Å; Q875-I879 HydrophobicContact CG-CD1 3.89Å; Q875-I879 WeakPolarHBondContact O-CD1 3.27Å; Q875-I879 VanDerWaalsContact O-CG1 3.28Å; Q875-I879 WeakPolarHBondContact O-CG1 3.45Å; Q875-I879 PolarHBondContact O-N 3.48Å
876	L	92.1	Very high	90.4	Very high	61 Å²	61	58 Å²	58	32%	0.319	31%	0.312	S	S	.	.	H	α-helix	trans	-63.6	-38.5	175.8	-66.9	171.3	0	0	0	111.7	I872 M873 G874 I879 Y880 L898	I872-L876 HydrophobicContact CG2-CD1 4.2Å; I872-L876 WeakPolarHBondContact O-CG 3.44Å; I872-L876 PolarHBondContact O-N 3.46Å; M873-L876 PolarHBondContact O-N 2.96Å; G874-L876 PolarHBondContact O-N 3.03Å; L876-I879 PolarHBondContact O-N 3.37Å; L876-Y880 HydrophobicContact CB-CD2 4.4Å; L876-Y880 HydrophobicContact CD2-CD2 4.34Å; L876-Y880 HydrophobicContact CD2-CE2 3.87Å; L876-Y880 WeakPolarHBondContact O-CB 3.48Å; L876-Y880 VanDerWaalsContact O-CD2 3.26Å; L876-Y880 WeakPolarHBondContact O-CD2 3.41Å; L876-Y880 PolarHBondContact O-N 3.04Å; L876-L898 HydrophobicContact CD2-CD1 4.44Å
877	L	91.6	Very high	89.8	Confident	91 Å²	91	54.2 Å²	54.2	48%	0.476	31%	0.305	S	S	.	.	H	α-helix	trans	-60.7	-44.9	173.1	-86.4	158.9	0	0	0	111.6	M873 G874 Q875 I879 Y880 F881 L884	M873-L877 PolarHBondContact O-N 2.83Å; G874-L877 WeakPolarHBondContact O-CB 3.42Å; G874-L877 PolarHBondContact O-N 3.04Å; Q875-L877 VanDerWaalsContact C-N 3.32Å; Q875-L877 PolarHBondContact O-N 3.29Å; L877-I879 VanDerWaalsContact C-N 3.25Å; L877-I879 PolarHBondContact O-N 2.8Å; L877-Y880 PolarHBondContact O-N 2.99Å; L877-F881 HydrophobicContact CD2-CB 4.21Å; L877-F881 HydrophobicContact CD2-CG 4.49Å; L877-F881 WeakPolarHBondContact O-CA 3.28Å; L877-F881 WeakPolarHBondContact O-CB 3.33Å; L877-F881 PolarHBondContact O-N 2.92Å; L877-L884 HydrophobicContact CB-CD1 4.11Å
878	V	90.2	Very high	89.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63	-32.6	177.2	173.6	0	0	0	0	112	W756 F832 G874 Q875 L884 F888 T890	W756-V878 HydrophobicContact CD2-CG2 4.39Å; W756-V878 HydrophobicContact CH2-CG2 3.84Å; W756-V878 HydrophobicContact CZ2-CG2 3.52Å; W756-V878 HydrophobicContact CZ3-CG2 4.38Å; F832-V878 HydrophobicContact CE1-CG1 3.99Å; G874-V878 WeakPolarHBondContact O-CG2 3.19Å; G874-V878 PolarHBondContact O-N 2.75Å; Q875-V878 PolarHBondContact O-N 2.9Å; V878-L884 HydrophobicContact CG2-CD1 4.46Å; V878-F888 HydrophobicContact CG1-CB 3.8Å; V878-F888 HydrophobicContact CG1-CD2 3.88Å; V878-F888 HydrophobicContact CG1-CG 3.87Å; V878-F888 HydrophobicContact CG2-CD2 4.15Å; V878-F888 HydrophobicContact CG2-CE2 4.26Å; V878-T890 HydrophobicContact CG1-CG2 4.05Å; V878-T890 PolarHBondContact O-OG1 3.04Å
879	I	92.5	Very high	88.9	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-83.6	-28	-178.7	-63.6	163.3	0	0	0	112.9	T829 T833 Q875 L876 L877 Q885 L893	T829-I879 HydrophobicContact CG2-CG1 4.1Å; T829-I879 HydrophobicContact CG2-CG2 4.42Å; T833-I879 HydrophobicContact CG2-CD1 3.75Å; T833-I879 WeakPolarHBondContact OG1-CD1 3.08Å; Q875-I879 HydrophobicContact CG-CD1 3.89Å; Q875-I879 WeakPolarHBondContact O-CD1 3.27Å; Q875-I879 VanDerWaalsContact O-CG1 3.28Å; Q875-I879 WeakPolarHBondContact O-CG1 3.45Å; Q875-I879 PolarHBondContact O-N 3.48Å; L876-I879 PolarHBondContact O-N 3.37Å; L877-I879 VanDerWaalsContact C-N 3.25Å; L877-I879 PolarHBondContact O-N 2.8Å; I879-Q885 PolarHBondContact O-NE2 2.93Å; I879-L893 HydrophobicContact CD1-CD1 4.32Å; I879-L893 HydrophobicContact CG2-CB 4.3Å; I879-L893 HydrophobicContact CG2-CG 4.09Å
880	Y	91.8	Very high	88.7	Confident	100 Å²	100	53.8 Å²	53.8	39%	0.392	30%	0.3	S	S	.	.	H	α-helix	trans	-117.7	-12.6	-171.7	-67.4	-69.7	0	0	0	115.4	L876 L877 L893	L876-Y880 HydrophobicContact CB-CD2 4.4Å; L876-Y880 HydrophobicContact CD2-CD2 4.34Å; L876-Y880 HydrophobicContact CD2-CE2 3.87Å; L876-Y880 WeakPolarHBondContact O-CB 3.48Å; L876-Y880 VanDerWaalsContact O-CD2 3.26Å; L876-Y880 WeakPolarHBondContact O-CD2 3.41Å; L876-Y880 PolarHBondContact O-N 3.04Å; L877-Y880 PolarHBondContact O-N 2.99Å; Y880-L893 PolarHBondContact OH-O 3.37Å
881	F	92	Very high	88.5	Confident	101 Å²	101	54.9 Å²	54.9	44%	0.443	29%	0.294	S	S	.	.			trans	-96.8	115.5	-177.5	-172.2	-121.2	0	0	0	111.6	L877 P883 L884 Q885	L877-F881 HydrophobicContact CD2-CB 4.21Å; L877-F881 HydrophobicContact CD2-CG 4.49Å; L877-F881 WeakPolarHBondContact O-CA 3.28Å; L877-F881 WeakPolarHBondContact O-CB 3.33Å; L877-F881 PolarHBondContact O-N 2.92Å; F881-P883 HydrophobicContact CD1-CB 4.19Å; F881-P883 HydrophobicContact CD1-CG 4.08Å; F881-P883 HydrophobicContact CE1-CB 3.76Å; F881-P883 HydrophobicContact CE1-CG 3.51Å; F881-P883 HydrophobicContact CE2-CG 4.25Å; F881-P883 HydrophobicContact CZ-CB 4.35Å; F881-P883 HydrophobicContact CZ-CG 3.61Å; F881-L884 HydrophobicContact CB-CD1 4.34Å; F881-L884 HydrophobicContact CD1-CB 4.24Å; F881-L884 HydrophobicContact CD1-CD1 3.81Å; F881-L884 HydrophobicContact CD1-CG 3.79Å; F881-L884 PolarHBondContact O-N 3.47Å; F881-Q885 PolarHBondContact O-N 3.02Å
882	P	87.3	Confident	88.4	Confident	83 Å²	83	57.9 Å²	57.9	54%	0.539	32%	0.315	S	S	.	.	H	α-helix	trans	-56.4	-39.3	-169.9	-24.8	32.2	0	0	0	116.4	L884 Q885 S886	P882-L884 VanDerWaalsContact C-N 3.3Å; P882-L884 PolarHBondContact O-N 3.41Å; P882-Q885 PolarHBondContact O-N 3.39Å; P882-S886 PolarHBondContact O-N 3.1Å; P882-S886 VanDerWaalsContact O-N 3.16Å
883	P	88.3	Confident	88.4	Confident	69 Å²	69	55.5 Å²	55.5	45%	0.448	30%	0.303	S	S	.	.	H	α-helix	trans	-65.1	-30.1	175.2	-24.1	35.1	0	0	0	114.3	F881 S886 V887	F881-P883 HydrophobicContact CD1-CB 4.19Å; F881-P883 HydrophobicContact CD1-CG 4.08Å; F881-P883 HydrophobicContact CE1-CB 3.76Å; F881-P883 HydrophobicContact CE1-CG 3.51Å; F881-P883 HydrophobicContact CE2-CG 4.25Å; F881-P883 HydrophobicContact CZ-CB 4.35Å; F881-P883 HydrophobicContact CZ-CG 3.61Å; P883-S886 PolarHBondContact O-OG 3.37Å; P883-V887 WeakPolarHBondContact O-CG2 3.33Å
884	L	84.1	Confident	88.3	Confident	50 Å²	50	52.7 Å²	52.7	26%	0.262	29%	0.294	S	S	.	.	H	α-helix	trans	-82.2	-34	175.5	-71.7	170	0	0	0	110.9	L877 V878 F881 P882 S886 V887 F888	L877-L884 HydrophobicContact CB-CD1 4.11Å; V878-L884 HydrophobicContact CG2-CD1 4.46Å; F881-L884 HydrophobicContact CB-CD1 4.34Å; F881-L884 HydrophobicContact CD1-CB 4.24Å; F881-L884 HydrophobicContact CD1-CD1 3.81Å; F881-L884 HydrophobicContact CD1-CG 3.79Å; F881-L884 PolarHBondContact O-N 3.47Å; P882-L884 VanDerWaalsContact C-N 3.3Å; P882-L884 PolarHBondContact O-N 3.41Å; L884-S886 VanDerWaalsContact C-N 3.29Å; L884-S886 PolarHBondContact O-N 2.91Å; L884-V887 PolarHBondContact O-N 3.5Å; L884-F888 HydrophobicContact CB-CD2 4.43Å; L884-F888 HydrophobicContact CD2-CD2 4.39Å; L884-F888 HydrophobicContact CD2-CE2 3.99Å; L884-F888 WeakPolarHBondContact O-CD2 3.24Å; L884-F888 PolarHBondContact O-N 2.71Å
885	Q	86.2	Confident	88.2	Confident	40 Å²	40	58.1 Å²	58.1	19%	0.187	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-38.8	174.6	-74.1	177.5	-35.7	0	0	112.8	I879 F881 P882 L889 T890	I879-Q885 PolarHBondContact O-NE2 2.93Å; F881-Q885 PolarHBondContact O-N 3.02Å; P882-Q885 PolarHBondContact O-N 3.39Å; Q885-L889 WeakPolarHBondContact O-CA 3.39Å; Q885-L889 PolarHBondContact O-N 2.81Å; Q885-T890 WeakPolarHBondContact CA-OG1 3.43Å; Q885-T890 WeakPolarHBondContact CB-O 3.26Å; Q885-T890 PolarHBondContact O-N 3.41Å; Q885-T890 VanDerWaalsContact O-N 3.09Å
886	S	81.7	Confident	88.1	Confident	84 Å²	84	64.6 Å²	64.6	59%	0.587	35%	0.353	S	S	*	.	H	α-helix	trans	-68.7	-33.4	177.4	60.9	0	0	0	0	113.2	P882 P883 L884	P882-S886 PolarHBondContact O-N 3.1Å; P882-S886 VanDerWaalsContact O-N 3.16Å; P883-S886 PolarHBondContact O-OG 3.37Å; L884-S886 VanDerWaalsContact C-N 3.29Å; L884-S886 PolarHBondContact O-N 2.91Å
887	V	81.1	Confident	88.1	Confident	78 Å²	78	62.7 Å²	62.7	47%	0.473	34%	0.343	S	S	.	.	H	α-helix	trans	-77.2	-43	179.4	175.6	0	0	0	0	111.6	M752 P883 L884	M752-V887 HydrophobicContact CE-CG1 4.21Å; P883-V887 WeakPolarHBondContact O-CG2 3.33Å; L884-V887 PolarHBondContact O-N 3.5Å
888	F	80.2	Confident	88	Confident	16 Å²	16	59.9 Å²	59.9	7%	0.07	33%	0.328	C	S	.	.	H	α-helix	trans	-93.5	-1.6	-177	-69.8	-76	0	0	0	114.1	M752 Q753 W756 V878 L884 T890	M752-F888 HydrophobicContact CB-CD1 4.16Å; M752-F888 HydrophobicContact CB-CE1 4.31Å; Q753-F888 PolarHBondContact NE2-O 3.13Å; W756-F888 HydrophobicContact CB-CE1 3.84Å; W756-F888 HydrophobicContact CB-CZ 4.46Å; W756-F888 HydrophobicContact CD2-CE1 4.34Å; W756-F888 HydrophobicContact CD2-CZ 4.18Å; W756-F888 HydrophobicContact CE3-CE1 4.15Å; W756-F888 HydrophobicContact CE3-CE2 4.27Å; W756-F888 AromaticContact CE3-CZ 3.6Å; W756-F888 HydrophobicContact CE3-CZ 3.6Å; W756-F888 HydrophobicContact CG-CE1 4.27Å; W756-F888 HydrophobicContact CZ3-CZ 4.2Å; V878-F888 HydrophobicContact CG1-CB 3.8Å; V878-F888 HydrophobicContact CG1-CD2 3.88Å; V878-F888 HydrophobicContact CG1-CG 3.87Å; V878-F888 HydrophobicContact CG2-CD2 4.15Å; V878-F888 HydrophobicContact CG2-CE2 4.26Å; L884-F888 HydrophobicContact CB-CD2 4.43Å; L884-F888 HydrophobicContact CD2-CD2 4.39Å; L884-F888 HydrophobicContact CD2-CE2 3.99Å; L884-F888 WeakPolarHBondContact O-CD2 3.24Å; L884-F888 PolarHBondContact O-N 2.71Å; F888-T890 HydrophobicContact CB-CG2 4.06Å
889	L	82.8	Confident	88.2	Confident	100 Å²	100	65 Å²	65	52%	0.524	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	48.9	-177.5	-57.5	173.2	0	0	0	112	Q885	Q885-L889 WeakPolarHBondContact O-CA 3.39Å; Q885-L889 PolarHBondContact O-N 2.81Å
890	T	87.3	Confident	88.3	Confident	11 Å²	11	67.7 Å²	67.7	7%	0.067	37%	0.367	C	S	.	.			trans	-108.9	157	-176.7	50.1	0	0	0	0	113.5	T829 F832 V878 Q885 F888	T829-T890 HydrophobicContact CG2-CG2 4.13Å; T829-T890 WeakPolarHBondContact OG1-CA 3.5Å; F832-T890 HydrophobicContact CD1-CG2 4.26Å; F832-T890 HydrophobicContact CE1-CG2 4.42Å; V878-T890 HydrophobicContact CG1-CG2 4.05Å; V878-T890 PolarHBondContact O-OG1 3.04Å; Q885-T890 WeakPolarHBondContact CA-OG1 3.43Å; Q885-T890 WeakPolarHBondContact CB-O 3.26Å; Q885-T890 PolarHBondContact O-N 3.41Å; Q885-T890 VanDerWaalsContact O-N 3.09Å; F888-T890 HydrophobicContact CB-CG2 4.06Å
891	E	89.1	Confident	88.3	Confident	83 Å²	83	62.9 Å²	62.9	39%	0.388	35%	0.348	S	S	.	.			trans	-124.7	152.2	178.5	-168	174.9	169.7	0	0	111.6	P825 R826 T829 L893	P825-E891 HydrophobicContact CB-CB 4.4Å; R826-E891 WeakPolarHBondContact CB-OE2 3.37Å; R826-E891 PolarHBondContact N-OE2 3.43Å; T829-E891 WeakPolarHBondContact CG2-O 3.5Å; T829-E891 PolarHBondContact OG1-N 2.91Å; E891-L893 PolarHBondContact O-N 3.48Å
892	S	89.9	Confident	88.4	Confident	67 Å²	67	62.4 Å²	62.4	47%	0.469	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-66.3	127.2	-179.7	57	0	0	0	0	112.4
893	L	90.4	Very high	88.7	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.037	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-89.3	154.9	176.3	-63.1	179.9	0	0	0	112.2	T829 M830 T833 I879 Y880 E891 D897 L898 L901	T829-L893 HydrophobicContact CG2-CD1 4.18Å; T829-L893 HydrophobicContact CG2-CD2 4.26Å; T829-L893 HydrophobicContact CG2-CG 4.07Å; M830-L893 HydrophobicContact CG-CD2 3.67Å; M830-L893 HydrophobicContact SD-CD1 3.98Å; M830-L893 HydrophobicContact SD-CD2 3.52Å; M830-L893 VanDerWaalsContact SD-CD2 3.52Å; M830-L893 HydrophobicContact SD-CG 4.34Å; T833-L893 HydrophobicContact CG2-CD1 4.17Å; I879-L893 HydrophobicContact CD1-CD1 4.32Å; I879-L893 HydrophobicContact CG2-CB 4.3Å; I879-L893 HydrophobicContact CG2-CG 4.09Å; Y880-L893 PolarHBondContact OH-O 3.37Å; E891-L893 PolarHBondContact O-N 3.48Å; L893-D897 HydrophobicContact CB-CB 4.46Å; L893-L898 HydrophobicContact CD1-CD2 4.39Å; L893-L901 HydrophobicContact CD1-CD1 4.4Å
894	S	90.9	Very high	88.9	Confident	51 Å²	51	60.4 Å²	60.4	36%	0.357	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-82.4	162	173.2	79.5	0	0	0	0	111.9	L896 D897 L898	S894-L896 PolarHBondContact O-N 3.29Å; S894-D897 VanDerWaalsContact CB-OD2 3.32Å; S894-D897 WeakPolarHBondContact CB-OD2 3.49Å; S894-D897 PolarHBondContact N-OD2 3.43Å; S894-D897 VanDerWaalsContact N-OD2 3.13Å; S894-D897 WeakPolarHBondContact O-CB 3.34Å; S894-D897 PolarHBondContact O-N 3.1Å; S894-D897 PolarHBondContact OG-N 3.26Å; S894-D897 PolarHBondContact OG-OD2 3.13Å; S894-L898 PolarHBondContact O-N 3.19Å; S894-L898 VanDerWaalsContact O-N 3.14Å
895	I	90	Very high	89.4	Confident	128 Å²	128	58 Å²	58	66%	0.656	32%	0.323	S	S	*	.	H	α-helix	trans	-62.8	-34.3	176	-63.8	167.4	0	0	0	111.3	D897 L898 L899	I895-D897 VanDerWaalsContact C-N 3.33Å; I895-L898 PolarHBondContact O-N 2.89Å; I895-L899 HydrophobicContact CG2-CD1 4.29Å; I895-L899 WeakPolarHBondContact O-CG 3.28Å; I895-L899 PolarHBondContact O-N 3.49Å
896	L	91.8	Very high	89.8	Confident	137 Å²	137	57.9 Å²	57.9	72%	0.717	33%	0.327	S	S	*	.	H	α-helix	trans	-66	-38.5	177.2	-68.4	175.4	0	0	0	111.4	S894 L899 F900	S894-L896 PolarHBondContact O-N 3.29Å; L896-L899 PolarHBondContact O-N 3.35Å; L896-F900 WeakPolarHBondContact O-CB 3.21Å; L896-F900 PolarHBondContact O-N 3.39Å
897	D	90.3	Very high	90.4	Very high	21 Å²	21	55.9 Å²	55.9	11%	0.112	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-44.5	175.6	-60.2	-41	0	0	0	110.7	R826 M830 L893 S894 I895 L899 F900 L901	R826-D897 IonicContact NH2-OD1 2.71Å; R826-D897 IonicContact NH2-OD2 3.51Å; R826-D897 PolarHBondContact NH2-OD2 2.98Å; M830-D897 HydrophobicContact CE-CB 4.02Å; M830-D897 HydrophobicContact SD-CB 3.81Å; L893-D897 HydrophobicContact CB-CB 4.46Å; S894-D897 VanDerWaalsContact CB-OD2 3.32Å; S894-D897 WeakPolarHBondContact CB-OD2 3.49Å; S894-D897 PolarHBondContact N-OD2 3.43Å; S894-D897 VanDerWaalsContact N-OD2 3.13Å; S894-D897 WeakPolarHBondContact O-CB 3.34Å; S894-D897 PolarHBondContact O-N 3.1Å; S894-D897 PolarHBondContact OG-N 3.26Å; S894-D897 PolarHBondContact OG-OD2 3.13Å; I895-D897 VanDerWaalsContact C-N 3.33Å; D897-L899 PolarHBondContact O-N 3.07Å; D897-F900 WeakPolarHBondContact O-CB 3.4Å; D897-F900 PolarHBondContact O-N 2.99Å; D897-L901 WeakPolarHBondContact O-CB 3.38Å; D897-L901 VanDerWaalsContact O-CG 3.3Å; D897-L901 WeakPolarHBondContact O-CG 3.35Å; D897-L901 PolarHBondContact O-N 3.44Å
898	L	91.3	Very high	90.9	Very high	31 Å²	31	52.1 Å²	52.1	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-41.9	176.9	-69.2	174.9	0	0	0	112.6	T833 F837 L876 L893 S894 I895 L901 L902	T833-L898 HydrophobicContact CG2-CD2 4.3Å; F837-L898 HydrophobicContact CE2-CD2 4.08Å; F837-L898 HydrophobicContact CZ-CD2 4.17Å; L876-L898 HydrophobicContact CD2-CD1 4.44Å; L893-L898 HydrophobicContact CD1-CD2 4.39Å; S894-L898 PolarHBondContact O-N 3.19Å; S894-L898 VanDerWaalsContact O-N 3.14Å; I895-L898 PolarHBondContact O-N 2.89Å; L898-L901 PolarHBondContact O-N 3.49Å; L898-L902 VanDerWaalsContact O-CB 3.29Å; L898-L902 WeakPolarHBondContact O-CB 3.18Å; L898-L902 PolarHBondContact O-N 2.99Å
899	L	93.3	Very high	91.4	Very high	107 Å²	107	52.2 Å²	52.2	56%	0.56	29%	0.292	S	S	*	.	H	α-helix	trans	-64.6	-41.7	175.9	-74.6	172.6	0	0	0	111.8	I895 L896 D897 L902 S903	I895-L899 HydrophobicContact CG2-CD1 4.29Å; I895-L899 WeakPolarHBondContact O-CG 3.28Å; I895-L899 PolarHBondContact O-N 3.49Å; L896-L899 PolarHBondContact O-N 3.35Å; D897-L899 PolarHBondContact O-N 3.07Å; L899-L902 PolarHBondContact O-N 3.42Å; L899-S903 PolarHBondContact O-N 3.48Å
900	F	93.9	Very high	91.9	Very high	57 Å²	57	51.7 Å²	51.7	25%	0.25	29%	0.293	C	S	.	.	H	α-helix	trans	-59.9	-50.8	174.7	168.5	-100.7	0	0	0	111	F812 V813 R816 L896 D897 L902 S903 L904	F812-F900 HydrophobicContact CE1-CZ 4.23Å; V813-F900 HydrophobicContact CG2-CE1 4.11Å; R816-F900 VanDerWaalsContact CZ-CE1 3.4Å; R816-F900 VanDerWaalsContact NH1-CE2 3.31Å; R816-F900 VanDerWaalsContact NH2-CE1 3.33Å; L896-F900 WeakPolarHBondContact O-CB 3.21Å; L896-F900 PolarHBondContact O-N 3.39Å; D897-F900 WeakPolarHBondContact O-CB 3.4Å; D897-F900 PolarHBondContact O-N 2.99Å; F900-L902 VanDerWaalsContact C-N 3.33Å; F900-L902 PolarHBondContact O-N 3.03Å; F900-S903 PolarHBondContact O-N 3.05Å; F900-S903 PolarHBondContact O-OG 3.24Å; F900-L904 HydrophobicContact CE1-CD2 4.37Å; F900-L904 HydrophobicContact CZ-CD2 4.19Å; F900-L904 PolarHBondContact O-N 3.31Å
901	L	93.4	Very high	92.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-42.8	178	-69.9	-179	0	0	0	111.7	V813 M830 T833 C834 F837 L893 D897 L898 S903 L904 T905	V813-L901 HydrophobicContact CG1-CD2 4.36Å; V813-L901 HydrophobicContact CG2-CD2 4.17Å; M830-L901 HydrophobicContact CE-CD2 4.37Å; M830-L901 HydrophobicContact CE-CG 4.44Å; M830-L901 HydrophobicContact SD-CD1 4.09Å; T833-L901 HydrophobicContact CG2-CD1 3.89Å; C834-L901 HydrophobicContact CB-CD2 3.64Å; F837-L901 HydrophobicContact CD2-CB 4Å; F837-L901 HydrophobicContact CE2-CB 4.36Å; L893-L901 HydrophobicContact CD1-CD1 4.4Å; D897-L901 WeakPolarHBondContact O-CB 3.38Å; D897-L901 VanDerWaalsContact O-CG 3.3Å; D897-L901 WeakPolarHBondContact O-CG 3.35Å; D897-L901 PolarHBondContact O-N 3.44Å; L898-L901 PolarHBondContact O-N 3.49Å; L901-S903 PolarHBondContact O-N 2.99Å; L901-L904 PolarHBondContact O-N 3.27Å; L901-T905 VanDerWaalsContact O-CB 3.27Å; L901-T905 WeakPolarHBondContact O-CB 3.36Å; L901-T905 WeakPolarHBondContact O-CG2 3.29Å; L901-T905 PolarHBondContact O-N 3Å; L901-T905 PolarHBondContact O-OG1 3.36Å
902	L	93.3	Very high	92.1	Very high	91 Å²	91	50 Å²	50	48%	0.476	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-39.8	179.1	-168.4	133.9	0	0	0	112.1	F841 L898 L899 F900 T905 S906	F841-L902 HydrophobicContact CE2-CG 4.37Å; F841-L902 HydrophobicContact CZ-CG 4.32Å; L898-L902 VanDerWaalsContact O-CB 3.29Å; L898-L902 WeakPolarHBondContact O-CB 3.18Å; L898-L902 PolarHBondContact O-N 2.99Å; L899-L902 PolarHBondContact O-N 3.42Å; F900-L902 VanDerWaalsContact C-N 3.33Å; F900-L902 PolarHBondContact O-N 3.03Å; L902-T905 WeakPolarHBondContact CA-OG1 3.46Å; L902-T905 PolarHBondContact O-OG1 2.91Å; L902-S906 PolarHBondContact O-N 2.98Å
903	S	93.1	Very high	92.1	Very high	69 Å²	69	48.5 Å²	48.5	48%	0.483	27%	0.274	S	S	.	.	H	α-helix	trans	-64.9	-45.9	175.9	75.8	0	0	0	0	112	L899 F900 L901 S906	L899-S903 PolarHBondContact O-N 3.48Å; F900-S903 PolarHBondContact O-N 3.05Å; F900-S903 PolarHBondContact O-OG 3.24Å; L901-S903 PolarHBondContact O-N 2.99Å; S903-S906 PolarHBondContact O-OG 3.33Å
904	L	94.1	Very high	92.1	Very high	40 Å²	40	52.1 Å²	52.1	21%	0.209	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-44.8	-179.1	-178.6	67.6	0	0	0	111.2	F812 V813 F838 F900 L901 S906 S907	F812-L904 HydrophobicContact CD1-CD2 4.36Å; V813-L904 HydrophobicContact CG2-CD2 3.53Å; F838-L904 HydrophobicContact CZ-CG 4.17Å; F900-L904 HydrophobicContact CE1-CD2 4.37Å; F900-L904 HydrophobicContact CZ-CD2 4.19Å; F900-L904 PolarHBondContact O-N 3.31Å; L901-L904 PolarHBondContact O-N 3.27Å; L904-S906 VanDerWaalsContact C-N 3.33Å; L904-S906 PolarHBondContact O-N 3.37Å; L904-S907 VanDerWaalsContact O-CB 3.26Å; L904-S907 WeakPolarHBondContact O-CB 3.4Å; L904-S907 PolarHBondContact O-N 3.11Å; L904-S907 PolarHBondContact O-OG 3.39Å
905	T	94.3	Very high	92	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-71.7	-27.3	-173.6	54.4	0	0	0	0	113.2	C834 F837 F838 F841 L901 L902 S907 V908	C834-T905 WeakPolarHBondContact O-CG2 3.5Å; F837-T905 HydrophobicContact CB-CG2 3.67Å; F838-T905 HydrophobicContact CB-CG2 4.37Å; F838-T905 HydrophobicContact CD1-CG2 3.98Å; F838-T905 HydrophobicContact CD2-CG2 3.69Å; F838-T905 VanDerWaalsContact CE1-CA 3.45Å; F838-T905 HydrophobicContact CE1-CG2 4.18Å; F838-T905 HydrophobicContact CE2-CG2 3.88Å; F838-T905 HydrophobicContact CG-CG2 3.74Å; F838-T905 HydrophobicContact CZ-CG2 4.12Å; F841-T905 WeakPolarHBondContact CD2-OG1 3.38Å; F841-T905 WeakPolarHBondContact CE2-OG1 3.34Å; L901-T905 VanDerWaalsContact O-CB 3.27Å; L901-T905 WeakPolarHBondContact O-CB 3.36Å; L901-T905 WeakPolarHBondContact O-CG2 3.29Å; L901-T905 PolarHBondContact O-N 3Å; L901-T905 PolarHBondContact O-OG1 3.36Å; L902-T905 WeakPolarHBondContact CA-OG1 3.46Å; L902-T905 PolarHBondContact O-OG1 2.91Å; T905-S907 PolarHBondContact O-N 3.38Å; T905-S907 VanDerWaalsContact O-N 3.1Å; T905-V908 PolarHBondContact O-N 3.35Å
906	S	93.9	Very high	91.9	Very high	38 Å²	38	45.9 Å²	45.9	27%	0.266	26%	0.26	S	S	.	.	H	α-helix	trans	-59.5	-21.1	174	76.1	0	0	0	0	113.9	L902 S903 L904 V908 C909 V910	L902-S906 PolarHBondContact O-N 2.98Å; S903-S906 PolarHBondContact O-OG 3.33Å; L904-S906 VanDerWaalsContact C-N 3.33Å; L904-S906 PolarHBondContact O-N 3.37Å; S906-V908 VanDerWaalsContact C-N 3.31Å; S906-V908 PolarHBondContact O-N 2.82Å; S906-C909 WeakPolarHBondContact O-CB 3.41Å; S906-C909 PolarHBondContact O-N 3.06Å; S906-C909 VanDerWaalsContact O-N 3.13Å; S906-V910 PolarHBondContact O-N 3.01Å
907	S	94	Very high	91.7	Very high	41 Å²	41	45.6 Å²	45.6	29%	0.287	25%	0.253	S	S	.	.	H	α-helix	trans	-57.5	-37.2	-179.6	63.1	0	0	0	0	113.8	L904 T905 C909 V910 V911	L904-S907 VanDerWaalsContact O-CB 3.26Å; L904-S907 WeakPolarHBondContact O-CB 3.4Å; L904-S907 PolarHBondContact O-N 3.11Å; L904-S907 PolarHBondContact O-OG 3.39Å; T905-S907 PolarHBondContact O-N 3.38Å; T905-S907 VanDerWaalsContact O-N 3.1Å; S907-C909 VanDerWaalsContact C-N 3.31Å; S907-C909 PolarHBondContact O-N 3.44Å; S907-V910 PolarHBondContact O-N 3.07Å; S907-V911 WeakPolarHBondContact O-CG2 3.35Å; S907-V911 PolarHBondContact O-N 2.81Å
908	V	92.5	Very high	91.5	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.1	-42.9	177.4	171.9	0	0	0	0	111.1	I805 I806 F838 N842 T905 S906 S912	I805-V908 HydrophobicContact CB-CG2 3.83Å; I805-V908 HydrophobicContact CG2-CB 4.44Å; I805-V908 HydrophobicContact CG2-CG2 3.35Å; I806-V908 HydrophobicContact CG1-CG2 4.02Å; F838-V908 HydrophobicContact CD1-CB 4.3Å; F838-V908 HydrophobicContact CD1-CG2 3.36Å; F838-V908 HydrophobicContact CE1-CG2 3.58Å; F838-V908 HydrophobicContact CG-CG2 4.5Å; N842-V908 HydrophobicContact CB-CG1 3.99Å; T905-V908 PolarHBondContact O-N 3.35Å; S906-V908 VanDerWaalsContact C-N 3.31Å; S906-V908 PolarHBondContact O-N 2.82Å; V908-S912 WeakPolarHBondContact O-CB 3.47Å; V908-S912 PolarHBondContact O-N 3.4Å; V908-S912 VanDerWaalsContact O-N 3.07Å
909	C	91	Very high	91.1	Very high	18 Å²	18	50 Å²	50	12%	0.122	28%	0.276	C	S	.	.	H	α-helix	trans	-66.4	-44.8	178.8	-172.6	0	0	0	0	111	F841 S906 S907 V911 S912 E913	F841-C909 HydrophobicContact CB-CB 4.29Å; F841-C909 HydrophobicContact CD1-CB 4.19Å; S906-C909 WeakPolarHBondContact O-CB 3.41Å; S906-C909 PolarHBondContact O-N 3.06Å; S906-C909 VanDerWaalsContact O-N 3.13Å; S907-C909 VanDerWaalsContact C-N 3.31Å; S907-C909 PolarHBondContact O-N 3.44Å; C909-V911 PolarHBondContact O-N 3.05Å; C909-S912 PolarHBondContact O-N 3.42Å; C909-E913 WeakPolarHBondContact O-CG 3.48Å; C909-E913 PolarHBondContact O-N 2.9Å
910	V	92	Very high	90.5	Very high	88 Å²	88	51.4 Å²	51.4	53%	0.533	27%	0.274	S	S	.	.	H	α-helix	trans	-60	-48	179.4	176.2	0	0	0	0	111.1	S906 S907 S912 E913 V914	S906-V910 PolarHBondContact O-N 3.01Å; S907-V910 PolarHBondContact O-N 3.07Å; V910-S912 PolarHBondContact O-N 2.9Å; V910-E913 PolarHBondContact O-N 2.98Å; V910-V914 WeakPolarHBondContact O-CG2 3.33Å; V910-V914 PolarHBondContact O-N 2.95Å
911	V	92.2	Very high	89.8	Confident	56 Å²	56	52.5 Å²	52.5	34%	0.339	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-43.5	179.7	175.7	0	0	0	0	111.2	V801 I805 S907 C909 E913 V914 I915	V801-V911 HydrophobicContact CG1-CG1 4.27Å; I805-V911 HydrophobicContact CD1-CB 3.79Å; I805-V911 HydrophobicContact CD1-CG1 3.77Å; I805-V911 HydrophobicContact CD1-CG2 4Å; S907-V911 WeakPolarHBondContact O-CG2 3.35Å; S907-V911 PolarHBondContact O-N 2.81Å; C909-V911 PolarHBondContact O-N 3.05Å; V911-E913 VanDerWaalsContact C-N 3.34Å; V911-E913 PolarHBondContact O-N 2.68Å; V911-V914 PolarHBondContact O-N 3.41Å; V911-I915 HydrophobicContact CG1-CD1 4.05Å; V911-I915 WeakPolarHBondContact O-CG1 3.5Å; V911-I915 PolarHBondContact O-N 3.34Å
912	S	88.7	Confident	89	Confident	4 Å²	4	61 Å²	61	3%	0.028	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-40.3	176.7	-95	0	0	0	0	112.8	R724 V908 C909 V910 I915 K916	R724-S912 PolarHBondContact NH2-OG 3.32Å; V908-S912 WeakPolarHBondContact O-CB 3.47Å; V908-S912 PolarHBondContact O-N 3.4Å; V908-S912 VanDerWaalsContact O-N 3.07Å; C909-S912 PolarHBondContact O-N 3.42Å; V910-S912 PolarHBondContact O-N 2.9Å; S912-I915 PolarHBondContact O-N 3.37Å; S912-K916 WeakPolarHBondContact O-CG 3.5Å; S912-K916 PolarHBondContact O-N 3.47Å; S912-K916 VanDerWaalsContact O-N 3.09Å
913	E	90.1	Very high	87.5	Confident	34 Å²	34	58.8 Å²	58.8	16%	0.159	32%	0.319	C	S	.	.	H	α-helix	trans	-67.5	-37.3	177.4	-69.7	-62.8	116.8	0	0	112.2	M852 V853 C909 V910 V911 K916 K917	M852-E913 WeakPolarHBondContact CA-OE2 3.5Å; M852-E913 WeakPolarHBondContact CB-OE2 3.47Å; V853-E913 WeakPolarHBondContact CG2-OE1 3.26Å; V853-E913 PolarHBondContact N-OE2 2.87Å; C909-E913 WeakPolarHBondContact O-CG 3.48Å; C909-E913 PolarHBondContact O-N 2.9Å; V910-E913 PolarHBondContact O-N 2.98Å; V911-E913 VanDerWaalsContact C-N 3.34Å; V911-E913 PolarHBondContact O-N 2.68Å; E913-K916 PolarHBondContact O-N 3.29Å; E913-K916 IonicContact OE1-NZ 3.47Å; E913-K916 PolarHBondContact OE1-NZ 2.64Å; E913-K917 PolarHBondContact O-N 3.24Å
914	V	90.3	Very high	85.4	Confident	83 Å²	83	59 Å²	59	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-61.7	-44.3	173.3	172.3	0	0	0	0	111	V910 V911 K916 K917 V918	V910-V914 WeakPolarHBondContact O-CG2 3.33Å; V910-V914 PolarHBondContact O-N 2.95Å; V911-V914 PolarHBondContact O-N 3.41Å; V914-K916 PolarHBondContact O-N 3.09Å; V914-K917 PolarHBondContact O-N 3.27Å; V914-V918 HydrophobicContact CG1-CG2 4.44Å; V914-V918 WeakPolarHBondContact O-CG2 3.32Å; V914-V918 PolarHBondContact O-N 2.61Å
915	I	88.3	Confident	82.8	Confident	45 Å²	45	65 Å²	65	23%	0.231	35%	0.352	C	S	.	.	H	α-helix	trans	-59.2	-47.3	177.2	-68.6	167.8	0	0	0	110.7	V801 V911 S912 K917 V918 E919	V801-I915 HydrophobicContact CG1-CD1 3.91Å; V911-I915 HydrophobicContact CG1-CD1 4.05Å; V911-I915 WeakPolarHBondContact O-CG1 3.5Å; V911-I915 PolarHBondContact O-N 3.34Å; S912-I915 PolarHBondContact O-N 3.37Å; I915-K917 VanDerWaalsContact C-N 3.32Å; I915-K917 PolarHBondContact O-N 3.17Å; I915-V918 PolarHBondContact O-N 3.01Å; I915-E919 HydrophobicContact CG2-CG 4.48Å; I915-E919 WeakPolarHBondContact O-CG 3.3Å; I915-E919 PolarHBondContact O-N 3.39Å
916	K	87.7	Confident	80.1	Confident	4 Å²	4	75.3 Å²	75.3	2%	0.017	39%	0.391	C	S	.	.	H	α-helix	trans	-59.3	-42.6	177.7	-68.6	174.5	-169	175.4	0	111.9	S845 S848 S912 E913 V914 E919 R920	S845-K916 WeakPolarHBondContact O-CE 3.46Å; S845-K916 PolarHBondContact O-NZ 3.35Å; S848-K916 WeakPolarHBondContact O-CE 3.39Å; S848-K916 PolarHBondContact O-NZ 2.94Å; S912-K916 WeakPolarHBondContact O-CG 3.5Å; S912-K916 PolarHBondContact O-N 3.47Å; S912-K916 VanDerWaalsContact O-N 3.09Å; E913-K916 PolarHBondContact O-N 3.29Å; E913-K916 IonicContact OE1-NZ 3.47Å; E913-K916 PolarHBondContact OE1-NZ 2.64Å; V914-K916 PolarHBondContact O-N 3.09Å; K916-E919 PolarHBondContact O-N 2.96Å; K916-R920 PolarHBondContact O-N 3.35Å; K916-R920 VanDerWaalsContact O-N 3.08Å
917	K	87.3	Confident	76.9	Confident	131 Å²	131	83.9 Å²	83.9	57%	0.57	42%	0.417	S	S	*	.	H	α-helix	trans	-62.2	-44.9	177.9	-171.2	175.2	-179.1	178.6	0	111.6	E913 V914 I915 R920 C921	E913-K917 PolarHBondContact O-N 3.24Å; V914-K917 PolarHBondContact O-N 3.27Å; I915-K917 VanDerWaalsContact C-N 3.32Å; I915-K917 PolarHBondContact O-N 3.17Å; K917-R920 PolarHBondContact O-N 3.14Å; K917-C921 PolarHBondContact O-N 3.43Å; K917-C921 VanDerWaalsContact O-N 3.11Å; K917-C921 PolarHBondContact O-SG 2.75Å; K917-C921 VanDerWaalsContact O-SG 3.37Å
918	V	86.9	Confident	73.8	Confident	72 Å²	72	87 Å²	87	44%	0.436	44%	0.437	S	S	.	.	H	α-helix	trans	-64.6	-43.1	178.2	172	0	0	0	0	111.8	V914 I915 R920 C921 R922	V914-V918 HydrophobicContact CG1-CG2 4.44Å; V914-V918 WeakPolarHBondContact O-CG2 3.32Å; V914-V918 PolarHBondContact O-N 2.61Å; I915-V918 PolarHBondContact O-N 3.01Å; V918-R920 VanDerWaalsContact C-N 3.3Å; V918-R920 PolarHBondContact O-N 3.13Å; V918-C921 PolarHBondContact O-N 3.4Å; V918-R922 PolarHBondContact O-N 3Å; V918-R922 VanDerWaalsContact O-N 3.08Å
919	E	83.8	Confident	71	Confident	72 Å²	72	92.1 Å²	92.1	34%	0.336	47%	0.47	S	S	.	.	H	α-helix	trans	-61.1	-39.7	176.9	-75.7	-177.9	167.4	0	0	112	K798 I915 K916 R922 G923	K798-E919 VanDerWaalsContact CE-CD 3.47Å; K798-E919 WeakPolarHBondContact CE-OE1 3.41Å; K798-E919 VanDerWaalsContact CE-OE2 3.23Å; K798-E919 WeakPolarHBondContact CE-OE2 3.44Å; K798-E919 IonicContact NZ-OE1 3.93Å; K798-E919 PolarHBondContact NZ-OE1 3.25Å; K798-E919 IonicContact NZ-OE2 3.36Å; K798-E919 PolarHBondContact NZ-OE2 3.21Å; I915-E919 HydrophobicContact CG2-CG 4.48Å; I915-E919 WeakPolarHBondContact O-CG 3.3Å; I915-E919 PolarHBondContact O-N 3.39Å; K916-E919 PolarHBondContact O-N 2.96Å; E919-R922 PolarHBondContact O-N 3.36Å; E919-G923 PolarHBondContact O-N 2.88Å
920	R	79.6	Confident	68.2	Low	137 Å²	137	97 Å²	97	52%	0.517	50%	0.504	S	S	.	.	H	α-helix	trans	-67.8	-41.8	178.6	-167.4	173.4	-179.2	-178.3	-3.5	112.3	E855 K916 K917 V918 R922 G923 A924	E855-R920 IonicContact OE1-CZ 3.73Å; E855-R920 IonicContact OE1-NH1 3.69Å; E855-R920 PolarHBondContact OE1-NH1 3.36Å; E855-R920 IonicContact OE1-NH2 2.86Å; E855-R920 IonicContact OE2-NH1 2.86Å; E855-R920 PolarHBondContact OE2-NH1 3.47Å; K916-R920 PolarHBondContact O-N 3.35Å; K916-R920 VanDerWaalsContact O-N 3.08Å; K917-R920 PolarHBondContact O-N 3.14Å; V918-R920 VanDerWaalsContact C-N 3.3Å; V918-R920 PolarHBondContact O-N 3.13Å; R920-R922 VanDerWaalsContact C-N 3.35Å; R920-G923 PolarHBondContact O-N 3.28Å; R920-A924 PolarHBondContact O-N 3.12Å; R920-A924 VanDerWaalsContact O-N 3.08Å
921	C	79.6	Confident	65.5	Low	80 Å²	80	99.5 Å²	99.5	54%	0.541	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-44.6	174.6	-69.1	0	0	0	0	111.5	K917 V918	K917-C921 PolarHBondContact O-N 3.43Å; K917-C921 VanDerWaalsContact O-N 3.11Å; K917-C921 PolarHBondContact O-SG 2.75Å; K917-C921 VanDerWaalsContact O-SG 3.37Å; V918-C921 PolarHBondContact O-N 3.4Å
922	R	76.5	Confident	62.5	Low	178 Å²	178	102 Å²	102	67%	0.672	53%	0.533	S	S	*	.	H	α-helix	trans	-70.3	-29.9	177.3	-75	178	153.8	-178.1	-5.6	113.9	V918 E919 R920	V918-R922 PolarHBondContact O-N 3Å; V918-R922 VanDerWaalsContact O-N 3.08Å; E919-R922 PolarHBondContact O-N 3.36Å; R920-R922 VanDerWaalsContact C-N 3.35Å
923	G	61.4	Low	59.7	Low	44 Å²	44	107.5 Å²	107.5	45%	0.454	57%	0.572	S	S	.	*	H	α-helix	trans	-76.1	-29.8	178.2	0	0	0	0	0	113.7	E919 R920 E925 R926	E919-G923 PolarHBondContact O-N 2.88Å; R920-G923 PolarHBondContact O-N 3.28Å; G923-E925 VanDerWaalsContact C-N 3.32Å; G923-R926 PolarHBondContact O-N 2.95Å
924	A	50.1	Low	56.9	Low	73 Å²	73	113.4 Å²	113.4	60%	0.603	60%	0.604	S	S	*	*	H	α-helix	trans	-67.2	-31.6	175.6	0	0	0	0	0	112.6	R920 R926	R920-A924 PolarHBondContact O-N 3.12Å; R920-A924 VanDerWaalsContact O-N 3.08Å; A924-R926 VanDerWaalsContact C-N 3.3Å; A924-R926 PolarHBondContact O-N 2.75Å
925	E	39.1	Very low	53.9	Low	166 Å²	166	117.7 Å²	117.7	78%	0.776	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-12.2	177.5	-74.7	177.2	154.6	0	0	114.2	G923	G923-E925 VanDerWaalsContact C-N 3.32Å
926	R	37.7	Very low	51.1	Low	218 Å²	218	126 Å²	126	82%	0.823	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	10.7	-176.7	-82.5	-171.5	178.7	-174.7	-0.5	115.4	G923 A924 P928	G923-R926 PolarHBondContact O-N 2.95Å; A924-R926 VanDerWaalsContact C-N 3.3Å; A924-R926 PolarHBondContact O-N 2.75Å; R926-P928 VanDerWaalsContact O-CD 3.27Å; R926-P928 WeakPolarHBondContact O-CD 3.36Å
927	R	27.3	Very low	49.3	Very low	217 Å²	217	132.1 Å²	132.1	82%	0.819	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-71.3	116.2	166	-73.7	-174.3	178.5	-177	-0.6	107.8
928	P	28.5	Very low	47.3	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-60.6	149	168.9	27.2	-31.7	0	0	0	108.6	R926 S930	R926-P928 VanDerWaalsContact O-CD 3.27Å; R926-P928 WeakPolarHBondContact O-CD 3.36Å; P928-S930 PolarHBondContact O-N 3.04Å
929	P	32.7	Very low	45.1	Very low	107 Å²	107	135.4 Å²	135.4	70%	0.695	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-55	132.3	168.8	24.4	-31.2	0	0	0	108.2	D931	P929-D931 PolarHBondContact O-N 3.24Å
930	S	32.4	Very low	42.8	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	75%	0.748	S	S	*	*			trans	-67.3	79.8	174.1	46	0	0	0	0	109.7	P928	P928-S930 PolarHBondContact O-N 3.04Å
931	D	35.1	Very low	40.5	Very low	140 Å²	140	139.3 Å²	139.3	75%	0.749	76%	0.763	S	S	*	*			trans	-118	97.5	168.1	-82.1	-24.8	0	0	0	109	P929	P929-D931 PolarHBondContact O-N 3.24Å
932	C	28.7	Very low	37.9	Very low	108 Å²	108	143.3 Å²	143.3	73%	0.73	78%	0.778	S	S	*	*			trans	-172	83.5	142.9	-104.4	0	0	0	0	108.4	L934	C932-L934 VanDerWaalsContact C-N 3.32Å; C932-L934 PolarHBondContact O-N 3Å; C932-L934 VanDerWaalsContact O-N 3.12Å
933	S	31.7	Very low	35.2	Very low	121 Å²	121	140.8 Å²	140.8	85%	0.846	79%	0.785	S	S	*	*			trans	-53.6	100.8	141.4	45.8	0	0	0	0	108.3
934	L	29.5	Very low	33.2	Very low	157 Å²	157	148.2 Å²	148.2	82%	0.822	81%	0.811	S	S	*	*			trans	-91.1	98.3	163.1	-94.1	150.2	0	0	0	107	C932	C932-L934 VanDerWaalsContact C-N 3.32Å; C932-L934 PolarHBondContact O-N 3Å; C932-L934 VanDerWaalsContact O-N 3.12Å
935	E	28.1	Very low	31.7	Very low	173 Å²	173	154.5 Å²	154.5	81%	0.808	83%	0.828	S	S	*	*			trans	-57.9	151.5	148	-73.2	179.4	146.6	0	0	109.6
936	V	30.2	Very low	31.1	Very low	219 Å²	219	153.5 Å²	153.5	100%	1.327	83%	0.833	S	S	*	*			trans	100	0	176.5	-170.1	0	0	0	0	115.6

Retrieved 936 of 936 residues in 190.8 ms (Link to these results)

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