A0A087YJM6_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A087YJM6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,146 aa.

						>A0A087YJM6_POEFO|A0A087YJM6
MRPKTFPAAPYVGNTRQRLQEIKEGLKQPAKLVSQALHGGSSRSEGSRPADSKSGKDTANRQQQLRPPQKFNNYQSALREIRRSLMPFANESGEVNRQMLQELVNAGCDQEMAVRALKQTGSRNIEAALEYISKMGYLDPRNELIVRVIKQTSPGKAGMPNGMDHRPPLEVPGEAGGLPPYHQMGAQMYDGAAGYGPESDLTRAYMGAPPVMNYMMPPSSAAQGPTMGNPMGRPPSMGSYPPVMPTQSNPGSAMYPQGAPQKAYPGGMEQHGPMMSYGVSGQQLQLQPQPPGGPGPGPHYDYAHARQHLMEPAGYGVKRTPSFQNKMQPPPMGPPDNYVNMQAKGGMSQNGSAGGGYLSSHSHPRQASPTSHQVHMMSRSPGGVPPMGPEFSDLPQGMMTPSRASLNLDLYEHHWAGPPGADGTPAARQPQPQGPFRGEVRVPSRTNSFNSRSAAPNGVRPTMTAGKQDSSMGPPNTITAVTSPPIQQPVKSIRVMRPEPKTAVGPCHPGWMTAQAPDTAEPLPYMPEESYPLEPAQEPRCPPPPYPKSLLIPAGEPGVLEGGGASGSDLSIATARGGCSSSSGGSGKAEDSQQVKEKTKAGKAEKAVKDKKQIQTSPVPVRKNGRDEEKRESRIKTYSPFAFKFYMEQHIENVMKTYQQKLNRRLQLEQEMSKAGLSEAEQEQMRKMLNQKESNYNRLRRAKMDKSMFVKIKTLGIGAFGEVCLTRKVDTGALYAMKTLRKKDVLNRNQVAHVKAERDILAEADNEWVVRLYYSFQDRDSLYFVMDYIPGGDMMSLLIRMGVFPELLARFYIAELTLAIESVHKMGFIHRDIKPDNILIDLDGHIKLTDFGLCTGFRWTHNSKYYQKGSHIRQDSMEPSDAWDDVSNCRCGDRLMTLEQRANRQHQRCLAHSLVGTPNYIAPEVLLRKAGYTQLCDWWSVGVILFEMLVGQPPFLAPTPTETQIKVINWESTLQVPPQVKLSPESVDIIGRLCCSAEERLGANGAGEIKAHPFFSEVDFSSNLRQQPAPYRPKIAHPMDTSNFDPVEEEGGPGSWSDSSDSTRALDALCSPHGKHPEHAFYEFTFRRFFDDHGCPFRYPKPPEADACLSVPAAGPEEGEETEEEEEVEDDEEEGEGGEGCEPVYV
					

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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	21.8	Very low	29.2	Very low	228 Å²	228	115.5 Å²	115.5	100%	1.123	59%	0.592	S	S	*	*				0	110.3	0	-56.5	-52.2	-105.6	0	0	110.7
2	R	25.1	Very low	29.8	Very low	223 Å²	223	118.5 Å²	118.5	84%	0.842	62%	0.619	S	S	*	*			trans	-133.8	148.2	165.8	-79.9	-174.3	178.8	167.6	3.2	108.1
3	P	27	Very low	30.1	Very low	117 Å²	117	111.8 Å²	111.8	76%	0.76	60%	0.597	S	S	*	*			trans	-66.6	138.6	174	-17.7	31.6	0	0	0	111.3
4	K	28.4	Very low	30.8	Very low	156 Å²	156	111.9 Å²	111.9	68%	0.678	60%	0.597	S	S	*	*			trans	-61.1	151.8	167.9	-65	-179.5	171.6	-176.9	0	110.4	E21	K4-E21 VanDerWaalsContact CD-OE1 3.24Å; K4-E21 WeakPolarHBondContact CD-OE1 3.33Å; K4-E21 WeakPolarHBondContact CE-OE1 3.38Å; K4-E21 IonicContact NZ-OE1 3.19Å; K4-E21 PolarHBondContact NZ-OE1 3.49Å
5	T	32	Very low	31.5	Very low	67 Å²	67	110.7 Å²	110.7	41%	0.411	60%	0.596	S	S	.	*			trans	-143.8	133	-178.1	59.6	0	0	0	0	114.9
6	F	27	Very low	32.1	Very low	53 Å²	53	115.9 Å²	115.9	23%	0.232	60%	0.604	C	S	.	*			trans	-21.8	123.9	165.4	-64.3	-114.7	0	0	0	116.1	R18 I22	F6-R18 HydrophobicContact CD1-CG 4.26Å; F6-R18 HydrophobicContact CE1-CG 4.33Å; F6-I22 HydrophobicContact CD2-CD1 4.49Å; F6-I22 HydrophobicContact CE1-CD1 3.74Å; F6-I22 HydrophobicContact CE2-CD1 3.62Å; F6-I22 HydrophobicContact CE2-CG1 3.82Å; F6-I22 HydrophobicContact CZ-CD1 3.2Å; F6-I22 HydrophobicContact CZ-CG1 3.94Å
7	P	31.7	Very low	32.7	Very low	46 Å²	46	116.6 Å²	116.6	30%	0.299	60%	0.604	S	S	.	*			trans	-75	157.8	168.8	31.3	-35.5	0	0	0	112.2	R18	P7-R18 PolarHBondContact O-NH2 2.92Å; P7-R18 VanDerWaalsContact O-NH2 3.1Å
8	A	31.5	Very low	33.4	Very low	44 Å²	44	112.7 Å²	112.7	36%	0.364	58%	0.58	S	S	.	*			trans	-118.4	14.1	-174.6	0	0	0	0	0	115	F1090	A8-F1090 HydrophobicContact CB-CD2 4.15Å; A8-F1090 HydrophobicContact CB-CE1 4.35Å; A8-F1090 HydrophobicContact CB-CE2 3.47Å; A8-F1090 VanDerWaalsContact CB-CE2 3.47Å; A8-F1090 HydrophobicContact CB-CZ 3.59Å
9	A	33.3	Very low	34	Very low	32 Å²	32	111.3 Å²	111.3	26%	0.264	57%	0.573	S	S	.	*	S	Bend	trans	-79.7	160.8	165.7	0	0	0	0	0	110.9	Y11	A9-Y11 PolarHBondContact O-N 2.94Å
10	P	32	Very low	34.5	Very low	133 Å²	133	111.2 Å²	111.2	86%	0.864	57%	0.57	S	S	*	*			trans	-71.9	66.2	166.8	32.6	-35.3	0	0	0	110.4	V12	P10-V12 PolarHBondContact O-N 2.96Å
11	Y	31	Very low	35	Very low	171 Å²	171	109.5 Å²	109.5	67%	0.671	56%	0.56	S	S	*	*			trans	-74	123.3	-174.2	-166.9	-109.9	0	0	0	111	A9 G13	A9-Y11 PolarHBondContact O-N 2.94Å; Y11-G13 VanDerWaalsContact C-N 3.27Å; Y11-G13 VanDerWaalsContact CE1-CA 3.45Å; Y11-G13 PolarHBondContact O-N 3.16Å
12	V	36.6	Very low	36.4	Very low	152 Å²	152	100.7 Å²	100.7	92%	0.921	52%	0.517	S	S	*	.			trans	-85.3	0.1	-177.8	-159.7	0	0	0	0	112.1	P10	P10-V12 PolarHBondContact O-N 2.96Å
13	G	34.4	Very low	37.3	Very low	32 Å²	32	96.8 Å²	96.8	33%	0.33	51%	0.506	S	S	.	.	S	Bend	trans	-80.8	158.3	-177.4	0	0	0	0	0	115.3	Y11 T15	Y11-G13 VanDerWaalsContact C-N 3.27Å; Y11-G13 VanDerWaalsContact CE1-CA 3.45Å; Y11-G13 PolarHBondContact O-N 3.16Å; G13-T15 PolarHBondContact O-N 3.49Å
14	N	39.4	Very low	38.2	Very low	113 Å²	113	96 Å²	96	60%	0.604	49%	0.492	S	S	*	.			trans	-57.2	112.8	-160.7	-169.3	-17	0	0	0	115.9	R16 Q17	N14-R16 PolarHBondContact O-N 3.33Å; N14-R16 VanDerWaalsContact OD1-CB 3.22Å; N14-R16 WeakPolarHBondContact OD1-CB 3.06Å; N14-R16 PolarHBondContact OD1-N 2.82Å; N14-Q17 PolarHBondContact O-N 2.76Å; N14-Q17 VanDerWaalsContact O-N 3.09Å
15	T	40.9	Very low	38.8	Very low	94 Å²	94	91.1 Å²	91.1	58%	0.577	49%	0.486	S	S	*	.	H	α-helix	trans	-49.4	-30.5	176.5	-42.8	0	0	0	0	114.4	G13 Q17 R18 L19	G13-T15 PolarHBondContact O-N 3.49Å; T15-Q17 VanDerWaalsContact C-N 3.32Å; T15-Q17 PolarHBondContact O-N 3.18Å; T15-R18 PolarHBondContact O-N 3.05Å; T15-L19 HydrophobicContact CG2-CD1 4.42Å; T15-L19 PolarHBondContact O-N 2.88Å
16	R	41	Very low	39.2	Very low	193 Å²	193	93.6 Å²	93.6	73%	0.728	50%	0.496	S	S	*	.	H	α-helix	trans	-63.5	-35.9	-178.4	-169.6	172.2	176.2	169	-2.7	112.4	N14 Q20	N14-R16 PolarHBondContact O-N 3.33Å; N14-R16 VanDerWaalsContact OD1-CB 3.22Å; N14-R16 WeakPolarHBondContact OD1-CB 3.06Å; N14-R16 PolarHBondContact OD1-N 2.82Å; R16-Q20 PolarHBondContact O-N 3.32Å; R16-Q20 VanDerWaalsContact O-N 3.1Å
17	Q	43.2	Very low	39.8	Very low	129 Å²	129	98.6 Å²	98.6	60%	0.603	52%	0.518	S	S	*	.	H	α-helix	trans	-70.4	-44.1	179.7	-170.2	174.5	4.1	0	0	111.5	N14 T15 L19 Q20 E21	N14-Q17 PolarHBondContact O-N 2.76Å; N14-Q17 VanDerWaalsContact O-N 3.09Å; T15-Q17 VanDerWaalsContact C-N 3.32Å; T15-Q17 PolarHBondContact O-N 3.18Å; Q17-L19 VanDerWaalsContact C-N 3.33Å; Q17-L19 PolarHBondContact O-N 3.16Å; Q17-Q20 PolarHBondContact O-N 3.04Å; Q17-Q20 VanDerWaalsContact O-N 3.09Å; Q17-E21 PolarHBondContact O-N 2.92Å
18	R	44.8	Very low	39.9	Very low	46 Å²	46	103.8 Å²	103.8	17%	0.174	54%	0.538	C	S	.	.	H	α-helix	trans	-53.5	-49.1	173.2	174.9	-176	-79.9	-157.6	-2.9	111.1	F6 P7 T15 Q20 E21 I22 E671	F6-R18 HydrophobicContact CD1-CG 4.26Å; F6-R18 HydrophobicContact CE1-CG 4.33Å; P7-R18 PolarHBondContact O-NH2 2.92Å; P7-R18 VanDerWaalsContact O-NH2 3.1Å; T15-R18 PolarHBondContact O-N 3.05Å; R18-Q20 VanDerWaalsContact C-N 3.3Å; R18-Q20 PolarHBondContact O-N 3.12Å; R18-E21 PolarHBondContact O-N 3.29Å; R18-I22 HydrophobicContact CG-CD1 3.88Å; R18-I22 WeakPolarHBondContact O-CD1 3.26Å; R18-I22 WeakPolarHBondContact O-CG1 3.32Å; R18-I22 PolarHBondContact O-N 3.48Å; R18-E671 WeakPolarHBondContact CD-OE2 3.29Å; R18-E671 IonicContact CZ-OE2 2.72Å; R18-E671 IonicContact NH1-OE1 3.85Å; R18-E671 PolarHBondContact NH1-OE1 3.05Å; R18-E671 IonicContact NH1-OE2 3.84Å; R18-E671 PolarHBondContact NH1-OE2 3.22Å
19	L	45	Very low	40.2	Very low	86 Å²	86	106.7 Å²	106.7	45%	0.45	55%	0.553	S	S	.	*	H	α-helix	trans	-64.5	-33	178.7	-70.9	171.2	0	0	0	112.9	T15 Q17 K23	T15-L19 HydrophobicContact CG2-CD1 4.42Å; T15-L19 PolarHBondContact O-N 2.88Å; Q17-L19 VanDerWaalsContact C-N 3.33Å; Q17-L19 PolarHBondContact O-N 3.16Å; L19-K23 VanDerWaalsContact O-CB 3.32Å; L19-K23 WeakPolarHBondContact O-CB 3.49Å; L19-K23 PolarHBondContact O-N 2.78Å
20	Q	43.7	Very low	40.5	Very low	109 Å²	109	109.8 Å²	109.8	51%	0.509	58%	0.579	S	S	.	*	H	α-helix	trans	-71.4	-44.1	177.8	-171.9	162	-25.1	0	0	112.2	R16 Q17 R18 I22 K23 E24	R16-Q20 PolarHBondContact O-N 3.32Å; R16-Q20 VanDerWaalsContact O-N 3.1Å; Q17-Q20 PolarHBondContact O-N 3.04Å; Q17-Q20 VanDerWaalsContact O-N 3.09Å; R18-Q20 VanDerWaalsContact C-N 3.3Å; R18-Q20 PolarHBondContact O-N 3.12Å; Q20-I22 VanDerWaalsContact C-N 3.29Å; Q20-I22 PolarHBondContact O-N 2.91Å; Q20-K23 PolarHBondContact O-N 3.01Å; Q20-K23 VanDerWaalsContact O-N 3.14Å; Q20-E24 WeakPolarHBondContact CG-OE1 3.24Å; Q20-E24 PolarHBondContact NE2-OE1 2.82Å; Q20-E24 WeakPolarHBondContact O-CG 3.28Å; Q20-E24 PolarHBondContact O-N 2.65Å
21	E	46.1	Very low	40.6	Very low	76 Å²	76	112.5 Å²	112.5	36%	0.355	58%	0.577	S	S	.	*	H	α-helix	trans	-61.7	-35.8	174.6	-65.8	-160.9	131.7	0	0	112.7	K4 Q17 R18 G25	K4-E21 VanDerWaalsContact CD-OE1 3.24Å; K4-E21 WeakPolarHBondContact CD-OE1 3.33Å; K4-E21 WeakPolarHBondContact CE-OE1 3.38Å; K4-E21 IonicContact NZ-OE1 3.19Å; K4-E21 PolarHBondContact NZ-OE1 3.49Å; Q17-E21 PolarHBondContact O-N 2.92Å; R18-E21 PolarHBondContact O-N 3.29Å; E21-G25 PolarHBondContact O-N 3.22Å
22	I	50.2	Low	40.7	Very low	43 Å²	43	111.3 Å²	111.3	22%	0.221	58%	0.581	C	S	.	*	H	α-helix	trans	-67	-44	174.2	-63.4	157.1	0	0	0	110.4	F6 R18 Q20 E24 G25 L26	F6-I22 HydrophobicContact CD2-CD1 4.49Å; F6-I22 HydrophobicContact CE1-CD1 3.74Å; F6-I22 HydrophobicContact CE2-CD1 3.62Å; F6-I22 HydrophobicContact CE2-CG1 3.82Å; F6-I22 HydrophobicContact CZ-CD1 3.2Å; F6-I22 HydrophobicContact CZ-CG1 3.94Å; R18-I22 HydrophobicContact CG-CD1 3.88Å; R18-I22 WeakPolarHBondContact O-CD1 3.26Å; R18-I22 WeakPolarHBondContact O-CG1 3.32Å; R18-I22 PolarHBondContact O-N 3.48Å; Q20-I22 VanDerWaalsContact C-N 3.29Å; Q20-I22 PolarHBondContact O-N 2.91Å; I22-E24 VanDerWaalsContact C-N 3.29Å; I22-E24 PolarHBondContact O-N 2.82Å; I22-G25 PolarHBondContact O-N 3.13Å; I22-L26 HydrophobicContact CG2-CD1 3.95Å; I22-L26 HydrophobicContact CG2-CG 4.49Å; I22-L26 WeakPolarHBondContact O-CB 3.42Å; I22-L26 WeakPolarHBondContact O-CG 3.26Å; I22-L26 PolarHBondContact O-N 2.9Å
23	K	43.7	Very low	40.6	Very low	141 Å²	141	110.8 Å²	110.8	61%	0.613	58%	0.578	S	S	*	*	H	α-helix	trans	-65.7	-31.1	178.5	-169.2	171.7	-174.9	173.6	0	112.5	L19 Q20 K27	L19-K23 VanDerWaalsContact O-CB 3.32Å; L19-K23 WeakPolarHBondContact O-CB 3.49Å; L19-K23 PolarHBondContact O-N 2.78Å; Q20-K23 PolarHBondContact O-N 3.01Å; Q20-K23 VanDerWaalsContact O-N 3.14Å; K23-K27 WeakPolarHBondContact O-CB 3.38Å; K23-K27 WeakPolarHBondContact O-CG 3.13Å; K23-K27 PolarHBondContact O-N 3.16Å
24	E	46.1	Very low	40.5	Very low	99 Å²	99	114.5 Å²	114.5	46%	0.463	60%	0.599	S	S	.	*	H	α-helix	trans	-75.6	-41.3	171.7	-74	169	-164.9	0	0	111.9	Q20 I22 L26 K27	Q20-E24 WeakPolarHBondContact CG-OE1 3.24Å; Q20-E24 PolarHBondContact NE2-OE1 2.82Å; Q20-E24 WeakPolarHBondContact O-CG 3.28Å; Q20-E24 PolarHBondContact O-N 2.65Å; I22-E24 VanDerWaalsContact C-N 3.29Å; I22-E24 PolarHBondContact O-N 2.82Å; E24-L26 VanDerWaalsContact C-N 3.29Å; E24-L26 PolarHBondContact O-N 2.87Å; E24-K27 WeakPolarHBondContact O-CB 3.28Å; E24-K27 PolarHBondContact O-N 3.1Å
25	G	41	Very low	40	Very low	54 Å²	54	118.8 Å²	118.8	56%	0.557	62%	0.616	S	S	*	*	H	α-helix	trans	-62.2	-31.8	173.5	0	0	0	0	0	114	E21 I22	E21-G25 PolarHBondContact O-N 3.22Å; I22-G25 PolarHBondContact O-N 3.13Å
26	L	41.1	Very low	39.5	Very low	119 Å²	119	118.4 Å²	118.4	62%	0.623	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-17.1	172.9	-69.6	170	0	0	0	113.4	I22 E24	I22-L26 HydrophobicContact CG2-CD1 3.95Å; I22-L26 HydrophobicContact CG2-CG 4.49Å; I22-L26 WeakPolarHBondContact O-CB 3.42Å; I22-L26 WeakPolarHBondContact O-CG 3.26Å; I22-L26 PolarHBondContact O-N 2.9Å; E24-L26 VanDerWaalsContact C-N 3.29Å; E24-L26 PolarHBondContact O-N 2.87Å
27	K	38.6	Very low	38.8	Very low	158 Å²	158	116.3 Å²	116.3	69%	0.687	63%	0.625	S	S	*	*	S	Bend	trans	-81.3	-7.7	178.7	-96.1	-178.5	170.1	-167.8	0	114.3	K23 E24 P29	K23-K27 WeakPolarHBondContact O-CB 3.38Å; K23-K27 WeakPolarHBondContact O-CG 3.13Å; K23-K27 PolarHBondContact O-N 3.16Å; E24-K27 WeakPolarHBondContact O-CB 3.28Å; E24-K27 PolarHBondContact O-N 3.1Å; K27-P29 WeakPolarHBondContact O-CD 3.4Å
28	Q	35.1	Very low	38.1	Very low	156 Å²	156	118.3 Å²	118.3	73%	0.729	63%	0.634	S	S	*	*			trans	-95.1	96.8	177.4	-66.1	-168.9	4.2	0	0	111.2
29	P	36.2	Very low	37.1	Very low	104 Å²	104	120 Å²	120	68%	0.675	67%	0.665	S	S	*	*			trans	-65.9	141.4	171.3	29.1	-35.6	0	0	0	110.5	K27 K31	K27-P29 WeakPolarHBondContact O-CD 3.4Å; P29-K31 VanDerWaalsContact C-N 3.34Å; P29-K31 PolarHBondContact O-N 2.94Å
30	A	39.8	Very low	36.3	Very low	97 Å²	97	119.5 Å²	119.5	80%	0.802	68%	0.681	S	S	*	*			trans	-72.1	78.7	-174	0	0	0	0	0	113.4
31	K	34.7	Very low	35.5	Very low	190 Å²	190	120.5 Å²	120.5	83%	0.826	70%	0.7	S	S	*	*			trans	-102.5	54.3	173.9	-76.8	-167.3	171.7	-174.5	0	113.3	P29	P29-K31 VanDerWaalsContact C-N 3.34Å; P29-K31 PolarHBondContact O-N 2.94Å
32	L	33.8	Very low	34.6	Very low	146 Å²	146	121.4 Å²	121.4	76%	0.764	71%	0.714	S	S	*	*	S	Bend	trans	-157.4	25.7	167.1	-121.1	161.1	0	0	0	116.2
33	V	34.1	Very low	33.5	Very low	141 Å²	141	130.2 Å²	130.2	86%	0.855	75%	0.745	S	S	*	*	S	Bend	trans	-138.6	45.4	169.3	-159.7	0	0	0	0	111.1
34	S	31.2	Very low	32.7	Very low	110 Å²	110	128.9 Å²	128.9	77%	0.769	75%	0.753	S	S	*	*			trans	-147.6	26.4	177.6	-51.6	0	0	0	0	113.9
35	Q	29.7	Very low	31.7	Very low	204 Å²	204	133.9 Å²	133.9	95%	0.953	78%	0.777	S	S	*	*	S	Bend	trans	-120.6	57	165	-84.3	-171.1	-24.6	0	0	110.5
36	A	30	Very low	30.9	Very low	85 Å²	85	134.5 Å²	134.5	70%	0.702	78%	0.783	S	S	*	*	S	Bend	trans	-154.4	137.9	157.3	0	0	0	0	0	106.9
37	L	27.7	Very low	30.2	Very low	150 Å²	150	134.9 Å²	134.9	79%	0.785	80%	0.795	S	S	*	*	S	Bend	trans	73.1	79.6	-177	-51	174.2	0	0	0	116
38	H	28.2	Very low	29.6	Very low	171 Å²	171	138.7 Å²	138.7	79%	0.792	81%	0.805	S	S	*	*			trans	71.8	105.4	146.5	-44.4	104.4	0	0	0	119.7
39	G	24.4	Very low	30.2	Very low	80 Å²	80	136.7 Å²	136.7	83%	0.825	81%	0.806	S	S	*	*				-81	152.5	119.5	0	0	0	0	0	109.2
40	G	27	Very low	29.8	Very low	77 Å²	77	135.9 Å²	135.9	79%	0.794	81%	0.808	S	S	*	*			cis	149.8	140.6	-10	0	0	0	0	0	112.5
41	S	26.6	Very low	29.2	Very low	129 Å²	129	138.7 Å²	138.7	90%	0.902	81%	0.81	S	S	*	*			trans	-160.1	167.5	155.2	-157.6	0	0	0	0	112.1
42	S	27.6	Very low	29	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	79%	0.794	S	S	*	*			trans	-113.2	170.4	-171.3	67.3	0	0	0	0	110.7
43	R	27.8	Very low	28.7	Very low	229 Å²	229	135.2 Å²	135.2	86%	0.864	80%	0.797	S	S	*	*			cis	-120.4	-103.8	25.4	-63.3	175.8	-172.7	173.3	2.9	114.3
44	S	25.6	Very low	28.5	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	80%	0.799	S	S	*	*			cis	-152.8	172.3	7.4	-64.3	0	0	0	0	111.5
45	E	24.8	Very low	28.3	Very low	205 Å²	205	132.6 Å²	132.6	96%	0.958	80%	0.796	S	S	*	*			trans	-85.2	169.4	-174.8	-56.4	-174.4	111.4	0	0	114.7
46	G	24.4	Very low	28.4	Very low	66 Å²	66	132.9 Å²	132.9	68%	0.68	79%	0.794	S	S	*	*			trans	147.2	70.5	153.1	0	0	0	0	0	120.3
47	S	26.6	Very low	28.4	Very low	127 Å²	127	136 Å²	136	89%	0.888	80%	0.799	S	S	*	*			trans	59.9	151.9	142.2	-58.2	0	0	0	0	124
48	R	26.1	Very low	28.5	Very low	239 Å²	239	134.9 Å²	134.9	90%	0.902	80%	0.799	S	S	*	*			trans	-107.5	-164.9	159.7	-50.1	175.3	171.8	173.5	-3.9	108.1
49	P	48.6	Very low	28.7	Very low	114 Å²	114	131.4 Å²	131.4	74%	0.74	80%	0.8	S	S	*	*			cis	-136.3	-160.8	-12.4	41.2	-21.3	0	0	0	114.2
50	A	27.7	Very low	29	Very low	87 Å²	87	134.7 Å²	134.7	72%	0.719	80%	0.798	S	S	*	*			trans	74.5	168.1	151.1	0	0	0	0	0	120
51	D	27.3	Very low	29.1	Very low	156 Å²	156	142.9 Å²	142.9	83%	0.834	81%	0.805	S	S	*	*				-179.7	168.3	-50.9	-118	-56.1	0	0	0	109
52	S	29	Very low	29.3	Very low	72 Å²	72	144.5 Å²	144.5	50%	0.503	80%	0.799	S	S	.	*			cis	-161.4	164.6	-3.8	72.5	0	0	0	0	112.5
53	K	28.7	Very low	29.3	Very low	191 Å²	191	147.4 Å²	147.4	83%	0.83	80%	0.802	S	S	*	*			trans	73.9	161	144.6	-72.4	167.4	-168.7	164.8	0	123.6
54	S	28.7	Very low	29.2	Very low	126 Å²	126	145 Å²	145	88%	0.881	80%	0.8	S	S	*	*			trans	84.6	142.3	163.8	77.1	0	0	0	0	118.7
55	G	28.3	Very low	29.3	Very low	70 Å²	70	148.2 Å²	148.2	72%	0.722	81%	0.808	S	S	*	*			cis	165.5	144.1	-16	0	0	0	0	0	116.6
56	K	31.3	Very low	29.4	Very low	209 Å²	209	149.9 Å²	149.9	91%	0.909	81%	0.805	S	S	*	*			trans	81.2	138.4	167.5	-67.8	-173.1	174.2	-178.1	0	121.2
57	D	29.5	Very low	29.7	Very low	150 Å²	150	151.9 Å²	151.9	80%	0.802	81%	0.806	S	S	*	*			trans	-79.3	-179.1	168.3	-42.8	-99.1	0	0	0	111.4
58	T	30.4	Very low	29.9	Very low	127 Å²	127	151.8 Å²	151.8	78%	0.779	80%	0.802	S	S	*	*			cis	-153.7	153	24.6	47.7	0	0	0	0	113.3
59	A	31.8	Very low	30.2	Very low	98 Å²	98	149.8 Å²	149.8	81%	0.81	80%	0.803	S	S	*	*			trans	52.1	149.3	139.6	0	0	0	0	0	122.9
60	N	31.1	Very low	29.5	Very low	150 Å²	150	153 Å²	153	80%	0.802	81%	0.806	S	S	*	*			cis	-173.4	123.4	-20.4	175.8	12.1	0	0	0	109.6
61	R	28.6	Very low	29.7	Very low	249 Å²	249	158.7 Å²	158.7	94%	0.94	81%	0.814	S	S	*	*			trans	-153.7	145.3	156.6	-158.7	167	-178.5	168.1	0.3	111.8
62	Q	30.5	Very low	30.2	Very low	162 Å²	162	156 Å²	156	76%	0.757	80%	0.8	S	S	*	*			trans	-85.2	147	-170.8	-56.6	164.6	-16.2	0	0	113.2
63	Q	27.6	Very low	30.7	Very low	157 Å²	157	159.2 Å²	159.2	73%	0.734	81%	0.812	S	S	*	*				179.6	161.3	96.1	-97.1	-164.9	20.3	0	0	114.7
64	Q	27.4	Very low	31	Very low	177 Å²	177	159.5 Å²	159.5	83%	0.827	81%	0.809	S	S	*	*			trans	60.6	99.2	164.5	-66.4	-177.2	43	0	0	119.5
65	L	27.1	Very low	31.6	Very low	180 Å²	180	159 Å²	159	94%	0.942	79%	0.793	S	S	*	*			trans	-125.4	140.1	152.7	-90.6	167.6	0	0	0	109.7
66	R	26.8	Very low	32	Very low	241 Å²	241	158.6 Å²	158.6	91%	0.909	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-91.3	151.4	169.7	-103.2	-175.9	173.5	171.3	-0.3	110.6
67	P	31.4	Very low	32.3	Very low	108 Å²	108	150.8 Å²	150.8	70%	0.701	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-88.2	155	-169.4	34.8	-36.5	0	0	0	114.1
68	P	30.2	Very low	32.9	Very low	124 Å²	124	148.5 Å²	148.5	81%	0.805	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-68.6	154.8	165.2	30.6	-34.5	0	0	0	111.9
69	Q	32.7	Very low	33.5	Very low	197 Å²	197	149.4 Å²	149.4	92%	0.921	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-84.4	166.3	-174.3	-74.4	-170.4	-24.8	0	0	114.5
70	K	32.9	Very low	34	Very low	183 Å²	183	151.1 Å²	151.1	80%	0.796	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-96.5	135.8	-158.1	-57	171.5	-177.8	175.6	0	113.2
71	F	33.1	Very low	34.6	Very low	205 Å²	205	148.5 Å²	148.5	90%	0.899	71%	0.706	S	S	*	*			trans	-106.5	20.4	170.3	-116.6	-81.1	0	0	0	113.3	N73	F71-N73 PolarHBondContact O-N 2.89Å
72	N	37.3	Very low	35.3	Very low	99 Å²	99	146.2 Å²	146.2	53%	0.529	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	-14.3	-159.2	-76.2	8.5	0	0	0	117.1	Y74 Q75 S76	N72-Y74 PolarHBondContact O-N 3.37Å; N72-Q75 PolarHBondContact O-N 3.16Å; N72-S76 PolarHBondContact O-N 3.06Å; N72-S76 VanDerWaalsContact O-N 3.14Å
73	N	38.9	Very low	35.7	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	70%	0.697	S	S	*	*	H	α-helix	trans	-65.4	-37.3	-167.1	-67.2	13.1	0	0	0	113.1	F71 S76 A77	F71-N73 PolarHBondContact O-N 2.89Å; N73-S76 PolarHBondContact O-N 2.96Å; N73-A77 PolarHBondContact O-N 3.41Å
74	Y	34.9	Very low	36.1	Very low	196 Å²	196	144.5 Å²	144.5	77%	0.769	69%	0.69	S	S	*	*	H	α-helix	trans	-68.9	-36.5	176	-105.9	-86.7	0	0	0	113.1	N72 S76 L78	N72-Y74 PolarHBondContact O-N 3.37Å; Y74-S76 VanDerWaalsContact C-N 3.32Å; Y74-S76 PolarHBondContact O-N 3.37Å; Y74-L78 WeakPolarHBondContact O-CG 3.49Å; Y74-L78 PolarHBondContact O-N 2.87Å; Y74-L78 VanDerWaalsContact O-N 3.11Å
75	Q	40.8	Very low	36.5	Very low	117 Å²	117	140.8 Å²	140.8	55%	0.547	68%	0.675	S	S	.	*	H	α-helix	trans	-68.5	-31.6	176.6	-73.2	-163.6	3	0	0	112.5	N72 R79	N72-Q75 PolarHBondContact O-N 3.16Å; Q75-R79 VanDerWaalsContact O-CB 3.25Å; Q75-R79 WeakPolarHBondContact O-CB 3.21Å; Q75-R79 PolarHBondContact O-N 3.25Å
76	S	36.9	Very low	36.9	Very low	60 Å²	60	139.1 Å²	139.1	42%	0.42	66%	0.664	S	S	.	*	H	α-helix	trans	-66	-49.1	176.2	-152.8	0	0	0	0	110.9	N72 N73 Y74 L78 R79 E80	N72-S76 PolarHBondContact O-N 3.06Å; N72-S76 VanDerWaalsContact O-N 3.14Å; N73-S76 PolarHBondContact O-N 2.96Å; Y74-S76 VanDerWaalsContact C-N 3.32Å; Y74-S76 PolarHBondContact O-N 3.37Å; S76-L78 PolarHBondContact O-N 2.92Å; S76-R79 WeakPolarHBondContact O-CB 3.47Å; S76-R79 PolarHBondContact O-N 3.03Å; S76-R79 VanDerWaalsContact O-N 3.1Å; S76-E80 WeakPolarHBondContact O-CB 3.32Å; S76-E80 PolarHBondContact O-N 3.03Å
77	A	39.2	Very low	37.3	Very low	45 Å²	45	132.5 Å²	132.5	37%	0.372	65%	0.653	S	S	.	*	H	α-helix	trans	-58.4	-43.9	176.6	0	0	0	0	0	112.4	N73 R79 E80 I81	N73-A77 PolarHBondContact O-N 3.41Å; A77-R79 VanDerWaalsContact C-N 3.32Å; A77-R79 PolarHBondContact O-N 3.1Å; A77-E80 PolarHBondContact O-N 2.86Å; A77-I81 WeakPolarHBondContact O-CB 3.43Å; A77-I81 VanDerWaalsContact O-CG1 3.27Å; A77-I81 WeakPolarHBondContact O-CG1 3.45Å; A77-I81 PolarHBondContact O-N 3.06Å
78	L	40.8	Very low	37.4	Very low	102 Å²	102	135.7 Å²	135.7	53%	0.534	66%	0.656	S	S	.	*	H	α-helix	trans	-65.8	-31.6	176.4	-70.4	169.4	0	0	0	113.3	Y74 S76 R82	Y74-L78 WeakPolarHBondContact O-CG 3.49Å; Y74-L78 PolarHBondContact O-N 2.87Å; Y74-L78 VanDerWaalsContact O-N 3.11Å; S76-L78 PolarHBondContact O-N 2.92Å; L78-R82 WeakPolarHBondContact O-CB 3.35Å; L78-R82 WeakPolarHBondContact O-CG 3.29Å; L78-R82 PolarHBondContact O-N 3.1Å; L78-R82 VanDerWaalsContact O-N 3.1Å
79	R	43	Very low	37.9	Very low	146 Å²	146	133.1 Å²	133.1	55%	0.551	65%	0.645	S	S	*	*	H	α-helix	trans	-74.2	-32.9	175.2	-170.4	-178.4	-61.9	129.7	2.7	112.1	Q75 S76 A77 R83	Q75-R79 VanDerWaalsContact O-CB 3.25Å; Q75-R79 WeakPolarHBondContact O-CB 3.21Å; Q75-R79 PolarHBondContact O-N 3.25Å; S76-R79 WeakPolarHBondContact O-CB 3.47Å; S76-R79 PolarHBondContact O-N 3.03Å; S76-R79 VanDerWaalsContact O-N 3.1Å; A77-R79 VanDerWaalsContact C-N 3.32Å; A77-R79 PolarHBondContact O-N 3.1Å; R79-R83 PolarHBondContact O-N 2.93Å
80	E	43.1	Very low	37.9	Very low	134 Å²	134	130.8 Å²	130.8	63%	0.626	64%	0.639	S	S	*	*	H	α-helix	trans	-76.3	-42	178.3	-165.4	150.1	-141.8	0	0	111.7	S76 A77 R82 R83 S84	S76-E80 WeakPolarHBondContact O-CB 3.32Å; S76-E80 PolarHBondContact O-N 3.03Å; A77-E80 PolarHBondContact O-N 2.86Å; E80-R82 VanDerWaalsContact C-N 3.33Å; E80-R82 PolarHBondContact O-N 2.8Å; E80-R83 WeakPolarHBondContact O-CB 3.5Å; E80-R83 PolarHBondContact O-N 3.19Å; E80-R83 VanDerWaalsContact O-N 3.14Å; E80-S84 PolarHBondContact O-N 3.37Å
81	I	43.1	Very low	38	Very low	96 Å²	96	131.8 Å²	131.8	49%	0.492	65%	0.647	S	S	.	*	H	α-helix	trans	-58.6	-44.6	167.9	-68	163.6	0	0	0	110.5	A77 R83 S84 L85	A77-I81 WeakPolarHBondContact O-CB 3.43Å; A77-I81 VanDerWaalsContact O-CG1 3.27Å; A77-I81 WeakPolarHBondContact O-CG1 3.45Å; A77-I81 PolarHBondContact O-N 3.06Å; I81-R83 PolarHBondContact O-N 2.98Å; I81-S84 PolarHBondContact O-N 2.78Å; I81-L85 HydrophobicContact CG2-CD1 3.91Å; I81-L85 WeakPolarHBondContact O-CG 3.49Å; I81-L85 PolarHBondContact O-N 3.08Å; I81-L85 VanDerWaalsContact O-N 3.11Å
82	R	42.8	Very low	38.3	Very low	200 Å²	200	127.4 Å²	127.4	76%	0.755	64%	0.641	S	S	*	*	H	α-helix	trans	-59.1	-42	173.3	-83.8	-177.7	174.8	178.2	-1.2	112.6	L78 E80 L85 M86	L78-R82 WeakPolarHBondContact O-CB 3.35Å; L78-R82 WeakPolarHBondContact O-CG 3.29Å; L78-R82 PolarHBondContact O-N 3.1Å; L78-R82 VanDerWaalsContact O-N 3.1Å; E80-R82 VanDerWaalsContact C-N 3.33Å; E80-R82 PolarHBondContact O-N 2.8Å; R82-L85 PolarHBondContact O-N 2.84Å; R82-M86 VanDerWaalsContact O-CG 3.3Å; R82-M86 WeakPolarHBondContact O-CG 3.48Å; R82-M86 PolarHBondContact O-N 3.15Å
83	R	40.2	Very low	38.5	Very low	198 Å²	198	125 Å²	125	75%	0.747	64%	0.64	S	S	*	*	H	α-helix	trans	-61.5	-44.2	173.2	-86.6	-176.4	171.4	171.9	-4	112.2	R79 E80 I81 L85 M86	R79-R83 PolarHBondContact O-N 2.93Å; E80-R83 WeakPolarHBondContact O-CB 3.5Å; E80-R83 PolarHBondContact O-N 3.19Å; E80-R83 VanDerWaalsContact O-N 3.14Å; I81-R83 PolarHBondContact O-N 2.98Å; R83-L85 PolarHBondContact O-N 2.81Å; R83-M86 WeakPolarHBondContact O-CB 3.21Å; R83-M86 PolarHBondContact O-N 2.87Å
84	S	36.1	Very low	39.2	Very low	85 Å²	85	127.6 Å²	127.6	59%	0.594	65%	0.647	S	S	*	*	H	α-helix	trans	-67.3	-19.2	-178.3	-165.7	0	0	0	0	114	E80 I81	E80-S84 PolarHBondContact O-N 3.37Å; I81-S84 PolarHBondContact O-N 2.78Å
85	L	34.3	Very low	40.5	Very low	99 Å²	99	119.7 Å²	119.7	52%	0.518	62%	0.619	S	S	.	*	H	α-helix	trans	-95.9	-10.6	178	-67.2	170.8	0	0	0	113.6	I81 R82 R83 P87 F88 A89	I81-L85 HydrophobicContact CG2-CD1 3.91Å; I81-L85 WeakPolarHBondContact O-CG 3.49Å; I81-L85 PolarHBondContact O-N 3.08Å; I81-L85 VanDerWaalsContact O-N 3.11Å; R82-L85 PolarHBondContact O-N 2.84Å; R83-L85 PolarHBondContact O-N 2.81Å; L85-P87 VanDerWaalsContact C-N 3.32Å; L85-F88 PolarHBondContact O-N 2.87Å; L85-A89 PolarHBondContact O-N 3.23Å
86	M	35.8	Very low	42	Very low	145 Å²	145	117.5 Å²	117.5	71%	0.714	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-56.6	-33.2	177.4	-67.9	-95.2	-76.8	0	0	114.6	R82 R83 F88	R82-M86 VanDerWaalsContact O-CG 3.3Å; R82-M86 WeakPolarHBondContact O-CG 3.48Å; R82-M86 PolarHBondContact O-N 3.15Å; R83-M86 WeakPolarHBondContact O-CB 3.21Å; R83-M86 PolarHBondContact O-N 2.87Å; M86-F88 PolarHBondContact O-N 3.23Å
87	P	36.4	Very low	43.8	Very low	102 Å²	102	125 Å²	125	66%	0.662	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-68.1	-16.3	174.8	-21.6	34.7	0	0	0	114.8	L85	L85-P87 VanDerWaalsContact C-N 3.32Å
88	F	33.5	Very low	45.5	Very low	176 Å²	176	129.2 Å²	129.2	77%	0.772	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-114.8	5.5	-174	-60.4	-76.3	0	0	0	113.3	L85 M86	L85-F88 PolarHBondContact O-N 2.87Å; M86-F88 PolarHBondContact O-N 3.23Å
89	A	39.3	Very low	47	Very low	70 Å²	70	125.4 Å²	125.4	58%	0.579	62%	0.622	S	S	*	*			trans	-108.3	69.2	-174.8	0	0	0	0	0	111.5	L85	L85-A89 PolarHBondContact O-N 3.23Å
90	N	34.2	Very low	48.7	Very low	148 Å²	148	119.5 Å²	119.5	79%	0.791	60%	0.601	S	S	*	*			trans	-161.1	93.2	173.5	-128.2	6.7	0	0	0	113.5
91	E	35.2	Very low	50.3	Low	204 Å²	204	117.9 Å²	117.9	95%	0.953	59%	0.594	S	S	*	*	S	Bend	trans	-155.5	59.5	156.4	-88	-125.1	134.7	0	0	110.4
92	S	38.6	Very low	51.8	Low	113 Å²	113	117.5 Å²	117.5	79%	0.79	59%	0.59	S	S	*	*			trans	-159.4	57.9	167.2	66.3	0	0	0	0	111	E94	S92-E94 PolarHBondContact O-N 3.24Å
93	G	41.3	Very low	53.2	Low	48 Å²	48	108 Å²	108	50%	0.495	56%	0.555	S	S	.	*			trans	-82.7	88.4	-172.6	0	0	0	0	0	114.2	K118	G93-K118 WeakPolarHBondContact O-CE 3.31Å
94	E	54.3	Low	55	Low	195 Å²	195	100.4 Å²	100.4	91%	0.911	53%	0.53	S	S	*	.			trans	-68.9	146.9	155.9	-71.1	-157.5	124.5	0	0	110.6	S92	S92-E94 PolarHBondContact O-N 3.24Å
95	V	61.9	Low	56.8	Low	30 Å²	30	102 Å²	102	18%	0.182	53%	0.532	C	S	.	.			trans	-106.3	138.5	-173.2	-167	0	0	0	0	109	R97 V114 L117 K118	V95-R97 PolarHBondContact O-N 2.9Å; V95-V114 HydrophobicContact CG2-CG1 4.44Å; V95-L117 HydrophobicContact CG1-CB 3.39Å; V95-L117 HydrophobicContact CG1-CD1 3.88Å; V95-L117 HydrophobicContact CG1-CG 4.3Å; V95-K118 HydrophobicContact CG2-CD 4.15Å; V95-K118 VanDerWaalsContact CG2-CE 3.42Å; V95-K118 HydrophobicContact CG2-CG 3.66Å
96	N	72.5	Confident	58.3	Low	72 Å²	72	99.2 Å²	99.2	39%	0.385	52%	0.523	S	S	.	.			trans	-63.5	103.4	177.9	-175.1	-16	0	0	0	110.5	Q98 M99 L100 S122	N96-Q98 PolarHBondContact O-N 2.87Å; N96-Q98 PolarHBondContact OD1-N 2.68Å; N96-Q98 VanDerWaalsContact OD1-N 3.1Å; N96-M99 HydrophobicContact CB-CB 4.28Å; N96-M99 HydrophobicContact CB-CG 4.2Å; N96-M99 HydrophobicContact CB-SD 3.84Å; N96-M99 PolarHBondContact ND2-SD 3.39Å; N96-M99 PolarHBondContact O-N 2.89Å; N96-L100 WeakPolarHBondContact O-CB 3.33Å; N96-L100 PolarHBondContact O-N 2.82Å; N96-S122 PolarHBondContact N-OG 3.21Å
97	R	74.8	Confident	59.5	Low	218 Å²	218	94.6 Å²	94.6	82%	0.823	51%	0.512	S	S	*	.	H	α-helix	trans	-56.5	-33.2	-177	-81.3	-176.3	171.6	-116.2	3.1	113.4	V95 Q101	V95-R97 PolarHBondContact O-N 2.9Å; R97-Q101 WeakPolarHBondContact O-CB 3.23Å; R97-Q101 PolarHBondContact O-N 3.49Å
98	Q	73.8	Confident	60.9	Low	132 Å²	132	90.6 Å²	90.6	62%	0.617	49%	0.486	S	S	*	.	H	α-helix	trans	-72.4	-48.2	-178.9	-177.4	169.6	-10.4	0	0	111.1	N96 L100 Q101 E102	N96-Q98 PolarHBondContact O-N 2.87Å; N96-Q98 PolarHBondContact OD1-N 2.68Å; N96-Q98 VanDerWaalsContact OD1-N 3.1Å; Q98-L100 PolarHBondContact O-N 2.83Å; Q98-Q101 PolarHBondContact O-N 3.3Å; Q98-Q101 VanDerWaalsContact O-N 3.16Å; Q98-E102 VanDerWaalsContact CG-OE1 3.26Å; Q98-E102 WeakPolarHBondContact CG-OE1 3.28Å; Q98-E102 PolarHBondContact NE2-OE1 2.83Å; Q98-E102 VanDerWaalsContact NE2-OE1 3.09Å; Q98-E102 WeakPolarHBondContact O-CG 3.37Å; Q98-E102 PolarHBondContact O-N 2.89Å
99	M	73.1	Confident	63	Low	23 Å²	23	86.2 Å²	86.2	11%	0.113	47%	0.471	C	S	.	.	H	α-helix	trans	-62	-35.1	174.4	-62.9	169.4	74.2	0	0	112	N96 E102 L103 L117 S122 I125	N96-M99 HydrophobicContact CB-CB 4.28Å; N96-M99 HydrophobicContact CB-CG 4.2Å; N96-M99 HydrophobicContact CB-SD 3.84Å; N96-M99 PolarHBondContact ND2-SD 3.39Å; N96-M99 PolarHBondContact O-N 2.89Å; M99-E102 PolarHBondContact O-N 3.46Å; M99-L103 WeakPolarHBondContact O-CG 3.1Å; M99-L103 PolarHBondContact O-N 3.37Å; M99-L117 HydrophobicContact CB-CD1 4.04Å; M99-L117 HydrophobicContact CB-CD2 3.99Å; M99-L117 HydrophobicContact CE-CD2 3.77Å; M99-L117 HydrophobicContact SD-CD2 4.41Å; M99-S122 VanDerWaalsContact SD-O 3.35Å; M99-I125 HydrophobicContact CB-CD1 4.21Å; M99-I125 HydrophobicContact CB-CG1 3.96Å; M99-I125 HydrophobicContact CE-CG1 3.88Å; M99-I125 HydrophobicContact CG-CD1 4.26Å; M99-I125 HydrophobicContact CG-CG1 4.07Å
100	L	78.5	Confident	64.7	Low	21 Å²	21	87 Å²	87	11%	0.11	46%	0.463	C	S	.	.	H	α-helix	trans	-64.3	-44.5	175	178.6	56.8	0	0	0	111.4	N96 Q98 E102 L103 V104 A113 V114 L117	N96-L100 WeakPolarHBondContact O-CB 3.33Å; N96-L100 PolarHBondContact O-N 2.82Å; Q98-L100 PolarHBondContact O-N 2.83Å; L100-E102 VanDerWaalsContact C-N 3.34Å; L100-L103 PolarHBondContact O-N 3.16Å; L100-V104 HydrophobicContact CD1-CG2 4.31Å; L100-V104 WeakPolarHBondContact O-CB 3.42Å; L100-V104 VanDerWaalsContact O-CG2 3.25Å; L100-V104 WeakPolarHBondContact O-CG2 3.19Å; L100-V104 PolarHBondContact O-N 3.15Å; L100-V104 VanDerWaalsContact O-N 3.08Å; L100-A113 HydrophobicContact CD1-CB 3.57Å; L100-V114 HydrophobicContact CD1-CG2 3.75Å; L100-V114 HydrophobicContact CD2-CG2 3.63Å; L100-V114 HydrophobicContact CG-CG2 4.36Å; L100-L117 HydrophobicContact CB-CD1 3.73Å; L100-L117 HydrophobicContact CD1-CD1 4.26Å
101	Q	76.1	Confident	66.5	Low	101 Å²	101	85.3 Å²	85.3	47%	0.472	45%	0.45	S	S	.	.	H	α-helix	trans	-64.7	-38.5	175.4	-166.2	65.5	63.2	0	0	111.8	R97 Q98 V104 N105	R97-Q101 WeakPolarHBondContact O-CB 3.23Å; R97-Q101 PolarHBondContact O-N 3.49Å; Q98-Q101 PolarHBondContact O-N 3.3Å; Q98-Q101 VanDerWaalsContact O-N 3.16Å; Q101-V104 PolarHBondContact O-N 3.26Å; Q101-N105 PolarHBondContact NE2-OD1 2.86Å; Q101-N105 VanDerWaalsContact O-CB 3.24Å; Q101-N105 WeakPolarHBondContact O-CB 3.34Å; Q101-N105 PolarHBondContact O-N 2.94Å; Q101-N105 PolarHBondContact O-OD1 2.92Å
102	E	74.9	Confident	68.1	Low	88 Å²	88	78.9 Å²	78.9	41%	0.411	42%	0.421	S	S	.	.	H	α-helix	trans	-67.5	-40.9	178.4	-73.3	168.6	-157	0	0	112.3	Q98 M99 L100 A106 I125	Q98-E102 VanDerWaalsContact CG-OE1 3.26Å; Q98-E102 WeakPolarHBondContact CG-OE1 3.28Å; Q98-E102 PolarHBondContact NE2-OE1 2.83Å; Q98-E102 VanDerWaalsContact NE2-OE1 3.09Å; Q98-E102 WeakPolarHBondContact O-CG 3.37Å; Q98-E102 PolarHBondContact O-N 2.89Å; M99-E102 PolarHBondContact O-N 3.46Å; L100-E102 VanDerWaalsContact C-N 3.34Å; E102-A106 WeakPolarHBondContact O-CB 3.44Å; E102-A106 PolarHBondContact O-N 2.81Å; E102-I125 HydrophobicContact CB-CD1 3.73Å; E102-I125 WeakPolarHBondContact OE2-CD1 3.48Å
103	L	73.4	Confident	69.8	Low	1 Å²	1	73.5 Å²	73.5	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-63.2	-40.9	172.4	-71.2	174.5	0	0	0	112.6	M99 L100 A106 G107 C108 A113 L117 I125 A128 L129 I132	M99-L103 WeakPolarHBondContact O-CG 3.1Å; M99-L103 PolarHBondContact O-N 3.37Å; L100-L103 PolarHBondContact O-N 3.16Å; L103-A106 CarbonylContact O-C 3.43Å; L103-A106 WeakPolarHBondContact O-CB 3.4Å; L103-A106 PolarHBondContact O-N 3.16Å; L103-G107 PolarHBondContact O-N 2.86Å; L103-C108 HydrophobicContact CB-CB 4.37Å; L103-C108 VanDerWaalsContact O-CB 3.3Å; L103-C108 WeakPolarHBondContact O-CB 3.19Å; L103-C108 PolarHBondContact O-N 3.16Å; L103-A113 HydrophobicContact CB-CB 3.87Å; L103-A113 HydrophobicContact CD1-CB 3.87Å; L103-L117 HydrophobicContact CD1-CD1 3.75Å; L103-L117 HydrophobicContact CD1-CD2 4.08Å; L103-L117 HydrophobicContact CD1-CG 3.73Å; L103-I125 HydrophobicContact CD2-CG2 4.02Å; L103-A128 HydrophobicContact CD1-CB 3.86Å; L103-L129 HydrophobicContact CD2-CD1 4.4Å; L103-L129 HydrophobicContact CD2-CD2 3.52Å; L103-L129 HydrophobicContact CD2-CG 3.6Å; L103-I132 HydrophobicContact CD1-CD1 4.42Å; L103-I132 HydrophobicContact CD2-CD1 4.48Å
104	V	77.2	Confident	71.6	Confident	37 Å²	37	73.2 Å²	73.2	22%	0.224	37%	0.372	C	S	.	.	H	α-helix	trans	-72	-39.1	179.8	170.5	0	0	0	0	111.6	L100 Q101 A106 G107 Q110 A113	L100-V104 HydrophobicContact CD1-CG2 4.31Å; L100-V104 WeakPolarHBondContact O-CB 3.42Å; L100-V104 VanDerWaalsContact O-CG2 3.25Å; L100-V104 WeakPolarHBondContact O-CG2 3.19Å; L100-V104 PolarHBondContact O-N 3.15Å; L100-V104 VanDerWaalsContact O-N 3.08Å; Q101-V104 PolarHBondContact O-N 3.26Å; V104-A106 PolarHBondContact O-N 2.95Å; V104-G107 PolarHBondContact O-N 2.91Å; V104-Q110 HydrophobicContact CG2-CB 4.21Å; V104-A113 HydrophobicContact CG2-CB 4.36Å
105	N	74.3	Confident	72.5	Confident	120 Å²	120	70.4 Å²	70.4	64%	0.642	35%	0.353	S	S	*	.	H	α-helix	trans	-65.5	-26.9	171.6	-68.4	0.9	0	0	0	112	Q101 G107	Q101-N105 PolarHBondContact NE2-OD1 2.86Å; Q101-N105 VanDerWaalsContact O-CB 3.24Å; Q101-N105 WeakPolarHBondContact O-CB 3.34Å; Q101-N105 PolarHBondContact O-N 2.94Å; Q101-N105 PolarHBondContact O-OD1 2.92Å; N105-G107 PolarHBondContact O-N 3.2Å
106	A	65.9	Low	73.1	Confident	39 Å²	39	69 Å²	69	32%	0.322	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	7.5	169.5	0	0	0	0	0	113.7	E102 L103 V104 I149	E102-A106 WeakPolarHBondContact O-CB 3.44Å; E102-A106 PolarHBondContact O-N 2.81Å; L103-A106 CarbonylContact O-C 3.43Å; L103-A106 WeakPolarHBondContact O-CB 3.4Å; L103-A106 PolarHBondContact O-N 3.16Å; V104-A106 PolarHBondContact O-N 2.95Å; A106-I149 WeakPolarHBondContact O-CD1 3.48Å
107	G	59.3	Low	73.4	Confident	48 Å²	48	65.6 Å²	65.6	50%	0.495	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	13.5	174.4	0	0	0	0	0	115.6	L103 V104 N105	L103-G107 PolarHBondContact O-N 2.86Å; V104-G107 PolarHBondContact O-N 2.91Å; N105-G107 PolarHBondContact O-N 3.2Å
108	C	65.8	Low	73.5	Confident	18 Å²	18	60.6 Å²	60.6	12%	0.122	31%	0.31	C	S	.	.			trans	-79.2	142.9	168.4	-60.8	0	0	0	0	110.5	L103 I132	L103-C108 HydrophobicContact CB-CB 4.37Å; L103-C108 VanDerWaalsContact O-CB 3.3Å; L103-C108 WeakPolarHBondContact O-CB 3.19Å; L103-C108 PolarHBondContact O-N 3.16Å; C108-I132 HydrophobicContact CB-CD1 4.1Å
109	D	79	Confident	73.3	Confident	84 Å²	84	60.7 Å²	60.7	45%	0.449	31%	0.311	S	S	.	.			trans	-57.4	141.3	175.5	168.1	-106.3	0	0	0	112.3	E111 M112 A113	D109-E111 PolarHBondContact O-N 3.14Å; D109-E111 WeakPolarHBondContact OD1-CA 3.16Å; D109-E111 WeakPolarHBondContact OD1-CB 3.2Å; D109-E111 PolarHBondContact OD1-N 2.74Å; D109-M112 HydrophobicContact CB-CB 3.92Å; D109-M112 HydrophobicContact CB-CE 4.5Å; D109-M112 PolarHBondContact O-N 2.97Å; D109-M112 PolarHBondContact OD1-N 2.93Å; D109-A113 VanDerWaalsContact O-CB 3.25Å; D109-A113 WeakPolarHBondContact O-CB 3.31Å; D109-A113 PolarHBondContact O-N 3.34Å
110	Q	75.1	Confident	73.3	Confident	88 Å²	88	60.9 Å²	60.9	41%	0.411	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-41.7	-175.9	-177.9	77.2	62.4	0	0	112.3	V104 V114	V104-Q110 HydrophobicContact CG2-CB 4.21Å; Q110-V114 VanDerWaalsContact O-CG2 3.31Å; Q110-V114 WeakPolarHBondContact O-CG2 3.16Å; Q110-V114 PolarHBondContact O-N 2.68Å; Q110-V114 VanDerWaalsContact O-N 3.07Å
111	E	71.9	Confident	73.1	Confident	112 Å²	112	62 Å²	62	52%	0.523	33%	0.329	S	S	.	.	H	α-helix	trans	-76.7	-37	177.6	-59.1	-159.9	160	0	0	112.1	D109 A113 V114 R115	D109-E111 PolarHBondContact O-N 3.14Å; D109-E111 WeakPolarHBondContact OD1-CA 3.16Å; D109-E111 WeakPolarHBondContact OD1-CB 3.2Å; D109-E111 PolarHBondContact OD1-N 2.74Å; E111-A113 VanDerWaalsContact C-N 3.33Å; E111-V114 WeakPolarHBondContact O-CB 3.4Å; E111-V114 PolarHBondContact O-N 2.85Å; E111-R115 WeakPolarHBondContact O-CG 3.36Å; E111-R115 PolarHBondContact O-N 2.7Å; E111-R115 IonicContact OE2-CZ 3.81Å; E111-R115 IonicContact OE2-NH1 2.66Å; E111-R115 PolarHBondContact OE2-NH1 3.46Å; E111-R115 IonicContact OE2-NH2 3.47Å; E111-R115 PolarHBondContact OE2-NH2 3.11Å
112	M	67.8	Low	72.9	Confident	69 Å²	69	58.4 Å²	58.4	34%	0.34	32%	0.316	S	S	.	.	H	α-helix	trans	-64.4	-40.3	177.5	-156.6	-177.1	-57.5	0	0	110.9	D109 R115 A116 I132	D109-M112 HydrophobicContact CB-CB 3.92Å; D109-M112 HydrophobicContact CB-CE 4.5Å; D109-M112 PolarHBondContact O-N 2.97Å; D109-M112 PolarHBondContact OD1-N 2.93Å; M112-R115 PolarHBondContact O-N 3.4Å; M112-A116 VanDerWaalsContact O-CB 3.26Å; M112-A116 WeakPolarHBondContact O-CB 3.4Å; M112-A116 PolarHBondContact O-N 3.39Å; M112-I132 HydrophobicContact CG-CG1 4.27Å; M112-I132 HydrophobicContact SD-CG2 3.92Å
113	A	74.9	Confident	72.4	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.7	-41.8	170.8	0	0	0	0	0	112.4	L100 L103 V104 D109 E111 A116 L117	L100-A113 HydrophobicContact CD1-CB 3.57Å; L103-A113 HydrophobicContact CB-CB 3.87Å; L103-A113 HydrophobicContact CD1-CB 3.87Å; V104-A113 HydrophobicContact CG2-CB 4.36Å; D109-A113 VanDerWaalsContact O-CB 3.25Å; D109-A113 WeakPolarHBondContact O-CB 3.31Å; D109-A113 PolarHBondContact O-N 3.34Å; E111-A113 VanDerWaalsContact C-N 3.33Å; A113-A116 PolarHBondContact O-N 3.13Å; A113-L117 VanDerWaalsContact O-CB 3.29Å; A113-L117 WeakPolarHBondContact O-CB 3.32Å; A113-L117 WeakPolarHBondContact O-CG 3.36Å; A113-L117 PolarHBondContact O-N 3.34Å
114	V	78.6	Confident	72.5	Confident	41 Å²	41	67.7 Å²	67.7	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-59	-46.8	171.5	161.3	0	0	0	0	111.6	V95 L100 Q110 E111 K118	V95-V114 HydrophobicContact CG2-CG1 4.44Å; L100-V114 HydrophobicContact CD1-CG2 3.75Å; L100-V114 HydrophobicContact CD2-CG2 3.63Å; L100-V114 HydrophobicContact CG-CG2 4.36Å; Q110-V114 VanDerWaalsContact O-CG2 3.31Å; Q110-V114 WeakPolarHBondContact O-CG2 3.16Å; Q110-V114 PolarHBondContact O-N 2.68Å; Q110-V114 VanDerWaalsContact O-N 3.07Å; E111-V114 WeakPolarHBondContact O-CB 3.4Å; E111-V114 PolarHBondContact O-N 2.85Å; V114-K118 HydrophobicContact CG1-CD 4.37Å; V114-K118 WeakPolarHBondContact O-CB 3.28Å; V114-K118 WeakPolarHBondContact O-CG 3.48Å; V114-K118 PolarHBondContact O-N 3.27Å
115	R	73.5	Confident	72.1	Confident	137 Å²	137	67.8 Å²	67.8	52%	0.517	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-46.4	178.5	-71.5	179.7	-174.3	97.8	8.1	111.1	E111 M112 L117 K118 Q119	E111-R115 WeakPolarHBondContact O-CG 3.36Å; E111-R115 PolarHBondContact O-N 2.7Å; E111-R115 IonicContact OE2-CZ 3.81Å; E111-R115 IonicContact OE2-NH1 2.66Å; E111-R115 PolarHBondContact OE2-NH1 3.46Å; E111-R115 IonicContact OE2-NH2 3.47Å; E111-R115 PolarHBondContact OE2-NH2 3.11Å; M112-R115 PolarHBondContact O-N 3.4Å; R115-L117 PolarHBondContact O-N 3.49Å; R115-K118 PolarHBondContact O-N 3.04Å; R115-Q119 PolarHBondContact O-N 3Å
116	A	74.6	Confident	72.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-44	178.1	0	0	0	0	0	112.6	M112 A113 K118 Q119 T120 A128 Y131 I132	M112-A116 VanDerWaalsContact O-CB 3.26Å; M112-A116 WeakPolarHBondContact O-CB 3.4Å; M112-A116 PolarHBondContact O-N 3.39Å; A113-A116 PolarHBondContact O-N 3.13Å; A116-K118 VanDerWaalsContact C-N 3.34Å; A116-Q119 PolarHBondContact O-N 2.93Å; A116-T120 WeakPolarHBondContact O-CB 3.25Å; A116-T120 WeakPolarHBondContact O-CG2 3.3Å; A116-T120 PolarHBondContact O-N 3.49Å; A116-T120 PolarHBondContact O-OG1 2.96Å; A116-A128 HydrophobicContact CB-CB 4.17Å; A116-Y131 HydrophobicContact CB-CD1 3.63Å; A116-Y131 HydrophobicContact CB-CE1 4.36Å; A116-Y131 HydrophobicContact CB-CG 4.34Å; A116-I132 HydrophobicContact CB-CD1 4Å; A116-I132 HydrophobicContact CB-CG1 3.7Å
117	L	79.2	Confident	72.5	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-72.4	-23.6	177	-71.7	172.7	0	0	0	113.3	V95 M99 L100 L103 A113 R115 G121 S122 A128	V95-L117 HydrophobicContact CG1-CB 3.39Å; V95-L117 HydrophobicContact CG1-CD1 3.88Å; V95-L117 HydrophobicContact CG1-CG 4.3Å; M99-L117 HydrophobicContact CB-CD1 4.04Å; M99-L117 HydrophobicContact CB-CD2 3.99Å; M99-L117 HydrophobicContact CE-CD2 3.77Å; M99-L117 HydrophobicContact SD-CD2 4.41Å; L100-L117 HydrophobicContact CB-CD1 3.73Å; L100-L117 HydrophobicContact CD1-CD1 4.26Å; L103-L117 HydrophobicContact CD1-CD1 3.75Å; L103-L117 HydrophobicContact CD1-CD2 4.08Å; L103-L117 HydrophobicContact CD1-CG 3.73Å; A113-L117 VanDerWaalsContact O-CB 3.29Å; A113-L117 WeakPolarHBondContact O-CB 3.32Å; A113-L117 WeakPolarHBondContact O-CG 3.36Å; A113-L117 PolarHBondContact O-N 3.34Å; R115-L117 PolarHBondContact O-N 3.49Å; L117-G121 CarbonylContact O-C 3.55Å; L117-G121 PolarHBondContact O-N 2.99Å; L117-S122 PolarHBondContact O-N 3.36Å; L117-S122 PolarHBondContact O-OG 3.01Å; L117-A128 HydrophobicContact CD2-CB 3.84Å; L117-A128 HydrophobicContact CG-CB 4.29Å
118	K	76.1	Confident	73.3	Confident	114 Å²	114	66.2 Å²	66.2	50%	0.496	33%	0.326	S	S	.	.	H	α-helix	trans	-71.8	-51.6	166.6	-76.9	-175.4	175.7	-170.2	0	111.4	G93 V95 V114 R115 A116 T120 G121	G93-K118 WeakPolarHBondContact O-CE 3.31Å; V95-K118 HydrophobicContact CG2-CD 4.15Å; V95-K118 VanDerWaalsContact CG2-CE 3.42Å; V95-K118 HydrophobicContact CG2-CG 3.66Å; V114-K118 HydrophobicContact CG1-CD 4.37Å; V114-K118 WeakPolarHBondContact O-CB 3.28Å; V114-K118 WeakPolarHBondContact O-CG 3.48Å; V114-K118 PolarHBondContact O-N 3.27Å; R115-K118 PolarHBondContact O-N 3.04Å; A116-K118 VanDerWaalsContact C-N 3.34Å; K118-T120 PolarHBondContact O-N 3.26Å; K118-G121 PolarHBondContact O-N 2.79Å
119	Q	69.5	Low	73.5	Confident	133 Å²	133	67.9 Å²	67.9	62%	0.621	33%	0.333	S	S	*	.	H	α-helix	trans	-67.2	-35.1	-176.4	-125.6	72.1	-1.5	0	0	113.6	R115 A116 G121 Y131	R115-Q119 PolarHBondContact O-N 3Å; A116-Q119 PolarHBondContact O-N 2.93Å; Q119-G121 VanDerWaalsContact C-N 3.27Å; Q119-Y131 HydrophobicContact CB-CD2 4.35Å; Q119-Y131 HydrophobicContact CB-CE1 4.3Å; Q119-Y131 HydrophobicContact CB-CE2 3.71Å; Q119-Y131 HydrophobicContact CG-CE2 3.87Å; Q119-Y131 WeakPolarHBondContact CG-OH 3.48Å
120	T	73.1	Confident	73.2	Confident	27 Å²	27	68.9 Å²	68.9	17%	0.166	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.7	173.5	60.8	0	0	0	0	113.4	A116 K118 S122 R123 A127 Y131	A116-T120 WeakPolarHBondContact O-CB 3.25Å; A116-T120 WeakPolarHBondContact O-CG2 3.3Å; A116-T120 PolarHBondContact O-N 3.49Å; A116-T120 PolarHBondContact O-OG1 2.96Å; K118-T120 PolarHBondContact O-N 3.26Å; T120-S122 VanDerWaalsContact C-N 3.26Å; T120-S122 PolarHBondContact O-N 2.88Å; T120-R123 WeakPolarHBondContact O-CG 3.27Å; T120-A127 HydrophobicContact CG2-CB 4.3Å; T120-Y131 HydrophobicContact CG2-CD2 4.5Å; T120-Y131 HydrophobicContact CG2-CG 4.42Å
121	G	74.3	Confident	73	Confident	44 Å²	44	68.1 Å²	68.1	45%	0.454	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	28	-176.8	0	0	0	0	0	114.2	L117 K118 Q119 R123	L117-G121 CarbonylContact O-C 3.55Å; L117-G121 PolarHBondContact O-N 2.99Å; K118-G121 PolarHBondContact O-N 2.79Å; Q119-G121 VanDerWaalsContact C-N 3.27Å; G121-R123 VanDerWaalsContact C-N 3.27Å; G121-R123 WeakPolarHBondContact O-CG 3.47Å; G121-R123 PolarHBondContact O-N 3.44Å
122	S	72.6	Confident	73	Confident	26 Å²	26	63.6 Å²	63.6	18%	0.182	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	36.8	-179.2	-60.4	0	0	0	0	113.9	N96 M99 L117 T120	N96-S122 PolarHBondContact N-OG 3.21Å; M99-S122 VanDerWaalsContact SD-O 3.35Å; L117-S122 PolarHBondContact O-N 3.36Å; L117-S122 PolarHBondContact O-OG 3.01Å; T120-S122 VanDerWaalsContact C-N 3.26Å; T120-S122 PolarHBondContact O-N 2.88Å
123	R	65.3	Low	72.8	Confident	218 Å²	218	62.9 Å²	62.9	82%	0.823	31%	0.311	S	S	*	.			trans	-88.5	-32.1	-171.8	-65.6	178.6	-176.4	172.5	3.7	115.2	T120 G121	T120-R123 WeakPolarHBondContact O-CG 3.27Å; G121-R123 VanDerWaalsContact C-N 3.27Å; G121-R123 WeakPolarHBondContact O-CG 3.47Å; G121-R123 PolarHBondContact O-N 3.44Å
124	N	75.4	Confident	72.3	Confident	67 Å²	67	69.6 Å²	69.6	36%	0.358	34%	0.34	S	S	.	.			trans	-156.9	143.3	174.4	-174.1	1.4	0	0	0	109.5	E126 A127 A128	N124-E126 VanDerWaalsContact C-N 3.34Å; N124-E126 PolarHBondContact ND2-OE2 3.44Å; N124-E126 PolarHBondContact OD1-N 3.45Å; N124-E126 VanDerWaalsContact OD1-N 3.12Å; N124-A127 HydrophobicContact CB-CB 4.17Å; N124-A128 PolarHBondContact O-N 2.91Å
125	I	68.3	Low	71.1	Confident	38 Å²	38	73.2 Å²	73.2	20%	0.195	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-40.3	172.3	-84.3	175.5	0	0	0	110.7	M99 E102 L103 A127 A128 L129	M99-I125 HydrophobicContact CB-CD1 4.21Å; M99-I125 HydrophobicContact CB-CG1 3.96Å; M99-I125 HydrophobicContact CE-CG1 3.88Å; M99-I125 HydrophobicContact CG-CD1 4.26Å; M99-I125 HydrophobicContact CG-CG1 4.07Å; E102-I125 HydrophobicContact CB-CD1 3.73Å; E102-I125 WeakPolarHBondContact OE2-CD1 3.48Å; L103-I125 HydrophobicContact CD2-CG2 4.02Å; I125-A127 VanDerWaalsContact C-N 3.3Å; I125-A127 PolarHBondContact O-N 2.92Å; I125-A128 CarbonylContact O-C 3.48Å; I125-A128 WeakPolarHBondContact O-CA 3.49Å; I125-A128 WeakPolarHBondContact O-CB 3.45Å; I125-A128 PolarHBondContact O-N 2.78Å; I125-L129 HydrophobicContact CG2-CD1 3.78Å; I125-L129 HydrophobicContact CG2-CG 4.21Å; I125-L129 WeakPolarHBondContact O-CG 3.43Å; I125-L129 PolarHBondContact O-N 3.17Å
126	E	73.6	Confident	70.1	Confident	138 Å²	138	68.3 Å²	68.3	65%	0.645	35%	0.348	S	S	*	.	H	α-helix	trans	-64.3	-37.9	-178.3	-57.8	166.9	127.2	0	0	111.2	N124 A128 L129 E130	N124-E126 VanDerWaalsContact C-N 3.34Å; N124-E126 PolarHBondContact ND2-OE2 3.44Å; N124-E126 PolarHBondContact OD1-N 3.45Å; N124-E126 VanDerWaalsContact OD1-N 3.12Å; E126-A128 VanDerWaalsContact C-N 3.35Å; E126-L129 PolarHBondContact O-N 3.37Å; E126-E130 VanDerWaalsContact O-CB 3.31Å; E126-E130 WeakPolarHBondContact O-CB 3.21Å; E126-E130 PolarHBondContact O-N 2.9Å
127	A	75.5	Confident	68.4	Low	36 Å²	36	77 Å²	77	30%	0.298	38%	0.382	S	S	.	.	H	α-helix	trans	-67.5	-34.3	173.5	0	0	0	0	0	112.2	T120 N124 I125 Y131	T120-A127 HydrophobicContact CG2-CB 4.3Å; N124-A127 HydrophobicContact CB-CB 4.17Å; I125-A127 VanDerWaalsContact C-N 3.3Å; I125-A127 PolarHBondContact O-N 2.92Å; A127-Y131 VanDerWaalsContact O-CB 3.3Å; A127-Y131 WeakPolarHBondContact O-CB 3.38Å; A127-Y131 PolarHBondContact O-N 2.85Å
128	A	74.4	Confident	66.5	Low	0 Å²	0	84.3 Å²	84.3	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-71	-39.8	173.7	0	0	0	0	0	111.9	L103 A116 L117 N124 I125 E126 Y131 I132	L103-A128 HydrophobicContact CD1-CB 3.86Å; A116-A128 HydrophobicContact CB-CB 4.17Å; L117-A128 HydrophobicContact CD2-CB 3.84Å; L117-A128 HydrophobicContact CG-CB 4.29Å; N124-A128 PolarHBondContact O-N 2.91Å; I125-A128 CarbonylContact O-C 3.48Å; I125-A128 WeakPolarHBondContact O-CA 3.49Å; I125-A128 WeakPolarHBondContact O-CB 3.45Å; I125-A128 PolarHBondContact O-N 2.78Å; E126-A128 VanDerWaalsContact C-N 3.35Å; A128-Y131 PolarHBondContact O-N 2.8Å; A128-I132 WeakPolarHBondContact O-CB 3.36Å; A128-I132 WeakPolarHBondContact O-CD1 3.15Å; A128-I132 WeakPolarHBondContact O-CG1 3.39Å; A128-I132 PolarHBondContact O-N 3.43Å
129	L	69.9	Low	64.9	Low	53 Å²	53	82.6 Å²	82.6	28%	0.277	42%	0.416	S	S	.	.	H	α-helix	trans	-65.8	-38.2	172.4	-72.7	172	0	0	0	112	L103 I125 E126 I132 S133	L103-L129 HydrophobicContact CD2-CD1 4.4Å; L103-L129 HydrophobicContact CD2-CD2 3.52Å; L103-L129 HydrophobicContact CD2-CG 3.6Å; I125-L129 HydrophobicContact CG2-CD1 3.78Å; I125-L129 HydrophobicContact CG2-CG 4.21Å; I125-L129 WeakPolarHBondContact O-CG 3.43Å; I125-L129 PolarHBondContact O-N 3.17Å; E126-L129 PolarHBondContact O-N 3.37Å; L129-I132 PolarHBondContact O-N 3.5Å; L129-S133 WeakPolarHBondContact O-CB 3.41Å; L129-S133 PolarHBondContact O-N 2.91Å
130	E	72.8	Confident	63.7	Low	106 Å²	106	81.7 Å²	81.7	50%	0.495	42%	0.422	S	S	.	.	H	α-helix	trans	-68.5	-37.4	174.4	-160.7	-164.9	-174	0	0	111.2	E126 S133 K134	E126-E130 VanDerWaalsContact O-CB 3.31Å; E126-E130 WeakPolarHBondContact O-CB 3.21Å; E126-E130 PolarHBondContact O-N 2.9Å; E130-S133 PolarHBondContact O-N 3.45Å; E130-K134 HydrophobicContact CG-CD 4.34Å; E130-K134 WeakPolarHBondContact O-CB 3.12Å; E130-K134 VanDerWaalsContact O-CG 3.27Å; E130-K134 WeakPolarHBondContact O-CG 3.37Å; E130-K134 PolarHBondContact O-N 3.12Å; E130-K134 VanDerWaalsContact OE1-CE 3.28Å; E130-K134 WeakPolarHBondContact OE1-CE 3.46Å; E130-K134 IonicContact OE1-NZ 3.65Å; E130-K134 PolarHBondContact OE1-NZ 3.1Å; E130-K134 IonicContact OE2-NZ 2.69Å; E130-K134 PolarHBondContact OE2-NZ 2.85Å
131	Y	71.9	Confident	62.3	Low	71 Å²	71	90 Å²	90	28%	0.278	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-47.7	171.8	-173.5	-84.7	0	0	0	111.4	A116 Q119 T120 A127 A128 S133 K134 M135	A116-Y131 HydrophobicContact CB-CD1 3.63Å; A116-Y131 HydrophobicContact CB-CE1 4.36Å; A116-Y131 HydrophobicContact CB-CG 4.34Å; Q119-Y131 HydrophobicContact CB-CD2 4.35Å; Q119-Y131 HydrophobicContact CB-CE1 4.3Å; Q119-Y131 HydrophobicContact CB-CE2 3.71Å; Q119-Y131 HydrophobicContact CG-CE2 3.87Å; Q119-Y131 WeakPolarHBondContact CG-OH 3.48Å; T120-Y131 HydrophobicContact CG2-CD2 4.5Å; T120-Y131 HydrophobicContact CG2-CG 4.42Å; A127-Y131 VanDerWaalsContact O-CB 3.3Å; A127-Y131 WeakPolarHBondContact O-CB 3.38Å; A127-Y131 PolarHBondContact O-N 2.85Å; A128-Y131 PolarHBondContact O-N 2.8Å; Y131-S133 VanDerWaalsContact C-N 3.32Å; Y131-S133 PolarHBondContact O-N 2.83Å; Y131-K134 PolarHBondContact O-N 3.39Å; Y131-K134 VanDerWaalsContact O-N 3.09Å; Y131-M135 HydrophobicContact CD1-CG 3.88Å; Y131-M135 HydrophobicContact CE1-CG 3.55Å; Y131-M135 HydrophobicContact CE1-SD 4.13Å; Y131-M135 VanDerWaalsContact O-CG 3.28Å; Y131-M135 WeakPolarHBondContact O-CG 3.38Å; Y131-M135 PolarHBondContact O-N 3.41Å
132	I	71.6	Confident	61.1	Low	17 Å²	17	91.2 Å²	91.2	9%	0.087	45%	0.447	C	S	.	.	H	α-helix	trans	-56.7	-46.4	173.4	-71.9	162.3	0	0	0	110.4	L103 C108 M112 A116 A128 L129 K134 M135 G136	L103-I132 HydrophobicContact CD1-CD1 4.42Å; L103-I132 HydrophobicContact CD2-CD1 4.48Å; C108-I132 HydrophobicContact CB-CD1 4.1Å; M112-I132 HydrophobicContact CG-CG1 4.27Å; M112-I132 HydrophobicContact SD-CG2 3.92Å; A116-I132 HydrophobicContact CB-CD1 4Å; A116-I132 HydrophobicContact CB-CG1 3.7Å; A128-I132 WeakPolarHBondContact O-CB 3.36Å; A128-I132 WeakPolarHBondContact O-CD1 3.15Å; A128-I132 WeakPolarHBondContact O-CG1 3.39Å; A128-I132 PolarHBondContact O-N 3.43Å; L129-I132 PolarHBondContact O-N 3.5Å; I132-K134 PolarHBondContact O-N 2.8Å; I132-M135 PolarHBondContact O-N 3.08Å; I132-G136 PolarHBondContact O-N 2.99Å
133	S	64	Low	59.9	Low	55 Å²	55	94.3 Å²	94.3	39%	0.385	46%	0.458	S	S	.	.	H	α-helix	trans	-66.7	-19.7	177.7	-173.2	0	0	0	0	114.1	L129 E130 Y131	L129-S133 WeakPolarHBondContact O-CB 3.41Å; L129-S133 PolarHBondContact O-N 2.91Å; E130-S133 PolarHBondContact O-N 3.45Å; Y131-S133 VanDerWaalsContact C-N 3.32Å; Y131-S133 PolarHBondContact O-N 2.83Å
134	K	63.5	Low	59	Low	141 Å²	141	89.3 Å²	89.3	61%	0.613	45%	0.447	S	S	*	.	H	α-helix	trans	-93.3	-20.7	174.2	-74.4	169.6	-176.4	169.7	0	113	E130 Y131 I132	E130-K134 HydrophobicContact CG-CD 4.34Å; E130-K134 WeakPolarHBondContact O-CB 3.12Å; E130-K134 VanDerWaalsContact O-CG 3.27Å; E130-K134 WeakPolarHBondContact O-CG 3.37Å; E130-K134 PolarHBondContact O-N 3.12Å; E130-K134 VanDerWaalsContact OE1-CE 3.28Å; E130-K134 WeakPolarHBondContact OE1-CE 3.46Å; E130-K134 IonicContact OE1-NZ 3.65Å; E130-K134 PolarHBondContact OE1-NZ 3.1Å; E130-K134 IonicContact OE2-NZ 2.69Å; E130-K134 PolarHBondContact OE2-NZ 2.85Å; Y131-K134 PolarHBondContact O-N 3.39Å; Y131-K134 VanDerWaalsContact O-N 3.09Å; I132-K134 PolarHBondContact O-N 2.8Å
135	M	54.3	Low	57.8	Low	116 Å²	116	89.4 Å²	89.4	57%	0.571	45%	0.447	S	S	*	.	H	α-helix	trans	-86.4	-8.2	170.4	-64.1	-68.1	-64.8	0	0	112.7	Y131 I132 Y137	Y131-M135 HydrophobicContact CD1-CG 3.88Å; Y131-M135 HydrophobicContact CE1-CG 3.55Å; Y131-M135 HydrophobicContact CE1-SD 4.13Å; Y131-M135 VanDerWaalsContact O-CG 3.28Å; Y131-M135 WeakPolarHBondContact O-CG 3.38Å; Y131-M135 PolarHBondContact O-N 3.41Å; I132-M135 PolarHBondContact O-N 3.08Å; M135-Y137 PolarHBondContact O-N 2.84Å
136	G	52.1	Low	56.9	Low	35 Å²	35	90 Å²	90	36%	0.361	45%	0.452	S	S	.	.			trans	-92.5	56.3	-167.4	0	0	0	0	0	117	I132	I132-G136 PolarHBondContact O-N 2.99Å
137	Y	39.5	Very low	55.6	Low	182 Å²	182	89 Å²	89	71%	0.714	44%	0.442	S	S	*	.			trans	-130.4	125	157.5	-75.1	-86.8	0	0	0	107	M135	M135-Y137 PolarHBondContact O-N 2.84Å
138	L	39.7	Very low	54.4	Low	154 Å²	154	91 Å²	91	81%	0.806	45%	0.451	S	S	*	.	S	Bend	cis	-130.2	110.3	25.9	-63.6	156.3	0	0	0	112.9
139	D	42.3	Very low	53.2	Low	78 Å²	78	93.2 Å²	93.2	42%	0.417	46%	0.462	S	S	.	.			trans	-156.7	117.2	152.7	-177	-10.3	0	0	0	109.9	R141 N142	D139-R141 PolarHBondContact O-N 2.73Å; D139-R141 VanDerWaalsContact O-N 3.12Å; D139-R141 WeakPolarHBondContact OD1-CB 3.26Å; D139-R141 PolarHBondContact OD1-N 2.62Å; D139-N142 PolarHBondContact O-N 3.5Å
140	P	44.2	Very low	52.1	Low	114 Å²	114	98 Å²	98	74%	0.74	48%	0.481	S	S	*	.	H	α-helix	trans	-55.6	-22	175.7	-26.8	36	0	0	0	115.9	N142	P140-N142 VanDerWaalsContact C-N 3.35Å
141	R	43.2	Very low	50.7	Low	200 Å²	200	100.1 Å²	100.1	76%	0.755	49%	0.491	S	S	*	.	H	α-helix	trans	-65.5	-35.6	176	-84.2	-177.9	161.5	175.2	-4.1	113.1	D139 L144	D139-R141 PolarHBondContact O-N 2.73Å; D139-R141 VanDerWaalsContact O-N 3.12Å; D139-R141 WeakPolarHBondContact OD1-CB 3.26Å; D139-R141 PolarHBondContact OD1-N 2.62Å; R141-L144 WeakPolarHBondContact O-CB 3.36Å; R141-L144 PolarHBondContact O-N 3.05Å
142	N	49.7	Very low	49.3	Very low	71 Å²	71	101.8 Å²	101.8	38%	0.38	51%	0.509	S	S	.	.	H	α-helix	trans	-75.1	-27.1	-173.7	-71	-30.8	0	0	0	112.9	D139 P140 L144 I145 V146	D139-N142 PolarHBondContact O-N 3.5Å; P140-N142 VanDerWaalsContact C-N 3.35Å; N142-L144 PolarHBondContact O-N 2.99Å; N142-I145 PolarHBondContact O-N 3.28Å; N142-V146 WeakPolarHBondContact O-CG2 3.35Å; N142-V146 PolarHBondContact O-N 2.93Å; N142-V146 VanDerWaalsContact O-N 3.15Å
143	E	47	Very low	47.7	Very low	90 Å²	90	104.8 Å²	104.8	42%	0.421	53%	0.531	S	S	.	.	H	α-helix	trans	-57.2	-40.6	168.2	-79.7	-148.9	148.8	0	0	111.8	I145 V146 R147	E143-I145 PolarHBondContact O-N 3.39Å; E143-V146 PolarHBondContact O-N 3.08Å; E143-R147 VanDerWaalsContact CD-NH2 3.29Å; E143-R147 WeakPolarHBondContact O-CB 3.4Å; E143-R147 PolarHBondContact O-N 3.1Å; E143-R147 IonicContact OE1-NH2 2.62Å; E143-R147 IonicContact OE2-CZ 3.45Å; E143-R147 IonicContact OE2-NH1 3.31Å; E143-R147 PolarHBondContact OE2-NH1 3.15Å; E143-R147 IonicContact OE2-NH2 2.85Å; E143-R147 PolarHBondContact OE2-NH2 3.34Å
144	L	47.1	Very low	46.3	Very low	113 Å²	113	108.6 Å²	108.6	59%	0.592	55%	0.554	S	S	*	*	H	α-helix	trans	-66.7	-40.1	-175.9	-148.6	75.7	0	0	0	111.2	R141 N142 R147 V148	R141-L144 WeakPolarHBondContact O-CB 3.36Å; R141-L144 PolarHBondContact O-N 3.05Å; N142-L144 PolarHBondContact O-N 2.99Å; L144-R147 PolarHBondContact O-N 3.01Å; L144-V148 WeakPolarHBondContact O-CB 3.33Å; L144-V148 VanDerWaalsContact O-CG2 3.3Å; L144-V148 WeakPolarHBondContact O-CG2 3.17Å; L144-V148 PolarHBondContact O-N 3.12Å
145	I	49	Very low	44.8	Very low	69 Å²	69	105.6 Å²	105.6	35%	0.354	56%	0.564	S	S	.	*	H	α-helix	trans	-63.9	-51.1	177	-63.6	172.2	0	0	0	110.4	N142 E143 R147 V148 I149	N142-I145 PolarHBondContact O-N 3.28Å; E143-I145 PolarHBondContact O-N 3.39Å; I145-R147 VanDerWaalsContact C-N 3.28Å; I145-R147 PolarHBondContact O-N 3.4Å; I145-V148 PolarHBondContact O-N 3.11Å; I145-I149 HydrophobicContact CG2-CD1 3.72Å; I145-I149 WeakPolarHBondContact O-CD1 3.38Å; I145-I149 VanDerWaalsContact O-CG1 3.3Å; I145-I149 WeakPolarHBondContact O-CG1 3.3Å; I145-I149 PolarHBondContact O-N 3.22Å
146	V	49.5	Very low	43.7	Very low	50 Å²	50	110.3 Å²	110.3	30%	0.303	58%	0.581	S	S	.	*	H	α-helix	trans	-62.4	-35.4	178	175.6	0	0	0	0	111.8	N142 E143 K150	N142-V146 WeakPolarHBondContact O-CG2 3.35Å; N142-V146 PolarHBondContact O-N 2.93Å; N142-V146 VanDerWaalsContact O-N 3.15Å; E143-V146 PolarHBondContact O-N 3.08Å; V146-K150 HydrophobicContact CG1-CD 4.39Å; V146-K150 WeakPolarHBondContact O-CB 3.3Å; V146-K150 WeakPolarHBondContact O-CG 3.31Å; V146-K150 PolarHBondContact O-N 2.83Å; V146-K150 VanDerWaalsContact O-N 3.17Å
147	R	47.1	Very low	42.6	Very low	117 Å²	117	113.8 Å²	113.8	44%	0.442	61%	0.606	S	S	.	*	H	α-helix	trans	-71.4	-37.2	178.2	-167.9	173	-68.7	139	3.8	112.1	E143 L144 I145 Q151	E143-R147 VanDerWaalsContact CD-NH2 3.29Å; E143-R147 WeakPolarHBondContact O-CB 3.4Å; E143-R147 PolarHBondContact O-N 3.1Å; E143-R147 IonicContact OE1-NH2 2.62Å; E143-R147 IonicContact OE2-CZ 3.45Å; E143-R147 IonicContact OE2-NH1 3.31Å; E143-R147 PolarHBondContact OE2-NH1 3.15Å; E143-R147 IonicContact OE2-NH2 2.85Å; E143-R147 PolarHBondContact OE2-NH2 3.34Å; L144-R147 PolarHBondContact O-N 3.01Å; I145-R147 VanDerWaalsContact C-N 3.28Å; I145-R147 PolarHBondContact O-N 3.4Å; R147-Q151 VanDerWaalsContact O-CG 3.3Å; R147-Q151 WeakPolarHBondContact O-CG 3.26Å; R147-Q151 PolarHBondContact O-N 3.19Å
148	V	50.4	Low	42.1	Very low	78 Å²	78	108.7 Å²	108.7	47%	0.473	61%	0.609	S	S	.	*	H	α-helix	trans	-68.4	-45	173.6	166.9	0	0	0	0	111.8	L144 I145 K150 Q151 T152	L144-V148 WeakPolarHBondContact O-CB 3.33Å; L144-V148 VanDerWaalsContact O-CG2 3.3Å; L144-V148 WeakPolarHBondContact O-CG2 3.17Å; L144-V148 PolarHBondContact O-N 3.12Å; I145-V148 PolarHBondContact O-N 3.11Å; V148-K150 VanDerWaalsContact C-N 3.3Å; V148-K150 PolarHBondContact O-N 2.79Å; V148-Q151 WeakPolarHBondContact O-CA 3.44Å; V148-Q151 WeakPolarHBondContact O-CB 3.45Å; V148-Q151 PolarHBondContact O-N 3.13Å; V148-T152 PolarHBondContact O-N 3.34Å; V148-T152 VanDerWaalsContact O-N 3.1Å; V148-T152 PolarHBondContact O-OG1 3.39Å
149	I	48.7	Very low	41.7	Very low	47 Å²	47	109.9 Å²	109.9	24%	0.241	61%	0.613	C	S	.	*	H	α-helix	trans	-63.3	-36.6	179.6	-64.5	161.2	0	0	0	111.5	A106 I145 Q151 T152 S153	A106-I149 WeakPolarHBondContact O-CD1 3.48Å; I145-I149 HydrophobicContact CG2-CD1 3.72Å; I145-I149 WeakPolarHBondContact O-CD1 3.38Å; I145-I149 VanDerWaalsContact O-CG1 3.3Å; I145-I149 WeakPolarHBondContact O-CG1 3.3Å; I145-I149 PolarHBondContact O-N 3.22Å; I149-Q151 VanDerWaalsContact C-N 3.25Å; I149-Q151 PolarHBondContact O-N 2.97Å; I149-T152 PolarHBondContact O-N 2.93Å; I149-T152 PolarHBondContact O-OG1 3.13Å; I149-S153 PolarHBondContact O-OG 2.99Å
150	K	45.9	Very low	42.3	Very low	155 Å²	155	110.9 Å²	110.9	67%	0.674	62%	0.624	S	S	*	*	H	α-helix	trans	-69.6	-18.7	172.3	-75.8	-179.3	176.4	178.5	0	113.7	V146 V148	V146-K150 HydrophobicContact CG1-CD 4.39Å; V146-K150 WeakPolarHBondContact O-CB 3.3Å; V146-K150 WeakPolarHBondContact O-CG 3.31Å; V146-K150 PolarHBondContact O-N 2.83Å; V146-K150 VanDerWaalsContact O-N 3.17Å; V148-K150 VanDerWaalsContact C-N 3.3Å; V148-K150 PolarHBondContact O-N 2.79Å
151	Q	43.6	Very low	41.5	Very low	149 Å²	149	113.2 Å²	113.2	70%	0.696	63%	0.63	S	S	*	*	H	α-helix	trans	-92.1	-19.4	177.2	-75.9	175	-10.4	0	0	113.8	R147 V148 I149	R147-Q151 VanDerWaalsContact O-CG 3.3Å; R147-Q151 WeakPolarHBondContact O-CG 3.26Å; R147-Q151 PolarHBondContact O-N 3.19Å; V148-Q151 WeakPolarHBondContact O-CA 3.44Å; V148-Q151 WeakPolarHBondContact O-CB 3.45Å; V148-Q151 PolarHBondContact O-N 3.13Å; I149-Q151 VanDerWaalsContact C-N 3.25Å; I149-Q151 PolarHBondContact O-N 2.97Å
152	T	42.3	Very low	40.9	Very low	107 Å²	107	107 Å²	107	66%	0.656	63%	0.628	S	S	*	*	S	Bend	trans	-95.2	-1.1	178.2	53.7	0	0	0	0	114.3	V148 I149	V148-T152 PolarHBondContact O-N 3.34Å; V148-T152 VanDerWaalsContact O-N 3.1Å; V148-T152 PolarHBondContact O-OG1 3.39Å; I149-T152 PolarHBondContact O-N 2.93Å; I149-T152 PolarHBondContact O-OG1 3.13Å
153	S	38.6	Very low	40	Very low	79 Å²	79	112 Å²	112	55%	0.552	65%	0.651	S	S	*	*	S	Bend	trans	-82.7	125.7	179.9	-65.2	0	0	0	0	112.3	I149 G155	I149-S153 PolarHBondContact O-OG 2.99Å; S153-G155 PolarHBondContact O-N 3.43Å
154	P	35.2	Very low	39.1	Very low	135 Å²	135	114.6 Å²	114.6	88%	0.877	67%	0.668	S	S	*	*			trans	-87.7	113.3	-167.2	31.9	-35.2	0	0	0	115.5
155	G	31.4	Very low	38.3	Very low	79 Å²	79	117 Å²	117	81%	0.814	68%	0.676	S	S	*	*			trans	93.5	152.3	165.5	0	0	0	0	0	114.9	S153	S153-G155 PolarHBondContact O-N 3.43Å
156	K	31	Very low	37.2	Very low	214 Å²	214	124.5 Å²	124.5	93%	0.93	70%	0.699	S	S	*	*			cis	-145.9	147	6.6	-160	173.1	-175.6	177.2	0	109.5
157	A	28.7	Very low	37.2	Very low	108 Å²	108	127 Å²	127	89%	0.893	72%	0.717	S	S	*	*			trans	-87	156.6	-160.5	0	0	0	0	0	116.7
158	G	29.2	Very low	37.2	Very low	75 Å²	75	126.1 Å²	126.1	77%	0.773	73%	0.726	S	S	*	*			trans	-166.5	137.1	167.3	0	0	0	0	0	110.8
159	M	31.4	Very low	36.1	Very low	180 Å²	180	129.1 Å²	129.1	89%	0.887	74%	0.739	S	S	*	*			trans	-149.1	170.1	-168.4	-81.2	-93.8	-173.1	0	0	109.2
160	P	54.9	Low	35	Very low	99 Å²	99	134.8 Å²	134.8	64%	0.643	77%	0.765	S	S	*	*				-136.4	-150.1	-51.2	40.4	-21.6	0	0	0	111.4
161	N	27.8	Very low	34.5	Very low	162 Å²	162	133.8 Å²	133.8	87%	0.866	77%	0.771	S	S	*	*			trans	78.1	145.7	172.8	-56.7	-15.1	0	0	0	116.6
162	G	30.6	Very low	34.1	Very low	69 Å²	69	132.3 Å²	132.3	71%	0.711	77%	0.774	S	S	*	*			cis	-157.8	171.5	-1.5	0	0	0	0	0	112.3
163	M	29.8	Very low	33.5	Very low	177 Å²	177	130.6 Å²	130.6	87%	0.872	78%	0.778	S	S	*	*			trans	-76.6	162.3	-175.9	-56.7	83.6	154.8	0	0	113.7
164	D	28.7	Very low	33.2	Very low	145 Å²	145	136 Å²	136	78%	0.775	79%	0.794	S	S	*	*				-159.4	176.5	112.1	-115.7	-28.4	0	0	0	116
165	H	29.9	Very low	33	Very low	164 Å²	164	134.1 Å²	134.1	76%	0.759	79%	0.79	S	S	*	*			trans	-67.2	131.7	-157.2	-66.4	-82.9	0	0	0	120.3
166	R	26.7	Very low	32.7	Very low	225 Å²	225	134.4 Å²	134.4	85%	0.849	79%	0.793	S	S	*	*				35.2	160.4	104.3	-134.3	-160.1	-176.6	178.3	2.8	119.7
167	P	49.2	Very low	32.5	Very low	103 Å²	103	128.1 Å²	128.1	67%	0.669	79%	0.789	S	S	*	*				-111.5	-136.4	-75.1	40.2	-21.9	0	0	0	109.3
168	P	47.7	Very low	32.9	Very low	99 Å²	99	130.6 Å²	130.6	64%	0.643	79%	0.786	S	S	*	*			cis	-135	-160.7	-20.2	32.3	-7.2	0	0	0	114.7
169	L	26.8	Very low	33.3	Very low	141 Å²	141	132.9 Å²	132.9	74%	0.738	79%	0.788	S	S	*	*			trans	67.4	160.6	166.8	-90	71.3	0	0	0	117.5
170	E	26.5	Very low	33.9	Very low	166 Å²	166	129 Å²	129	78%	0.776	78%	0.776	S	S	*	*			cis	-160.1	151.9	-45.2	-121.5	170	-166.2	0	0	110.3
171	V	34.6	Very low	32.5	Very low	133 Å²	133	133.9 Å²	133.9	81%	0.806	78%	0.783	S	S	*	*			trans	-32.9	142.1	161.4	170.2	0	0	0	0	113.1
172	P	35.5	Very low	32.6	Very low	119 Å²	119	134 Å²	134	77%	0.773	78%	0.778	S	S	*	*				-141.5	160.5	50.5	21.8	4	0	0	0	119.9
173	G	29.3	Very low	32.5	Very low	70 Å²	70	138.9 Å²	138.9	72%	0.722	78%	0.782	S	S	*	*			trans	-99	172.8	138	0	0	0	0	0	109.8
174	E	32.6	Very low	32.4	Very low	192 Å²	192	139.6 Å²	139.6	90%	0.897	79%	0.786	S	S	*	*			cis	-158.1	168.8	14.9	-159.3	-179.6	-170.4	0	0	110.9
175	A	30.9	Very low	32.4	Very low	97 Å²	97	136.5 Å²	136.5	80%	0.802	79%	0.788	S	S	*	*			trans	52.9	107	156.7	0	0	0	0	0	120.3
176	G	25.8	Very low	32.4	Very low	84 Å²	84	133.4 Å²	133.4	87%	0.866	79%	0.791	S	S	*	*			trans	171.9	128.6	155.9	0	0	0	0	0	116
177	G	26	Very low	32.4	Very low	83 Å²	83	131.3 Å²	131.3	86%	0.856	79%	0.791	S	S	*	*			trans	99.2	142.3	156.8	0	0	0	0	0	118.3
178	L	36.6	Very low	31.3	Very low	159 Å²	159	134.2 Å²	134.2	83%	0.832	80%	0.797	S	S	*	*			trans	-75.9	156.2	174.6	-65.3	160.8	0	0	0	112.3
179	P	37.1	Very low	30.4	Very low	123 Å²	123	139.7 Å²	139.7	80%	0.799	81%	0.807	S	S	*	*			trans	-74.6	144.2	164.3	31.6	-33.3	0	0	0	112
180	P	45.9	Very low	30.4	Very low	98 Å²	98	139.8 Å²	139.8	64%	0.636	81%	0.808	S	S	*	*			trans	-142	-174.4	-145.1	30.6	-4.5	0	0	0	116.5
181	Y	25.3	Very low	30.3	Very low	203 Å²	203	135 Å²	135	80%	0.796	80%	0.803	S	S	*	*			trans	65.1	160.6	163.1	-74.4	-73.7	0	0	0	117.6
182	H	29.4	Very low	30.1	Very low	164 Å²	164	134 Å²	134	76%	0.759	81%	0.808	S	S	*	*			cis	-137	161.7	6.2	-133.4	-70.2	0	0	0	113.3
183	Q	29.1	Very low	29.9	Very low	171 Å²	171	133 Å²	133	80%	0.799	81%	0.811	S	S	*	*			trans	-100.2	141.6	-179.8	162.9	-162.7	42	0	0	111.8
184	M	27.8	Very low	30.1	Very low	193 Å²	193	132.9 Å²	132.9	95%	0.951	81%	0.809	S	S	*	*			trans	-177.5	156.3	145.4	-109	-171.7	-168	0	0	114.5
185	G	27.4	Very low	30.4	Very low	80 Å²	80	135.1 Å²	135.1	83%	0.825	81%	0.811	S	S	*	*			trans	101.6	132.5	156.4	0	0	0	0	0	117.3
186	A	30.3	Very low	30.5	Very low	99 Å²	99	133.6 Å²	133.6	82%	0.818	81%	0.805	S	S	*	*			trans	-155	140.5	172.4	0	0	0	0	0	111
187	Q	26.5	Very low	31.5	Very low	180 Å²	180	135.1 Å²	135.1	84%	0.841	80%	0.8	S	S	*	*			trans	176	146.7	152.5	-104	172.4	11.6	0	0	113.6
188	M	26.7	Very low	31.6	Very low	165 Å²	165	140.5 Å²	140.5	81%	0.813	80%	0.803	S	S	*	*			trans	50.3	138.1	145.3	-54	-59.3	-168.3	0	0	124.5
189	Y	28.3	Very low	31.5	Very low	214 Å²	214	137.5 Å²	137.5	84%	0.839	80%	0.795	S	S	*	*			trans	80.9	170.4	145.3	-126.4	-106.7	0	0	0	121.5
190	D	25.9	Very low	31.2	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	79%	0.788	S	S	*	*			trans	-42.6	156.6	-167.4	-78.3	-40.2	0	0	0	118.5
191	G	26.2	Very low	30.5	Very low	64 Å²	64	139.7 Å²	139.7	66%	0.66	79%	0.794	S	S	*	*			cis	160.4	144.4	-3.3	0	0	0	0	0	113.9
192	A	28.8	Very low	30.7	Very low	112 Å²	112	135.3 Å²	135.3	93%	0.926	79%	0.788	S	S	*	*			trans	57.2	140.1	173.9	0	0	0	0	0	118.7
193	A	31.4	Very low	30.8	Very low	100 Å²	100	136.9 Å²	136.9	83%	0.826	79%	0.787	S	S	*	*			cis	-154.4	153.8	-15.5	0	0	0	0	0	106.3
194	G	34.9	Very low	30.8	Very low	67 Å²	67	132.3 Å²	132.3	69%	0.691	78%	0.778	S	S	*	*			cis	102	133.9	39.2	0	0	0	0	0	108.7
195	Y	37.3	Very low	31	Very low	238 Å²	238	131.4 Å²	131.4	93%	0.933	77%	0.766	S	S	*	*			cis	-149.5	175.7	4.4	-100.6	-99.7	0	0	0	107.7
196	G	33.3	Very low	31.2	Very low	65 Å²	65	135.6 Å²	135.6	67%	0.67	77%	0.766	S	S	*	*			cis	-173.4	-173.3	9	0	0	0	0	0	112.7
197	P	47.9	Very low	31.1	Very low	117 Å²	117	134 Å²	134	76%	0.76	76%	0.759	S	S	*	*			trans	-129.9	-174.8	-154.7	44.4	-31	0	0	0	116.2
198	E	28	Very low	31.2	Very low	196 Å²	196	130 Å²	130	92%	0.916	76%	0.757	S	S	*	*			trans	-146.6	163.3	147.5	-80.2	-148.3	136.2	0	0	112.1
199	S	33.6	Very low	32.4	Very low	95 Å²	95	128.1 Å²	128.1	66%	0.664	76%	0.757	S	S	*	*			trans	-134.2	179	179.3	52.8	0	0	0	0	109.4
200	D	30.6	Very low	33.8	Very low	125 Å²	125	123.1 Å²	123.1	67%	0.668	75%	0.751	S	S	*	*			cis	-168	165.5	37.3	-114.4	-49.3	0	0	0	114.9
201	L	30.7	Very low	34	Very low	143 Å²	143	122.3 Å²	122.3	75%	0.749	75%	0.751	S	S	*	*			trans	15.6	154.1	143.4	-94.1	55.3	0	0	0	123.6
202	T	30	Very low	34.2	Very low	110 Å²	110	126.4 Å²	126.4	68%	0.675	76%	0.755	S	S	*	*			cis	-174.6	151.1	-14.8	10	0	0	0	0	115.5
203	R	32.1	Very low	34.3	Very low	198 Å²	198	126.2 Å²	126.2	75%	0.747	74%	0.738	S	S	*	*			trans	57	162.4	141.7	-113.1	-170.9	170	98	1.1	121.6	Y205	R203-Y205 PolarHBondContact NH2-OH 2.94Å
204	A	29.2	Very low	34.3	Very low	74 Å²	74	130.7 Å²	130.7	61%	0.612	74%	0.735	S	S	*	*			cis	-160.1	147.4	3.6	0	0	0	0	0	117
205	Y	31.5	Very low	33.9	Very low	175 Å²	175	134.7 Å²	134.7	69%	0.686	74%	0.737	S	S	*	*			trans	63	149.8	136.1	-75.1	-142.8	0	0	0	120.3	R203	R203-Y205 PolarHBondContact NH2-OH 2.94Å
206	M	32.4	Very low	33.7	Very low	167 Å²	167	127.9 Å²	127.9	82%	0.823	72%	0.715	S	S	*	*			cis	-155.4	-167.6	1.4	-112.4	-65	-177.2	0	0	108.8
207	G	27.9	Very low	34.2	Very low	65 Å²	65	129.2 Å²	129.2	67%	0.67	71%	0.712	S	S	*	*			cis	179.6	-177.2	6.3	0	0	0	0	0	112.1
208	A	27.3	Very low	34.3	Very low	97 Å²	97	128.8 Å²	128.8	80%	0.802	71%	0.709	S	S	*	*			trans	-163.1	-161.7	-173.3	0	0	0	0	0	113.3
209	P	53.8	Low	34.3	Very low	126 Å²	126	125.4 Å²	125.4	82%	0.818	71%	0.707	S	S	*	*			cis	-126.7	-90.5	-17.2	21.8	4.2	0	0	0	122.3
210	P	56	Low	34	Very low	108 Å²	108	126.7 Å²	126.7	70%	0.701	72%	0.716	S	S	*	*			trans	-138.5	-166.2	-137.4	41.8	-18.9	0	0	0	120.5
211	V	31.6	Very low	33.8	Very low	126 Å²	126	125.3 Å²	125.3	76%	0.764	72%	0.722	S	S	*	*			trans	128.8	112.4	144.3	-173.6	0	0	0	0	121.5
212	M	30.2	Very low	33.7	Very low	151 Å²	151	122.7 Å²	122.7	74%	0.744	72%	0.721	S	S	*	*			trans	47.9	134.3	142.2	-67.7	-173.2	177.1	0	0	131.1
213	N	30.3	Very low	33.6	Very low	108 Å²	108	127.2 Å²	127.2	58%	0.578	74%	0.735	S	S	*	*				76.3	117.3	126.9	-69	0.3	0	0	0	129.1
214	Y	30.7	Very low	33.2	Very low	194 Å²	194	121 Å²	121	76%	0.761	73%	0.732	S	S	*	*				63.7	133.3	128.9	-84.8	-84.3	0	0	0	127.3
215	M	27.7	Very low	33.8	Very low	151 Å²	151	123.8 Å²	123.8	74%	0.744	74%	0.744	S	S	*	*			trans	102	151.6	141.4	-133.2	119.4	73.6	0	0	122	S392	M215-S392 PolarHBondContact N-OG 2.82Å; M215-S392 VanDerWaalsContact N-OG 3.14Å; M215-S392 WeakPolarHBondContact O-CB 3.35Å
216	M	31.8	Very low	33.7	Very low	95 Å²	95	121.6 Å²	121.6	47%	0.468	75%	0.749	S	S	.	*			trans	-121.1	-171.3	-174.4	-108.1	-72.1	-165.6	0	0	110.3	S392 D393 L394	M216-S392 WeakPolarHBondContact CE-O 3.43Å; M216-D393 VanDerWaalsContact CG-C 3.46Å; M216-L394 WeakPolarHBondContact CB-O 3.23Å
217	P	44.2	Very low	33.5	Very low	93 Å²	93	122.7 Å²	122.7	60%	0.604	75%	0.754	S	S	*	*			cis	-134.3	-127.7	22.9	30.3	-0.7	0	0	0	116.6
218	P	49.7	Very low	33.5	Very low	108 Å²	108	123 Å²	123	70%	0.701	76%	0.758	S	S	*	*				-127.7	-176.4	-112	42.8	-25.2	0	0	0	116.1
219	S	28.2	Very low	33.7	Very low	125 Å²	125	125.2 Å²	125.2	87%	0.874	76%	0.756	S	S	*	*			trans	159.9	176.1	136.7	-74.5	0	0	0	0	114.9
220	S	27.2	Very low	33.5	Very low	121 Å²	121	124.9 Å²	124.9	85%	0.846	75%	0.754	S	S	*	*			trans	-139.1	135.9	-167.2	58.4	0	0	0	0	116.1
221	A	27.5	Very low	32.3	Very low	96 Å²	96	128.5 Å²	128.5	79%	0.793	76%	0.763	S	S	*	*			trans	-168.2	144.6	154	0	0	0	0	0	108.4
222	A	28.2	Very low	32.2	Very low	88 Å²	88	125.1 Å²	125.1	73%	0.727	75%	0.754	S	S	*	*			cis	92.4	94.5	22.4	0	0	0	0	0	115.9
223	Q	27.8	Very low	32.2	Very low	206 Å²	206	129.6 Å²	129.6	96%	0.963	76%	0.762	S	S	*	*			trans	-178.8	158.6	141.9	-102.6	163.5	61.3	0	0	113.2
224	G	24.6	Very low	33.1	Very low	67 Å²	67	129.7 Å²	129.7	69%	0.691	77%	0.769	S	S	*	*			trans	-103.4	-153.7	168.7	0	0	0	0	0	111.8
225	P	42	Very low	34.3	Very low	132 Å²	132	126.5 Å²	126.5	86%	0.857	77%	0.772	S	S	*	*			cis	-138.3	-152.5	21.3	43.5	-23.3	0	0	0	115.5
226	T	29.6	Very low	34.8	Very low	129 Å²	129	124.5 Å²	124.5	79%	0.791	77%	0.773	S	S	*	*			trans	-84.4	158.1	-164.5	52.9	0	0	0	0	117.9
227	M	28	Very low	34.8	Very low	191 Å²	191	128.9 Å²	128.9	94%	0.941	80%	0.795	S	S	*	*			trans	-170.2	150.9	135.4	-108.4	-61.3	-175.4	0	0	113.8
228	G	27.6	Very low	34.1	Very low	72 Å²	72	127.3 Å²	127.3	74%	0.742	80%	0.795	S	S	*	*			trans	101.4	113.5	153.6	0	0	0	0	0	119.6
229	N	31.6	Very low	33.1	Very low	143 Å²	143	128.1 Å²	128.1	77%	0.765	80%	0.803	S	S	*	*			trans	-150.1	147	167.5	-162	52.1	0	0	0	109.4
230	P	50.1	Low	33.2	Very low	119 Å²	119	133 Å²	133	77%	0.773	80%	0.804	S	S	*	*				-147.6	171.3	111.1	35.8	-17.9	0	0	0	113.7
231	M	29.6	Very low	34.7	Very low	183 Å²	183	132.5 Å²	132.5	90%	0.901	80%	0.798	S	S	*	*			cis	-131.3	-114.1	17.5	-161.8	179.2	-175.5	0	0	114.2
232	G	29.8	Very low	36	Very low	55 Å²	55	133.1 Å²	133.1	57%	0.567	79%	0.794	S	S	*	*			cis	-146.5	-92.2	7.7	0	0	0	0	0	113.5
233	R	30.2	Very low	36	Very low	245 Å²	245	135.3 Å²	135.3	93%	0.925	80%	0.798	S	S	*	*			trans	76.7	175.6	173.2	-115.8	-177.9	-175.2	-152.5	2.5	116.1
234	P	48.3	Very low	36.4	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	79%	0.792	S	S	*	*			cis	-133.9	-137.6	-5	38.3	-12.5	0	0	0	116.1
235	P	56.1	Low	37.3	Very low	127 Å²	127	136.2 Å²	136.2	83%	0.825	80%	0.797	S	S	*	*				-137.8	-138.4	-114	47.1	-23.3	0	0	0	118.4
236	S	38.2	Very low	36.8	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	79%	0.788	S	S	*	*			trans	-132.3	168	-147.6	58.9	0	0	0	0	119.5
237	M	31.8	Very low	36.9	Very low	188 Å²	188	137.4 Å²	137.4	93%	0.926	79%	0.79	S	S	*	*			trans	-160.8	170.9	158.2	-96.2	-61.3	-178.8	0	0	110
238	G	31	Very low	36.9	Very low	60 Å²	60	134.1 Å²	134.1	62%	0.619	79%	0.786	S	S	*	*			cis	166.4	164.8	-6.9	0	0	0	0	0	114.9
239	S	26.9	Very low	37.3	Very low	124 Å²	124	138 Å²	138	87%	0.867	79%	0.789	S	S	*	*			trans	80	151.1	161	-60.1	0	0	0	0	124
240	Y	31.8	Very low	38	Very low	228 Å²	228	137.1 Å²	137.1	89%	0.894	79%	0.791	S	S	*	*			trans	-169.1	-175.5	-171.4	-104	-72.3	0	0	0	107.5
241	P	57.8	Low	36.9	Very low	110 Å²	110	135 Å²	135	71%	0.714	79%	0.791	S	S	*	*			cis	-127.6	-134.3	-19.7	37.6	-13.9	0	0	0	109.7
242	P	54.4	Low	37	Very low	110 Å²	110	132.2 Å²	132.2	71%	0.714	79%	0.79	S	S	*	*			cis	-134.7	-173.7	-23.9	32.3	-9.2	0	0	0	116.5
243	V	29.8	Very low	37.1	Very low	133 Å²	133	134 Å²	134	81%	0.806	80%	0.799	S	S	*	*			trans	129.5	137.6	146.8	177.8	0	0	0	0	115.6
244	M	34.8	Very low	36.9	Very low	168 Å²	168	131.3 Å²	131.3	83%	0.828	80%	0.799	S	S	*	*			trans	-150.7	151.6	176.6	-88.3	-85.5	-168.6	0	0	106.5
245	P	44.5	Very low	36.1	Very low	124 Å²	124	136.6 Å²	136.6	81%	0.805	81%	0.807	S	S	*	*				-154.1	-156.2	92.3	42.5	-21.9	0	0	0	115.5
246	T	30.8	Very low	36	Very low	110 Å²	110	135.4 Å²	135.4	68%	0.675	80%	0.799	S	S	*	*			trans	-121.3	166.3	-146.3	53.9	0	0	0	0	116.7
247	Q	31.2	Very low	35.5	Very low	177 Å²	177	139.3 Å²	139.3	83%	0.827	81%	0.805	S	S	*	*			trans	87.8	147.6	137.1	-93.4	179.4	52.5	0	0	123.5
248	S	29.4	Very low	35.3	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	80%	0.801	S	S	*	*			trans	91.8	155.2	148.8	76.4	0	0	0	0	120.8
249	N	34.4	Very low	35.3	Very low	152 Å²	152	136 Å²	136	81%	0.813	81%	0.81	S	S	*	*			trans	-150.9	135.2	-171.4	-177.1	37.3	0	0	0	105.8
250	P	46.1	Very low	36.4	Very low	125 Å²	125	135 Å²	135	81%	0.812	80%	0.801	S	S	*	*				-157.6	-174.7	90.5	42.2	-22.6	0	0	0	115.6
251	G	28.2	Very low	36.2	Very low	75 Å²	75	132.3 Å²	132.3	77%	0.773	80%	0.796	S	S	*	*			trans	136.4	142.9	153.1	0	0	0	0	0	116.6
252	S	31.1	Very low	35	Very low	124 Å²	124	135 Å²	135	87%	0.867	80%	0.797	S	S	*	*			trans	-111.6	157.9	-168.8	-59.6	0	0	0	0	115.9
253	A	31.2	Very low	33.6	Very low	93 Å²	93	134.7 Å²	134.7	77%	0.769	80%	0.803	S	S	*	*			trans	75.8	119.4	146.4	0	0	0	0	0	121.4
254	M	26.7	Very low	33.7	Very low	188 Å²	188	138.2 Å²	138.2	93%	0.926	80%	0.803	S	S	*	*				-167	162.2	110.7	-96.6	-71.2	173.6	0	0	111.5
255	Y	32.4	Very low	34.5	Very low	222 Å²	222	136 Å²	136	87%	0.871	80%	0.801	S	S	*	*			trans	-99.2	-169.8	-175.7	-106.3	-106.8	0	0	0	110.9
256	P	53.7	Low	33.8	Very low	102 Å²	102	134 Å²	134	66%	0.662	80%	0.804	S	S	*	*			cis	-138.5	-170	1.9	30.7	-5.7	0	0	0	117.2
257	Q	28.5	Very low	33.7	Very low	191 Å²	191	132 Å²	132	89%	0.893	81%	0.805	S	S	*	*			trans	77.4	138	163.1	-56.8	-175.2	-13.8	0	0	117.7
258	G	27.5	Very low	33.7	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	81%	0.81	S	S	*	*			cis	-175.2	163.4	-5.1	0	0	0	0	0	112.6
259	A	30.1	Very low	33.9	Very low	99 Å²	99	133.4 Å²	133.4	82%	0.818	80%	0.8	S	S	*	*			trans	-120.3	-169.4	175.9	0	0	0	0	0	109.2
260	P	49.9	Very low	33.7	Very low	103 Å²	103	134 Å²	134	67%	0.669	80%	0.798	S	S	*	*			cis	-140.7	-160.1	-4.1	39.3	-17.2	0	0	0	114.4
261	Q	27.6	Very low	33	Very low	170 Å²	170	136.6 Å²	136.6	79%	0.794	80%	0.799	S	S	*	*			trans	70.7	167.4	153.1	-72.9	-177.8	36.2	0	0	119.9
262	K	33.3	Very low	33.1	Very low	168 Å²	168	136.5 Å²	136.5	73%	0.73	80%	0.798	S	S	*	*			cis	179.2	132.8	-33.4	-178.4	177.8	-176	-178.5	0	108.9
263	A	24.7	Very low	34.2	Very low	102 Å²	102	136.4 Å²	136.4	84%	0.843	79%	0.794	S	S	*	*			trans	-154.4	159.5	177.2	0	0	0	0	0	115.6
264	Y	30.6	Very low	34	Very low	207 Å²	207	139.9 Å²	139.9	81%	0.812	80%	0.797	S	S	*	*			trans	-120	-164.6	-174.9	-91.4	-92.3	0	0	0	110.1
265	P	52.1	Low	34.1	Very low	122 Å²	122	138.8 Å²	138.8	79%	0.792	79%	0.791	S	S	*	*			cis	-129.5	-166.9	-11.5	22.5	4.1	0	0	0	114.4
266	G	29.6	Very low	33.7	Very low	83 Å²	83	133.7 Å²	133.7	86%	0.856	79%	0.788	S	S	*	*			trans	-121.6	-159.5	180	0	0	0	0	0	117.3
267	G	28.7	Very low	32.8	Very low	67 Å²	67	140 Å²	140	69%	0.691	80%	0.801	S	S	*	*			trans	174.4	139.1	179.2	0	0	0	0	0	110.2
268	M	32.3	Very low	32.8	Very low	191 Å²	191	134.3 Å²	134.3	94%	0.941	79%	0.792	S	S	*	*				73.4	134.1	82.6	-81.4	-179.8	165.9	0	0	114.4
269	E	32.3	Very low	33	Very low	138 Å²	138	136.9 Å²	136.9	65%	0.645	79%	0.792	S	S	*	*			cis	-168.3	-173.6	-0.6	-155	-103.5	-65	0	0	111.2
270	Q	31.7	Very low	32.9	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	79%	0.794	S	S	*	*			trans	99.3	153.4	158	-61.3	-168.2	4.8	0	0	124.1
271	H	31	Very low	31.9	Very low	179 Å²	179	136.9 Å²	136.9	83%	0.829	80%	0.801	S	S	*	*			trans	-81.1	166.2	-156.3	-62	-103.9	0	0	0	117.5
272	G	30.4	Very low	32.2	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	80%	0.804	S	S	*	*			trans	-89.5	-145.6	173.5	0	0	0	0	0	114.9
273	P	53.3	Low	32	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	80%	0.804	S	S	*	*			cis	-141.5	-179.3	8.8	44.6	-26.3	0	0	0	117.5
274	M	27.5	Very low	32.3	Very low	166 Å²	166	138.4 Å²	138.4	82%	0.818	80%	0.796	S	S	*	*			trans	46.7	128.7	146.9	-82	-175.8	70.3	0	0	125
275	M	29.2	Very low	32.7	Very low	164 Å²	164	136.9 Å²	136.9	81%	0.808	80%	0.797	S	S	*	*				37	128.5	125.9	-62.1	-70.6	-165.5	0	0	121.6
276	S	24	Very low	31.5	Very low	116 Å²	116	139.3 Å²	139.3	81%	0.811	80%	0.802	S	S	*	*				-172.2	159.6	102.9	-163.2	0	0	0	0	113.2
277	Y	34.7	Very low	31.7	Very low	235 Å²	235	143.7 Å²	143.7	92%	0.922	80%	0.8	S	S	*	*			trans	-103.4	156.5	167.8	-92.5	-96.3	0	0	0	111.4
278	G	29	Very low	32.8	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	81%	0.806	S	S	*	*			trans	152.7	157.3	157.2	0	0	0	0	0	114.4
279	V	30.1	Very low	32.8	Very low	134 Å²	134	145.8 Å²	145.8	81%	0.812	80%	0.801	S	S	*	*			cis	-173.4	151.2	-30.9	118.7	0	0	0	0	107.3
280	S	29.7	Very low	34	Very low	125 Å²	125	144.3 Å²	144.3	87%	0.874	80%	0.803	S	S	*	*			trans	67.7	155.4	167	75.5	0	0	0	0	120
281	G	29	Very low	35.2	Very low	78 Å²	78	142.1 Å²	142.1	80%	0.804	80%	0.803	S	S	*	*			trans	147.1	129.8	176.1	0	0	0	0	0	112
282	Q	32.4	Very low	35.2	Very low	182 Å²	182	137.7 Å²	137.7	85%	0.85	81%	0.806	S	S	*	*			trans	-145	149.7	-171.2	-156	-177	16.6	0	0	113.5
283	Q	29.4	Very low	35.2	Very low	160 Å²	160	137.8 Å²	137.8	75%	0.748	81%	0.807	S	S	*	*			trans	83	143.5	155.5	-100.2	-176.3	-8.7	0	0	123
284	L	32	Very low	35	Very low	129 Å²	129	138.7 Å²	138.7	68%	0.675	81%	0.813	S	S	*	*			trans	75.9	88.3	146.6	-69.6	163.7	0	0	0	123
285	Q	38.7	Very low	35.3	Very low	176 Å²	176	134.1 Å²	134.1	82%	0.822	81%	0.808	S	S	*	*				44.1	129.8	108.1	-173.2	174.4	43.4	0	0	121.9
286	L	27.1	Very low	36.5	Very low	172 Å²	172	132.7 Å²	132.7	90%	0.901	81%	0.811	S	S	*	*			trans	-160.7	164.4	149.5	-111	164.9	0	0	0	112.8
287	Q	34	Very low	36.9	Very low	175 Å²	175	130.7 Å²	130.7	82%	0.818	81%	0.809	S	S	*	*			trans	-156.4	144.5	-174.3	158.2	176.9	87.8	0	0	110.1
288	P	50.5	Low	37.9	Very low	126 Å²	126	125.2 Å²	125.2	82%	0.818	80%	0.802	S	S	*	*				-151.7	170	126.4	37.2	-18.6	0	0	0	117.3
289	Q	32.8	Very low	37.9	Very low	177 Å²	177	129.3 Å²	129.3	83%	0.827	80%	0.802	S	S	*	*			trans	-97.5	-161.1	165.1	-123.4	-165	45.3	0	0	109.6
290	P	58.6	Low	37.8	Very low	106 Å²	106	132.5 Å²	132.5	69%	0.688	80%	0.801	S	S	*	*			cis	-141.9	-131.7	16.1	39.1	-12.7	0	0	0	113.6
291	P	56.8	Low	37.8	Very low	120 Å²	120	133 Å²	133	78%	0.779	79%	0.794	S	S	*	*				-122.6	178.2	-66	32.7	-14.8	0	0	0	115.5
292	G	29.5	Very low	37.7	Very low	85 Å²	85	140.3 Å²	140.3	88%	0.876	80%	0.799	S	S	*	*			trans	156.1	147.2	151.2	0	0	0	0	0	119.2
293	G	30.8	Very low	37.4	Very low	75 Å²	75	135.8 Å²	135.8	77%	0.773	79%	0.792	S	S	*	*			trans	174.2	151.5	170.1	0	0	0	0	0	115
294	P	50	Low	37.5	Very low	141 Å²	141	137.5 Å²	137.5	92%	0.916	80%	0.8	S	S	*	*			trans	-149.5	-179.5	130.4	36	-16.5	0	0	0	115.9
295	G	32.7	Very low	37.3	Very low	71 Å²	71	135.7 Å²	135.7	73%	0.732	80%	0.804	S	S	*	*			trans	-95.1	-148.5	-179.4	0	0	0	0	0	115.8
296	P	55.3	Low	36.8	Very low	134 Å²	134	137.6 Å²	137.6	87%	0.87	80%	0.803	S	S	*	*			cis	-148.4	164.9	9.4	43.4	-23.4	0	0	0	120.9
297	G	32	Very low	36.6	Very low	74 Å²	74	136.9 Å²	136.9	76%	0.763	80%	0.796	S	S	*	*			trans	73.6	172.8	145.1	0	0	0	0	0	122.3
298	P	55.7	Low	36.3	Very low	119 Å²	119	135.9 Å²	135.9	77%	0.773	79%	0.79	S	S	*	*			cis	-141	178.6	-17.1	43.1	-25.4	0	0	0	118
299	H	28.1	Very low	35.1	Very low	156 Å²	156	137 Å²	137	72%	0.722	79%	0.789	S	S	*	*			trans	93	115.8	150	-85.1	-55.3	0	0	0	127
300	Y	29.1	Very low	34.7	Very low	202 Å²	202	137.6 Å²	137.6	79%	0.792	79%	0.794	S	S	*	*			trans	85.2	151.9	134.7	-86.2	-47.2	0	0	0	126.5
301	D	28.6	Very low	32.9	Very low	135 Å²	135	140.8 Å²	140.8	72%	0.722	80%	0.8	S	S	*	*			trans	-126.7	164	-160.8	-50.1	-102.1	0	0	0	114.3
302	Y	28.1	Very low	32.3	Very low	231 Å²	231	140.2 Å²	140.2	91%	0.906	80%	0.796	S	S	*	*			trans	160.5	154.6	138.1	-106.9	-120.5	0	0	0	110
303	A	25.4	Very low	32.1	Very low	87 Å²	87	141 Å²	141	72%	0.719	79%	0.794	S	S	*	*			cis	-152.5	177.8	6.2	0	0	0	0	0	112.3
304	H	30.9	Very low	31.8	Very low	197 Å²	197	141.2 Å²	141.2	91%	0.912	80%	0.796	S	S	*	*			trans	-119.9	152.1	177.5	-89	-66.4	0	0	0	114.8
305	A	27.9	Very low	30.6	Very low	91 Å²	91	146.1 Å²	146.1	75%	0.752	80%	0.798	S	S	*	*			trans	-145.1	130.3	146.4	0	0	0	0	0	107.3
306	R	28.3	Very low	30.2	Very low	215 Å²	215	146.1 Å²	146.1	81%	0.811	80%	0.798	S	S	*	*			cis	78.9	136.7	33.6	-136.1	-163.3	177.9	-172.6	-0.2	111.6
307	Q	24.5	Very low	28.8	Very low	158 Å²	158	145.3 Å²	145.3	74%	0.738	79%	0.79	S	S	*	*			cis	-131.2	158.1	18.2	-67.4	159.8	-91.8	0	0	111.1
308	H	26.5	Very low	28.5	Very low	153 Å²	153	150.2 Å²	150.2	71%	0.708	79%	0.791	S	S	*	*				60.5	121	56.6	-79.3	-99.7	0	0	0	114.1
309	L	26.3	Very low	27	Very low	149 Å²	149	154.8 Å²	154.8	78%	0.78	79%	0.793	S	S	*	*			cis	95.1	118.2	42.7	-179.4	87.5	0	0	0	112.3
310	M	23.8	Very low	26.9	Very low	190 Å²	190	153.3 Å²	153.3	94%	0.936	79%	0.794	S	S	*	*			trans	-166.7	165.5	142.2	-108.3	175	90.3	0	0	114.1
311	E	21.4	Very low	27.4	Very low	174 Å²	174	149.5 Å²	149.5	81%	0.813	80%	0.795	S	S	*	*			trans	-87.3	-167.5	-172	-109.8	-166.2	115.4	0	0	114
312	P	44.4	Very low	27.4	Very low	108 Å²	108	147.4 Å²	147.4	70%	0.701	79%	0.791	S	S	*	*			cis	-136.7	171.8	-0.9	21.6	4.6	0	0	0	118.3
313	A	24.9	Very low	27.5	Very low	102 Å²	102	145.6 Å²	145.6	84%	0.843	79%	0.788	S	S	*	*			trans	47.4	133.2	142.6	0	0	0	0	0	124.4
314	G	23.8	Very low	27.5	Very low	78 Å²	78	150.4 Å²	150.4	80%	0.804	80%	0.795	S	S	*	*			trans	-172.4	139.6	163.6	0	0	0	0	0	114.1
315	Y	24.9	Very low	27.9	Very low	244 Å²	244	148.9 Å²	148.9	96%	0.957	79%	0.794	S	S	*	*			trans	-91.9	154.9	-176	-100.4	-110.3	0	0	0	113.9
316	G	24.6	Very low	27.9	Very low	71 Å²	71	154.5 Å²	154.5	73%	0.732	80%	0.801	S	S	*	*			trans	107.6	139.2	152.3	0	0	0	0	0	117.9
317	V	26	Very low	28.1	Very low	118 Å²	118	151.7 Å²	151.7	72%	0.715	80%	0.799	S	S	*	*			cis	168.5	130.4	-28.2	143.3	0	0	0	0	107
318	K	24.7	Very low	28.2	Very low	176 Å²	176	152.5 Å²	152.5	77%	0.765	80%	0.803	S	S	*	*			trans	82.1	123.9	161.4	-76	162	-169.1	168.9	0	123.6
319	R	25	Very low	29.4	Very low	216 Å²	216	150.5 Å²	150.5	82%	0.815	80%	0.804	S	S	*	*			trans	87.7	92.8	132	-71.8	174.6	176.1	-177.7	-3.5	122.7
320	T	25.8	Very low	31.3	Very low	124 Å²	124	149.1 Å²	149.1	76%	0.761	80%	0.804	S	S	*	*				20.9	155.1	109.9	59.7	0	0	0	0	121.1
321	P	40.3	Very low	32.8	Very low	123 Å²	123	145.4 Å²	145.4	80%	0.799	79%	0.794	S	S	*	*			cis	-115.9	-154.7	4.9	43.8	-31.2	0	0	0	111.2
322	S	28.8	Very low	33.4	Very low	91 Å²	91	146.5 Å²	146.5	64%	0.636	80%	0.801	S	S	*	*			cis	-155.9	-173.9	-4.2	-140.5	0	0	0	0	107.5
323	F	28.5	Very low	32.9	Very low	193 Å²	193	144.5 Å²	144.5	85%	0.846	80%	0.8	S	S	*	*			cis	-142.3	143.4	-2.3	-127.5	-69.1	0	0	0	106.6
324	Q	26.6	Very low	34.6	Very low	188 Å²	188	145.6 Å²	145.6	88%	0.879	80%	0.799	S	S	*	*			trans	-147.7	166.3	-178	-83.7	-172.2	-23	0	0	113.3
325	N	39.2	Very low	35.7	Very low	165 Å²	165	147.2 Å²	147.2	88%	0.882	80%	0.795	S	S	*	*			trans	-59.1	165	168.7	-80	-27.8	0	0	0	113.1
326	K	28.1	Very low	35.9	Very low	208 Å²	208	142.1 Å²	142.1	90%	0.904	78%	0.784	S	S	*	*			trans	-151.4	169.5	173.8	-126.4	-175.7	-178.9	-171.1	0	115.4
327	M	32.8	Very low	36.1	Very low	156 Å²	156	144.6 Å²	144.6	77%	0.768	78%	0.781	S	S	*	*			trans	-139.8	155.5	-170.5	-55.9	168.1	64.9	0	0	113.2
328	Q	25	Very low	36.2	Very low	176 Å²	176	148.5 Å²	148.5	82%	0.822	78%	0.784	S	S	*	*			trans	64.6	163.6	144.7	-83.6	-169.3	-34.7	0	0	123
329	P	52.3	Low	36.4	Very low	111 Å²	111	145.7 Å²	145.7	72%	0.721	78%	0.781	S	S	*	*			trans	-109.6	-144.4	-159.6	48.8	-39.2	0	0	0	112
330	P	65.7	Low	36.7	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	77%	0.774	S	S	*	*			cis	-124.9	-104.8	2.4	24.5	4.6	0	0	0	120.4
331	P	55.4	Low	37.1	Very low	113 Å²	113	142.6 Å²	142.6	73%	0.734	77%	0.773	S	S	*	*				-132	-178.3	-126.3	43.3	-24.6	0	0	0	118.2
332	M	34.8	Very low	36.6	Very low	197 Å²	197	145.1 Å²	145.1	97%	0.97	78%	0.775	S	S	*	*			trans	-152.9	170.7	165	-101	-64.7	-101.2	0	0	112.8
333	G	34.1	Very low	36.8	Very low	65 Å²	65	145 Å²	145	67%	0.67	78%	0.779	S	S	*	*			trans	-116.3	-165	-159.2	0	0	0	0	0	120.5
334	P	59.6	Low	36.9	Very low	126 Å²	126	146 Å²	146	82%	0.818	78%	0.783	S	S	*	*			trans	-107.8	173.7	-144.5	44.8	-41.3	0	0	0	116.4
335	P	47.1	Very low	37	Very low	112 Å²	112	141 Å²	141	73%	0.727	78%	0.782	S	S	*	*				-154.1	178.5	85.2	42.7	-22.8	0	0	0	118.9
336	D	29.1	Very low	36.5	Very low	137 Å²	137	137 Å²	137	73%	0.733	78%	0.78	S	S	*	*			trans	75.4	121.7	147.2	-69.7	-28.8	0	0	0	128.1
337	N	29.8	Very low	36.6	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	78%	0.778	S	S	*	*				76.2	129.5	129.6	-70.9	-42	0	0	0	128
338	Y	27.2	Very low	36.6	Very low	200 Å²	200	132.1 Å²	132.1	78%	0.784	77%	0.771	S	S	*	*			trans	61.9	123.8	142.8	-82.3	-114.6	0	0	0	121
339	V	30.3	Very low	37	Very low	117 Å²	117	131.2 Å²	131.2	71%	0.709	77%	0.766	S	S	*	*				79.4	133.5	69.7	165.4	0	0	0	0	112.4
340	N	29.8	Very low	35.9	Very low	125 Å²	125	132.8 Å²	132.8	67%	0.668	77%	0.769	S	S	*	*			cis	-158.1	158.3	27.5	-154.5	6.1	0	0	0	116.2
341	M	33.6	Very low	34.1	Very low	149 Å²	149	130.2 Å²	130.2	73%	0.734	76%	0.763	S	S	*	*			trans	51.4	163.7	147.3	-89.2	-178.9	-173.5	0	0	122.7
342	Q	30.1	Very low	32.8	Very low	177 Å²	177	131 Å²	131	83%	0.827	77%	0.771	S	S	*	*			cis	-146.7	-178.3	14.8	-142.8	164.5	36.7	0	0	115.3
343	A	33.1	Very low	32.5	Very low	89 Å²	89	126.8 Å²	126.8	74%	0.736	77%	0.768	S	S	*	*			trans	-69	-178.2	-168.5	0	0	0	0	0	116.6
344	K	31.6	Very low	32.1	Very low	212 Å²	212	127.4 Å²	127.4	92%	0.922	77%	0.774	S	S	*	*			cis	-170.4	142.6	36.5	-154.6	173.1	-173.9	178.9	0	115.3
345	G	27.6	Very low	30.6	Very low	84 Å²	84	125.5 Å²	125.5	87%	0.866	78%	0.778	S	S	*	*			trans	96.5	158.3	167.5	0	0	0	0	0	116.5
346	G	29	Very low	29.5	Very low	82 Å²	82	123.4 Å²	123.4	85%	0.845	78%	0.777	S	S	*	*			cis	120.8	145.2	-14	0	0	0	0	0	116.1
347	M	31.2	Very low	29.5	Very low	175 Å²	175	127.3 Å²	127.3	86%	0.862	78%	0.783	S	S	*	*			cis	-173.3	149.6	-13	-165.8	173.3	71.7	0	0	112.6
348	S	31.8	Very low	29.5	Very low	86 Å²	86	128.1 Å²	128.1	60%	0.601	79%	0.786	S	S	*	*			trans	71	148.6	168.3	-63	0	0	0	0	119.7
349	Q	33.5	Very low	29.4	Very low	157 Å²	157	123.4 Å²	123.4	73%	0.734	78%	0.783	S	S	*	*			cis	-169.8	173.6	-12	-102.9	173.2	82.9	0	0	105.9
350	N	28.8	Very low	29.2	Very low	144 Å²	144	122.3 Å²	122.3	77%	0.77	78%	0.78	S	S	*	*			cis	-161.7	-177.9	-1.4	-106.9	-15.5	0	0	0	107.4
351	G	27.7	Very low	29.1	Very low	64 Å²	64	124.5 Å²	124.5	66%	0.66	79%	0.786	S	S	*	*			cis	154.7	135.7	-8.4	0	0	0	0	0	114.5
352	S	28.6	Very low	28.6	Very low	129 Å²	129	121.9 Å²	121.9	90%	0.902	78%	0.782	S	S	*	*			trans	79.6	135	161.7	-63.9	0	0	0	0	124.3
353	A	27.9	Very low	28.8	Very low	110 Å²	110	122 Å²	122	91%	0.909	78%	0.782	S	S	*	*			trans	67.4	146	159	0	0	0	0	0	120.5
354	G	27.2	Very low	28.9	Very low	77 Å²	77	123.8 Å²	123.8	79%	0.794	79%	0.786	S	S	*	*			cis	175.2	160.1	-7.7	0	0	0	0	0	114.3
355	G	26.9	Very low	28.7	Very low	86 Å²	86	124.8 Å²	124.8	89%	0.887	79%	0.785	S	S	*	*			trans	88.4	148	-177.4	0	0	0	0	0	113.9
356	G	24.5	Very low	28.7	Very low	69 Å²	69	129.8 Å²	129.8	71%	0.711	79%	0.785	S	S	*	*			cis	112.3	119.3	14.3	0	0	0	0	0	109.1
357	Y	30.2	Very low	28.5	Very low	219 Å²	219	130.2 Å²	130.2	86%	0.859	78%	0.781	S	S	*	*			cis	-145.8	149	35.2	-90.9	-108.2	0	0	0	114.8
358	L	28.4	Very low	28.5	Very low	140 Å²	140	127.6 Å²	127.6	73%	0.733	78%	0.78	S	S	*	*			trans	20.7	116.7	137.8	-72.9	170.8	0	0	0	119.6
359	S	25.7	Very low	28.5	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	79%	0.786	S	S	*	*				83	155.3	95.6	-84.5	0	0	0	0	114.8
360	S	25.7	Very low	28.2	Very low	94 Å²	94	126.8 Å²	126.8	66%	0.657	78%	0.784	S	S	*	*			cis	-163.3	-177.5	-4.5	-107	0	0	0	0	107.8
361	H	27.1	Very low	28	Very low	171 Å²	171	125.1 Å²	125.1	79%	0.792	78%	0.784	S	S	*	*			cis	-140.2	-99.9	10.6	-148.8	-65.9	0	0	0	113.4
362	S	24.7	Very low	28	Very low	94 Å²	94	130 Å²	130	66%	0.657	79%	0.789	S	S	*	*			trans	-170.8	162.3	-166.5	56.9	0	0	0	0	112.9
363	H	32.9	Very low	27.7	Very low	179 Å²	179	131.5 Å²	131.5	83%	0.829	78%	0.782	S	S	*	*			trans	-58.5	166.8	164.4	-57	-79.8	0	0	0	113.1
364	P	35.2	Very low	27.5	Very low	126 Å²	126	131.7 Å²	131.7	82%	0.818	77%	0.771	S	S	*	*				-125.2	162.2	127.4	36.9	-31.9	0	0	0	113.9
365	R	28.8	Very low	27.4	Very low	234 Å²	234	136 Å²	136	88%	0.883	77%	0.771	S	S	*	*			trans	-96.6	146.1	170.9	-69.1	172.8	160.6	-151	-1.4	111.2
366	Q	26.8	Very low	27.4	Very low	188 Å²	188	139.5 Å²	139.5	88%	0.879	77%	0.766	S	S	*	*			trans	-170.9	123.8	136.3	-104.4	155.5	82	0	0	107.9
367	A	25.3	Very low	27.4	Very low	92 Å²	92	144.3 Å²	144.3	76%	0.76	77%	0.772	S	S	*	*				92.3	115.1	78.5	0	0	0	0	0	112.2
368	S	31.7	Very low	27.1	Very low	120 Å²	120	139.4 Å²	139.4	84%	0.839	77%	0.769	S	S	*	*			trans	-78.4	165.1	176.8	-41.4	0	0	0	0	112
369	P	31.7	Very low	27	Very low	112 Å²	112	144.6 Å²	144.6	73%	0.727	78%	0.779	S	S	*	*				-142.4	165.2	125.9	39.1	-27.1	0	0	0	116.3
370	T	26.1	Very low	26.9	Very low	113 Å²	113	145.2 Å²	145.2	69%	0.693	78%	0.784	S	S	*	*			trans	56.6	109.4	150.4	44.9	0	0	0	0	121.4
371	S	25.7	Very low	27.7	Very low	110 Å²	110	147 Å²	147	77%	0.769	79%	0.793	S	S	*	*			trans	-60.9	149.3	140.4	170.7	0	0	0	0	111
372	H	26.4	Very low	27.6	Very low	167 Å²	167	142.7 Å²	142.7	77%	0.773	80%	0.795	S	S	*	*			trans	-132.7	109.2	164.9	-105.9	-73.7	0	0	0	113.4
373	Q	22.6	Very low	27.6	Very low	160 Å²	160	142 Å²	142	75%	0.748	80%	0.803	S	S	*	*			trans	-67.7	163.1	146.5	-70.6	179.8	-9.2	0	0	108.8
374	V	24.4	Very low	27.3	Very low	113 Å²	113	140.4 Å²	140.4	69%	0.685	81%	0.806	S	S	*	*			cis	-164.6	176.4	9.4	-120.3	0	0	0	0	110.8
375	H	25.1	Very low	27.8	Very low	168 Å²	168	140 Å²	140	78%	0.778	80%	0.803	S	S	*	*			trans	78.7	127.1	148.8	-84.2	31.3	0	0	0	119.9
376	M	26.1	Very low	28.3	Very low	160 Å²	160	133.7 Å²	133.7	79%	0.788	79%	0.792	S	S	*	*				-151.4	141.6	106.6	-98.2	-56.7	-179.1	0	0	112.1
377	M	25.4	Very low	28.2	Very low	169 Å²	169	133.6 Å²	133.6	83%	0.833	79%	0.794	S	S	*	*			trans	57	119.1	152.3	-64.4	173.9	179.4	0	0	121.1
378	S	23.7	Very low	28.2	Very low	116 Å²	116	132.6 Å²	132.6	81%	0.811	79%	0.793	S	S	*	*			trans	-103.1	145.8	170.9	49.4	0	0	0	0	112.4
379	R	26.1	Very low	28.5	Very low	249 Å²	249	132.4 Å²	132.4	94%	0.94	79%	0.789	S	S	*	*			trans	-166.9	136.4	152.4	-114.5	173.3	-177.2	-157.3	-1.3	112.5
380	S	24.3	Very low	28.3	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	79%	0.787	S	S	*	*			trans	-174.2	170.2	176.3	-74.9	0	0	0	0	108.2
381	P	41.5	Very low	28.3	Very low	130 Å²	130	135.1 Å²	135.1	84%	0.844	78%	0.782	S	S	*	*				-134	173.4	-57.5	39.1	-23.9	0	0	0	113
382	G	24.8	Very low	28.4	Very low	81 Å²	81	132.3 Å²	132.3	84%	0.835	76%	0.763	S	S	*	*			trans	161.4	148.8	168.8	0	0	0	0	0	112.7
383	G	25.6	Very low	28.5	Very low	81 Å²	81	130 Å²	130	84%	0.835	76%	0.756	S	S	*	*			cis	-165.2	173.5	-1.1	0	0	0	0	0	113.6
384	V	25.3	Very low	28.8	Very low	145 Å²	145	127 Å²	127	88%	0.879	75%	0.745	S	S	*	*			trans	-92.7	-178.7	177.9	-90.7	0	0	0	0	111.5
385	P	47.3	Very low	29.5	Very low	116 Å²	116	126.1 Å²	126.1	75%	0.753	74%	0.741	S	S	*	*			cis	-125	-136	7.8	31.2	-3.9	0	0	0	110.6
386	P	38.8	Very low	29.7	Very low	103 Å²	103	126.6 Å²	126.6	67%	0.669	74%	0.744	S	S	*	*			cis	-143.9	178.7	-11.5	45.8	-26.9	0	0	0	119.1
387	M	25.5	Very low	29.8	Very low	185 Å²	185	122.8 Å²	122.8	91%	0.911	75%	0.745	S	S	*	*			trans	59.8	140.1	155.9	-59.4	-35.7	-172.6	0	0	124.1
388	G	24.9	Very low	30	Very low	72 Å²	72	122.8 Å²	122.8	74%	0.742	75%	0.745	S	S	*	*			trans	-113.9	-147.2	171.5	0	0	0	0	0	113.1
389	P	38.4	Very low	30.2	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	74%	0.742	S	S	*	*			cis	-128	-140.7	25.1	30.4	-4	0	0	0	113.2
390	E	25.7	Very low	30.4	Very low	148 Å²	148	117.8 Å²	117.8	69%	0.692	73%	0.729	S	S	*	*			cis	-157.7	-119.4	9.7	-159.4	63.9	-81	0	0	115.4
391	F	26.5	Very low	30.9	Very low	133 Å²	133	118.5 Å²	118.5	58%	0.583	73%	0.731	S	S	*	*			trans	-116.3	178	-163.9	-71.9	-177.2	0	0	0	113.3
392	S	28.8	Very low	30.2	Very low	51 Å²	51	117.6 Å²	117.6	36%	0.357	73%	0.728	S	S	.	*			cis	-155	-167.7	-1.5	-129.4	0	0	0	0	110.6	M215 M216	M215-S392 PolarHBondContact N-OG 2.82Å; M215-S392 VanDerWaalsContact N-OG 3.14Å; M215-S392 WeakPolarHBondContact O-CB 3.35Å; M216-S392 WeakPolarHBondContact CE-O 3.43Å
393	D	27.5	Very low	30.4	Very low	120 Å²	120	125 Å²	125	64%	0.642	73%	0.73	S	S	*	*			trans	-147.2	171.8	-173.3	-167.7	21.9	0	0	0	116.7	M216	M216-D393 VanDerWaalsContact CG-C 3.46Å
394	L	29.3	Very low	30.6	Very low	97 Å²	97	124.8 Å²	124.8	51%	0.508	72%	0.721	S	S	.	*			trans	75	166	175.2	-98.6	69.5	0	0	0	118	M216 Q396	M216-L394 WeakPolarHBondContact CB-O 3.23Å; L394-Q396 HydrophobicContact CD2-CG 4.45Å
395	P	39.5	Very low	30.7	Very low	93 Å²	93	123.1 Å²	123.1	60%	0.604	72%	0.716	S	S	*	*			cis	-134.2	138.7	4.1	37.3	-17.4	0	0	0	119.7
396	Q	28.8	Very low	29.8	Very low	179 Å²	179	125.9 Å²	125.9	84%	0.836	72%	0.723	S	S	*	*				48.6	137.6	125	-59.6	173	-30.3	0	0	124.8	L394	L394-Q396 HydrophobicContact CD2-CG 4.45Å
397	G	28.4	Very low	29.4	Very low	79 Å²	79	127.7 Å²	127.7	81%	0.814	73%	0.727	S	S	*	*			trans	-169	118.7	159.6	0	0	0	0	0	113.5
398	M	29.4	Very low	29.5	Very low	169 Å²	169	125.8 Å²	125.8	83%	0.833	72%	0.72	S	S	*	*			trans	-74.1	160.2	-169.3	-54.8	-177.9	-68.9	0	0	114.2
399	M	28.3	Very low	29.6	Very low	151 Å²	151	128.6 Å²	128.6	74%	0.744	72%	0.718	S	S	*	*				-169.1	179.3	70.5	-113.5	-67.7	124.3	0	0	114.6
400	T	29.4	Very low	29	Very low	109 Å²	109	129.9 Å²	129.9	67%	0.669	72%	0.718	S	S	*	*			trans	-82.8	178.3	-170.1	61.6	0	0	0	0	115.4
401	P	34.3	Very low	29.2	Very low	131 Å²	131	132.5 Å²	132.5	85%	0.851	72%	0.723	S	S	*	*				-135.2	172.6	101.5	40.2	-32.3	0	0	0	115.1
402	S	27	Very low	29.2	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	73%	0.73	S	S	*	*			trans	-147.6	137.7	176.2	170.5	0	0	0	0	111.2
403	R	29.9	Very low	29.2	Very low	235 Å²	235	137.2 Å²	137.2	89%	0.887	74%	0.741	S	S	*	*			trans	-178.8	127	150.7	-103.7	-177	165.2	161.3	-2.2	109.1
404	A	28.9	Very low	29.1	Very low	77 Å²	77	139.1 Å²	139.1	64%	0.636	75%	0.745	S	S	*	*				75.1	108.6	79.3	0	0	0	0	0	111.9
405	S	28	Very low	29	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	77%	0.767	S	S	*	*				79.8	130.7	56.8	76.4	0	0	0	0	114.4
406	L	29.4	Very low	28.4	Very low	173 Å²	173	146.8 Å²	146.8	91%	0.906	78%	0.777	S	S	*	*			trans	-163.1	172.1	149.2	-110.2	165.2	0	0	0	111.4
407	N	29.6	Very low	28.2	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	77%	0.774	S	S	*	*			trans	-135.5	169.3	-171.7	-94.2	-63.7	0	0	0	110.4
408	L	27.7	Very low	28.9	Very low	146 Å²	146	144 Å²	144	76%	0.764	77%	0.774	S	S	*	*			trans	70.1	159.7	168.1	-95.3	58.8	0	0	0	114.7
409	D	27.9	Very low	29.8	Very low	131 Å²	131	141.8 Å²	141.8	70%	0.701	77%	0.772	S	S	*	*			cis	-150.3	-166.3	23.4	-134.1	-33	0	0	0	116.3
410	L	25.8	Very low	29.7	Very low	142 Å²	142	138.4 Å²	138.4	74%	0.743	78%	0.776	S	S	*	*			trans	-56.7	141.5	-170.3	-103.4	74.1	0	0	0	122.3
411	Y	28.8	Very low	29.7	Very low	204 Å²	204	137.4 Å²	137.4	80%	0.8	78%	0.779	S	S	*	*				66.3	159.7	127.8	-102.6	-106.9	0	0	0	125.8
412	E	25.5	Very low	29.5	Very low	157 Å²	157	139.3 Å²	139.3	73%	0.734	78%	0.782	S	S	*	*			trans	70	143.8	167.4	-68.2	-164.6	151.1	0	0	118.9
413	H	30.5	Very low	29.6	Very low	125 Å²	125	137.5 Å²	137.5	58%	0.579	78%	0.781	S	S	*	*			cis	-164.1	162.3	-18.8	-121.3	-10.6	0	0	0	114
414	H	25.3	Very low	29.6	Very low	160 Å²	160	132.9 Å²	132.9	74%	0.741	78%	0.779	S	S	*	*			trans	72.3	164	155.1	-54.6	-31.1	0	0	0	123.3
415	W	26.1	Very low	30.3	Very low	252 Å²	252	135 Å²	135	96%	0.955	79%	0.786	S	S	*	*			trans	-125.2	162.6	-179.7	-102.9	93.5	0	0	0	110.5
416	A	26.6	Very low	30.3	Very low	99 Å²	99	134.4 Å²	134.4	82%	0.818	79%	0.788	S	S	*	*			trans	103.8	137.7	150.2	0	0	0	0	0	119.9
417	G	24.9	Very low	30.3	Very low	75 Å²	75	130.6 Å²	130.6	77%	0.773	78%	0.781	S	S	*	*			trans	129.3	123.6	162.1	0	0	0	0	0	116.9
418	P	44.1	Very low	30.2	Very low	125 Å²	125	135.7 Å²	135.7	81%	0.812	79%	0.79	S	S	*	*			trans	-116.5	-159.3	171	44.5	-33.6	0	0	0	111.2
419	P	46.9	Very low	30.3	Very low	122 Å²	122	137 Å²	137	79%	0.792	79%	0.792	S	S	*	*			cis	-130.3	176.3	-32.2	25.2	-3.6	0	0	0	114.3
420	G	26.8	Very low	30.9	Very low	80 Å²	80	135.5 Å²	135.5	83%	0.825	79%	0.79	S	S	*	*			trans	87	154.9	150.9	0	0	0	0	0	117.8
421	A	29.6	Very low	31.1	Very low	89 Å²	89	137 Å²	137	74%	0.736	79%	0.793	S	S	*	*			cis	-153.2	166.5	-1.2	0	0	0	0	0	112.5
422	D	29.7	Very low	31.8	Very low	171 Å²	171	131.5 Å²	131.5	91%	0.914	78%	0.782	S	S	*	*			trans	59.5	149.4	163	-59.5	-29.4	0	0	0	121.6
423	G	30	Very low	31.8	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	79%	0.788	S	S	*	*			trans	129.4	58.8	160.3	0	0	0	0	0	119.1
424	T	28.9	Very low	31.6	Very low	138 Å²	138	130.1 Å²	130.1	85%	0.847	79%	0.794	S	S	*	*			trans	-69.5	154.1	151.2	52.6	0	0	0	0	110.1
425	P	44.6	Very low	32.6	Very low	122 Å²	122	127.9 Å²	127.9	79%	0.792	79%	0.794	S	S	*	*			cis	-116.5	-158.4	13	37.5	-18.4	0	0	0	110.7
426	A	28.5	Very low	32.6	Very low	98 Å²	98	125.5 Å²	125.5	81%	0.81	79%	0.791	S	S	*	*			cis	-154.8	179.9	13	0	0	0	0	0	112.5
427	A	28.5	Very low	32.5	Very low	93 Å²	93	132.5 Å²	132.5	77%	0.769	80%	0.796	S	S	*	*			trans	-101.7	145.2	178.6	0	0	0	0	0	113.5
428	R	27.5	Very low	32.6	Very low	247 Å²	247	132.2 Å²	132.2	93%	0.932	79%	0.793	S	S	*	*				-171.6	125.6	121.2	-109.6	179.4	177.4	177.4	-0.9	115.2
429	Q	30.2	Very low	31.7	Very low	175 Å²	175	135.8 Å²	135.8	82%	0.818	80%	0.799	S	S	*	*			trans	-63	165.3	140	-81.8	-169.9	-0.8	0	0	109.8
430	P	40.7	Very low	30.8	Very low	99 Å²	99	136.5 Å²	136.5	64%	0.643	80%	0.801	S	S	*	*			cis	-146.8	-179	28.3	46.7	-28.2	0	0	0	117.1
431	Q	29.3	Very low	30.7	Very low	173 Å²	173	144.5 Å²	144.5	81%	0.808	81%	0.806	S	S	*	*			trans	42.9	169.9	132.5	-77.7	-170.7	-14.8	0	0	122.9
432	P	44.3	Very low	30.8	Very low	88 Å²	88	146.4 Å²	146.4	57%	0.571	81%	0.809	S	S	*	*			cis	-136.9	-163.1	-39.5	39	-21.3	0	0	0	111.9
433	Q	25.7	Very low	31.5	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	80%	0.799	S	S	*	*			trans	70.8	137.6	156.4	-68.7	165.8	5.5	0	0	118.6
434	G	26.6	Very low	31.6	Very low	69 Å²	69	145.2 Å²	145.2	71%	0.711	80%	0.799	S	S	*	*			trans	-98.8	-138.2	157.9	0	0	0	0	0	109.5
435	P	45.3	Very low	31.8	Very low	114 Å²	114	149.7 Å²	149.7	74%	0.74	80%	0.801	S	S	*	*			cis	-135.1	-157.4	-4	27.1	-1	0	0	0	112.7
436	F	25.2	Very low	31.3	Very low	202 Å²	202	148.9 Å²	148.9	89%	0.886	79%	0.794	S	S	*	*			trans	87.6	155.2	165.4	-76.6	-80.1	0	0	0	121.2
437	R	26.4	Very low	31.7	Very low	246 Å²	246	151.5 Å²	151.5	93%	0.928	79%	0.794	S	S	*	*			trans	-82.2	161.1	-173.2	-59.9	170.9	163.3	-155.2	-2.3	112.5
438	G	25.5	Very low	32	Very low	69 Å²	69	151.7 Å²	151.7	71%	0.711	79%	0.79	S	S	*	*			trans	-172.9	91.4	162.2	0	0	0	0	0	117.3
439	E	24.9	Very low	32.3	Very low	200 Å²	200	149.4 Å²	149.4	94%	0.935	79%	0.787	S	S	*	*			trans	61.6	-177.5	149	-52.7	-153.2	127.4	0	0	121.2
440	V	28.7	Very low	32.6	Very low	137 Å²	137	147.9 Å²	147.9	83%	0.83	79%	0.785	S	S	*	*			trans	-151.2	132.9	-151.3	171.8	0	0	0	0	112.4
441	R	24.9	Very low	32.2	Very low	247 Å²	247	149.1 Å²	149.1	93%	0.932	80%	0.796	S	S	*	*			trans	-170.2	148.7	142	-109.9	160.8	179.8	158.7	0.7	115.9
442	V	31.2	Very low	32.7	Very low	130 Å²	130	152.4 Å²	152.4	79%	0.788	80%	0.801	S	S	*	*			trans	-80	172.4	170.2	-115.9	0	0	0	0	111
443	P	44.5	Very low	32.4	Very low	110 Å²	110	154 Å²	154	71%	0.714	81%	0.814	S	S	*	*			cis	-161.6	155.7	47.3	42.3	-18.1	0	0	0	123.3
444	S	32.1	Very low	32.9	Very low	109 Å²	109	150.2 Å²	150.2	76%	0.762	81%	0.814	S	S	*	*			trans	68.2	156.3	132.2	-61.1	0	0	0	0	127.5
445	R	32.5	Very low	33.3	Very low	231 Å²	231	151.3 Å²	151.3	87%	0.872	82%	0.817	S	S	*	*			trans	97.2	149.4	152.2	-62.5	-156.4	168.1	-179.4	-3.2	120.6
446	T	35.5	Very low	34.3	Very low	106 Å²	106	151.8 Å²	151.8	65%	0.65	82%	0.82	S	S	*	*			cis	-170.5	158.7	-18.3	27.3	0	0	0	0	114.8
447	N	36.8	Very low	35	Very low	152 Å²	152	150 Å²	150	81%	0.813	82%	0.819	S	S	*	*			trans	76	172.7	156	-57.7	-9.5	0	0	0	119.4
448	S	34.8	Very low	35.6	Very low	98 Å²	98	141.5 Å²	141.5	69%	0.685	81%	0.809	S	S	*	*			cis	-162.3	139.5	10.5	-148.8	0	0	0	0	118
449	F	33.2	Very low	36.2	Very low	198 Å²	198	144.9 Å²	144.9	87%	0.868	82%	0.815	S	S	*	*			trans	47.5	157.9	146.3	-82.2	-92.6	0	0	0	127.9
450	N	35.8	Very low	36.9	Very low	144 Å²	144	146.7 Å²	146.7	77%	0.77	81%	0.813	S	S	*	*			trans	-156.9	166.9	-166.7	52.5	-138.2	0	0	0	117.1
451	S	33.4	Very low	38.3	Very low	125 Å²	125	145.5 Å²	145.5	87%	0.874	81%	0.808	S	S	*	*			trans	-141.3	177.9	-177.6	-67.2	0	0	0	0	116.2
452	R	40.4	Very low	39.1	Very low	241 Å²	241	139.4 Å²	139.4	91%	0.909	80%	0.799	S	S	*	*			trans	-161	174.7	-171.9	-127.3	-172.4	-170.5	-167.9	4	119.5
453	S	37.2	Very low	39.6	Very low	122 Å²	122	140.8 Å²	140.8	85%	0.853	80%	0.799	S	S	*	*			trans	-154.9	177.9	177.1	-48.4	0	0	0	0	114.7
454	A	36.6	Very low	39.1	Very low	104 Å²	104	141.9 Å²	141.9	86%	0.86	80%	0.803	S	S	*	*			trans	-157.6	-177	178.5	0	0	0	0	0	111
455	A	34.6	Very low	39.2	Very low	93 Å²	93	141.5 Å²	141.5	77%	0.769	81%	0.807	S	S	*	*			cis	-141.3	-124.6	7.1	0	0	0	0	0	111
456	P	66.3	Low	39.1	Very low	124 Å²	124	134.1 Å²	134.1	81%	0.805	80%	0.803	S	S	*	*			cis	-131.2	-101.5	-0.7	39	-15	0	0	0	117.6
457	N	39.7	Very low	38.9	Very low	163 Å²	163	137.8 Å²	137.8	87%	0.872	81%	0.81	S	S	*	*			trans	-116.5	155.4	-158.8	-66.5	-16.5	0	0	0	115.6
458	G	39.2	Very low	38.6	Very low	69 Å²	69	137.2 Å²	137.2	71%	0.711	80%	0.802	S	S	*	*			cis	165.3	-174.2	-8.4	0	0	0	0	0	116
459	V	38.3	Very low	38.3	Very low	139 Å²	139	138.1 Å²	138.1	84%	0.842	80%	0.799	S	S	*	*			trans	98	111.7	163.7	-171.9	0	0	0	0	121
460	R	38.7	Very low	38.2	Very low	238 Å²	238	133.6 Å²	133.6	90%	0.898	79%	0.792	S	S	*	*			trans	69.9	142.4	159.2	-76.4	-179.8	168.9	173.3	-3	120
461	P	59.5	Low	37.9	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	79%	0.79	S	S	*	*			trans	-119.3	-156.7	-144.2	35.8	-13.7	0	0	0	112
462	T	41.9	Very low	37.7	Very low	120 Å²	120	134.7 Å²	134.7	74%	0.736	79%	0.793	S	S	*	*			cis	-172.1	148.8	30.2	-11.3	0	0	0	0	107
463	M	39.8	Very low	37.1	Very low	159 Å²	159	126.7 Å²	126.7	78%	0.783	79%	0.785	S	S	*	*			cis	-141.2	-138.4	-8.6	-130.4	-60	-178.7	0	0	107
464	T	35.4	Very low	38.1	Very low	132 Å²	132	126.9 Å²	126.9	81%	0.81	78%	0.783	S	S	*	*			cis	-144.2	-143.7	4.9	-36.4	0	0	0	0	108.8
465	A	34.3	Very low	39	Very low	101 Å²	101	126.5 Å²	126.5	84%	0.835	77%	0.772	S	S	*	*			trans	-150.9	156.2	-176	0	0	0	0	0	113.9
466	G	30.3	Very low	39	Very low	76 Å²	76	129 Å²	129	78%	0.784	77%	0.772	S	S	*	*			trans	159.7	90.6	162.3	0	0	0	0	0	119.9
467	K	31.8	Very low	37.4	Very low	183 Å²	183	128.4 Å²	128.4	80%	0.796	77%	0.767	S	S	*	*			trans	40.2	129.8	136.2	-85.1	-167.2	170.9	-146.5	0	125.3
468	Q	30.3	Very low	36.9	Very low	140 Å²	140	127.5 Å²	127.5	65%	0.654	76%	0.76	S	S	*	*				61.6	139	122.5	-76.1	-176.4	-93.4	0	0	125.4
469	D	27.7	Very low	36.5	Very low	118 Å²	118	129.8 Å²	129.8	63%	0.631	76%	0.761	S	S	*	*			trans	82	113.6	135.8	-82.9	-67.8	0	0	0	125.5
470	S	31.2	Very low	36.3	Very low	102 Å²	102	127.5 Å²	127.5	71%	0.713	76%	0.756	S	S	*	*				64.4	131.5	113	-61.4	0	0	0	0	125.8
471	S	29.8	Very low	36.1	Very low	104 Å²	104	122.3 Å²	122.3	73%	0.727	75%	0.751	S	S	*	*				95.1	123.3	123.2	178.7	0	0	0	0	123.9
472	M	28.2	Very low	34.9	Very low	189 Å²	189	123.4 Å²	123.4	93%	0.931	76%	0.756	S	S	*	*			trans	64.8	144.5	141.8	-67.3	-77.6	-167.2	0	0	123.6
473	G	28.4	Very low	35	Very low	73 Å²	73	122.9 Å²	122.9	75%	0.753	76%	0.757	S	S	*	*			trans	124.7	122.7	133.5	0	0	0	0	0	119.5
474	P	58.4	Low	35.1	Very low	125 Å²	125	121 Å²	121	81%	0.812	76%	0.756	S	S	*	*			trans	-115.4	-154.9	167.8	46.3	-35.2	0	0	0	110.3
475	P	55.2	Low	35.4	Very low	96 Å²	96	120.3 Å²	120.3	62%	0.623	75%	0.754	S	S	*	*			cis	-136.5	-170.5	-14.3	43	-25.5	0	0	0	115.2
476	N	33.8	Very low	36.1	Very low	145 Å²	145	123.2 Å²	123.2	78%	0.775	75%	0.754	S	S	*	*			trans	70.2	159	149.1	-67.6	-8.1	0	0	0	119.6
477	T	32.8	Very low	36.1	Very low	112 Å²	112	128.7 Å²	128.7	69%	0.687	76%	0.759	S	S	*	*			cis	-153.1	162.2	-4	-118.4	0	0	0	0	113.1
478	I	30.1	Very low	36.1	Very low	144 Å²	144	129 Å²	129	74%	0.738	76%	0.763	S	S	*	*			trans	-78.5	175.9	-177.2	51.7	167.2	0	0	0	114.5
479	T	30.6	Very low	37.3	Very low	118 Å²	118	127.9 Å²	127.9	72%	0.724	77%	0.768	S	S	*	*			cis	-167.4	170.6	28.9	-25.3	0	0	0	0	113.3
480	A	33.9	Very low	37.5	Very low	90 Å²	90	129.3 Å²	129.3	74%	0.744	78%	0.781	S	S	*	*			trans	75.1	155.7	147.7	0	0	0	0	0	119.2
481	V	33.9	Very low	37.8	Very low	130 Å²	130	134.4 Å²	134.4	79%	0.788	79%	0.79	S	S	*	*			cis	-166.7	162.1	-12.5	125.1	0	0	0	0	108.9
482	T	34.3	Very low	38.3	Very low	135 Å²	135	135.2 Å²	135.2	83%	0.828	80%	0.796	S	S	*	*			trans	154.7	157.4	148.1	-68.8	0	0	0	0	113.5
483	S	45.3	Very low	38.6	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	79%	0.793	S	S	*	*			trans	-147.9	152	169.1	61.3	0	0	0	0	112.5
484	P	42	Very low	39	Very low	119 Å²	119	142.1 Å²	142.1	77%	0.773	80%	0.8	S	S	*	*				-150.6	-152.5	111.4	42.8	-24.9	0	0	0	110.9
485	P	42.1	Very low	37.6	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	80%	0.802	S	S	*	*			cis	-128.1	-163.6	-17.1	42.8	-25.1	0	0	0	114
486	I	48.2	Very low	36.5	Very low	163 Å²	163	147.1 Å²	147.1	84%	0.836	82%	0.816	S	S	*	*			trans	-143.2	148.7	-179.7	-59.3	173.9	0	0	0	112.2
487	Q	30.5	Very low	36.7	Very low	190 Å²	190	151.8 Å²	151.8	89%	0.888	82%	0.822	S	S	*	*			trans	-144	178.6	161.2	-78.1	-152.6	1.3	0	0	114.8
488	Q	32.1	Very low	36.8	Very low	189 Å²	189	152.3 Å²	152.3	88%	0.883	83%	0.828	S	S	*	*			trans	-103.3	176.7	-142.8	-80.2	-165.7	13	0	0	119.1
489	P	54	Low	37.2	Very low	117 Å²	117	154.3 Å²	154.3	76%	0.76	83%	0.834	S	S	*	*			trans	-111.2	175.4	-165.5	42.3	-34.9	0	0	0	117.6
490	V	32.8	Very low	37.4	Very low	149 Å²	149	154.6 Å²	154.6	90%	0.903	84%	0.838	S	S	*	*			trans	-134.2	162.1	-177.2	-174.1	0	0	0	0	113
491	K	37.2	Very low	37.3	Very low	208 Å²	208	160.3 Å²	160.3	90%	0.904	85%	0.846	S	S	*	*			trans	-104	178.6	-162	-61.8	176.4	-178.1	173.6	0	115.8
492	S	39.9	Very low	37.5	Very low	122 Å²	122	161 Å²	161	85%	0.853	85%	0.851	S	S	*	*			trans	-102.9	170.9	-163.8	57.5	0	0	0	0	116.8
493	I	34.4	Very low	37.2	Very low	166 Å²	166	159.2 Å²	159.2	85%	0.851	85%	0.849	S	S	*	*			trans	-141.8	160.3	178.9	-149.6	165.8	0	0	0	112.5
494	R	37.3	Very low	36.7	Very low	241 Å²	241	161.2 Å²	161.2	91%	0.909	86%	0.857	S	S	*	*			trans	-110.3	157.1	-179.3	-74.2	-176	174.8	-178.3	-0.6	112.8
495	V	30.3	Very low	36	Very low	140 Å²	140	158.5 Å²	158.5	85%	0.848	85%	0.85	S	S	*	*			trans	-137.4	151	178	-176	0	0	0	0	111.2
496	M	31.7	Very low	35.6	Very low	185 Å²	185	159.3 Å²	159.3	91%	0.911	86%	0.855	S	S	*	*			trans	-99	170.3	-173.8	-83.2	-69	161.1	0	0	115.3
497	R	38	Very low	34.6	Very low	243 Å²	243	156.8 Å²	156.8	92%	0.917	85%	0.851	S	S	*	*			trans	-102.8	142.1	-175.2	-107.7	-178.4	-178.2	162.6	1.2	113.3
498	P	34.2	Very low	34.6	Very low	123 Å²	123	155.1 Å²	155.1	80%	0.799	84%	0.843	S	S	*	*			trans	-107.4	160.3	168.7	38	-31.3	0	0	0	114.3
499	E	37.9	Very low	34.9	Very low	187 Å²	187	152 Å²	152	87%	0.874	84%	0.839	S	S	*	*			trans	-102	160.4	-177.9	-60	-176.4	138.7	0	0	114
500	P	35.5	Very low	33.7	Very low	124 Å²	124	149.2 Å²	149.2	81%	0.805	83%	0.832	S	S	*	*			trans	-97.1	155.3	178.4	37.4	-33.8	0	0	0	114.7
501	K	31.2	Very low	33.7	Very low	210 Å²	210	153.5 Å²	153.5	91%	0.913	83%	0.832	S	S	*	*			trans	-138.5	155.3	169.2	-69.7	-171.9	177.3	-177.6	0	111.7
502	T	38.4	Very low	33.3	Very low	144 Å²	144	150.6 Å²	150.6	88%	0.883	82%	0.823	S	S	*	*			trans	-108.2	152.9	-168.5	-42.8	0	0	0	0	112.7
503	A	29.1	Very low	32.8	Very low	97 Å²	97	150.9 Å²	150.9	80%	0.802	82%	0.82	S	S	*	*			trans	-151.8	165.4	171.9	0	0	0	0	0	112.6
504	V	34.3	Very low	32.7	Very low	150 Å²	150	147.2 Å²	147.2	91%	0.909	82%	0.815	S	S	*	*			trans	-136.1	168.4	-168.9	-153.9	0	0	0	0	111.1
505	G	27.2	Very low	32.2	Very low	62 Å²	62	144.8 Å²	144.8	64%	0.639	81%	0.814	S	S	*	*			trans	-144.3	167.6	178.7	0	0	0	0	0	115.9
506	P	34	Very low	32	Very low	135 Å²	135	142.8 Å²	142.8	88%	0.877	81%	0.811	S	S	*	*			trans	-108.2	-165.7	-154.2	41.8	-36.1	0	0	0	117
507	C	27.2	Very low	33	Very low	110 Å²	110	139.3 Å²	139.3	74%	0.743	80%	0.803	S	S	*	*			trans	-142.5	166	-159	-50.7	0	0	0	0	118
508	H	30.3	Very low	32.6	Very low	156 Å²	156	135 Å²	135	72%	0.722	80%	0.798	S	S	*	*			trans	83	158.1	148.6	-82.5	-45.7	0	0	0	122.6
509	P	37.8	Very low	32.5	Very low	123 Å²	123	135.9 Å²	135.9	80%	0.799	80%	0.801	S	S	*	*			cis	-96.6	-135.8	18.6	44	-40.7	0	0	0	115.7
510	G	29.7	Very low	32.1	Very low	59 Å²	59	131.7 Å²	131.7	61%	0.608	80%	0.799	S	S	*	*			cis	176.2	144.3	-11	0	0	0	0	0	116.7
511	W	31.7	Very low	31.9	Very low	239 Å²	239	135.1 Å²	135.1	91%	0.905	80%	0.804	S	S	*	*			trans	47	173	159	82.6	-0.8	0	0	0	122.8
512	M	28.6	Very low	32.8	Very low	147 Å²	147	130.6 Å²	130.6	72%	0.724	80%	0.796	S	S	*	*			cis	-152.8	-155.5	-1	-146.3	176.6	178	0	0	113.8
513	T	29.5	Very low	32.5	Very low	128 Å²	128	131.7 Å²	131.7	79%	0.785	80%	0.796	S	S	*	*			trans	-160.7	170.1	-160.8	45.8	0	0	0	0	113.3
514	A	32.2	Very low	33.4	Very low	89 Å²	89	132.9 Å²	132.9	74%	0.736	80%	0.795	S	S	*	*			cis	-179.9	-177.7	-23.8	0	0	0	0	0	111.7
515	Q	27.2	Very low	33.3	Very low	190 Å²	190	134.8 Å²	134.8	89%	0.888	79%	0.788	S	S	*	*			trans	105.9	114.6	157.4	-62.1	-170.7	-35.2	0	0	124.5
516	A	26.9	Very low	33.5	Very low	97 Å²	97	139.7 Å²	139.7	80%	0.802	80%	0.796	S	S	*	*			trans	52.2	170.7	132.1	0	0	0	0	0	124.8
517	P	51.7	Low	34.1	Very low	113 Å²	113	138.3 Å²	138.3	73%	0.734	79%	0.787	S	S	*	*			cis	-141	169.6	-11.1	42	-22.9	0	0	0	120.5
518	D	30.3	Very low	34.3	Very low	151 Å²	151	142.8 Å²	142.8	81%	0.807	80%	0.797	S	S	*	*			trans	62.2	151.9	141.6	-72.2	-42.9	0	0	0	131.6
519	T	30.9	Very low	34.5	Very low	142 Å²	142	143.2 Å²	143.2	87%	0.871	80%	0.799	S	S	*	*			trans	89.1	155.7	166.8	68.2	0	0	0	0	120.7
520	A	29.8	Very low	34.1	Very low	100 Å²	100	143.1 Å²	143.1	83%	0.826	80%	0.801	S	S	*	*			cis	-171.1	165.1	-26.5	0	0	0	0	0	112.3
521	E	31.4	Very low	34.2	Very low	195 Å²	195	150.5 Å²	150.5	91%	0.911	81%	0.812	S	S	*	*			trans	-157.5	160.3	-169	-159	161.6	-126.1	0	0	118.2
522	P	50.3	Low	34.7	Very low	115 Å²	115	144.3 Å²	144.3	75%	0.747	80%	0.803	S	S	*	*			trans	-134	-176.5	-172	44.2	-27.6	0	0	0	120.2
523	L	32.8	Very low	34.6	Very low	168 Å²	168	145.7 Å²	145.7	88%	0.88	81%	0.812	S	S	*	*			trans	-151.8	-175.8	179.1	-68.2	177.6	0	0	0	112
524	P	48	Very low	34.5	Very low	121 Å²	121	147.7 Å²	147.7	79%	0.786	81%	0.813	S	S	*	*			cis	-124.4	-138.3	0.6	28.4	-0.3	0	0	0	113.3
525	Y	32.6	Very low	34.7	Very low	191 Å²	191	148.4 Å²	148.4	75%	0.749	81%	0.81	S	S	*	*			cis	-167.8	160.1	7.2	-173.4	-94.9	0	0	0	112.5
526	M	29.9	Very low	34.6	Very low	164 Å²	164	143.2 Å²	143.2	81%	0.808	80%	0.8	S	S	*	*			trans	-154.5	155.7	177.6	-68.2	-86.8	65.5	0	0	116.6
527	P	47.1	Very low	34.6	Very low	107 Å²	107	147.7 Å²	147.7	70%	0.695	80%	0.804	S	S	*	*			trans	-146.7	152.5	174.4	41.8	-23.3	0	0	0	122.2
528	E	32.6	Very low	33.5	Very low	203 Å²	203	151.7 Å²	151.7	95%	0.949	81%	0.813	S	S	*	*			trans	49.8	166.6	155.8	-91.6	178.1	-143.2	0	0	128
529	E	33.1	Very low	33.5	Very low	166 Å²	166	150.7 Å²	150.7	78%	0.776	81%	0.814	S	S	*	*				-154.2	151	-122.5	-177.5	179.3	-97.7	0	0	118.6
530	S	29.7	Very low	33.1	Very low	120 Å²	120	154 Å²	154	84%	0.839	81%	0.811	S	S	*	*			trans	177.5	166.5	150.4	28.4	0	0	0	0	115.3
531	Y	32.6	Very low	33	Very low	214 Å²	214	154.8 Å²	154.8	84%	0.839	81%	0.809	S	S	*	*			trans	-109.7	175.7	-168.1	-77.3	-79.8	0	0	0	114.6
532	P	41	Very low	33.1	Very low	110 Å²	110	151.3 Å²	151.3	71%	0.714	80%	0.803	S	S	*	*			cis	-142.4	-172.1	16.4	45.6	-26.3	0	0	0	119
533	L	27	Very low	32.7	Very low	175 Å²	175	151.4 Å²	151.4	92%	0.916	80%	0.804	S	S	*	*			trans	81.9	156.7	165.2	-70.1	171.2	0	0	0	120.5
534	E	27.4	Very low	33.2	Very low	171 Å²	171	149.1 Å²	149.1	80%	0.799	80%	0.799	S	S	*	*			trans	-93	178.1	-164.7	-113.7	-140.9	110.5	0	0	114.2
535	P	37.4	Very low	32.5	Very low	104 Å²	104	148.7 Å²	148.7	68%	0.675	80%	0.796	S	S	*	*			cis	-135.7	177.2	5.4	40.6	-22.9	0	0	0	118
536	A	25.2	Very low	32.7	Very low	81 Å²	81	150.5 Å²	150.5	67%	0.669	80%	0.803	S	S	*	*			trans	84.4	149.9	145.2	0	0	0	0	0	124.3
537	Q	26.8	Very low	33.1	Very low	191 Å²	191	147.9 Å²	147.9	89%	0.893	80%	0.799	S	S	*	*			trans	82.1	129	163.4	-56.1	-165.6	11.4	0	0	121.3
538	E	28.7	Very low	32.3	Very low	197 Å²	197	152 Å²	152	92%	0.921	81%	0.805	S	S	*	*			trans	-86.4	146.9	178.2	-57.4	177.6	107.9	0	0	114.6
539	P	28.3	Very low	32.2	Very low	129 Å²	129	147.4 Å²	147.4	84%	0.838	80%	0.796	S	S	*	*			trans	-119.7	179	153.2	36.6	-25.9	0	0	0	114.1
540	R	24.6	Very low	32	Very low	213 Å²	213	147 Å²	147	80%	0.804	80%	0.798	S	S	*	*			trans	-93.1	136.2	-163.2	-90.8	-179.1	158	121.7	-5.3	117.4
541	C	27.4	Very low	31.8	Very low	115 Å²	115	149.4 Å²	149.4	78%	0.777	80%	0.801	S	S	*	*			trans	63.9	173.2	144.1	-56.7	0	0	0	0	117.4
542	P	32.9	Very low	31.8	Very low	122 Å²	122	146.3 Å²	146.3	79%	0.792	80%	0.797	S	S	*	*			cis	-127.5	-167.2	-1.7	45	-27.6	0	0	0	113.8
543	P	41.9	Very low	31.7	Very low	118 Å²	118	147.3 Å²	147.3	77%	0.766	80%	0.804	S	S	*	*			trans	-106.3	167.9	-169.9	41	-34.9	0	0	0	116.7
544	P	43.7	Very low	31.9	Very low	120 Å²	120	144 Å²	144	78%	0.779	80%	0.802	S	S	*	*				-140.2	-147.4	108.8	42	-27.9	0	0	0	110.7
545	P	32.6	Very low	31.8	Very low	112 Å²	112	139.6 Å²	139.6	73%	0.727	80%	0.802	S	S	*	*			cis	-130.2	-161	-20.1	42.2	-23.4	0	0	0	114.2
546	Y	35.9	Very low	31.2	Very low	228 Å²	228	143.6 Å²	143.6	89%	0.894	81%	0.812	S	S	*	*			trans	-161.6	137.2	167.7	-107.3	-90.4	0	0	0	110.7
547	P	39.8	Very low	32.2	Very low	109 Å²	109	145.5 Å²	145.5	71%	0.708	82%	0.817	S	S	*	*				-155.1	137.3	122.6	36.1	-16.9	0	0	0	116.5
548	K	29.6	Very low	32.1	Very low	193 Å²	193	139.7 Å²	139.7	84%	0.839	81%	0.809	S	S	*	*				83.9	145.7	88.3	-65.1	177.8	-179.2	174	0	118.7
549	S	29.8	Very low	32.1	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	80%	0.803	S	S	*	*			trans	76.6	160.7	157.4	-58.9	0	0	0	0	118.9
550	L	30.4	Very low	32.1	Very low	157 Å²	157	137.9 Å²	137.9	82%	0.822	80%	0.802	S	S	*	*			cis	167.4	130.8	-42.1	-106.6	170.9	0	0	0	108.8
551	L	25.6	Very low	32.2	Very low	172 Å²	172	136.6 Å²	136.6	90%	0.901	81%	0.805	S	S	*	*			trans	150.3	173.1	143.6	-83.1	163.3	0	0	0	115.7
552	I	31.4	Very low	32.1	Very low	148 Å²	148	134.6 Å²	134.6	76%	0.759	80%	0.804	S	S	*	*			trans	-128.5	157.8	-171.1	-30.1	174.9	0	0	0	108.9
553	P	39.2	Very low	31.8	Very low	132 Å²	132	133 Å²	133	86%	0.857	81%	0.809	S	S	*	*				-145	-174.3	112.9	37.6	-21.5	0	0	0	114.4
554	A	30.4	Very low	30.9	Very low	105 Å²	105	131 Å²	131	87%	0.868	81%	0.811	S	S	*	*			trans	-140.8	165.5	-174.9	0	0	0	0	0	112.8
555	G	26.1	Very low	30.1	Very low	79 Å²	79	130 Å²	130	81%	0.814	81%	0.812	S	S	*	*			trans	-179.3	147.6	173	0	0	0	0	0	115.3
556	E	24.8	Very low	29.7	Very low	187 Å²	187	130.8 Å²	130.8	87%	0.874	82%	0.821	S	S	*	*			trans	-119	179.4	172.5	-85.7	-167.2	163.7	0	0	108.9
557	P	45.3	Very low	29.4	Very low	121 Å²	121	123.7 Å²	123.7	79%	0.786	82%	0.817	S	S	*	*			cis	-134.5	175.1	-43.2	37	-21.6	0	0	0	113.2
558	G	26.6	Very low	28.8	Very low	69 Å²	69	124.6 Å²	124.6	71%	0.711	83%	0.826	S	S	*	*			trans	139.2	123.2	142.1	0	0	0	0	0	121.8
559	V	27.3	Very low	28.5	Very low	131 Å²	131	122.3 Å²	122.3	79%	0.794	82%	0.823	S	S	*	*			trans	70.9	104.4	132.6	-172.5	0	0	0	0	121.2
560	L	28.2	Very low	28.4	Very low	157 Å²	157	124 Å²	124	82%	0.822	82%	0.823	S	S	*	*			trans	62.1	153.4	146.3	-57.8	172.7	0	0	0	119
561	E	26.7	Very low	28.2	Very low	186 Å²	186	121.8 Å²	121.8	87%	0.869	82%	0.82	S	S	*	*			cis	-148.3	170.6	4.1	-153.7	177	-165.2	0	0	110.6
562	G	26.3	Very low	28.1	Very low	73 Å²	73	121.1 Å²	121.1	75%	0.753	82%	0.816	S	S	*	*			trans	114.4	57.3	147.2	0	0	0	0	0	122
563	G	25.5	Very low	27.8	Very low	88 Å²	88	118.4 Å²	118.4	91%	0.907	82%	0.816	S	S	*	*			trans	54.8	142.9	140.1	0	0	0	0	0	124.2
564	G	23.7	Very low	27.1	Very low	77 Å²	77	119.1 Å²	119.1	79%	0.794	82%	0.818	S	S	*	*			trans	137.1	75.5	148.5	0	0	0	0	0	120.5
565	A	26.4	Very low	26.9	Very low	98 Å²	98	118.1 Å²	118.1	81%	0.81	81%	0.809	S	S	*	*			trans	65	162	149.5	0	0	0	0	0	122.2
566	S	25.6	Very low	26.7	Very low	130 Å²	130	126.6 Å²	126.6	91%	0.909	82%	0.817	S	S	*	*			trans	71.3	155.7	176.7	79.8	0	0	0	0	117.5
567	G	28.2	Very low	26.8	Very low	79 Å²	79	121.8 Å²	121.8	81%	0.814	82%	0.818	S	S	*	*			trans	88.2	78	174.3	0	0	0	0	0	116.1
568	S	27.7	Very low	25.8	Very low	128 Å²	128	119.1 Å²	119.1	90%	0.895	81%	0.812	S	S	*	*			trans	-95.2	95.5	172.2	59.7	0	0	0	0	111.9
569	D	23.6	Very low	25.7	Very low	144 Å²	144	122.2 Å²	122.2	77%	0.77	82%	0.821	S	S	*	*			trans	-147.2	160.9	164.2	-158.4	0.4	0	0	0	111.1
570	L	28	Very low	25.7	Very low	144 Å²	144	121 Å²	121	75%	0.754	82%	0.818	S	S	*	*			trans	61.3	106.7	170.3	-63.7	170.2	0	0	0	117.9
571	S	24.9	Very low	25.6	Very low	109 Å²	109	118.3 Å²	118.3	76%	0.762	81%	0.813	S	S	*	*				137.2	154.5	105.1	70	0	0	0	0	114.7
572	I	24.8	Very low	25.6	Very low	158 Å²	158	114.4 Å²	114.4	81%	0.81	81%	0.806	S	S	*	*				-161.6	140.7	121	-103	161.5	0	0	0	108.1
573	A	25.3	Very low	25.7	Very low	92 Å²	92	116.9 Å²	116.9	76%	0.76	81%	0.812	S	S	*	*			trans	-105.6	146.2	171.6	0	0	0	0	0	110
574	T	24	Very low	25.5	Very low	146 Å²	146	116.3 Å²	116.3	90%	0.896	81%	0.806	S	S	*	*			trans	-162.8	169.9	149.5	2.2	0	0	0	0	111.9
575	A	25.4	Very low	25.6	Very low	84 Å²	84	115.7 Å²	115.7	69%	0.694	80%	0.8	S	S	*	*			trans	-115.9	177.5	-170.8	0	0	0	0	0	112.6
576	R	22.9	Very low	25.6	Very low	258 Å²	258	117.6 Å²	117.6	97%	0.974	81%	0.807	S	S	*	*			trans	82	145.3	171.8	-53.7	171.6	168.7	175.7	-4.5	115.5
577	G	26.5	Very low	25.6	Very low	86 Å²	86	114.9 Å²	114.9	89%	0.887	80%	0.799	S	S	*	*			trans	138.2	81.4	177.3	0	0	0	0	0	112.3
578	G	24.2	Very low	25.6	Very low	64 Å²	64	120.8 Å²	120.8	66%	0.66	80%	0.803	S	S	*	*			trans	-145.4	133.8	177.1	0	0	0	0	0	111.8
579	C	24.5	Very low	25.5	Very low	134 Å²	134	118.4 Å²	118.4	91%	0.905	79%	0.79	S	S	*	*			trans	58.5	162.2	-175.6	81.8	0	0	0	0	115.3
580	S	27.2	Very low	25.6	Very low	106 Å²	106	120.5 Å²	120.5	74%	0.741	80%	0.796	S	S	*	*			cis	-151.5	169.6	16.7	66.8	0	0	0	0	113
581	S	26.8	Very low	25.5	Very low	100 Å²	100	120.1 Å²	120.1	70%	0.699	80%	0.795	S	S	*	*			cis	-114.2	-91.6	-0.3	41.9	0	0	0	0	113.7
582	S	26.2	Very low	25.6	Very low	105 Å²	105	119.1 Å²	119.1	73%	0.734	79%	0.787	S	S	*	*			cis	-156.8	141.8	-2.2	-59.5	0	0	0	0	109
583	S	27.2	Very low	25.6	Very low	124 Å²	124	119.4 Å²	119.4	87%	0.867	79%	0.785	S	S	*	*			cis	-153.2	-28.1	-7.5	54.9	0	0	0	0	115.4
584	G	22.8	Very low	25.7	Very low	76 Å²	76	124.1 Å²	124.1	78%	0.784	79%	0.791	S	S	*	*			trans	-156.4	157.8	-178.8	0	0	0	0	0	115.4
585	G	24.2	Very low	25.8	Very low	65 Å²	65	123.1 Å²	123.1	67%	0.67	79%	0.785	S	S	*	*			cis	176.9	161.4	-5.7	0	0	0	0	0	115.1
586	S	27	Very low	25.9	Very low	138 Å²	138	126.9 Å²	126.9	97%	0.965	79%	0.786	S	S	*	*			trans	63.7	149.7	-178.8	75.2	0	0	0	0	116.3
587	G	26.4	Very low	26.1	Very low	72 Å²	72	121.8 Å²	121.8	74%	0.742	77%	0.773	S	S	*	*			cis	-179.9	165.1	-6.1	0	0	0	0	0	107.4
588	K	27.2	Very low	26.2	Very low	204 Å²	204	126.9 Å²	126.9	89%	0.887	77%	0.77	S	S	*	*			cis	-157	177.3	14.5	-63.3	177.3	171.4	-177.1	0	109.9
589	A	25.9	Very low	26.3	Very low	77 Å²	77	130.8 Å²	130.8	64%	0.636	78%	0.782	S	S	*	*			trans	66.7	117.1	151.2	0	0	0	0	0	117.9
590	E	25.7	Very low	26.5	Very low	189 Å²	189	134 Å²	134	88%	0.883	78%	0.78	S	S	*	*				77.6	138.9	72.6	-72.9	168.6	126.6	0	0	113.4
591	D	25.9	Very low	26.5	Very low	136 Å²	136	133.6 Å²	133.6	73%	0.727	78%	0.784	S	S	*	*			cis	-163.6	171.3	-7.3	174.5	50	0	0	0	110.8
592	S	27.3	Very low	26.6	Very low	87 Å²	87	132.6 Å²	132.6	61%	0.608	79%	0.789	S	S	*	*			trans	64	121.1	162.3	-77.3	0	0	0	0	118.4
593	Q	25.4	Very low	26.7	Very low	165 Å²	165	137.7 Å²	137.7	77%	0.771	80%	0.798	S	S	*	*			cis	75.2	99.9	49.4	-66.9	-157.9	1.9	0	0	117.1
594	Q	27.8	Very low	26.8	Very low	190 Å²	190	136.2 Å²	136.2	89%	0.888	79%	0.793	S	S	*	*			trans	174.2	117.8	137.1	-97.4	159.2	78.2	0	0	107.4
595	V	25.3	Very low	27.1	Very low	125 Å²	125	140.1 Å²	140.1	76%	0.758	79%	0.791	S	S	*	*			cis	76.9	135.5	20.8	-168.5	0	0	0	0	114.5
596	K	27.5	Very low	27.5	Very low	164 Å²	164	145.7 Å²	145.7	71%	0.713	80%	0.797	S	S	*	*			trans	74	140.7	-177.5	-82.1	-177	175	-75.7	0	116.3
597	E	26.8	Very low	27.5	Very low	151 Å²	151	143.9 Å²	143.9	71%	0.706	79%	0.79	S	S	*	*			cis	-150.8	172.9	-11.4	-158.8	137	-130.5	0	0	113.1
598	K	28	Very low	28	Very low	192 Å²	192	147.1 Å²	147.1	84%	0.835	80%	0.795	S	S	*	*			trans	-91.2	155	-175.4	-53.9	158.5	-179.2	165.1	0	111.7
599	T	28.3	Very low	28.2	Very low	146 Å²	146	145.6 Å²	145.6	90%	0.896	79%	0.789	S	S	*	*			trans	-140.5	142.7	139.7	-32	0	0	0	0	112.6
600	K	28.5	Very low	28.5	Very low	202 Å²	202	149.4 Å²	149.4	88%	0.878	80%	0.799	S	S	*	*			trans	-78.7	172.6	169.2	-100	-179.7	176.5	177.7	0	110.2
601	A	27.1	Very low	29.1	Very low	98 Å²	98	149.9 Å²	149.9	81%	0.81	80%	0.797	S	S	*	*			cis	-161.9	169.2	-6.3	0	0	0	0	0	109.7
602	G	27.4	Very low	29.6	Very low	78 Å²	78	153.1 Å²	153.1	80%	0.804	81%	0.805	S	S	*	*			trans	-171.1	147.9	167.4	0	0	0	0	0	110.2
603	K	29.9	Very low	29.8	Very low	212 Å²	212	158 Å²	158	92%	0.922	82%	0.819	S	S	*	*			trans	-142.5	149.9	-169.2	-145	-173.7	-174.8	-169.1	0	111.2
604	A	27.9	Very low	30.5	Very low	94 Å²	94	156.8 Å²	156.8	78%	0.777	82%	0.816	S	S	*	*			trans	65.5	153	168	0	0	0	0	0	117.4
605	E	29	Very low	31.2	Very low	158 Å²	158	156.9 Å²	156.9	74%	0.738	82%	0.816	S	S	*	*			cis	-150.7	-159.9	-37.8	-141.3	-162.9	125.4	0	0	110.6
606	K	32.4	Very low	31.9	Very low	181 Å²	181	156.3 Å²	156.3	79%	0.787	81%	0.813	S	S	*	*			trans	-67.6	144.5	-168	-55	178.3	-168.7	87.9	0	114.2
607	A	28.1	Very low	32.2	Very low	100 Å²	100	153.6 Å²	153.6	83%	0.826	82%	0.815	S	S	*	*			trans	-139.8	130.4	153.6	0	0	0	0	0	110
608	V	35.8	Very low	32.8	Very low	141 Å²	141	152.5 Å²	152.5	86%	0.855	82%	0.821	S	S	*	*			trans	-81.2	150.5	176.2	176.7	0	0	0	0	109.5
609	K	32.8	Very low	33.6	Very low	172 Å²	172	149.2 Å²	149.2	75%	0.748	82%	0.817	S	S	*	*			trans	-146.7	123.1	176	-155.7	167.1	-169.3	170.2	0	111.8
610	D	32.5	Very low	34	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	81%	0.81	S	S	*	*			trans	-61.5	140.7	-173.5	-63.1	-80.5	0	0	0	114
611	K	36.7	Very low	34.5	Very low	198 Å²	198	144.6 Å²	144.6	86%	0.861	81%	0.807	S	S	*	*			trans	-108.1	115	169	-75.4	-177.9	176.9	175.6	0	109.4	Q613	K611-Q613 PolarHBondContact O-N 3.01Å
612	K	36.3	Very low	35.1	Very low	205 Å²	205	150.2 Å²	150.2	89%	0.891	81%	0.807	S	S	*	*			trans	-57.1	120.9	165.7	-69.1	-172.5	176.4	-174.5	0	109	I614	K612-I614 PolarHBondContact O-N 2.86Å
613	Q	32.6	Very low	35.7	Very low	190 Å²	190	156.4 Å²	156.4	89%	0.888	81%	0.812	S	S	*	*			trans	-77.2	93.7	-172.9	-171.8	177.2	11.1	0	0	110.9	K611 Q615	K611-Q613 PolarHBondContact O-N 3.01Å; Q613-Q615 PolarHBondContact O-N 2.73Å
614	I	40	Very low	36.2	Very low	139 Å²	139	153.7 Å²	153.7	71%	0.713	81%	0.808	S	S	*	*			trans	-68.9	122.2	165.3	-57.3	178	0	0	0	107.5	K612 T616	K612-I614 PolarHBondContact O-N 2.86Å; I614-T616 HydrophobicContact CG2-CG2 4.24Å; I614-T616 PolarHBondContact O-N 2.75Å
615	Q	42.2	Very low	36.8	Very low	192 Å²	192	152.2 Å²	152.2	90%	0.897	80%	0.801	S	S	*	*			trans	-76.8	69.4	-176.6	-164.2	-175.9	43.9	0	0	112	Q613	Q613-Q615 PolarHBondContact O-N 2.73Å
616	T	40.7	Very low	37.5	Very low	113 Å²	113	156.7 Å²	156.7	69%	0.693	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-99.9	124.5	165.4	48.7	0	0	0	0	109.7	I614	I614-T616 HydrophobicContact CG2-CG2 4.24Å; I614-T616 PolarHBondContact O-N 2.75Å
617	S	33.8	Very low	38.1	Very low	107 Å²	107	155.5 Å²	155.5	75%	0.748	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58	148.8	173.6	-48.7	0	0	0	0	111.2	V619	S617-V619 PolarHBondContact O-N 3.25Å
618	P	38.7	Very low	38.7	Very low	128 Å²	128	160.2 Å²	160.2	83%	0.831	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-56.7	125.2	-170.8	-27.3	35.7	0	0	0	113.7
619	V	44.9	Very low	39.2	Very low	123 Å²	123	161.8 Å²	161.8	75%	0.745	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-67.6	131.5	164.3	178.4	0	0	0	0	107.6	S617 V621	S617-V619 PolarHBondContact O-N 3.25Å; V619-V621 PolarHBondContact O-N 3.36Å
620	P	36.9	Very low	39.7	Very low	118 Å²	118	161.2 Å²	161.2	77%	0.766	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-53.4	117.8	174.9	-28	35.7	0	0	0	110.9	R622	P620-R622 PolarHBondContact O-N 3.17Å; P620-R622 VanDerWaalsContact O-N 3.14Å
621	V	37.8	Very low	40.2	Very low	132 Å²	132	165.7 Å²	165.7	80%	0.8	82%	0.819	S	S	*	*			trans	-64.1	116	-174.9	178	0	0	0	0	108.9	V619 K623	V619-V621 PolarHBondContact O-N 3.36Å; V621-K623 PolarHBondContact O-N 2.84Å; V621-K623 VanDerWaalsContact O-N 3.12Å
622	R	39.8	Very low	40.3	Very low	217 Å²	217	162.4 Å²	162.4	82%	0.819	81%	0.807	S	S	*	*			trans	-62.4	115.4	163.8	-83.2	-172.7	166.9	91.2	-2.8	107.6	P620 N624	P620-R622 PolarHBondContact O-N 3.17Å; P620-R622 VanDerWaalsContact O-N 3.14Å; R622-N624 VanDerWaalsContact C-N 3.29Å; R622-N624 PolarHBondContact O-N 3.23Å; R622-N624 PolarHBondContact O-OD1 3.31Å
623	K	40.7	Very low	40.8	Very low	207 Å²	207	157.7 Å²	157.7	90%	0.9	80%	0.8	S	S	*	*			trans	-69.9	87	174.7	-171.2	177.2	-177.6	179.3	0	108.5	V621 G625	V621-K623 PolarHBondContact O-N 2.84Å; V621-K623 VanDerWaalsContact O-N 3.12Å; K623-G625 PolarHBondContact O-N 3.22Å
624	N	41.1	Very low	41.7	Very low	156 Å²	156	159.1 Å²	159.1	83%	0.834	80%	0.797	S	S	*	*			trans	-63.4	114.9	-179.2	-69.4	-12.7	0	0	0	109.9	R622	R622-N624 VanDerWaalsContact C-N 3.29Å; R622-N624 PolarHBondContact O-N 3.23Å; R622-N624 PolarHBondContact O-OD1 3.31Å
625	G	39.9	Very low	42.2	Very low	63 Å²	63	159.2 Å²	159.2	65%	0.649	80%	0.798	S	S	*	*	S	Bend	trans	-171	83.1	-178.6	0	0	0	0	0	112.9	K623	K623-G625 PolarHBondContact O-N 3.22Å
626	R	44.3	Very low	42.8	Very low	252 Å²	252	156.9 Å²	156.9	95%	0.951	78%	0.784	S	S	*	*			trans	57	90.3	175.4	-53.4	-175.6	-169.8	-174.8	4.3	114.7
627	D	43.7	Very low	43.5	Very low	155 Å²	155	158.1 Å²	158.1	83%	0.829	79%	0.792	S	S	*	*			trans	-136.1	42.2	176.3	-153.1	23.7	0	0	0	110
628	E	41.3	Very low	44.8	Very low	199 Å²	199	159 Å²	159	93%	0.93	78%	0.78	S	S	*	*			trans	-118.6	4.8	-177.1	-157.2	167.1	-141.3	0	0	113.5
629	E	46.3	Very low	46.3	Very low	174 Å²	174	154.5 Å²	154.5	81%	0.813	75%	0.751	S	S	*	*	S	Bend	trans	-113.3	147	170.7	-163.1	173.2	-174.4	0	0	109.7
630	K	42.9	Very low	47.5	Very low	160 Å²	160	154.1 Å²	154.1	70%	0.696	75%	0.751	S	S	*	*			trans	60.2	61.9	-169.7	-59.8	-168.1	173.8	177	0	115	E632	K630-E632 WeakPolarHBondContact CG-OE2 3.42Å; K630-E632 PolarHBondContact O-N 2.95Å; K630-E632 VanDerWaalsContact O-N 3.16Å
631	R	42.8	Very low	48.8	Very low	252 Å²	252	153.2 Å²	153.2	95%	0.951	74%	0.735	S	S	*	*			trans	-77.6	34.4	151.6	-153.2	-177.3	-174.7	172.9	3.7	112.5
632	E	40.1	Very low	50.1	Low	129 Å²	129	147.3 Å²	147.3	60%	0.603	70%	0.7	S	S	*	*			trans	-51.1	149.3	160.4	-103.7	74.4	-109.3	0	0	109.5	K630 R634	K630-E632 WeakPolarHBondContact CG-OE2 3.42Å; K630-E632 PolarHBondContact O-N 2.95Å; K630-E632 VanDerWaalsContact O-N 3.16Å; E632-R634 VanDerWaalsContact C-N 3.32Å; E632-R634 PolarHBondContact O-N 3.07Å
633	S	46.4	Very low	51.9	Low	105 Å²	105	142.8 Å²	142.8	73%	0.734	69%	0.687	S	S	*	*			trans	-67.5	86	177.1	52.3	0	0	0	0	111.5	I635	S633-I635 PolarHBondContact O-N 3.38Å
634	R	51.2	Low	53.6	Low	220 Å²	220	136.7 Å²	136.7	83%	0.83	66%	0.66	S	S	*	*			trans	-64.1	18.9	175.3	-71.2	176.9	60.4	-173.8	0.7	115.1	E632 K636	E632-R634 VanDerWaalsContact C-N 3.32Å; E632-R634 PolarHBondContact O-N 3.07Å; R634-K636 PolarHBondContact O-N 3.26Å
635	I	50.9	Low	54.9	Low	142 Å²	142	129.6 Å²	129.6	73%	0.728	62%	0.622	S	S	*	*			trans	-73.2	101.3	161.4	-58.4	176	0	0	0	105.5	S633 T637	S633-I635 PolarHBondContact O-N 3.38Å; I635-T637 PolarHBondContact O-N 2.97Å
636	K	55.1	Low	56.6	Low	143 Å²	143	130.9 Å²	130.9	62%	0.622	61%	0.608	S	S	*	*			trans	-53.7	132.1	167.8	-75.9	-170.3	170.6	-165.4	0	108.3	R634 Y638	R634-K636 PolarHBondContact O-N 3.26Å; K636-Y638 HydrophobicContact CB-CD1 4.43Å; K636-Y638 HydrophobicContact CB-CD2 4.25Å; K636-Y638 HydrophobicContact CB-CE1 4.03Å; K636-Y638 HydrophobicContact CB-CE2 3.84Å; K636-Y638 HydrophobicContact CD-CE1 4.18Å; K636-Y638 VanDerWaalsContact O-CD2 3.28Å; K636-Y638 WeakPolarHBondContact O-CD2 3.46Å; K636-Y638 PolarHBondContact O-N 3.16Å
637	T	54.5	Low	58.3	Low	138 Å²	138	122 Å²	122	85%	0.847	58%	0.578	S	S	*	*			trans	-77.7	58.9	-172.1	-36.1	0	0	0	0	111.7	I635 S639	I635-T637 PolarHBondContact O-N 2.97Å; T637-S639 PolarHBondContact O-N 3.49Å
638	Y	61.1	Low	60	Low	127 Å²	127	117.6 Å²	117.6	50%	0.498	55%	0.552	S	S	.	*			trans	-56.2	137.1	-176.6	-63.5	-64.5	0	0	0	111.3	K636 E1078	K636-Y638 HydrophobicContact CB-CD1 4.43Å; K636-Y638 HydrophobicContact CB-CD2 4.25Å; K636-Y638 HydrophobicContact CB-CE1 4.03Å; K636-Y638 HydrophobicContact CB-CE2 3.84Å; K636-Y638 HydrophobicContact CD-CE1 4.18Å; K636-Y638 VanDerWaalsContact O-CD2 3.28Å; K636-Y638 WeakPolarHBondContact O-CD2 3.46Å; K636-Y638 PolarHBondContact O-N 3.16Å; Y638-E1078 WeakPolarHBondContact CA-OE2 3.34Å; Y638-E1078 HydrophobicContact CD1-CB 4.31Å
639	S	69.9	Low	61.4	Low	33 Å²	33	109.1 Å²	109.1	23%	0.231	51%	0.513	C	S	.	.			trans	-57.7	144.9	173.4	65.4	0	0	0	0	111.7	T637 F641 A642 F643 E1078	T637-S639 PolarHBondContact O-N 3.49Å; S639-F641 PolarHBondContact O-N 3.08Å; S639-F641 VanDerWaalsContact O-N 3.09Å; S639-A642 WeakPolarHBondContact O-CB 3.24Å; S639-A642 PolarHBondContact O-N 3.2Å; S639-A642 VanDerWaalsContact OG-CB 3.31Å; S639-A642 WeakPolarHBondContact OG-CB 3.16Å; S639-A642 PolarHBondContact OG-N 3.38Å; S639-F643 PolarHBondContact O-N 3.07Å; S639-E1078 PolarHBondContact N-OE2 3.48Å
640	P	71.8	Confident	62.8	Low	114 Å²	114	104.2 Å²	104.2	74%	0.74	49%	0.49	S	S	*	.	H	α-helix	trans	-56	-29.3	177.3	-28.2	35.7	0	0	0	113.7	F643 K644	P640-F643 PolarHBondContact O-N 3.27Å; P640-K644 PolarHBondContact O-N 3.05Å
641	F	63.1	Low	64.7	Low	99 Å²	99	101.2 Å²	101.2	43%	0.434	48%	0.48	S	S	.	.	H	α-helix	trans	-67.9	-44.9	173.8	-171.4	-93.9	0	0	0	112.3	S639 F643 K644 F645 Y865	S639-F641 PolarHBondContact O-N 3.08Å; S639-F641 VanDerWaalsContact O-N 3.09Å; F641-F643 VanDerWaalsContact C-N 3.26Å; F641-F643 PolarHBondContact O-N 3.49Å; F641-K644 PolarHBondContact O-N 3.11Å; F641-F645 WeakPolarHBondContact O-CB 3.42Å; F641-F645 PolarHBondContact O-N 3.01Å; F641-Y865 HydrophobicContact CE1-CE2 4.48Å; F641-Y865 AromaticContact CE1-CZ 3.84Å; F641-Y865 WeakPolarHBondContact CE1-OH 3.47Å; F641-Y865 AromaticContact CZ-CE2 3.91Å; F641-Y865 HydrophobicContact CZ-CE2 3.91Å; F641-Y865 AromaticContact CZ-CZ 3.72Å; F641-Y865 WeakPolarHBondContact CZ-OH 3.34Å
642	A	66.3	Low	66.4	Low	8 Å²	8	94.5 Å²	94.5	7%	0.066	46%	0.46	C	S	.	.	H	α-helix	trans	-62.5	-33.5	172.9	0	0	0	0	0	112.1	S639 Y646 H1079	S639-A642 WeakPolarHBondContact O-CB 3.24Å; S639-A642 PolarHBondContact O-N 3.2Å; S639-A642 VanDerWaalsContact OG-CB 3.31Å; S639-A642 WeakPolarHBondContact OG-CB 3.16Å; S639-A642 PolarHBondContact OG-N 3.38Å; A642-Y646 VanDerWaalsContact O-CB 3.27Å; A642-Y646 WeakPolarHBondContact O-CB 3.25Å; A642-Y646 PolarHBondContact O-N 3.21Å; A642-H1079 HydrophobicContact CB-CB 3.98Å
643	F	75.8	Confident	68.2	Low	122 Å²	122	90.6 Å²	90.6	54%	0.535	44%	0.443	S	S	.	.	H	α-helix	trans	-72.6	-40.8	173.7	-173.2	-104.3	0	0	0	113.1	S639 P640 F641 Y646 M647	S639-F643 PolarHBondContact O-N 3.07Å; P640-F643 PolarHBondContact O-N 3.27Å; F641-F643 VanDerWaalsContact C-N 3.26Å; F641-F643 PolarHBondContact O-N 3.49Å; F643-Y646 PolarHBondContact O-N 2.96Å; F643-M647 HydrophobicContact CD1-CG 4.09Å; F643-M647 HydrophobicContact CD2-CG 4.26Å; F643-M647 HydrophobicContact CE1-CG 3.61Å; F643-M647 HydrophobicContact CE1-SD 4.47Å; F643-M647 HydrophobicContact CE2-CG 3.81Å; F643-M647 HydrophobicContact CE2-SD 4.01Å; F643-M647 HydrophobicContact CG-CG 4.4Å; F643-M647 HydrophobicContact CZ-CG 3.46Å; F643-M647 VanDerWaalsContact CZ-CG 3.46Å; F643-M647 HydrophobicContact CZ-SD 3.76Å; F643-M647 WeakPolarHBondContact O-CB 3.45Å; F643-M647 WeakPolarHBondContact O-CG 3.46Å; F643-M647 PolarHBondContact O-N 2.88Å
644	K	76.3	Confident	69.8	Low	80 Å²	80	89.2 Å²	89.2	35%	0.348	43%	0.43	S	S	.	.	H	α-helix	trans	-57.4	-52.1	171.4	-179.1	175.7	178.7	179.8	0	110.2	P640 F641 Y646 M647 E648 E878	P640-K644 PolarHBondContact O-N 3.05Å; F641-K644 PolarHBondContact O-N 3.11Å; K644-Y646 PolarHBondContact O-N 3.3Å; K644-M647 PolarHBondContact O-N 3.28Å; K644-E648 WeakPolarHBondContact CE-OE1 3.46Å; K644-E648 HydrophobicContact CG-CG 4.34Å; K644-E648 WeakPolarHBondContact CG-OE1 3.32Å; K644-E648 WeakPolarHBondContact O-CB 3.33Å; K644-E648 VanDerWaalsContact O-CG 3.28Å; K644-E648 WeakPolarHBondContact O-CG 3.26Å; K644-E648 PolarHBondContact O-N 2.88Å; K644-E878 IonicContact NZ-OE1 3.98Å; K644-E878 PolarHBondContact NZ-OE1 3.49Å; K644-E878 IonicContact NZ-OE2 3.9Å
645	F	69.3	Low	71.3	Confident	7 Å²	7	84.3 Å²	84.3	3%	0.031	42%	0.418	C	S	.	.	H	α-helix	trans	-54.5	-49.9	175.5	179.6	-84.2	0	0	0	112.3	F641 M647 Q649 W859 Y865 H1079 Y1082	F641-F645 WeakPolarHBondContact O-CB 3.42Å; F641-F645 PolarHBondContact O-N 3.01Å; F645-M647 PolarHBondContact O-N 3.37Å; F645-Q649 VanDerWaalsContact O-CB 3.31Å; F645-Q649 WeakPolarHBondContact O-CB 3.45Å; F645-Q649 PolarHBondContact O-N 3.43Å; F645-Q649 VanDerWaalsContact O-N 3.12Å; F645-W859 AromaticContact CD2-CH2 3.76Å; F645-W859 HydrophobicContact CD2-CH2 3.76Å; F645-W859 HydrophobicContact CD2-CZ3 4.04Å; F645-W859 AromaticContact CE2-CH2 3.46Å; F645-W859 HydrophobicContact CE2-CH2 3.46Å; F645-W859 VanDerWaalsContact CE2-CH2 3.46Å; F645-W859 AromaticContact CE2-CZ3 3.66Å; F645-W859 HydrophobicContact CE2-CZ3 3.66Å; F645-W859 HydrophobicContact CZ-CH2 4.49Å; F645-Y865 HydrophobicContact CD2-CE1 4.39Å; F645-Y865 WeakPolarHBondContact CD2-OH 3.4Å; F645-Y865 HydrophobicContact CE2-CE1 4.27Å; F645-H1079 HydrophobicContact CD1-CB 4Å; F645-H1079 HydrophobicContact CE1-CB 4.4Å; F645-H1079 HydrophobicContact CG-CB 4.47Å; F645-Y1082 HydrophobicContact CD1-CD1 4.3Å; F645-Y1082 AromaticContact CE1-CD1 3.88Å; F645-Y1082 HydrophobicContact CE1-CD1 3.88Å; F645-Y1082 HydrophobicContact CE1-CG 4.41Å
646	Y	76.3	Confident	72.6	Confident	89 Å²	89	82 Å²	82	35%	0.349	40%	0.403	S	S	.	.	H	α-helix	trans	-56.2	-50.8	175.7	173.2	-77.9	0	0	0	111.2	A642 F643 K644 H650 Y1082	A642-Y646 VanDerWaalsContact O-CB 3.27Å; A642-Y646 WeakPolarHBondContact O-CB 3.25Å; A642-Y646 PolarHBondContact O-N 3.21Å; F643-Y646 PolarHBondContact O-N 2.96Å; K644-Y646 PolarHBondContact O-N 3.3Å; Y646-H650 HydrophobicContact CD1-CB 4.45Å; Y646-H650 HydrophobicContact CE1-CB 4.14Å; Y646-H650 WeakPolarHBondContact O-CB 3.38Å; Y646-H650 PolarHBondContact O-N 3.19Å; Y646-Y1082 HydrophobicContact CD2-CD2 4.05Å; Y646-Y1082 HydrophobicContact CD2-CE1 4.06Å; Y646-Y1082 AromaticContact CD2-CE2 3.32Å; Y646-Y1082 HydrophobicContact CD2-CE2 3.32Å; Y646-Y1082 AromaticContact CD2-CZ 3.32Å; Y646-Y1082 WeakPolarHBondContact CD2-OH 3.48Å; Y646-Y1082 HydrophobicContact CE2-CD2 4.49Å; Y646-Y1082 AromaticContact CE2-CE2 3.43Å; Y646-Y1082 HydrophobicContact CE2-CE2 3.43Å; Y646-Y1082 VanDerWaalsContact CE2-CE2 3.43Å; Y646-Y1082 AromaticContact CE2-CZ 3.48Å; Y646-Y1082 VanDerWaalsContact CE2-CZ 3.48Å; Y646-Y1082 WeakPolarHBondContact CE2-OH 3.1Å; Y646-Y1082 HydrophobicContact CG-CE2 4.48Å
647	M	79.9	Confident	73.7	Confident	66 Å²	66	76.2 Å²	76.2	33%	0.325	38%	0.379	S	S	.	.	H	α-helix	trans	-69.2	-42.8	-172.2	-75.8	-59.1	-56.3	0	0	112.3	F643 K644 F645 I651	F643-M647 HydrophobicContact CD1-CG 4.09Å; F643-M647 HydrophobicContact CD2-CG 4.26Å; F643-M647 HydrophobicContact CE1-CG 3.61Å; F643-M647 HydrophobicContact CE1-SD 4.47Å; F643-M647 HydrophobicContact CE2-CG 3.81Å; F643-M647 HydrophobicContact CE2-SD 4.01Å; F643-M647 HydrophobicContact CG-CG 4.4Å; F643-M647 HydrophobicContact CZ-CG 3.46Å; F643-M647 VanDerWaalsContact CZ-CG 3.46Å; F643-M647 HydrophobicContact CZ-SD 3.76Å; F643-M647 WeakPolarHBondContact O-CB 3.45Å; F643-M647 WeakPolarHBondContact O-CG 3.46Å; F643-M647 PolarHBondContact O-N 2.88Å; K644-M647 PolarHBondContact O-N 3.28Å; F645-M647 PolarHBondContact O-N 3.37Å; M647-I651 HydrophobicContact CE-CD1 4.16Å; M647-I651 WeakPolarHBondContact O-CB 3.46Å; M647-I651 WeakPolarHBondContact O-CD1 3.47Å; M647-I651 WeakPolarHBondContact O-CG1 3.43Å; M647-I651 PolarHBondContact O-N 3.2Å
648	E	78.8	Confident	75	Confident	62 Å²	62	76 Å²	76	29%	0.29	36%	0.364	S	S	.	.	H	α-helix	trans	-60.7	-53.4	176	-69.3	170.7	162.7	0	0	111	K644 H650 I651 E652 R873	K644-E648 WeakPolarHBondContact CE-OE1 3.46Å; K644-E648 HydrophobicContact CG-CG 4.34Å; K644-E648 WeakPolarHBondContact CG-OE1 3.32Å; K644-E648 WeakPolarHBondContact O-CB 3.33Å; K644-E648 VanDerWaalsContact O-CG 3.28Å; K644-E648 WeakPolarHBondContact O-CG 3.26Å; K644-E648 PolarHBondContact O-N 2.88Å; E648-H650 VanDerWaalsContact C-N 3.32Å; E648-H650 PolarHBondContact O-N 3.47Å; E648-I651 PolarHBondContact O-N 3.16Å; E648-E652 PolarHBondContact O-N 3.37Å; E648-R873 IonicContact OE1-CZ 2.86Å; E648-R873 IonicContact OE1-NH1 3.6Å; E648-R873 PolarHBondContact OE1-NH1 3.27Å; E648-R873 IonicContact OE2-CZ 2.73Å; E648-R873 IonicContact OE2-NH1 2.93Å; E648-R873 PolarHBondContact OE2-NH1 3.11Å; E648-R873 IonicContact OE2-NH2 3.26Å; E648-R873 PolarHBondContact OE2-NH2 3.26Å
649	Q	70.1	Confident	76.1	Confident	21 Å²	21	74.8 Å²	74.8	10%	0.098	36%	0.363	C	S	.	.	H	α-helix	trans	-65.4	-37.1	-178	-167.1	64.7	80.5	0	0	111.7	F645 E652 N653 Y1082 E1083	F645-Q649 VanDerWaalsContact O-CB 3.31Å; F645-Q649 WeakPolarHBondContact O-CB 3.45Å; F645-Q649 PolarHBondContact O-N 3.43Å; F645-Q649 VanDerWaalsContact O-N 3.12Å; Q649-E652 PolarHBondContact NE2-OE2 2.98Å; Q649-N653 WeakPolarHBondContact O-CB 3.45Å; Q649-N653 PolarHBondContact O-N 2.85Å; Q649-N653 PolarHBondContact O-ND2 2.97Å; Q649-Y1082 HydrophobicContact CB-CE1 4.48Å; Q649-E1083 WeakPolarHBondContact CG-OE2 3.22Å
650	H	77.2	Confident	76.6	Confident	72 Å²	72	77 Å²	77	33%	0.333	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-43.6	174.6	-176.3	74	0	0	0	112.2	Y646 E648 N653 V654	Y646-H650 HydrophobicContact CD1-CB 4.45Å; Y646-H650 HydrophobicContact CE1-CB 4.14Å; Y646-H650 WeakPolarHBondContact O-CB 3.38Å; Y646-H650 PolarHBondContact O-N 3.19Å; E648-H650 VanDerWaalsContact C-N 3.32Å; E648-H650 PolarHBondContact O-N 3.47Å; H650-N653 PolarHBondContact O-N 3.44Å; H650-V654 WeakPolarHBondContact O-CB 3.37Å; H650-V654 VanDerWaalsContact O-CG2 3.24Å; H650-V654 WeakPolarHBondContact O-CG2 3.3Å; H650-V654 PolarHBondContact O-N 2.99Å
651	I	82.9	Confident	77.2	Confident	96 Å²	96	74.3 Å²	74.3	49%	0.492	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-45.9	177	-71.6	165.6	0	0	0	110.1	M647 E648 N653 V654 M655	M647-I651 HydrophobicContact CE-CD1 4.16Å; M647-I651 WeakPolarHBondContact O-CB 3.46Å; M647-I651 WeakPolarHBondContact O-CD1 3.47Å; M647-I651 WeakPolarHBondContact O-CG1 3.43Å; M647-I651 PolarHBondContact O-N 3.2Å; E648-I651 PolarHBondContact O-N 3.16Å; I651-N653 PolarHBondContact O-N 3.14Å; I651-V654 PolarHBondContact O-N 3.21Å; I651-M655 HydrophobicContact CG2-CG 4.48Å; I651-M655 VanDerWaalsContact O-CG 3.32Å; I651-M655 WeakPolarHBondContact O-CG 3.39Å; I651-M655 PolarHBondContact O-N 3.09Å
652	E	78.6	Confident	78.3	Confident	111 Å²	111	72.8 Å²	72.8	52%	0.519	34%	0.342	S	S	.	.	H	α-helix	trans	-56.1	-48.9	174.8	-175.3	-178.8	-157.2	0	0	111.1	E648 Q649 V654 M655 K656	E648-E652 PolarHBondContact O-N 3.37Å; Q649-E652 PolarHBondContact NE2-OE2 2.98Å; E652-V654 PolarHBondContact O-N 2.86Å; E652-M655 PolarHBondContact O-N 2.91Å; E652-K656 WeakPolarHBondContact O-CB 3.36Å; E652-K656 PolarHBondContact O-N 3.17Å
653	N	76.1	Confident	79.2	Confident	47 Å²	47	76.5 Å²	76.5	25%	0.251	36%	0.361	S	S	.	.	H	α-helix	trans	-69.2	-30.1	179.4	-81.9	-43.2	0	0	0	113.7	Q649 H650 I651 T657 E1083	Q649-N653 WeakPolarHBondContact O-CB 3.45Å; Q649-N653 PolarHBondContact O-N 2.85Å; Q649-N653 PolarHBondContact O-ND2 2.97Å; H650-N653 PolarHBondContact O-N 3.44Å; I651-N653 PolarHBondContact O-N 3.14Å; N653-T657 WeakPolarHBondContact O-CB 3.37Å; N653-T657 PolarHBondContact O-N 3.2Å; N653-T657 PolarHBondContact O-OG1 3.07Å; N653-E1083 PolarHBondContact ND2-OE1 3.12Å; N653-E1083 PolarHBondContact ND2-OE2 2.69Å
654	V	81.7	Confident	79.7	Confident	76 Å²	76	73.7 Å²	73.7	46%	0.461	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-43.2	170.2	164.9	0	0	0	0	110.4	H650 I651 E652 T657 Y658	H650-V654 WeakPolarHBondContact O-CB 3.37Å; H650-V654 VanDerWaalsContact O-CG2 3.24Å; H650-V654 WeakPolarHBondContact O-CG2 3.3Å; H650-V654 PolarHBondContact O-N 2.99Å; I651-V654 PolarHBondContact O-N 3.21Å; E652-V654 PolarHBondContact O-N 2.86Å; V654-T657 PolarHBondContact O-N 3.08Å; V654-Y658 WeakPolarHBondContact O-CB 3.35Å; V654-Y658 PolarHBondContact O-N 2.85Å
655	M	81.6	Confident	80.2	Confident	118 Å²	118	76.7 Å²	76.7	58%	0.581	36%	0.356	S	S	*	.	H	α-helix	trans	-67	-47.2	176.2	-67.1	-63.8	-74.2	0	0	112.1	I651 E652 T657 Y658 Q659	I651-M655 HydrophobicContact CG2-CG 4.48Å; I651-M655 VanDerWaalsContact O-CG 3.32Å; I651-M655 WeakPolarHBondContact O-CG 3.39Å; I651-M655 PolarHBondContact O-N 3.09Å; E652-M655 PolarHBondContact O-N 2.91Å; M655-T657 VanDerWaalsContact C-N 3.33Å; M655-T657 PolarHBondContact O-N 2.63Å; M655-Y658 PolarHBondContact O-N 2.92Å; M655-Y658 VanDerWaalsContact O-N 3.13Å; M655-Q659 PolarHBondContact O-N 3.41Å
656	K	78.6	Confident	81.2	Confident	93 Å²	93	81.1 Å²	81.1	40%	0.404	38%	0.379	S	S	.	.	H	α-helix	trans	-56.7	-45.6	173.4	-168.7	172.4	179.8	177.9	0	110.4	E652 Q660 E763	E652-K656 WeakPolarHBondContact O-CB 3.36Å; E652-K656 PolarHBondContact O-N 3.17Å; K656-Q660 WeakPolarHBondContact O-CB 3.33Å; K656-Q660 WeakPolarHBondContact O-CG 3.2Å; K656-Q660 PolarHBondContact O-N 2.86Å; K656-E763 IonicContact NZ-OE1 3.28Å; K656-E763 PolarHBondContact NZ-OE1 3.15Å
657	T	78.4	Confident	81.8	Confident	22 Å²	22	80.5 Å²	80.5	14%	0.135	38%	0.38	C	S	.	.	H	α-helix	trans	-61.8	-44.3	174.7	-59	0	0	0	0	111.8	N653 V654 M655 K661 R700	N653-T657 WeakPolarHBondContact O-CB 3.37Å; N653-T657 PolarHBondContact O-N 3.2Å; N653-T657 PolarHBondContact O-OG1 3.07Å; V654-T657 PolarHBondContact O-N 3.08Å; M655-T657 VanDerWaalsContact C-N 3.33Å; M655-T657 PolarHBondContact O-N 2.63Å; T657-K661 HydrophobicContact CG2-CD 4.15Å; T657-K661 WeakPolarHBondContact O-CG 3.45Å; T657-K661 PolarHBondContact O-N 2.94Å; T657-R700 PolarHBondContact OG1-NH1 2.83Å
658	Y	82.5	Confident	82.1	Confident	132 Å²	132	78.5 Å²	78.5	52%	0.518	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-45.9	-179.2	178.1	-108.5	0	0	0	112.1	V654 M655 Q660 K661 L662	V654-Y658 WeakPolarHBondContact O-CB 3.35Å; V654-Y658 PolarHBondContact O-N 2.85Å; M655-Y658 PolarHBondContact O-N 2.92Å; M655-Y658 VanDerWaalsContact O-N 3.13Å; Y658-Q660 VanDerWaalsContact C-N 3.35Å; Y658-Q660 PolarHBondContact O-N 2.81Å; Y658-K661 WeakPolarHBondContact O-CB 3.37Å; Y658-K661 PolarHBondContact O-N 2.86Å; Y658-K661 VanDerWaalsContact O-N 3.14Å; Y658-L662 HydrophobicContact CD1-CD1 4.11Å; Y658-L662 HydrophobicContact CE1-CD1 3.5Å; Y658-L662 HydrophobicContact CE1-CG 4.13Å; Y658-L662 HydrophobicContact CE2-CD2 4.42Å; Y658-L662 HydrophobicContact CE2-CG 4.36Å; Y658-L662 PolarHBondContact O-N 2.79Å
659	Q	83.3	Confident	82.6	Confident	102 Å²	102	77.6 Å²	77.6	48%	0.477	37%	0.366	S	S	.	.	H	α-helix	trans	-62	-42.4	176.6	-168.9	61.2	46.9	0	0	111.5	M655 K661 L662 N663	M655-Q659 PolarHBondContact O-N 3.41Å; Q659-K661 VanDerWaalsContact C-N 3.31Å; Q659-K661 PolarHBondContact O-N 3.05Å; Q659-L662 PolarHBondContact O-N 3.43Å; Q659-N663 PolarHBondContact NE2-OD1 2.96Å; Q659-N663 WeakPolarHBondContact O-CB 3.43Å; Q659-N663 VanDerWaalsContact O-CG 3.25Å; Q659-N663 PolarHBondContact O-N 3Å; Q659-N663 PolarHBondContact O-OD1 3.43Å; Q659-N663 VanDerWaalsContact O-OD1 3.12Å
660	Q	81	Confident	83.6	Confident	80 Å²	80	81.2 Å²	81.2	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-35.9	174.5	-74.6	176.9	-5.4	0	0	113.1	K656 Y658 R664	K656-Q660 WeakPolarHBondContact O-CB 3.33Å; K656-Q660 WeakPolarHBondContact O-CG 3.2Å; K656-Q660 PolarHBondContact O-N 2.86Å; Y658-Q660 VanDerWaalsContact C-N 3.35Å; Y658-Q660 PolarHBondContact O-N 2.81Å; Q660-R664 WeakPolarHBondContact O-CG 3.35Å; Q660-R664 PolarHBondContact O-N 2.91Å
661	K	82.8	Confident	84.1	Confident	58 Å²	58	79.9 Å²	79.9	25%	0.252	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-46.1	172.8	-70.2	163.9	150.2	-79.5	0	111.3	T657 Y658 Q659 R665 E693	T657-K661 HydrophobicContact CG2-CD 4.15Å; T657-K661 WeakPolarHBondContact O-CG 3.45Å; T657-K661 PolarHBondContact O-N 2.94Å; Y658-K661 WeakPolarHBondContact O-CB 3.37Å; Y658-K661 PolarHBondContact O-N 2.86Å; Y658-K661 VanDerWaalsContact O-N 3.14Å; Q659-K661 VanDerWaalsContact C-N 3.31Å; Q659-K661 PolarHBondContact O-N 3.05Å; K661-R665 WeakPolarHBondContact O-CB 3.39Å; K661-R665 PolarHBondContact O-N 3.29Å; K661-E693 WeakPolarHBondContact CG-OE1 3.43Å; K661-E693 IonicContact NZ-OE2 2.77Å; K661-E693 PolarHBondContact NZ-OE2 3.42Å
662	L	86.8	Confident	84.5	Confident	66 Å²	66	75.4 Å²	75.4	35%	0.346	35%	0.354	S	S	.	.	H	α-helix	trans	-60.6	-46.4	175.8	-70.6	-177.4	0	0	0	111.6	Y658 Q659 R665 L666	Y658-L662 HydrophobicContact CD1-CD1 4.11Å; Y658-L662 HydrophobicContact CE1-CD1 3.5Å; Y658-L662 HydrophobicContact CE1-CG 4.13Å; Y658-L662 HydrophobicContact CE2-CD2 4.42Å; Y658-L662 HydrophobicContact CE2-CG 4.36Å; Y658-L662 PolarHBondContact O-N 2.79Å; Q659-L662 PolarHBondContact O-N 3.43Å; L662-R665 PolarHBondContact O-N 3Å; L662-L666 WeakPolarHBondContact O-CB 3.46Å; L662-L666 PolarHBondContact O-N 2.62Å
663	N	85.6	Confident	84.9	Confident	86 Å²	86	74.4 Å²	74.4	46%	0.46	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-47.6	179.9	-69.3	11.1	0	0	0	111.6	Q659 R665 L666 Q667	Q659-N663 PolarHBondContact NE2-OD1 2.96Å; Q659-N663 WeakPolarHBondContact O-CB 3.43Å; Q659-N663 VanDerWaalsContact O-CG 3.25Å; Q659-N663 PolarHBondContact O-N 3Å; Q659-N663 PolarHBondContact O-OD1 3.43Å; Q659-N663 VanDerWaalsContact O-OD1 3.12Å; N663-R665 VanDerWaalsContact C-N 3.33Å; N663-R665 PolarHBondContact O-N 2.87Å; N663-L666 PolarHBondContact O-N 2.84Å; N663-Q667 WeakPolarHBondContact O-CB 3.47Å; N663-Q667 PolarHBondContact O-N 2.91Å
664	R	87.1	Confident	85.5	Confident	64 Å²	64	80.4 Å²	80.4	24%	0.242	38%	0.383	C	S	.	.	H	α-helix	trans	-63.8	-36.3	176.1	-74	-173.3	-58.6	-93	-6.8	112.9	Q660 L668 E693	Q660-R664 WeakPolarHBondContact O-CG 3.35Å; Q660-R664 PolarHBondContact O-N 2.91Å; R664-L668 PolarHBondContact O-N 2.83Å; R664-L668 VanDerWaalsContact O-N 3.09Å; R664-E693 IonicContact CZ-OE1 3.83Å; R664-E693 IonicContact NE-OE1 3.07Å; R664-E693 IonicContact NH2-OE1 3.71Å; R664-E693 PolarHBondContact NH2-OE1 2.84Å
665	R	85.9	Confident	85.8	Confident	142 Å²	142	78.8 Å²	78.8	54%	0.536	38%	0.377	S	S	.	.	H	α-helix	trans	-64.1	-52	172.9	-177.7	-178.8	172.8	-166.1	-4.3	110.4	K661 L662 N663 Q667 L668 E669 L689	K661-R665 WeakPolarHBondContact O-CB 3.39Å; K661-R665 PolarHBondContact O-N 3.29Å; L662-R665 PolarHBondContact O-N 3Å; N663-R665 VanDerWaalsContact C-N 3.33Å; N663-R665 PolarHBondContact O-N 2.87Å; R665-Q667 VanDerWaalsContact C-N 3.3Å; R665-Q667 PolarHBondContact O-N 3.02Å; R665-L668 WeakPolarHBondContact O-CB 3.28Å; R665-L668 PolarHBondContact O-N 2.66Å; R665-E669 HydrophobicContact CG-CG 4.19Å; R665-E669 IonicContact CZ-OE1 2.78Å; R665-E669 IonicContact NE-OE1 2.64Å; R665-E669 PolarHBondContact NE-OE1 3.17Å; R665-E669 IonicContact NH2-OE1 3.45Å; R665-E669 PolarHBondContact NH2-OE1 3.04Å; R665-E669 VanDerWaalsContact O-CG 3.32Å; R665-E669 WeakPolarHBondContact O-CG 3.47Å; R665-E669 PolarHBondContact O-N 3.32Å; R665-L689 HydrophobicContact CB-CD2 4.29Å
666	L	89.4	Confident	86.1	Confident	100 Å²	100	76.4 Å²	76.4	52%	0.524	38%	0.383	S	S	.	.	H	α-helix	trans	-59.2	-41.7	-179.3	-179	61.9	0	0	0	111.8	L662 N663 L668 E669 Q670	L662-L666 WeakPolarHBondContact O-CB 3.46Å; L662-L666 PolarHBondContact O-N 2.62Å; N663-L666 PolarHBondContact O-N 2.84Å; L666-L668 VanDerWaalsContact C-N 3.35Å; L666-L668 PolarHBondContact O-N 3.41Å; L666-E669 PolarHBondContact O-N 3.32Å; L666-Q670 WeakPolarHBondContact O-CB 3.08Å; L666-Q670 WeakPolarHBondContact O-CG 3.26Å; L666-Q670 PolarHBondContact O-N 3.29Å
667	Q	88.8	Confident	86.6	Confident	76 Å²	76	74.3 Å²	74.3	36%	0.355	38%	0.376	S	S	.	.	H	α-helix	trans	-57.2	-46.7	172.3	177.7	175.9	5.2	0	0	111.6	N663 R665 Q670 E671	N663-Q667 WeakPolarHBondContact O-CB 3.47Å; N663-Q667 PolarHBondContact O-N 2.91Å; R665-Q667 VanDerWaalsContact C-N 3.3Å; R665-Q667 PolarHBondContact O-N 3.02Å; Q667-Q670 PolarHBondContact O-N 2.85Å; Q667-E671 WeakPolarHBondContact CG-OE1 3.48Å; Q667-E671 PolarHBondContact NE2-OE1 2.64Å; Q667-E671 WeakPolarHBondContact O-CG 3.44Å; Q667-E671 PolarHBondContact O-N 2.93Å
668	L	88.1	Confident	87.2	Confident	24 Å²	24	76 Å²	76	13%	0.126	39%	0.389	C	S	.	.	H	α-helix	trans	-63.1	-46.2	176.5	-177.2	63.6	0	0	0	111.7	R664 R665 L666 Q670 E671 M672 M685 L689	R664-L668 PolarHBondContact O-N 2.83Å; R664-L668 VanDerWaalsContact O-N 3.09Å; R665-L668 WeakPolarHBondContact O-CB 3.28Å; R665-L668 PolarHBondContact O-N 2.66Å; L666-L668 VanDerWaalsContact C-N 3.35Å; L666-L668 PolarHBondContact O-N 3.41Å; L668-Q670 VanDerWaalsContact C-N 3.26Å; L668-Q670 PolarHBondContact O-N 3.35Å; L668-E671 PolarHBondContact O-N 3.1Å; L668-M672 HydrophobicContact CD1-CG 4Å; L668-M672 HydrophobicContact CD1-SD 4.23Å; L668-M672 HydrophobicContact CD2-SD 4.41Å; L668-M672 HydrophobicContact CG-CE 4.05Å; L668-M672 HydrophobicContact CG-CG 4.15Å; L668-M672 HydrophobicContact CG-SD 3.95Å; L668-M672 VanDerWaalsContact O-CB 3.3Å; L668-M672 WeakPolarHBondContact O-CB 3.35Å; L668-M672 WeakPolarHBondContact O-CG 3.45Å; L668-M672 PolarHBondContact O-N 3.48Å; L668-M685 HydrophobicContact CD1-CB 4.41Å; L668-M685 HydrophobicContact CD2-CB 4.34Å; L668-L689 HydrophobicContact CB-CD2 4.39Å; L668-L689 HydrophobicContact CD2-CB 3.81Å; L668-L689 HydrophobicContact CD2-CD2 3.73Å; L668-L689 HydrophobicContact CD2-CG 4.34Å
669	E	89.4	Confident	87.6	Confident	43 Å²	43	77.3 Å²	77.3	20%	0.201	40%	0.4	C	S	.	.	H	α-helix	trans	-60.1	-36.2	177.2	-52	-80.4	-171.2	0	0	111.3	R665 L666 M672 S673 R686	R665-E669 HydrophobicContact CG-CG 4.19Å; R665-E669 IonicContact CZ-OE1 2.78Å; R665-E669 IonicContact NE-OE1 2.64Å; R665-E669 PolarHBondContact NE-OE1 3.17Å; R665-E669 IonicContact NH2-OE1 3.45Å; R665-E669 PolarHBondContact NH2-OE1 3.04Å; R665-E669 VanDerWaalsContact O-CG 3.32Å; R665-E669 WeakPolarHBondContact O-CG 3.47Å; R665-E669 PolarHBondContact O-N 3.32Å; L666-E669 PolarHBondContact O-N 3.32Å; E669-M672 HydrophobicContact CB-CE 4.42Å; E669-M672 HydrophobicContact CG-CE 4.38Å; E669-M672 WeakPolarHBondContact OE2-CE 3.08Å; E669-S673 VanDerWaalsContact O-CB 3.25Å; E669-S673 WeakPolarHBondContact O-CB 3.49Å; E669-S673 PolarHBondContact O-N 3.41Å; E669-R686 IonicContact OE1-NE 2.79Å; E669-R686 PolarHBondContact OE1-NE 3.46Å; E669-R686 IonicContact OE2-CZ 2.71Å; E669-R686 VanDerWaalsContact OE2-CZ 3.26Å; E669-R686 IonicContact OE2-NE 3.69Å; E669-R686 PolarHBondContact OE2-NE 2.82Å; E669-R686 IonicContact OE2-NH2 3.2Å; E669-R686 PolarHBondContact OE2-NH2 3.03Å
670	Q	89.4	Confident	87.9	Confident	97 Å²	97	76 Å²	76	45%	0.453	41%	0.407	S	S	.	.	H	α-helix	trans	-69.7	-44	173.9	-73	179.3	9.8	0	0	113.3	L666 Q667 L668 S673 K674	L666-Q670 WeakPolarHBondContact O-CB 3.08Å; L666-Q670 WeakPolarHBondContact O-CG 3.26Å; L666-Q670 PolarHBondContact O-N 3.29Å; Q667-Q670 PolarHBondContact O-N 2.85Å; L668-Q670 VanDerWaalsContact C-N 3.26Å; L668-Q670 PolarHBondContact O-N 3.35Å; Q670-S673 PolarHBondContact O-N 2.83Å; Q670-K674 WeakPolarHBondContact O-CB 3.36Å; Q670-K674 VanDerWaalsContact O-CG 3.28Å; Q670-K674 WeakPolarHBondContact O-CG 3.38Å; Q670-K674 PolarHBondContact O-N 3.31Å
671	E	88.6	Confident	88.2	Confident	44 Å²	44	75.7 Å²	75.7	21%	0.206	41%	0.405	C	S	.	.	H	α-helix	trans	-66.9	-38.9	177.4	-74.8	178.6	-142.5	0	0	111.3	R18 Q667 L668 A675	R18-E671 WeakPolarHBondContact CD-OE2 3.29Å; R18-E671 IonicContact CZ-OE2 2.72Å; R18-E671 IonicContact NH1-OE1 3.85Å; R18-E671 PolarHBondContact NH1-OE1 3.05Å; R18-E671 IonicContact NH1-OE2 3.84Å; R18-E671 PolarHBondContact NH1-OE2 3.22Å; Q667-E671 WeakPolarHBondContact CG-OE1 3.48Å; Q667-E671 PolarHBondContact NE2-OE1 2.64Å; Q667-E671 WeakPolarHBondContact O-CG 3.44Å; Q667-E671 PolarHBondContact O-N 2.93Å; L668-E671 PolarHBondContact O-N 3.1Å; E671-A675 VanDerWaalsContact O-CB 3.3Å; E671-A675 WeakPolarHBondContact O-CB 3.42Å; E671-A675 PolarHBondContact O-N 3.26Å
672	M	90.3	Very high	88.5	Confident	3 Å²	3	75.1 Å²	75.1	2%	0.015	40%	0.403	C	S	.	.	H	α-helix	trans	-63.2	-43.5	173.3	-71.6	-171.4	-49.9	0	0	112.5	L668 E669 A675 G676 Q682 M685 R686	L668-M672 HydrophobicContact CD1-CG 4Å; L668-M672 HydrophobicContact CD1-SD 4.23Å; L668-M672 HydrophobicContact CD2-SD 4.41Å; L668-M672 HydrophobicContact CG-CE 4.05Å; L668-M672 HydrophobicContact CG-CG 4.15Å; L668-M672 HydrophobicContact CG-SD 3.95Å; L668-M672 VanDerWaalsContact O-CB 3.3Å; L668-M672 WeakPolarHBondContact O-CB 3.35Å; L668-M672 WeakPolarHBondContact O-CG 3.45Å; L668-M672 PolarHBondContact O-N 3.48Å; E669-M672 HydrophobicContact CB-CE 4.42Å; E669-M672 HydrophobicContact CG-CE 4.38Å; E669-M672 WeakPolarHBondContact OE2-CE 3.08Å; M672-A675 PolarHBondContact O-N 2.79Å; M672-G676 PolarHBondContact O-N 3.19Å; M672-Q682 HydrophobicContact CB-CG 4.21Å; M672-Q682 HydrophobicContact CE-CB 4.28Å; M672-Q682 VanDerWaalsContact SD-CA 3.54Å; M672-Q682 HydrophobicContact SD-CB 3.86Å; M672-Q682 HydrophobicContact SD-CG 4.17Å; M672-M685 HydrophobicContact CG-CE 3.61Å; M672-M685 HydrophobicContact CG-SD 4.28Å; M672-M685 HydrophobicContact SD-CB 3.78Å; M672-M685 HydrophobicContact SD-CE 3.83Å; M672-R686 HydrophobicContact CE-CG 4.05Å
673	S	86.8	Confident	88.6	Confident	90 Å²	90	75.5 Å²	75.5	63%	0.629	40%	0.403	S	S	*	.	H	α-helix	trans	-64.7	-48.3	176.7	179.9	0	0	0	0	111.8	E669 Q670 A675 G676	E669-S673 VanDerWaalsContact O-CB 3.25Å; E669-S673 WeakPolarHBondContact O-CB 3.49Å; E669-S673 PolarHBondContact O-N 3.41Å; Q670-S673 PolarHBondContact O-N 2.83Å; S673-A675 PolarHBondContact O-N 2.74Å; S673-G676 PolarHBondContact O-N 2.81Å
674	K	90.4	Very high	88.9	Confident	173 Å²	173	77.3 Å²	77.3	75%	0.752	41%	0.409	S	S	*	.	H	α-helix	trans	-60.2	-29.3	175.9	-74.8	172.4	179	177.4	0	113.5	Q670	Q670-K674 WeakPolarHBondContact O-CB 3.36Å; Q670-K674 VanDerWaalsContact O-CG 3.28Å; Q670-K674 WeakPolarHBondContact O-CG 3.38Å; Q670-K674 PolarHBondContact O-N 3.31Å
675	A	86.7	Confident	88.8	Confident	41 Å²	41	75.8 Å²	75.8	34%	0.339	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-5.8	177.7	0	0	0	0	0	114	E671 M672 S673 L677	E671-A675 VanDerWaalsContact O-CB 3.3Å; E671-A675 WeakPolarHBondContact O-CB 3.42Å; E671-A675 PolarHBondContact O-N 3.26Å; M672-A675 PolarHBondContact O-N 2.79Å; S673-A675 PolarHBondContact O-N 2.74Å; A675-L677 VanDerWaalsContact C-N 3.25Å; A675-L677 HydrophobicContact CB-CD1 3.65Å; A675-L677 HydrophobicContact CB-CG 3.71Å; A675-L677 PolarHBondContact O-N 3.05Å
676	G	88.3	Confident	89	Confident	68 Å²	68	71.7 Å²	71.7	70%	0.701	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	23.8	177.1	0	0	0	0	0	114.9	M672 S673	M672-G676 PolarHBondContact O-N 3.19Å; S673-G676 PolarHBondContact O-N 2.81Å
677	L	89.7	Confident	89	Confident	49 Å²	49	72.8 Å²	72.8	26%	0.257	39%	0.39	S	S	.	.			trans	-76.2	149.2	-168.3	-65.3	167.8	0	0	0	112.8	A675 E681 Q682 M685	A675-L677 VanDerWaalsContact C-N 3.25Å; A675-L677 HydrophobicContact CB-CD1 3.65Å; A675-L677 HydrophobicContact CB-CG 3.71Å; A675-L677 PolarHBondContact O-N 3.05Å; L677-E681 HydrophobicContact CB-CB 4.29Å; L677-Q682 PolarHBondContact O-NE2 3.2Å; L677-M685 HydrophobicContact CD1-CE 3.46Å; L677-M685 VanDerWaalsContact CD1-CE 3.46Å
678	S	91.1	Very high	88.8	Confident	59 Å²	59	72.6 Å²	72.6	41%	0.413	39%	0.39	S	S	.	.			trans	-65.8	154.7	-177	69.7	0	0	0	0	112.3	A680 E681 Q682	S678-A680 PolarHBondContact O-N 2.86Å; S678-A680 VanDerWaalsContact O-N 3.12Å; S678-E681 VanDerWaalsContact CB-OE2 3.26Å; S678-E681 WeakPolarHBondContact CB-OE2 3.23Å; S678-E681 PolarHBondContact N-OE2 3.47Å; S678-E681 PolarHBondContact O-N 3.26Å; S678-E681 WeakPolarHBondContact OG-CG 3.46Å; S678-E681 PolarHBondContact OG-OE2 2.83Å; S678-Q682 WeakPolarHBondContact O-CG 3.15Å; S678-Q682 PolarHBondContact O-N 2.8Å
679	E	89.9	Confident	88.7	Confident	159 Å²	159	73 Å²	73	74%	0.743	39%	0.392	S	S	*	.	H	α-helix	trans	-54.9	-35.3	-178.5	-172.1	177.9	-169	0	0	112.9	E683	E679-E683 VanDerWaalsContact O-CB 3.3Å; E679-E683 WeakPolarHBondContact O-CB 3.26Å; E679-E683 PolarHBondContact O-N 3.47Å
680	A	89.3	Confident	88.5	Confident	75 Å²	75	75.6 Å²	75.6	62%	0.62	41%	0.407	S	S	*	.	H	α-helix	trans	-65.5	-43.9	175.8	0	0	0	0	0	112.8	S678 E683 Q684	S678-A680 PolarHBondContact O-N 2.86Å; S678-A680 VanDerWaalsContact O-N 3.12Å; A680-E683 PolarHBondContact O-N 3.22Å; A680-Q684 WeakPolarHBondContact O-CB 3.28Å; A680-Q684 PolarHBondContact O-N 3.22Å
681	E	88.3	Confident	88.2	Confident	73 Å²	73	76.7 Å²	76.7	34%	0.341	41%	0.413	S	S	.	.	H	α-helix	trans	-68.1	-40.5	176.4	-67.4	165.2	115.2	0	0	111.4	L677 S678 E683 Q684 M685	L677-E681 HydrophobicContact CB-CB 4.29Å; S678-E681 VanDerWaalsContact CB-OE2 3.26Å; S678-E681 WeakPolarHBondContact CB-OE2 3.23Å; S678-E681 PolarHBondContact N-OE2 3.47Å; S678-E681 PolarHBondContact O-N 3.26Å; S678-E681 WeakPolarHBondContact OG-CG 3.46Å; S678-E681 PolarHBondContact OG-OE2 2.83Å; E681-E683 VanDerWaalsContact C-N 3.35Å; E681-E683 PolarHBondContact O-N 3.43Å; E681-Q684 PolarHBondContact O-N 3.38Å; E681-M685 WeakPolarHBondContact O-CE 3.41Å; E681-M685 PolarHBondContact O-N 3.22Å
682	Q	88.2	Confident	87.7	Confident	46 Å²	46	77.9 Å²	77.9	22%	0.215	42%	0.417	C	S	.	.	H	α-helix	trans	-58.5	-48.6	174.1	-65.3	-177.4	25.6	0	0	110.9	M672 L677 S678 Q684 M685 R686	M672-Q682 HydrophobicContact CB-CG 4.21Å; M672-Q682 HydrophobicContact CE-CB 4.28Å; M672-Q682 VanDerWaalsContact SD-CA 3.54Å; M672-Q682 HydrophobicContact SD-CB 3.86Å; M672-Q682 HydrophobicContact SD-CG 4.17Å; L677-Q682 PolarHBondContact O-NE2 3.2Å; S678-Q682 WeakPolarHBondContact O-CG 3.15Å; S678-Q682 PolarHBondContact O-N 2.8Å; Q682-Q684 VanDerWaalsContact C-N 3.34Å; Q682-Q684 PolarHBondContact O-N 3.49Å; Q682-M685 PolarHBondContact O-N 3.18Å; Q682-M685 VanDerWaalsContact O-N 3.16Å; Q682-R686 WeakPolarHBondContact O-CG 3.49Å; Q682-R686 PolarHBondContact O-N 3.3Å
683	E	90.6	Very high	87.3	Confident	73 Å²	73	79 Å²	79	34%	0.341	42%	0.422	S	S	.	.	H	α-helix	trans	-68.3	-32.4	179.9	178.1	52.3	-156.5	0	0	112.4	E679 A680 E681 R686 K687	E679-E683 VanDerWaalsContact O-CB 3.3Å; E679-E683 WeakPolarHBondContact O-CB 3.26Å; E679-E683 PolarHBondContact O-N 3.47Å; A680-E683 PolarHBondContact O-N 3.22Å; E681-E683 VanDerWaalsContact C-N 3.35Å; E681-E683 PolarHBondContact O-N 3.43Å; E683-R686 PolarHBondContact O-N 2.76Å; E683-K687 VanDerWaalsContact CG-NZ 3.25Å; E683-K687 WeakPolarHBondContact O-CB 3.22Å; E683-K687 VanDerWaalsContact O-CG 3.31Å; E683-K687 WeakPolarHBondContact O-CG 3.25Å; E683-K687 PolarHBondContact O-N 3.46Å; E683-K687 IonicContact OE1-NZ 3.59Å; E683-K687 PolarHBondContact OE1-NZ 2.91Å
684	Q	90.6	Very high	87	Confident	125 Å²	125	77.3 Å²	77.3	58%	0.584	41%	0.411	S	S	*	.	H	α-helix	trans	-63	-39.9	169.8	-177.8	172.6	-14.9	0	0	111.9	A680 E681 Q682 K687 M688	A680-Q684 WeakPolarHBondContact O-CB 3.28Å; A680-Q684 PolarHBondContact O-N 3.22Å; E681-Q684 PolarHBondContact O-N 3.38Å; Q682-Q684 VanDerWaalsContact C-N 3.34Å; Q682-Q684 PolarHBondContact O-N 3.49Å; Q684-K687 WeakPolarHBondContact O-CB 3.39Å; Q684-K687 PolarHBondContact O-N 3.35Å; Q684-M688 PolarHBondContact O-N 3.37Å
685	M	84.8	Confident	86.3	Confident	31 Å²	31	73 Å²	73	15%	0.153	40%	0.396	C	S	.	.	H	α-helix	trans	-73.3	-37.5	175.8	-74.7	-174.3	-76.9	0	0	113.2	L668 M672 L677 E681 Q682 K687 M688 L689	L668-M685 HydrophobicContact CD1-CB 4.41Å; L668-M685 HydrophobicContact CD2-CB 4.34Å; M672-M685 HydrophobicContact CG-CE 3.61Å; M672-M685 HydrophobicContact CG-SD 4.28Å; M672-M685 HydrophobicContact SD-CB 3.78Å; M672-M685 HydrophobicContact SD-CE 3.83Å; L677-M685 HydrophobicContact CD1-CE 3.46Å; L677-M685 VanDerWaalsContact CD1-CE 3.46Å; E681-M685 WeakPolarHBondContact O-CE 3.41Å; E681-M685 PolarHBondContact O-N 3.22Å; Q682-M685 PolarHBondContact O-N 3.18Å; Q682-M685 VanDerWaalsContact O-N 3.16Å; M685-K687 VanDerWaalsContact C-N 3.33Å; M685-K687 PolarHBondContact O-N 3.41Å; M685-M688 WeakPolarHBondContact O-CB 3.33Å; M685-M688 PolarHBondContact O-N 3.11Å; M685-M688 VanDerWaalsContact O-N 3.15Å; M685-L689 PolarHBondContact O-N 3.35Å
686	R	90	Very high	85.6	Confident	56 Å²	56	74.1 Å²	74.1	21%	0.211	39%	0.391	C	S	.	.	H	α-helix	trans	-57.9	-45.2	169.5	-69.4	177.2	-171.1	116	10.8	110.9	E669 M672 Q682 E683 L689 N690	E669-R686 IonicContact OE1-NE 2.79Å; E669-R686 PolarHBondContact OE1-NE 3.46Å; E669-R686 IonicContact OE2-CZ 2.71Å; E669-R686 VanDerWaalsContact OE2-CZ 3.26Å; E669-R686 IonicContact OE2-NE 3.69Å; E669-R686 PolarHBondContact OE2-NE 2.82Å; E669-R686 IonicContact OE2-NH2 3.2Å; E669-R686 PolarHBondContact OE2-NH2 3.03Å; M672-R686 HydrophobicContact CE-CG 4.05Å; Q682-R686 WeakPolarHBondContact O-CG 3.49Å; Q682-R686 PolarHBondContact O-N 3.3Å; E683-R686 PolarHBondContact O-N 2.76Å; R686-L689 PolarHBondContact O-N 3.05Å; R686-N690 WeakPolarHBondContact O-CB 3.22Å; R686-N690 PolarHBondContact O-N 3.17Å; R686-N690 PolarHBondContact O-ND2 2.73Å; R686-N690 VanDerWaalsContact O-ND2 3.16Å
687	K	89.6	Confident	84.9	Confident	123 Å²	123	72.4 Å²	72.4	54%	0.535	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-44.9	172	-76.5	176.5	170.6	76.9	0	112.1	E683 Q684 M685 N690 Q691	E683-K687 VanDerWaalsContact CG-NZ 3.25Å; E683-K687 WeakPolarHBondContact O-CB 3.22Å; E683-K687 VanDerWaalsContact O-CG 3.31Å; E683-K687 WeakPolarHBondContact O-CG 3.25Å; E683-K687 PolarHBondContact O-N 3.46Å; E683-K687 IonicContact OE1-NZ 3.59Å; E683-K687 PolarHBondContact OE1-NZ 2.91Å; Q684-K687 WeakPolarHBondContact O-CB 3.39Å; Q684-K687 PolarHBondContact O-N 3.35Å; M685-K687 VanDerWaalsContact C-N 3.33Å; M685-K687 PolarHBondContact O-N 3.41Å; K687-N690 PolarHBondContact O-N 2.89Å; K687-Q691 WeakPolarHBondContact O-CB 3.46Å; K687-Q691 PolarHBondContact O-N 2.8Å
688	M	85.6	Confident	84.3	Confident	73 Å²	73	76.8 Å²	76.8	36%	0.36	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-43.4	177.4	-167.4	-164.1	-63.1	0	0	112.2	Q684 M685 Q691 K692	Q684-M688 PolarHBondContact O-N 3.37Å; M685-M688 WeakPolarHBondContact O-CB 3.33Å; M685-M688 PolarHBondContact O-N 3.11Å; M685-M688 VanDerWaalsContact O-N 3.15Å; M688-Q691 PolarHBondContact O-N 3.13Å; M688-K692 HydrophobicContact CG-CD 4.39Å; M688-K692 WeakPolarHBondContact O-CB 3.22Å; M688-K692 WeakPolarHBondContact O-CG 3.37Å; M688-K692 PolarHBondContact O-N 3.27Å
689	L	85.9	Confident	83.3	Confident	33 Å²	33	77.5 Å²	77.5	17%	0.173	38%	0.378	C	S	.	.	H	α-helix	trans	-61.3	-48.3	175.6	-179.9	62.2	0	0	0	110.9	R665 L668 M685 R686 Q691 K692 E693	R665-L689 HydrophobicContact CB-CD2 4.29Å; L668-L689 HydrophobicContact CB-CD2 4.39Å; L668-L689 HydrophobicContact CD2-CB 3.81Å; L668-L689 HydrophobicContact CD2-CD2 3.73Å; L668-L689 HydrophobicContact CD2-CG 4.34Å; M685-L689 PolarHBondContact O-N 3.35Å; R686-L689 PolarHBondContact O-N 3.05Å; L689-Q691 VanDerWaalsContact C-N 3.28Å; L689-Q691 PolarHBondContact O-N 3.19Å; L689-K692 WeakPolarHBondContact O-CB 3.36Å; L689-K692 PolarHBondContact O-N 3.24Å; L689-K692 VanDerWaalsContact O-N 3.16Å; L689-E693 HydrophobicContact CD1-CG 4.31Å; L689-E693 HydrophobicContact CG-CG 4.48Å; L689-E693 WeakPolarHBondContact O-CG 3.4Å; L689-E693 PolarHBondContact O-N 2.74Å
690	N	85.4	Confident	82.3	Confident	96 Å²	96	75.8 Å²	75.8	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-60.3	-36.1	177	-73.1	-33.3	0	0	0	112.7	R686 K687 S694	R686-N690 WeakPolarHBondContact O-CB 3.22Å; R686-N690 PolarHBondContact O-N 3.17Å; R686-N690 PolarHBondContact O-ND2 2.73Å; R686-N690 VanDerWaalsContact O-ND2 3.16Å; K687-N690 PolarHBondContact O-N 2.89Å; N690-S694 WeakPolarHBondContact O-CB 3.41Å; N690-S694 PolarHBondContact O-N 2.86Å; N690-S694 PolarHBondContact O-OG 3.27Å
691	Q	82.6	Confident	81.4	Confident	121 Å²	121	80.9 Å²	80.9	57%	0.565	37%	0.368	S	S	*	.	H	α-helix	trans	-68.6	-44.3	174.3	-166.9	-175.5	29.6	0	0	111.7	K687 M688 L689 S694 N695	K687-Q691 WeakPolarHBondContact O-CB 3.46Å; K687-Q691 PolarHBondContact O-N 2.8Å; M688-Q691 PolarHBondContact O-N 3.13Å; L689-Q691 VanDerWaalsContact C-N 3.28Å; L689-Q691 PolarHBondContact O-N 3.19Å; Q691-S694 WeakPolarHBondContact O-CB 3.36Å; Q691-S694 PolarHBondContact O-N 2.83Å; Q691-N695 PolarHBondContact O-N 2.61Å
692	K	78.3	Confident	80.8	Confident	68 Å²	68	80 Å²	80	30%	0.296	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-47	173.7	-74.9	174	177.3	177.3	0	111.4	M688 L689 S694 N695 Y696	M688-K692 HydrophobicContact CG-CD 4.39Å; M688-K692 WeakPolarHBondContact O-CB 3.22Å; M688-K692 WeakPolarHBondContact O-CG 3.37Å; M688-K692 PolarHBondContact O-N 3.27Å; L689-K692 WeakPolarHBondContact O-CB 3.36Å; L689-K692 PolarHBondContact O-N 3.24Å; L689-K692 VanDerWaalsContact O-N 3.16Å; K692-S694 VanDerWaalsContact C-N 3.31Å; K692-S694 PolarHBondContact O-N 2.84Å; K692-N695 PolarHBondContact O-N 3.23Å; K692-Y696 WeakPolarHBondContact O-CB 3.34Å; K692-Y696 PolarHBondContact O-N 2.65Å
693	E	81.1	Confident	80.3	Confident	27 Å²	27	85.8 Å²	85.8	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-63.3	-35.8	176.1	-65.5	-136.8	137.3	0	0	112.7	K661 R664 L689 N697	K661-E693 WeakPolarHBondContact CG-OE1 3.43Å; K661-E693 IonicContact NZ-OE2 2.77Å; K661-E693 PolarHBondContact NZ-OE2 3.42Å; R664-E693 IonicContact CZ-OE1 3.83Å; R664-E693 IonicContact NE-OE1 3.07Å; R664-E693 IonicContact NH2-OE1 3.71Å; R664-E693 PolarHBondContact NH2-OE1 2.84Å; L689-E693 HydrophobicContact CD1-CG 4.31Å; L689-E693 HydrophobicContact CG-CG 4.48Å; L689-E693 WeakPolarHBondContact O-CG 3.4Å; L689-E693 PolarHBondContact O-N 2.74Å; E693-N697 WeakPolarHBondContact O-CB 3.48Å; E693-N697 PolarHBondContact O-N 2.93Å; E693-N697 PolarHBondContact O-ND2 3.25Å
694	S	80.3	Confident	80	Confident	55 Å²	55	83.2 Å²	83.2	39%	0.385	39%	0.386	S	S	.	.	H	α-helix	trans	-68.5	-38.1	175.4	-63.1	0	0	0	0	112.3	N690 Q691 K692 R698	N690-S694 WeakPolarHBondContact O-CB 3.41Å; N690-S694 PolarHBondContact O-N 2.86Å; N690-S694 PolarHBondContact O-OG 3.27Å; Q691-S694 WeakPolarHBondContact O-CB 3.36Å; Q691-S694 PolarHBondContact O-N 2.83Å; K692-S694 VanDerWaalsContact C-N 3.31Å; K692-S694 PolarHBondContact O-N 2.84Å; S694-R698 PolarHBondContact O-N 3.23Å
695	N	76.7	Confident	79.8	Confident	82 Å²	82	81 Å²	81	44%	0.439	38%	0.378	S	S	.	.	H	α-helix	trans	-68.3	-45.8	173.9	-74.3	-13.2	0	0	0	111.4	Q691 K692 N697 R698 L699	Q691-N695 PolarHBondContact O-N 2.61Å; K692-N695 PolarHBondContact O-N 3.23Å; N695-N697 VanDerWaalsContact C-N 3.33Å; N695-N697 PolarHBondContact O-N 3.5Å; N695-R698 WeakPolarHBondContact O-CB 3.48Å; N695-R698 PolarHBondContact O-N 3.3Å; N695-R698 PolarHBondContact OD1-NE 3.29Å; N695-R698 PolarHBondContact OD1-NH2 2.8Å; N695-L699 WeakPolarHBondContact O-CB 3.38Å; N695-L699 PolarHBondContact O-N 3.28Å
696	Y	70.9	Confident	80.1	Confident	64 Å²	64	83.7 Å²	83.7	25%	0.251	39%	0.389	S	S	.	.	H	α-helix	trans	-53.5	-48.2	172	174.7	-86.4	0	0	0	111.5	K692 R698 L699 R700 F1089	K692-Y696 WeakPolarHBondContact O-CB 3.34Å; K692-Y696 PolarHBondContact O-N 2.65Å; Y696-R698 VanDerWaalsContact C-N 3.29Å; Y696-R698 PolarHBondContact O-N 2.95Å; Y696-L699 PolarHBondContact O-N 3.09Å; Y696-R700 WeakPolarHBondContact O-CB 3.43Å; Y696-R700 PolarHBondContact O-N 3.09Å; Y696-F1089 HydrophobicContact CD2-CB 4.29Å; Y696-F1089 AromaticContact CD2-CD1 3.76Å; Y696-F1089 HydrophobicContact CD2-CD1 3.76Å; Y696-F1089 HydrophobicContact CD2-CD2 4.05Å; Y696-F1089 HydrophobicContact CD2-CE1 4.04Å; Y696-F1089 HydrophobicContact CD2-CE2 4.31Å; Y696-F1089 AromaticContact CD2-CG 3.77Å; Y696-F1089 HydrophobicContact CD2-CG 3.77Å; Y696-F1089 HydrophobicContact CD2-CZ 4.31Å; Y696-F1089 HydrophobicContact CE2-CB 4.17Å; Y696-F1089 AromaticContact CE2-CD1 3.95Å; Y696-F1089 HydrophobicContact CE2-CD1 3.95Å; Y696-F1089 AromaticContact CE2-CD2 3.37Å; Y696-F1089 HydrophobicContact CE2-CD2 3.37Å; Y696-F1089 HydrophobicContact CE2-CE1 4.16Å; Y696-F1089 AromaticContact CE2-CE2 3.6Å; Y696-F1089 HydrophobicContact CE2-CE2 3.6Å; Y696-F1089 AromaticContact CE2-CG 3.56Å; Y696-F1089 HydrophobicContact CE2-CG 3.56Å; Y696-F1089 AromaticContact CE2-CZ 4Å; Y696-F1089 HydrophobicContact CE2-CZ 4Å
697	N	74.8	Confident	80.2	Confident	33 Å²	33	86 Å²	86	18%	0.176	41%	0.413	C	S	.	.	H	α-helix	trans	-70.2	-20.5	178.4	-82.1	-85.1	0	0	0	114	E693 N695 R701	E693-N697 WeakPolarHBondContact O-CB 3.48Å; E693-N697 PolarHBondContact O-N 2.93Å; E693-N697 PolarHBondContact O-ND2 3.25Å; N695-N697 VanDerWaalsContact C-N 3.33Å; N695-N697 PolarHBondContact O-N 3.5Å; N697-R701 WeakPolarHBondContact O-CG 3.48Å; N697-R701 PolarHBondContact O-NE 3.43Å; N697-R701 PolarHBondContact O-NH1 2.9Å
698	R	75.6	Confident	80.2	Confident	141 Å²	141	83.1 Å²	83.1	53%	0.532	40%	0.402	S	S	.	.	H	α-helix	trans	-76	-48.4	167	-80.2	-178.7	-81.8	-97	2.2	110.9	S694 N695 Y696 R700 R701 A702	S694-R698 PolarHBondContact O-N 3.23Å; N695-R698 WeakPolarHBondContact O-CB 3.48Å; N695-R698 PolarHBondContact O-N 3.3Å; N695-R698 PolarHBondContact OD1-NE 3.29Å; N695-R698 PolarHBondContact OD1-NH2 2.8Å; Y696-R698 VanDerWaalsContact C-N 3.29Å; Y696-R698 PolarHBondContact O-N 2.95Å; R698-R700 VanDerWaalsContact C-N 3.35Å; R698-R700 PolarHBondContact O-N 3.19Å; R698-R701 WeakPolarHBondContact O-CA 3.25Å; R698-R701 WeakPolarHBondContact O-CB 3.47Å; R698-R701 PolarHBondContact O-N 2.85Å; R698-A702 PolarHBondContact O-N 3.18Å
699	L	70.8	Confident	80.7	Confident	73 Å²	73	80.4 Å²	80.4	38%	0.382	39%	0.389	S	S	.	.	H	α-helix	trans	-67.1	-33.2	-176.2	-167.5	62.4	0	0	0	112.5	N695 Y696 R701 A702 F1089	N695-L699 WeakPolarHBondContact O-CB 3.38Å; N695-L699 PolarHBondContact O-N 3.28Å; Y696-L699 PolarHBondContact O-N 3.09Å; L699-R701 PolarHBondContact O-N 3.08Å; L699-A702 WeakPolarHBondContact O-CB 3.3Å; L699-A702 PolarHBondContact O-N 3.5Å; L699-F1089 HydrophobicContact CB-CE1 4.03Å; L699-F1089 HydrophobicContact CD2-CD1 4Å; L699-F1089 HydrophobicContact CD2-CE1 3.87Å; L699-F1089 HydrophobicContact CG-CE1 3.92Å
700	R	69.8	Low	81.1	Confident	124 Å²	124	82.8 Å²	82.8	47%	0.468	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.4	170	-158.1	-179.5	80.3	166	5.3	114	T657 Y696 R698 F1089	T657-R700 PolarHBondContact OG1-NH1 2.83Å; Y696-R700 WeakPolarHBondContact O-CB 3.43Å; Y696-R700 PolarHBondContact O-N 3.09Å; R698-R700 VanDerWaalsContact C-N 3.35Å; R698-R700 PolarHBondContact O-N 3.19Å; R700-F1089 HydrophobicContact CB-CZ 3.94Å; R700-F1089 HydrophobicContact CG-CZ 4.19Å
701	R	69.8	Low	81.6	Confident	182 Å²	182	82.3 Å²	82.3	69%	0.687	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-10.7	172.7	-66.4	-175	-143.4	112	-1.2	113.3	N697 R698 L699 K703	N697-R701 WeakPolarHBondContact O-CG 3.48Å; N697-R701 PolarHBondContact O-NE 3.43Å; N697-R701 PolarHBondContact O-NH1 2.9Å; R698-R701 WeakPolarHBondContact O-CA 3.25Å; R698-R701 WeakPolarHBondContact O-CB 3.47Å; R698-R701 PolarHBondContact O-N 2.85Å; L699-R701 PolarHBondContact O-N 3.08Å; R701-K703 PolarHBondContact O-N 3.15Å
702	A	75.6	Confident	82.1	Confident	53 Å²	53	79.7 Å²	79.7	44%	0.438	39%	0.387	S	S	.	.	S	Bend	trans	-68	124.5	169.5	0	0	0	0	0	108.1	R698 L699	R698-A702 PolarHBondContact O-N 3.18Å; L699-A702 WeakPolarHBondContact O-CB 3.3Å; L699-A702 PolarHBondContact O-N 3.5Å
703	K	78.6	Confident	82.8	Confident	169 Å²	169	80.6 Å²	80.6	74%	0.735	39%	0.391	S	S	*	.			trans	-68.1	159.8	169.8	-73.3	-170.4	171.5	-166.6	0	110.1	R701	R701-K703 PolarHBondContact O-N 3.15Å
704	M	82.9	Confident	83.4	Confident	18 Å²	18	80 Å²	80	9%	0.089	39%	0.389	C	S	.	.			trans	-120.8	138.9	166.2	-70.4	-173.1	57.1	0	0	108.3	M708 F709 Y774 F776	M704-M708 HydrophobicContact CB-SD 4.3Å; M704-M708 HydrophobicContact CG-SD 4.29Å; M704-F709 HydrophobicContact CE-CE2 3.66Å; M704-F709 HydrophobicContact CE-CZ 3.69Å; M704-Y774 HydrophobicContact CE-CD1 4.06Å; M704-Y774 HydrophobicContact CE-CD2 3.64Å; M704-Y774 HydrophobicContact CE-CE2 4.36Å; M704-Y774 HydrophobicContact CE-CG 3.46Å; M704-Y774 VanDerWaalsContact CE-CG 3.46Å; M704-Y774 HydrophobicContact SD-CD1 3.75Å; M704-Y774 HydrophobicContact SD-CD2 4.43Å; M704-Y774 HydrophobicContact SD-CG 3.71Å; M704-F776 HydrophobicContact CB-CB 4.06Å; M704-F776 HydrophobicContact CB-CD1 4.05Å; M704-F776 HydrophobicContact CB-CD2 4.35Å; M704-F776 HydrophobicContact CB-CG 3.91Å; M704-F776 HydrophobicContact CE-CD1 4.03Å; M704-F776 HydrophobicContact CE-CE1 4.1Å; M704-F776 WeakPolarHBondContact O-CD2 3.36Å
705	D	87	Confident	83.9	Confident	79 Å²	79	78.2 Å²	78.2	42%	0.422	38%	0.375	S	S	.	.			trans	-135	150.1	-172	-58.5	-77.6	0	0	0	108.6	S707 M708	D705-S707 PolarHBondContact O-N 2.85Å; D705-S707 VanDerWaalsContact O-N 3.09Å; D705-M708 HydrophobicContact CB-CE 4.35Å; D705-M708 WeakPolarHBondContact O-CB 3.34Å; D705-M708 WeakPolarHBondContact O-CG 3.42Å; D705-M708 PolarHBondContact O-N 3.06Å
706	K	91	Very high	84.3	Confident	88 Å²	88	75.4 Å²	75.4	38%	0.383	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-53.7	-36.2	-173.7	-168.6	-171.9	-174	179	0	112.5	M708 F709 M737 Y783	K706-M708 PolarHBondContact O-N 3.31Å; K706-F709 PolarHBondContact O-N 2.73Å; K706-M737 HydrophobicContact CG-CE 4.29Å; K706-Y783 HydrophobicContact CD-CE1 4.36Å; K706-Y783 HydrophobicContact CG-CE1 4.32Å
707	S	91.7	Very high	84.8	Confident	103 Å²	103	76.7 Å²	76.7	72%	0.72	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-64.8	-5.7	179.9	52.9	0	0	0	0	115.7	D705 F709	D705-S707 PolarHBondContact O-N 2.85Å; D705-S707 VanDerWaalsContact O-N 3.09Å; S707-F709 PolarHBondContact O-N 3.23Å
708	M	90.6	Very high	84.8	Confident	63 Å²	63	76.9 Å²	76.9	31%	0.31	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-76.7	-8.6	169.4	-59.8	-179.6	-174.8	0	0	112.7	M704 D705 K706 K728 V729	M704-M708 HydrophobicContact CB-SD 4.3Å; M704-M708 HydrophobicContact CG-SD 4.29Å; D705-M708 HydrophobicContact CB-CE 4.35Å; D705-M708 WeakPolarHBondContact O-CB 3.34Å; D705-M708 WeakPolarHBondContact O-CG 3.42Å; D705-M708 PolarHBondContact O-N 3.06Å; K706-M708 PolarHBondContact O-N 3.31Å; M708-K728 WeakPolarHBondContact O-CA 3.4Å; M708-V729 PolarHBondContact O-N 2.81Å
709	F	94.6	Very high	84.6	Confident	17 Å²	17	73.4 Å²	73.4	8%	0.075	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.5	-176.3	-59.1	-90.3	0	0	0	110.8	M704 K706 S707 R727 K728 Y735 M737 Y774 F776 V785	M704-F709 HydrophobicContact CE-CE2 3.66Å; M704-F709 HydrophobicContact CE-CZ 3.69Å; K706-F709 PolarHBondContact O-N 2.73Å; S707-F709 PolarHBondContact O-N 3.23Å; F709-R727 WeakPolarHBondContact CA-O 3.33Å; F709-K728 HydrophobicContact CD1-CB 3.87Å; F709-K728 HydrophobicContact CD1-CG 4.08Å; F709-K728 HydrophobicContact CE1-CB 3.74Å; F709-K728 HydrophobicContact CE1-CD 3.68Å; F709-K728 HydrophobicContact CE1-CG 3.64Å; F709-K728 HydrophobicContact CZ-CD 3.91Å; F709-K728 HydrophobicContact CZ-CG 4.07Å; F709-Y735 HydrophobicContact CE1-CD2 4.17Å; F709-Y735 HydrophobicContact CE1-CE2 4.48Å; F709-M737 HydrophobicContact CB-SD 3.89Å; F709-M737 HydrophobicContact CD1-SD 4.49Å; F709-M737 HydrophobicContact CD2-SD 4.34Å; F709-M737 HydrophobicContact CG-SD 3.99Å; F709-Y774 AromaticContact CZ-CD2 3.95Å; F709-Y774 HydrophobicContact CZ-CD2 3.95Å; F709-Y774 HydrophobicContact CZ-CE2 4.33Å; F709-F776 HydrophobicContact CD2-CE1 4.3Å; F709-F776 HydrophobicContact CD2-CZ 4.09Å; F709-F776 AromaticContact CE2-CE1 3.81Å; F709-F776 HydrophobicContact CE2-CE1 3.81Å; F709-F776 HydrophobicContact CE2-CZ 4.01Å; F709-V785 HydrophobicContact CD1-CG1 4.44Å; F709-V785 HydrophobicContact CE1-CG1 3.67Å; F709-V785 HydrophobicContact CE1-CG2 4.12Å; F709-V785 HydrophobicContact CE2-CG2 4.26Å; F709-V785 HydrophobicContact CZ-CB 4.49Å; F709-V785 HydrophobicContact CZ-CG1 4.06Å; F709-V785 HydrophobicContact CZ-CG2 3.9Å
710	V	95.3	Very high	84.8	Confident	83 Å²	83	72.2 Å²	72.2	50%	0.503	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.7	172.7	178.5	0	0	0	0	108.3	T726 R727 V729	V710-T726 CarbonylContact O-C 3.55Å; V710-T726 WeakPolarHBondContact O-CA 3.38Å; V710-T726 WeakPolarHBondContact O-CB 3.43Å; V710-R727 PolarHBondContact N-O 3.03Å; V710-R727 PolarHBondContact O-N 3.03Å; V710-V729 HydrophobicContact CG2-CG2 3.8Å
711	K	95.1	Very high	85.6	Confident	85 Å²	85	66.7 Å²	66.7	37%	0.37	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.3	171.3	179.4	172	175.4	174	0	109.2	T714 E722 C724	K711-T714 VanDerWaalsContact CE-OG1 3.23Å; K711-T714 WeakPolarHBondContact CE-OG1 3.16Å; K711-T714 PolarHBondContact NZ-OG1 3.14Å; K711-E722 IonicContact NZ-OE1 2.68Å; K711-E722 PolarHBondContact NZ-OE1 3.23Å; K711-E722 IonicContact NZ-OE2 2.76Å; K711-E722 PolarHBondContact NZ-OE2 2.84Å; K711-C724 HydrophobicContact CD-CB 4.29Å; K711-C724 WeakPolarHBondContact CE-SG 3.32Å; K711-C724 HydrophobicContact CG-CB 4.12Å
712	I	93.8	Very high	86.6	Confident	66 Å²	66	58.9 Å²	58.9	34%	0.338	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-56.6	174	-66.5	162.7	0	0	0	109.5	L725 R727 L734 M1039	I712-L725 HydrophobicContact CB-CB 4.42Å; I712-L725 HydrophobicContact CB-CD2 4.28Å; I712-L725 HydrophobicContact CB-CG 4.08Å; I712-L725 HydrophobicContact CD1-CD2 4.25Å; I712-L725 HydrophobicContact CD1-CG 3.95Å; I712-L725 HydrophobicContact CG2-CD2 4.06Å; I712-L725 HydrophobicContact CG2-CG 4.42Å; I712-L725 PolarHBondContact N-O 2.85Å; I712-R727 HydrophobicContact CD1-CB 3.92Å; I712-R727 HydrophobicContact CG1-CB 4.5Å; I712-L734 HydrophobicContact CD1-CD2 3.49Å; I712-L734 VanDerWaalsContact CD1-CD2 3.49Å; I712-M1039 HydrophobicContact CD1-CG 4.3Å; I712-M1039 HydrophobicContact CD1-SD 3.76Å; I712-M1039 HydrophobicContact CG2-SD 4.34Å
713	K	93.3	Very high	87.4	Confident	87 Å²	87	58.3 Å²	58.3	38%	0.378	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	150	-178.7	-170.9	179.2	162.2	-174.6	0	110.4	C724 L725 T1041	K713-C724 CarbonylContact O-C 3.52Å; K713-C724 WeakPolarHBondContact O-CA 3.15Å; K713-L725 PolarHBondContact O-N 2.77Å; K713-T1041 HydrophobicContact CD-CG2 4.18Å; K713-T1041 VanDerWaalsContact CD-OG1 3.31Å; K713-T1041 WeakPolarHBondContact CD-OG1 3.35Å; K713-T1041 PolarHBondContact NZ-OG1 2.94Å
714	T	92.9	Very high	88.2	Confident	16 Å²	16	50.4 Å²	50.4	10%	0.098	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.6	168.2	-44.1	0	0	0	0	109.3	K711 I717 E722 V1047	K711-T714 VanDerWaalsContact CE-OG1 3.23Å; K711-T714 WeakPolarHBondContact CE-OG1 3.16Å; K711-T714 PolarHBondContact NZ-OG1 3.14Å; T714-I717 HydrophobicContact CG2-CG1 4.26Å; T714-E722 HydrophobicContact CG2-CB 4.33Å; T714-V1047 HydrophobicContact CG2-CB 4.47Å; T714-V1047 HydrophobicContact CG2-CG1 4Å; T714-V1047 HydrophobicContact CG2-CG2 4.4Å
715	L	90.6	Very high	88.8	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.084	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-25.6	177.8	-64.2	173.6	0	0	0	112.4	V723 L725 A736 Y788 T1041 F1044	L715-V723 HydrophobicContact CB-CG1 4.26Å; L715-V723 HydrophobicContact CD1-CG1 4.29Å; L715-V723 PolarHBondContact N-O 3.41Å; L715-L725 HydrophobicContact CD1-CB 4.09Å; L715-L725 HydrophobicContact CD2-CB 4.14Å; L715-L725 HydrophobicContact CG-CB 4.11Å; L715-A736 HydrophobicContact CD1-CB 4.29Å; L715-Y788 HydrophobicContact CD1-CD2 3.89Å; L715-Y788 HydrophobicContact CD1-CE2 3.64Å; L715-Y788 HydrophobicContact CD2-CE2 3.96Å; L715-Y788 HydrophobicContact CG-CE2 4.48Å; L715-T1041 HydrophobicContact CD2-CG2 3.46Å; L715-T1041 VanDerWaalsContact CD2-CG2 3.46Å; L715-F1044 HydrophobicContact CB-CD1 4.13Å; L715-F1044 HydrophobicContact CB-CE1 4.19Å; L715-F1044 HydrophobicContact CD1-CE1 4.43Å; L715-F1044 HydrophobicContact CD1-CZ 4.42Å; L715-F1044 HydrophobicContact CD2-CD1 4.18Å; L715-F1044 HydrophobicContact CD2-CD2 4.07Å; L715-F1044 HydrophobicContact CD2-CE1 4.2Å; L715-F1044 HydrophobicContact CD2-CE2 4.09Å; L715-F1044 HydrophobicContact CD2-CG 4.11Å; L715-F1044 HydrophobicContact CD2-CZ 4.14Å
716	G	86.3	Confident	89.2	Confident	23 Å²	23	46 Å²	46	24%	0.237	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	153.9	178.4	0	0	0	0	0	111.9	V723	G716-V723 PolarHBondContact N-O 3.24Å; G716-V723 PolarHBondContact O-N 3.09Å
717	I	81.9	Confident	89.4	Confident	91 Å²	91	47 Å²	47	47%	0.467	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	110.3	176.5	-59.9	177.6	0	0	0	108.3	T714 V1047 W1056	T714-I717 HydrophobicContact CG2-CG1 4.26Å; I717-V1047 HydrophobicContact CD1-CG1 3.63Å; I717-V1047 HydrophobicContact CG1-CG1 3.83Å; I717-W1056 HydrophobicContact CG2-CH2 4.07Å; I717-W1056 HydrophobicContact CG2-CZ2 3.68Å
718	G	73.8	Confident	89.5	Confident	38 Å²	38	42.5 Å²	42.5	39%	0.392	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	165.1	175	0	0	0	0	0	112	F720 G721	G718-F720 PolarHBondContact O-N 2.92Å; G718-G721 CarbonylContact C-O 3.5Å; G718-G721 WeakPolarHBondContact CA-O 3.03Å; G718-G721 PolarHBondContact N-O 3.34Å; G718-G721 PolarHBondContact O-N 2.88Å; G718-G721 VanDerWaalsContact O-N 3.16Å
719	A	71.5	Confident	89.5	Confident	67 Å²	67	44.1 Å²	44.1	55%	0.554	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.4	-175.1	0	0	0	0	0	115.4	R748	A719-R748 PolarHBondContact O-NH1 2.87Å
720	F	75.6	Confident	89.2	Confident	49 Å²	49	48.9 Å²	48.9	22%	0.215	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	2.9	-176	-48.7	-82.9	0	0	0	114	G718 L740 R741 V745 R748 Q750	G718-F720 PolarHBondContact O-N 2.92Å; F720-L740 HydrophobicContact CB-CD2 4.42Å; F720-L740 WeakPolarHBondContact O-CA 3.45Å; F720-R741 PolarHBondContact O-N 2.83Å; F720-V745 HydrophobicContact CB-CG2 4.46Å; F720-R748 HydrophobicContact CE1-CB 4.13Å; F720-R748 VanDerWaalsContact CE1-CD 3.45Å; F720-R748 HydrophobicContact CE1-CG 4.43Å; F720-Q750 HydrophobicContact CE1-CB 4.31Å; F720-Q750 HydrophobicContact CE1-CG 3.62Å; F720-Q750 HydrophobicContact CZ-CG 3.71Å
721	G	85.1	Confident	88.8	Confident	7 Å²	7	48.8 Å²	48.8	7%	0.072	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.8	-176.5	-164.9	0	0	0	0	0	114.9	G718 T739	G718-G721 CarbonylContact C-O 3.5Å; G718-G721 WeakPolarHBondContact CA-O 3.03Å; G718-G721 PolarHBondContact N-O 3.34Å; G718-G721 PolarHBondContact O-N 2.88Å; G718-G721 VanDerWaalsContact O-N 3.16Å; G721-T739 CarbonylContact C-O 3.57Å; G721-T739 WeakPolarHBondContact CA-O 3.5Å
722	E	91	Very high	88.5	Confident	18 Å²	18	46.9 Å²	46.9	8%	0.084	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	149	-174.6	57.5	172.9	-166.8	0	0	112.8	K711 T714 C724 T739	K711-E722 IonicContact NZ-OE1 2.68Å; K711-E722 PolarHBondContact NZ-OE1 3.23Å; K711-E722 IonicContact NZ-OE2 2.76Å; K711-E722 PolarHBondContact NZ-OE2 2.84Å; T714-E722 HydrophobicContact CG2-CB 4.33Å; E722-C724 PolarHBondContact OE1-SG 3.17Å; E722-T739 PolarHBondContact N-O 3.34Å; E722-T739 VanDerWaalsContact N-O 3.13Å; E722-T739 PolarHBondContact O-N 3.38Å
723	V	92.8	Very high	88.3	Confident	41 Å²	41	44.4 Å²	44.4	25%	0.248	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.3	162.9	-177.5	0	0	0	0	107.7	L715 G716 A736 K738	L715-V723 HydrophobicContact CB-CG1 4.26Å; L715-V723 HydrophobicContact CD1-CG1 4.29Å; L715-V723 PolarHBondContact N-O 3.41Å; G716-V723 PolarHBondContact N-O 3.24Å; G716-V723 PolarHBondContact O-N 3.09Å; V723-A736 HydrophobicContact CG1-CB 4.41Å; V723-K738 HydrophobicContact CG2-CB 4.25Å; V723-K738 HydrophobicContact CG2-CG 3.96Å
724	C	95	Very high	88.3	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.02	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144	-177.7	-64.4	0	0	0	0	112.2	K711 K713 E722 T726 A736 M737	K711-C724 HydrophobicContact CD-CB 4.29Å; K711-C724 WeakPolarHBondContact CE-SG 3.32Å; K711-C724 HydrophobicContact CG-CB 4.12Å; K713-C724 CarbonylContact O-C 3.52Å; K713-C724 WeakPolarHBondContact O-CA 3.15Å; E722-C724 PolarHBondContact OE1-SG 3.17Å; C724-T726 HydrophobicContact CB-CG2 4.13Å; C724-A736 CarbonylContact O-C 3.45Å; C724-A736 WeakPolarHBondContact O-CA 3.3Å; C724-M737 PolarHBondContact N-O 3Å; C724-M737 PolarHBondContact O-N 2.72Å
725	L	95.7	Very high	88.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	129	159.8	176.7	58.4	0	0	0	108	I712 K713 L715 L734 Y788 M1039 T1041	I712-L725 HydrophobicContact CB-CB 4.42Å; I712-L725 HydrophobicContact CB-CD2 4.28Å; I712-L725 HydrophobicContact CB-CG 4.08Å; I712-L725 HydrophobicContact CD1-CD2 4.25Å; I712-L725 HydrophobicContact CD1-CG 3.95Å; I712-L725 HydrophobicContact CG2-CD2 4.06Å; I712-L725 HydrophobicContact CG2-CG 4.42Å; I712-L725 PolarHBondContact N-O 2.85Å; K713-L725 PolarHBondContact O-N 2.77Å; L715-L725 HydrophobicContact CD1-CB 4.09Å; L715-L725 HydrophobicContact CD2-CB 4.14Å; L715-L725 HydrophobicContact CG-CB 4.11Å; L725-L734 HydrophobicContact CD1-CB 4.22Å; L725-L734 HydrophobicContact CD1-CD2 4.38Å; L725-Y788 HydrophobicContact CD1-CD1 3.59Å; L725-Y788 HydrophobicContact CD1-CD2 3.82Å; L725-Y788 HydrophobicContact CD1-CE1 3.79Å; L725-Y788 HydrophobicContact CD1-CE2 4.06Å; L725-Y788 HydrophobicContact CD1-CG 3.59Å; L725-Y788 HydrophobicContact CD2-CE1 4.19Å; L725-M1039 HydrophobicContact CD2-CB 3.94Å; L725-M1039 HydrophobicContact CD2-CG 4.39Å; L725-T1041 HydrophobicContact CD2-CG2 4.25Å
726	T	95.8	Very high	88.7	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.025	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	150.6	-178.2	62.4	0	0	0	0	112.1	V710 C724 L734 Y735 M737	V710-T726 CarbonylContact O-C 3.55Å; V710-T726 WeakPolarHBondContact O-CA 3.38Å; V710-T726 WeakPolarHBondContact O-CB 3.43Å; C724-T726 HydrophobicContact CB-CG2 4.13Å; T726-L734 CarbonylContact O-C 3.53Å; T726-L734 WeakPolarHBondContact O-CA 3.45Å; T726-Y735 PolarHBondContact N-O 2.88Å; T726-Y735 PolarHBondContact O-N 3.09Å; T726-Y735 PolarHBondContact OG1-O 3.49Å; T726-M737 HydrophobicContact CG2-CB 3.53Å; T726-M737 HydrophobicContact CG2-CG 4.28Å; T726-M737 HydrophobicContact CG2-SD 3.91Å
727	R	95	Very high	89.1	Confident	110 Å²	110	39.4 Å²	39.4	42%	0.415	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.8	170.4	-166.4	179.9	-68	-173.3	-1.2	110	F709 V710 I712 G732 A733 L734 M1039	F709-R727 WeakPolarHBondContact CA-O 3.33Å; V710-R727 PolarHBondContact N-O 3.03Å; V710-R727 PolarHBondContact O-N 3.03Å; I712-R727 HydrophobicContact CD1-CB 3.92Å; I712-R727 HydrophobicContact CG1-CB 4.5Å; R727-G732 VanDerWaalsContact CG-O 3.3Å; R727-G732 WeakPolarHBondContact CG-O 3.2Å; R727-A733 WeakPolarHBondContact CA-O 3.38Å; R727-L734 HydrophobicContact CB-CD2 4.16Å; R727-L734 HydrophobicContact CG-CD2 4.26Å; R727-M1039 PolarHBondContact NH2-SD 3.07Å
728	K	93.6	Very high	89.7	Confident	9 Å²	9	36.7 Å²	36.7	4%	0.039	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	123.7	177.6	-172.6	175.8	162	-70.1	0	110.4	M708 F709 D730 T731 G732 A733 Y735 Y774	M708-K728 WeakPolarHBondContact O-CA 3.4Å; F709-K728 HydrophobicContact CD1-CB 3.87Å; F709-K728 HydrophobicContact CD1-CG 4.08Å; F709-K728 HydrophobicContact CE1-CB 3.74Å; F709-K728 HydrophobicContact CE1-CD 3.68Å; F709-K728 HydrophobicContact CE1-CG 3.64Å; F709-K728 HydrophobicContact CZ-CD 3.91Å; F709-K728 HydrophobicContact CZ-CG 4.07Å; K728-D730 WeakPolarHBondContact CE-OD1 3.47Å; K728-D730 WeakPolarHBondContact CG-OD1 3.28Å; K728-D730 IonicContact NZ-OD1 2.78Å; K728-D730 PolarHBondContact NZ-OD1 2.82Å; K728-D730 IonicContact NZ-OD2 3.8Å; K728-D730 PolarHBondContact NZ-OD2 2.84Å; K728-D730 PolarHBondContact O-N 3.48Å; K728-T731 PolarHBondContact NZ-OG1 3.21Å; K728-T731 PolarHBondContact O-N 3.08Å; K728-G732 WeakPolarHBondContact O-CA 3.41Å; K728-G732 PolarHBondContact O-N 2.8Å; K728-A733 PolarHBondContact N-O 3Å; K728-Y735 HydrophobicContact CB-CD2 3.92Å; K728-Y735 HydrophobicContact CB-CE2 3.57Å; K728-Y735 HydrophobicContact CD-CE2 3.66Å; K728-Y735 HydrophobicContact CG-CE2 4.25Å; K728-Y774 HydrophobicContact CD-CE2 3.95Å
729	V	91.9	Very high	90.7	Very high	97 Å²	97	35.6 Å²	35.6	59%	0.588	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-39.5	-161.2	175.6	0	0	0	0	114.1	M708 V710	M708-V729 PolarHBondContact O-N 2.81Å; V710-V729 HydrophobicContact CG2-CG2 3.8Å
730	D	86.9	Confident	91.7	Very high	117 Å²	117	32.8 Å²	32.8	63%	0.626	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-14	-176.5	61.5	-41.4	0	0	0	114.3	K728	K728-D730 WeakPolarHBondContact CE-OD1 3.47Å; K728-D730 WeakPolarHBondContact CG-OD1 3.28Å; K728-D730 IonicContact NZ-OD1 2.78Å; K728-D730 PolarHBondContact NZ-OD1 2.82Å; K728-D730 IonicContact NZ-OD2 3.8Å; K728-D730 PolarHBondContact NZ-OD2 2.84Å; K728-D730 PolarHBondContact O-N 3.48Å
731	T	88.1	Confident	92.4	Very high	81 Å²	81	34.2 Å²	34.2	50%	0.497	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-10.5	-177.9	52.5	0	0	0	0	114.5	K728 A733	K728-T731 PolarHBondContact NZ-OG1 3.21Å; K728-T731 PolarHBondContact O-N 3.08Å; T731-A733 PolarHBondContact O-N 2.99Å
732	G	87.6	Confident	92.6	Very high	44 Å²	44	34.8 Å²	34.8	45%	0.454	19%	0.19	S	C	.	.			trans	66.8	-3.3	-173.7	0	0	0	0	0	114.8	R727 K728	R727-G732 VanDerWaalsContact CG-O 3.3Å; R727-G732 WeakPolarHBondContact CG-O 3.2Å; K728-G732 WeakPolarHBondContact O-CA 3.41Å; K728-G732 PolarHBondContact O-N 2.8Å
733	A	90.2	Very high	92.4	Very high	15 Å²	15	37.2 Å²	37.2	12%	0.124	20%	0.2	C	C	.	.			trans	-71.2	143.2	-174	0	0	0	0	0	112.5	R727 K728 T731 Y735 P1096	R727-A733 WeakPolarHBondContact CA-O 3.38Å; K728-A733 PolarHBondContact N-O 3Å; T731-A733 PolarHBondContact O-N 2.99Å; A733-Y735 HydrophobicContact CB-CE2 3.7Å; A733-Y735 WeakPolarHBondContact O-CD2 3.4Å; A733-P1096 HydrophobicContact CB-CG 4.22Å
734	L	93.6	Very high	92.1	Very high	13 Å²	13	37.2 Å²	37.2	7%	0.068	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	142.7	176.9	-60.3	177.3	0	0	0	111.2	I712 L725 T726 R727 P1038 M1039 P1096	I712-L734 HydrophobicContact CD1-CD2 3.49Å; I712-L734 VanDerWaalsContact CD1-CD2 3.49Å; L725-L734 HydrophobicContact CD1-CB 4.22Å; L725-L734 HydrophobicContact CD1-CD2 4.38Å; T726-L734 CarbonylContact O-C 3.53Å; T726-L734 WeakPolarHBondContact O-CA 3.45Å; R727-L734 HydrophobicContact CB-CD2 4.16Å; R727-L734 HydrophobicContact CG-CD2 4.26Å; L734-P1038 HydrophobicContact CD1-CB 3.92Å; L734-P1038 WeakPolarHBondContact CD1-O 3.25Å; L734-M1039 HydrophobicContact CD1-CG 3.77Å; L734-M1039 HydrophobicContact CD2-CG 4.1Å; L734-M1039 HydrophobicContact CD2-SD 4.47Å; L734-P1096 WeakPolarHBondContact O-CB 3.33Å
735	Y	95.3	Very high	91.7	Very high	8 Å²	8	37 Å²	37	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	148.5	177.3	-61.1	-89.8	0	0	0	110.5	F709 T726 K728 A733 Y773 Y774 V785 M786 P1096	F709-Y735 HydrophobicContact CE1-CD2 4.17Å; F709-Y735 HydrophobicContact CE1-CE2 4.48Å; T726-Y735 PolarHBondContact N-O 2.88Å; T726-Y735 PolarHBondContact O-N 3.09Å; T726-Y735 PolarHBondContact OG1-O 3.49Å; K728-Y735 HydrophobicContact CB-CD2 3.92Å; K728-Y735 HydrophobicContact CB-CE2 3.57Å; K728-Y735 HydrophobicContact CD-CE2 3.66Å; K728-Y735 HydrophobicContact CG-CE2 4.25Å; A733-Y735 HydrophobicContact CB-CE2 3.7Å; A733-Y735 WeakPolarHBondContact O-CD2 3.4Å; Y735-Y773 AromaticContact CD1-CD2 3.87Å; Y735-Y773 HydrophobicContact CD1-CD2 3.87Å; Y735-Y773 HydrophobicContact CD1-CE2 4.3Å; Y735-Y773 HydrophobicContact CD1-CG 4.3Å; Y735-Y773 HydrophobicContact CE1-CD1 4.11Å; Y735-Y773 AromaticContact CE1-CD2 3.6Å; Y735-Y773 HydrophobicContact CE1-CD2 3.6Å; Y735-Y773 HydrophobicContact CE1-CE1 4.43Å; Y735-Y773 AromaticContact CE1-CE2 3.96Å; Y735-Y773 HydrophobicContact CE1-CE2 3.96Å; Y735-Y773 AromaticContact CE1-CG 3.67Å; Y735-Y773 HydrophobicContact CE1-CG 3.67Å; Y735-Y774 HydrophobicContact CE1-CE2 4.32Å; Y735-V785 VanDerWaalsContact CB-CG1 3.5Å; Y735-V785 HydrophobicContact CD1-CG1 3.65Å; Y735-V785 HydrophobicContact CD2-CG1 4.19Å; Y735-V785 HydrophobicContact CE1-CG1 4.38Å; Y735-V785 HydrophobicContact CG-CG1 3.52Å; Y735-M786 WeakPolarHBondContact CA-O 3.43Å; Y735-M786 WeakPolarHBondContact CB-O 3.12Å; Y735-P1096 HydrophobicContact CD1-CB 4.22Å; Y735-P1096 HydrophobicContact CD1-CG 3.88Å; Y735-P1096 HydrophobicContact CE1-CB 4.07Å; Y735-P1096 HydrophobicContact CE1-CG 3.3Å; Y735-P1096 HydrophobicContact CE2-CG 4.25Å
736	A	95.8	Very high	91.3	Very high	8 Å²	8	38.8 Å²	38.8	7%	0.066	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	135.3	160.9	0	0	0	0	0	109.4	L715 V723 C724 M786 D787 Y788	L715-A736 HydrophobicContact CD1-CB 4.29Å; V723-A736 HydrophobicContact CG1-CB 4.41Å; C724-A736 CarbonylContact O-C 3.45Å; C724-A736 WeakPolarHBondContact O-CA 3.3Å; A736-M786 HydrophobicContact CB-CG 4Å; A736-M786 PolarHBondContact N-O 3.18Å; A736-M786 VanDerWaalsContact N-O 3.07Å; A736-M786 WeakPolarHBondContact O-CG 3.18Å; A736-M786 PolarHBondContact O-N 2.73Å; A736-D787 WeakPolarHBondContact CB-O 3.47Å; A736-Y788 HydrophobicContact CB-CD2 4.45Å
737	M	95.3	Very high	90.7	Very high	7 Å²	7	42.5 Å²	42.5	3%	0.034	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	106.3	-176.9	-174.8	165.9	167.7	0	0	110.4	K706 F709 C724 T726 F776 Y783 F784 V785	K706-M737 HydrophobicContact CG-CE 4.29Å; F709-M737 HydrophobicContact CB-SD 3.89Å; F709-M737 HydrophobicContact CD1-SD 4.49Å; F709-M737 HydrophobicContact CD2-SD 4.34Å; F709-M737 HydrophobicContact CG-SD 3.99Å; C724-M737 PolarHBondContact N-O 3Å; C724-M737 PolarHBondContact O-N 2.72Å; T726-M737 HydrophobicContact CG2-CB 3.53Å; T726-M737 HydrophobicContact CG2-CG 4.28Å; T726-M737 HydrophobicContact CG2-SD 3.91Å; M737-F776 HydrophobicContact CE-CE1 4.44Å; M737-F776 HydrophobicContact CE-CZ 3.79Å; M737-Y783 HydrophobicContact CE-CD1 3.24Å; M737-Y783 HydrophobicContact CE-CE1 3.76Å; M737-Y783 HydrophobicContact CE-CG 3.78Å; M737-F784 CarbonylContact C-O 3.56Å; M737-F784 VanDerWaalsContact CA-O 3.25Å; M737-F784 WeakPolarHBondContact CA-O 3.43Å; M737-V785 HydrophobicContact CG-CG2 4.19Å; M737-V785 HydrophobicContact SD-CG2 4.31Å
738	K	94.4	Very high	90.1	Very high	34 Å²	34	43.6 Å²	43.6	15%	0.148	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	113.3	176	-166.9	-176.3	-163.9	-173.9	0	108.3	V723 L740 E757 Y783 F784 M786 D850	V723-K738 HydrophobicContact CG2-CB 4.25Å; V723-K738 HydrophobicContact CG2-CG 3.96Å; K738-L740 HydrophobicContact CB-CD1 4.45Å; K738-L740 HydrophobicContact CD-CD1 4.21Å; K738-L740 HydrophobicContact CG-CD1 3.83Å; K738-E757 WeakPolarHBondContact CD-OE1 3.31Å; K738-E757 IonicContact NZ-OE1 2.78Å; K738-E757 PolarHBondContact NZ-OE1 2.88Å; K738-E757 IonicContact NZ-OE2 3.81Å; K738-E757 PolarHBondContact NZ-OE2 2.89Å; K738-Y783 WeakPolarHBondContact O-CA 3.34Å; K738-F784 HydrophobicContact CB-CB 4.19Å; K738-F784 HydrophobicContact CB-CD2 4.34Å; K738-F784 HydrophobicContact CD-CD2 4.34Å; K738-F784 PolarHBondContact N-O 3.09Å; K738-F784 PolarHBondContact O-N 3.15Å; K738-M786 HydrophobicContact CB-CE 4.49Å; K738-D850 IonicContact NZ-OD1 3.82Å; K738-D850 PolarHBondContact NZ-OD1 2.76Å
739	T	94.1	Very high	89.6	Confident	16 Å²	16	47 Å²	47	10%	0.098	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.8	179.3	-62.9	0	0	0	0	109.3	G721 E722 L782 Y783	G721-T739 CarbonylContact C-O 3.57Å; G721-T739 WeakPolarHBondContact CA-O 3.5Å; E722-T739 PolarHBondContact N-O 3.34Å; E722-T739 VanDerWaalsContact N-O 3.13Å; E722-T739 PolarHBondContact O-N 3.38Å; T739-L782 CarbonylContact C-O 3.47Å; T739-L782 WeakPolarHBondContact CA-O 3.28Å; T739-Y783 HydrophobicContact CG2-CD1 3.92Å; T739-Y783 HydrophobicContact CG2-CE1 3.46Å; T739-Y783 VanDerWaalsContact CG2-CE1 3.46Å; T739-Y783 WeakPolarHBondContact OG1-CD1 3.21Å; T739-Y783 WeakPolarHBondContact OG1-CE1 3.26Å
740	L	92.1	Very high	89.2	Confident	7 Å²	7	44.6 Å²	44.6	4%	0.037	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.5	-179.9	-56.9	79.1	0	0	0	111	F720 K738 K742 V745 V754 S781 L782 F784	F720-L740 HydrophobicContact CB-CD2 4.42Å; F720-L740 WeakPolarHBondContact O-CA 3.45Å; K738-L740 HydrophobicContact CB-CD1 4.45Å; K738-L740 HydrophobicContact CD-CD1 4.21Å; K738-L740 HydrophobicContact CG-CD1 3.83Å; L740-K742 PolarHBondContact O-N 3.13Å; L740-V745 HydrophobicContact CB-CG2 4.14Å; L740-V745 HydrophobicContact CD2-CG2 4.22Å; L740-V754 HydrophobicContact CD2-CG2 3.82Å; L740-S781 CarbonylContact O-C 3.5Å; L740-S781 WeakPolarHBondContact O-CA 3.44Å; L740-L782 HydrophobicContact CB-CB 4.39Å; L740-L782 PolarHBondContact N-O 2.85Å; L740-L782 PolarHBondContact O-N 3.28Å; L740-F784 HydrophobicContact CD1-CD2 3.61Å; L740-F784 HydrophobicContact CD1-CE2 3.54Å; L740-F784 HydrophobicContact CD2-CE2 4.44Å
741	R	90.4	Very high	89.1	Confident	79 Å²	79	39.2 Å²	39.2	30%	0.298	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	121.1	176.6	-48.1	-163.5	-157.2	-157.7	9.8	110	F720 K743 D744 V745 W1056	F720-R741 PolarHBondContact O-N 2.83Å; R741-K743 VanDerWaalsContact C-N 3.27Å; R741-K743 PolarHBondContact O-N 3.34Å; R741-D744 HydrophobicContact CB-CB 4.38Å; R741-D744 WeakPolarHBondContact CB-OD2 3.45Å; R741-D744 WeakPolarHBondContact CD-OD2 3.32Å; R741-D744 PolarHBondContact O-N 3.1Å; R741-D744 VanDerWaalsContact O-N 3.07Å; R741-V745 PolarHBondContact O-N 3.35Å; R741-V745 VanDerWaalsContact O-N 3.16Å; R741-W1056 VanDerWaalsContact CZ-CE3 3.48Å; R741-W1056 VanDerWaalsContact NE-CE3 3.35Å; R741-W1056 VanDerWaalsContact NE-CZ3 3.32Å; R741-W1056 VanDerWaalsContact NH2-CD2 3.25Å
742	K	89.8	Confident	88.9	Confident	19 Å²	19	35.4 Å²	35.4	8%	0.083	18%	0.179	C	C	.	.	H	α-helix	trans	-58	-38.7	-178.7	-73.6	173.4	169	178.5	0	112.9	L740 D744 V745 L746 D778 R779 D780 S781 L782 F1081	L740-K742 PolarHBondContact O-N 3.13Å; K742-D744 VanDerWaalsContact C-N 3.27Å; K742-D744 PolarHBondContact O-N 2.86Å; K742-V745 PolarHBondContact O-N 3.34Å; K742-L746 WeakPolarHBondContact O-CB 3.32Å; K742-L746 VanDerWaalsContact O-CG 3.3Å; K742-L746 WeakPolarHBondContact O-CG 3.38Å; K742-L746 PolarHBondContact O-N 2.89Å; K742-D778 PolarHBondContact NZ-O 3.02Å; K742-R779 WeakPolarHBondContact CD-O 3.48Å; K742-R779 PolarHBondContact NZ-O 3.16Å; K742-D780 VanDerWaalsContact CB-O 3.25Å; K742-D780 WeakPolarHBondContact CB-O 3.38Å; K742-D780 WeakPolarHBondContact CG-O 3.37Å; K742-D780 PolarHBondContact N-O 3Å; K742-S781 VanDerWaalsContact CE-O 3.3Å; K742-S781 WeakPolarHBondContact CE-O 3.25Å; K742-L782 HydrophobicContact CD-CD2 4.3Å; K742-L782 HydrophobicContact CG-CD1 4.45Å; K742-L782 HydrophobicContact CG-CD2 3.96Å; K742-L782 HydrophobicContact CG-CG 3.79Å; K742-F1081 HydrophobicContact CB-CE2 3.96Å; K742-F1081 HydrophobicContact CD-CD2 4.16Å; K742-F1081 HydrophobicContact CD-CE2 4.38Å; K742-F1081 HydrophobicContact CG-CD2 4.04Å; K742-F1081 HydrophobicContact CG-CE2 3.87Å
743	K	87	Confident	88.7	Confident	69 Å²	69	34.2 Å²	34.2	30%	0.3	16%	0.162	S	C	.	.	H	α-helix	trans	-53.8	-44.8	175.8	-179.1	-179.2	174.9	-172.1	0	111.2	R741 L746 N747 A1065 L1069	R741-K743 VanDerWaalsContact C-N 3.27Å; R741-K743 PolarHBondContact O-N 3.34Å; K743-L746 PolarHBondContact O-N 2.91Å; K743-N747 VanDerWaalsContact O-CB 3.27Å; K743-N747 WeakPolarHBondContact O-CB 3.48Å; K743-N747 PolarHBondContact O-N 3.44Å; K743-N747 PolarHBondContact O-ND2 3.03Å; K743-N747 PolarHBondContact O-OD1 3.07Å; K743-A1065 HydrophobicContact CD-CB 4.45Å; K743-L1069 HydrophobicContact CG-CD1 4.31Å
744	D	86.5	Confident	88.6	Confident	41 Å²	41	33.9 Å²	33.9	22%	0.219	16%	0.158	C	C	.	.	H	α-helix	trans	-81.5	-35.3	-173	-56.3	-29	0	0	0	111.9	R741 K742 L746 R748	R741-D744 HydrophobicContact CB-CB 4.38Å; R741-D744 WeakPolarHBondContact CB-OD2 3.45Å; R741-D744 WeakPolarHBondContact CD-OD2 3.32Å; R741-D744 PolarHBondContact O-N 3.1Å; R741-D744 VanDerWaalsContact O-N 3.07Å; K742-D744 VanDerWaalsContact C-N 3.27Å; K742-D744 PolarHBondContact O-N 2.86Å; D744-L746 VanDerWaalsContact C-N 3.33Å; D744-R748 WeakPolarHBondContact O-CB 3.42Å; D744-R748 WeakPolarHBondContact O-CG 3.44Å; D744-R748 PolarHBondContact O-N 3.18Å; D744-R748 VanDerWaalsContact O-N 3.08Å
745	V	87	Confident	88.2	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-42.6	169.4	176.4	0	0	0	0	111.2	F720 L740 R741 K742 N749 Q750 V751 V754 F1081	F720-V745 HydrophobicContact CB-CG2 4.46Å; L740-V745 HydrophobicContact CB-CG2 4.14Å; L740-V745 HydrophobicContact CD2-CG2 4.22Å; R741-V745 PolarHBondContact O-N 3.35Å; R741-V745 VanDerWaalsContact O-N 3.16Å; K742-V745 PolarHBondContact O-N 3.34Å; V745-N749 PolarHBondContact O-N 2.95Å; V745-Q750 HydrophobicContact CG1-CB 4.25Å; V745-Q750 PolarHBondContact O-N 2.73Å; V745-V751 HydrophobicContact CG1-CG2 4.37Å; V745-V754 HydrophobicContact CG1-CB 4.39Å; V745-V754 HydrophobicContact CG1-CG2 3.74Å; V745-V754 HydrophobicContact CG2-CG2 4.1Å; V745-F1081 HydrophobicContact CB-CZ 4.17Å; V745-F1081 HydrophobicContact CG1-CE1 3.81Å; V745-F1081 HydrophobicContact CG1-CZ 3.77Å
746	L	86.1	Confident	87.7	Confident	36 Å²	36	33.6 Å²	33.6	19%	0.188	16%	0.157	C	C	.	.	H	α-helix	trans	-69.1	-51.6	176.4	-73.9	168	0	0	0	112	K742 K743 D744 R748 N749 V751 P1077 A1080 F1081	K742-L746 WeakPolarHBondContact O-CB 3.32Å; K742-L746 VanDerWaalsContact O-CG 3.3Å; K742-L746 WeakPolarHBondContact O-CG 3.38Å; K742-L746 PolarHBondContact O-N 2.89Å; K743-L746 PolarHBondContact O-N 2.91Å; D744-L746 VanDerWaalsContact C-N 3.33Å; L746-R748 PolarHBondContact O-N 3.25Å; L746-N749 PolarHBondContact O-N 2.9Å; L746-V751 HydrophobicContact CD2-CG2 3.85Å; L746-P1077 HydrophobicContact CD1-CB 3.94Å; L746-P1077 HydrophobicContact CD2-CB 4.26Å; L746-A1080 HydrophobicContact CD2-CB 3.93Å; L746-F1081 HydrophobicContact CD1-CE2 4.07Å; L746-F1081 HydrophobicContact CD2-CE2 4.16Å; L746-F1081 HydrophobicContact CD2-CZ 4.16Å; L746-F1081 HydrophobicContact CG-CE2 3.91Å; L746-F1081 HydrophobicContact CG-CZ 3.99Å
747	N	83.8	Confident	87.5	Confident	82 Å²	82	33.4 Å²	33.4	44%	0.439	16%	0.155	S	C	.	.	H	α-helix	trans	-59.1	-31.9	-177.5	-73.9	-15.8	0	0	0	112.9	K743 L1069	K743-N747 VanDerWaalsContact O-CB 3.27Å; K743-N747 WeakPolarHBondContact O-CB 3.48Å; K743-N747 PolarHBondContact O-N 3.44Å; K743-N747 PolarHBondContact O-ND2 3.03Å; K743-N747 PolarHBondContact O-OD1 3.07Å; N747-L1069 WeakPolarHBondContact OD1-CD1 3.49Å
748	R	82.8	Confident	87.2	Confident	133 Å²	133	34.8 Å²	34.8	50%	0.502	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4.6	177.8	-62.4	174.9	178.1	-179.1	10.5	113.6	A719 F720 D744 L746 Q750	A719-R748 PolarHBondContact O-NH1 2.87Å; F720-R748 HydrophobicContact CE1-CB 4.13Å; F720-R748 VanDerWaalsContact CE1-CD 3.45Å; F720-R748 HydrophobicContact CE1-CG 4.43Å; D744-R748 WeakPolarHBondContact O-CB 3.42Å; D744-R748 WeakPolarHBondContact O-CG 3.44Å; D744-R748 PolarHBondContact O-N 3.18Å; D744-R748 VanDerWaalsContact O-N 3.08Å; L746-R748 PolarHBondContact O-N 3.25Å; R748-Q750 VanDerWaalsContact C-N 3.3Å; R748-Q750 HydrophobicContact CB-CG 3.96Å; R748-Q750 PolarHBondContact O-N 2.73Å
749	N	82.4	Confident	86.9	Confident	80 Å²	80	33.5 Å²	33.5	43%	0.428	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	25	179.6	-52.3	-83.7	0	0	0	115.5	V745 L746 V751	V745-N749 PolarHBondContact O-N 2.95Å; L746-N749 PolarHBondContact O-N 2.9Å; N749-V751 VanDerWaalsContact C-N 3.29Å; N749-V751 PolarHBondContact O-N 3.34Å
750	Q	84.4	Confident	86.5	Confident	47 Å²	47	32.8 Å²	32.8	22%	0.22	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	14.4	-171.8	-62.6	-72.4	85.8	0	0	114.4	F720 V745 R748 A752 H753 V754	F720-Q750 HydrophobicContact CE1-CB 4.31Å; F720-Q750 HydrophobicContact CE1-CG 3.62Å; F720-Q750 HydrophobicContact CZ-CG 3.71Å; V745-Q750 HydrophobicContact CG1-CB 4.25Å; V745-Q750 PolarHBondContact O-N 2.73Å; R748-Q750 VanDerWaalsContact C-N 3.3Å; R748-Q750 HydrophobicContact CB-CG 3.96Å; R748-Q750 PolarHBondContact O-N 2.73Å; Q750-A752 VanDerWaalsContact C-N 3.26Å; Q750-A752 PolarHBondContact O-N 3.31Å; Q750-H753 PolarHBondContact NE2-ND1 3.18Å; Q750-H753 VanDerWaalsContact NE2-ND1 3.11Å; Q750-H753 PolarHBondContact O-N 2.93Å; Q750-H753 VanDerWaalsContact O-N 3.13Å; Q750-H753 PolarHBondContact OE1-CE1 3.44Å; Q750-H753 VanDerWaalsContact OE1-CE1 3.28Å; Q750-H753 PolarHBondContact OE1-ND1 3.4Å; Q750-V754 PolarHBondContact O-N 3.3Å; Q750-V754 VanDerWaalsContact O-N 3.11Å
751	V	84.8	Confident	86.4	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.03	15%	0.148	C	C	.	.	H	α-helix	trans	-57	-39.4	-177.6	178.3	0	0	0	0	112.3	V745 L746 N749 K755 Y866 A1080 F1081	V745-V751 HydrophobicContact CG1-CG2 4.37Å; L746-V751 HydrophobicContact CD2-CG2 3.85Å; N749-V751 VanDerWaalsContact C-N 3.29Å; N749-V751 PolarHBondContact O-N 3.34Å; V751-K755 PolarHBondContact O-N 3.43Å; V751-K755 VanDerWaalsContact O-N 3.16Å; V751-Y866 HydrophobicContact CB-CD1 4.13Å; V751-Y866 HydrophobicContact CB-CD2 4.3Å; V751-Y866 HydrophobicContact CB-CE1 4.5Å; V751-Y866 HydrophobicContact CB-CG 4.02Å; V751-Y866 HydrophobicContact CG1-CD1 3.67Å; V751-Y866 HydrophobicContact CG1-CD2 4.34Å; V751-Y866 HydrophobicContact CG1-CE1 3.63Å; V751-Y866 HydrophobicContact CG1-CE2 4.3Å; V751-Y866 HydrophobicContact CG1-CG 4.04Å; V751-A1080 HydrophobicContact CG1-CB 3.74Å; V751-A1080 WeakPolarHBondContact CG1-O 3.48Å; V751-A1080 HydrophobicContact CG2-CB 3.95Å; V751-F1081 HydrophobicContact CG1-CE1 4.27Å; V751-F1081 HydrophobicContact CG2-CE1 4.15Å; V751-F1081 HydrophobicContact CG2-CZ 4.14Å
752	A	82.9	Confident	86.3	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-43.2	177.5	0	0	0	0	0	112.6	Q750 K755 A756 Y866	Q750-A752 VanDerWaalsContact C-N 3.26Å; Q750-A752 PolarHBondContact O-N 3.31Å; A752-K755 PolarHBondContact O-N 3.02Å; A752-A756 PolarHBondContact O-N 2.87Å; A752-Y866 HydrophobicContact CB-CD2 3.9Å; A752-Y866 HydrophobicContact CB-CE2 3.86Å
753	H	83.5	Confident	86	Confident	20 Å²	20	33 Å²	33	9%	0.093	16%	0.158	C	C	.	.	H	α-helix	trans	-65.6	-44.7	179.4	-63.9	145.9	0	0	0	111.8	Q750 K755 A756 E757 G852	Q750-H753 PolarHBondContact NE2-ND1 3.18Å; Q750-H753 VanDerWaalsContact NE2-ND1 3.11Å; Q750-H753 PolarHBondContact O-N 2.93Å; Q750-H753 VanDerWaalsContact O-N 3.13Å; Q750-H753 PolarHBondContact OE1-CE1 3.44Å; Q750-H753 VanDerWaalsContact OE1-CE1 3.28Å; Q750-H753 PolarHBondContact OE1-ND1 3.4Å; H753-K755 PolarHBondContact O-N 3.44Å; H753-A756 PolarHBondContact O-N 2.79Å; H753-A756 VanDerWaalsContact O-N 3.14Å; H753-E757 PolarHBondContact O-N 3.42Å; H753-G852 WeakPolarHBondContact CA-O 3.22Å; H753-G852 WeakPolarHBondContact CB-O 3.46Å; H753-G852 PolarHBondContact CD2-O 2.91Å; H753-G852 VanDerWaalsContact CG-O 3.28Å
754	V	89.1	Confident	85.9	Confident	7 Å²	7	30 Å²	30	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-65.7	-26.5	176.7	176.5	0	0	0	0	112.5	L740 V745 Q750 R758 L782 F784 F1084	L740-V754 HydrophobicContact CD2-CG2 3.82Å; V745-V754 HydrophobicContact CG1-CB 4.39Å; V745-V754 HydrophobicContact CG1-CG2 3.74Å; V745-V754 HydrophobicContact CG2-CG2 4.1Å; Q750-V754 PolarHBondContact O-N 3.3Å; Q750-V754 VanDerWaalsContact O-N 3.11Å; V754-R758 WeakPolarHBondContact O-CB 3.37Å; V754-R758 PolarHBondContact O-N 3.29Å; V754-L782 HydrophobicContact CG1-CD1 3.72Å; V754-F784 HydrophobicContact CG1-CE2 4.28Å; V754-F784 HydrophobicContact CG1-CZ 4.09Å; V754-F1084 HydrophobicContact CG1-CD2 4.21Å; V754-F1084 HydrophobicContact CG1-CE2 3.69Å
755	K	85.6	Confident	85.5	Confident	15 Å²	15	32.9 Å²	32.9	7%	0.065	16%	0.161	C	C	.	.	H	α-helix	trans	-76.2	-44.7	168.2	-73.4	-167.4	-170.3	175	0	112.6	V751 A752 H753 E757 R758 D759 Y866 A1080	V751-K755 PolarHBondContact O-N 3.43Å; V751-K755 VanDerWaalsContact O-N 3.16Å; A752-K755 PolarHBondContact O-N 3.02Å; H753-K755 PolarHBondContact O-N 3.44Å; K755-E757 VanDerWaalsContact C-N 3.27Å; K755-E757 PolarHBondContact O-N 3.16Å; K755-R758 PolarHBondContact O-N 3.3Å; K755-D759 VanDerWaalsContact O-CB 3.29Å; K755-D759 WeakPolarHBondContact O-CB 3.35Å; K755-D759 PolarHBondContact O-N 3.16Å; K755-Y866 WeakPolarHBondContact CD-OH 3.21Å; K755-Y866 WeakPolarHBondContact CE-OH 3.42Å; K755-Y866 PolarHBondContact NZ-OH 2.87Å; K755-A1080 WeakPolarHBondContact CE-O 3.43Å; K755-A1080 PolarHBondContact NZ-O 3.17Å
756	A	84.6	Confident	85.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-53.9	-47.3	176.4	0	0	0	0	0	111.1	A752 H753 D759 I760 H861	A752-A756 PolarHBondContact O-N 2.87Å; H753-A756 PolarHBondContact O-N 2.79Å; H753-A756 VanDerWaalsContact O-N 3.14Å; A756-D759 PolarHBondContact O-N 3.27Å; A756-I760 WeakPolarHBondContact O-CB 3.19Å; A756-I760 WeakPolarHBondContact O-CD1 3.36Å; A756-I760 VanDerWaalsContact O-CG1 3.25Å; A756-I760 WeakPolarHBondContact O-CG1 3.41Å; A756-I760 PolarHBondContact O-N 2.88Å; A756-H861 HydrophobicContact CB-CB 4.11Å
757	E	90.5	Very high	85.5	Confident	5 Å²	5	37.7 Å²	37.7	2%	0.023	18%	0.183	C	C	.	.	H	α-helix	trans	-56.8	-53.6	175	-174.8	179.3	-178.6	0	0	112	K738 H753 K755 D759 L761 F784 F851	K738-E757 WeakPolarHBondContact CD-OE1 3.31Å; K738-E757 IonicContact NZ-OE1 2.78Å; K738-E757 PolarHBondContact NZ-OE1 2.88Å; K738-E757 IonicContact NZ-OE2 3.81Å; K738-E757 PolarHBondContact NZ-OE2 2.89Å; H753-E757 PolarHBondContact O-N 3.42Å; K755-E757 VanDerWaalsContact C-N 3.27Å; K755-E757 PolarHBondContact O-N 3.16Å; E757-D759 PolarHBondContact O-N 3.14Å; E757-L761 HydrophobicContact CG-CD1 3.69Å; E757-L761 HydrophobicContact CG-CG 4.46Å; E757-L761 VanDerWaalsContact O-CB 3.32Å; E757-L761 WeakPolarHBondContact O-CB 3.39Å; E757-L761 WeakPolarHBondContact O-CG 3.44Å; E757-L761 PolarHBondContact O-N 3.18Å; E757-F784 HydrophobicContact CB-CE1 4.35Å; E757-F784 HydrophobicContact CB-CZ 4.24Å; E757-F784 HydrophobicContact CG-CE1 3.91Å; E757-F784 HydrophobicContact CG-CZ 4.01Å; E757-F851 HydrophobicContact CG-CB 4.44Å; E757-F851 PolarHBondContact N-O 2.83Å
758	R	90.4	Very high	85.9	Confident	36 Å²	36	35.2 Å²	35.2	14%	0.136	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-47	-179.9	-173.4	-148	71	120.7	1.7	112.3	V754 K755 A762 F784 E1083 F1084	V754-R758 WeakPolarHBondContact O-CB 3.37Å; V754-R758 PolarHBondContact O-N 3.29Å; K755-R758 PolarHBondContact O-N 3.3Å; R758-A762 WeakPolarHBondContact O-CB 3.2Å; R758-A762 PolarHBondContact O-N 3.16Å; R758-F784 HydrophobicContact CB-CE1 3.81Å; R758-F784 HydrophobicContact CB-CZ 4.35Å; R758-F784 HydrophobicContact CG-CE1 4.41Å; R758-E1083 PolarHBondContact NH1-O 2.85Å; R758-F1084 HydrophobicContact CB-CD2 4.5Å; R758-F1084 HydrophobicContact CB-CE2 4.22Å; R758-F1084 WeakPolarHBondContact CD-O 3.3Å; R758-F1084 HydrophobicContact CG-CD2 4.41Å; R758-F1084 HydrophobicContact CG-CE2 4.33Å
759	D	86.3	Confident	86.4	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.037	15%	0.145	C	C	.	.	H	α-helix	trans	-69.2	-41.4	-172.8	-78.5	59.1	0	0	0	111.3	K755 A756 E757 A762 E763 R858	K755-D759 VanDerWaalsContact O-CB 3.29Å; K755-D759 WeakPolarHBondContact O-CB 3.35Å; K755-D759 PolarHBondContact O-N 3.16Å; A756-D759 PolarHBondContact O-N 3.27Å; E757-D759 PolarHBondContact O-N 3.14Å; D759-A762 PolarHBondContact O-N 3.32Å; D759-E763 WeakPolarHBondContact O-CB 3.46Å; D759-E763 WeakPolarHBondContact O-CG 3.49Å; D759-E763 PolarHBondContact O-N 2.97Å; D759-R858 IonicContact OD2-CZ 2.87Å; D759-R858 IonicContact OD2-NH1 3.57Å; D759-R858 PolarHBondContact OD2-NH1 2.83Å; D759-R858 IonicContact OD2-NH2 2.64Å; D759-R858 PolarHBondContact OD2-NH2 3.04Å
760	I	87.4	Confident	86.9	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.9	-50.7	175.5	-65.9	165.6	0	0	0	110.5	A756 A762 E763 A764 F828 F851 C854	A756-I760 WeakPolarHBondContact O-CB 3.19Å; A756-I760 WeakPolarHBondContact O-CD1 3.36Å; A756-I760 VanDerWaalsContact O-CG1 3.25Å; A756-I760 WeakPolarHBondContact O-CG1 3.41Å; A756-I760 PolarHBondContact O-N 2.88Å; I760-A762 PolarHBondContact O-N 3Å; I760-E763 PolarHBondContact O-N 3.13Å; I760-A764 WeakPolarHBondContact O-CB 3.15Å; I760-A764 PolarHBondContact O-N 3.25Å; I760-F828 HydrophobicContact CD1-CB 4.14Å; I760-F828 HydrophobicContact CD1-CD1 3.64Å; I760-F828 HydrophobicContact CD1-CE1 4.17Å; I760-F828 HydrophobicContact CD1-CG 3.86Å; I760-F828 HydrophobicContact CG1-CB 4.38Å; I760-F828 HydrophobicContact CG1-CD1 3.42Å; I760-F828 VanDerWaalsContact CG1-CD1 3.42Å; I760-F828 HydrophobicContact CG1-CD2 3.85Å; I760-F828 HydrophobicContact CG1-CE1 3.5Å; I760-F828 HydrophobicContact CG1-CE2 3.91Å; I760-F828 HydrophobicContact CG1-CG 3.62Å; I760-F828 HydrophobicContact CG1-CZ 3.75Å; I760-F828 HydrophobicContact CG2-CD2 4.34Å; I760-F851 HydrophobicContact CB-CB 4.31Å; I760-F851 HydrophobicContact CB-CD1 4.35Å; I760-F851 HydrophobicContact CB-CG 4.41Å; I760-F851 HydrophobicContact CD1-CB 4.16Å; I760-F851 HydrophobicContact CD1-CD1 4.29Å; I760-F851 HydrophobicContact CG2-CB 4.36Å; I760-F851 HydrophobicContact CG2-CD1 3.53Å; I760-F851 HydrophobicContact CG2-CE1 3.97Å; I760-F851 HydrophobicContact CG2-CG 3.94Å; I760-C854 HydrophobicContact CD1-CB 3.23Å
761	L	90.1	Very high	87.2	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-21.6	-179.7	-65.1	174.2	0	0	0	113.3	E757 V769 V770 L772 F784 M786 F851 R1088	E757-L761 HydrophobicContact CG-CD1 3.69Å; E757-L761 HydrophobicContact CG-CG 4.46Å; E757-L761 VanDerWaalsContact O-CB 3.32Å; E757-L761 WeakPolarHBondContact O-CB 3.39Å; E757-L761 WeakPolarHBondContact O-CG 3.44Å; E757-L761 PolarHBondContact O-N 3.18Å; L761-V769 HydrophobicContact CD2-CG1 3.79Å; L761-V770 VanDerWaalsContact CD2-O 3.31Å; L761-V770 WeakPolarHBondContact CD2-O 3.49Å; L761-L772 HydrophobicContact CB-CB 3.68Å; L761-L772 HydrophobicContact CB-CD2 4.01Å; L761-L772 HydrophobicContact CB-CG 4.43Å; L761-L772 WeakPolarHBondContact O-CB 3.32Å; L761-F784 HydrophobicContact CD1-CD1 4.42Å; L761-M786 HydrophobicContact CD1-CE 4.13Å; L761-F851 HydrophobicContact CD2-CD2 3.5Å; L761-F851 HydrophobicContact CD2-CE2 3.68Å; L761-F851 HydrophobicContact CD2-CG 4.48Å; L761-F851 HydrophobicContact CG-CD2 4.03Å; L761-R1088 PolarHBondContact O-NH2 2.93Å
762	A	87.3	Confident	87.6	Confident	19 Å²	19	26.9 Å²	26.9	16%	0.157	13%	0.128	C	C	.	.	H	α-helix	trans	-86.1	-31.9	175	0	0	0	0	0	113.8	R758 D759 I760 L772 F1086	R758-A762 WeakPolarHBondContact O-CB 3.2Å; R758-A762 PolarHBondContact O-N 3.16Å; D759-A762 PolarHBondContact O-N 3.32Å; I760-A762 PolarHBondContact O-N 3Å; A762-L772 HydrophobicContact CB-CD2 4.42Å; A762-F1086 HydrophobicContact CB-CD1 4.02Å; A762-F1086 HydrophobicContact CB-CD2 3.72Å; A762-F1086 HydrophobicContact CB-CE1 4Å; A762-F1086 HydrophobicContact CB-CE2 3.7Å; A762-F1086 HydrophobicContact CB-CG 3.87Å; A762-F1086 HydrophobicContact CB-CZ 3.84Å
763	E	83.9	Confident	87.9	Confident	91 Å²	91	27.5 Å²	27.5	43%	0.425	13%	0.131	S	C	.	.	H	α-helix	trans	-90.8	-20.4	178.1	-66.3	-170.9	141.1	0	0	112.6	K656 D759 I760 D765 R858	K656-E763 IonicContact NZ-OE1 3.28Å; K656-E763 PolarHBondContact NZ-OE1 3.15Å; D759-E763 WeakPolarHBondContact O-CB 3.46Å; D759-E763 WeakPolarHBondContact O-CG 3.49Å; D759-E763 PolarHBondContact O-N 2.97Å; I760-E763 PolarHBondContact O-N 3.13Å; E763-D765 PolarHBondContact O-N 3.21Å; E763-R858 IonicContact OE2-NH1 2.65Å; E763-R858 PolarHBondContact OE2-NH1 2.88Å
764	A	84.6	Confident	88.3	Confident	5 Å²	5	26.8 Å²	26.8	4%	0.041	13%	0.127	C	C	.	.			trans	-68.4	120.6	173.6	0	0	0	0	0	112.4	I760 V769 M826 R1088	I760-A764 WeakPolarHBondContact O-CB 3.15Å; I760-A764 PolarHBondContact O-N 3.25Å; A764-V769 HydrophobicContact CB-CB 4.07Å; A764-V769 HydrophobicContact CB-CG1 3.81Å; A764-V769 HydrophobicContact CB-CG2 4.35Å; A764-M826 HydrophobicContact CB-CE 4.02Å; A764-M826 HydrophobicContact CB-SD 3.98Å; A764-R1088 VanDerWaalsContact O-CZ 3.3Å; A764-R1088 PolarHBondContact O-NH1 3Å; A764-R1088 PolarHBondContact O-NH2 3.3Å
765	D	78.6	Confident	88.4	Confident	102 Å²	102	26.4 Å²	26.4	55%	0.545	13%	0.125	S	C	.	.			trans	-132.1	58.1	173.5	-152.3	37.9	0	0	0	109.6	E763 R1088	E763-D765 PolarHBondContact O-N 3.21Å; D765-R1088 IonicContact OD1-NH1 3.6Å; D765-R1088 PolarHBondContact OD1-NH1 3.4Å
766	N	83	Confident	88.8	Confident	30 Å²	30	25.9 Å²	25.9	16%	0.16	12%	0.123	C	C	.	.	S	Bend	trans	-131.1	174.4	177.2	67.7	61.1	0	0	0	109.6	W768 V769 S822 M826	N766-W768 PolarHBondContact OD1-N 2.91Å; N766-V769 WeakPolarHBondContact OD1-CG2 3.22Å; N766-V769 PolarHBondContact OD1-N 3.19Å; N766-S822 PolarHBondContact ND2-OG 3.18Å; N766-M826 WeakPolarHBondContact ND2-CE 3.45Å
767	E	88.5	Confident	89.1	Confident	106 Å²	106	28.7 Å²	28.7	50%	0.495	14%	0.136	S	C	.	.	S	Bend	trans	-90.8	-14.2	-178	-58.5	-173.6	115.4	0	0	113.8	K847 R1025	E767-K847 PolarHBondContact O-NZ 3.39Å; E767-R1025 PolarHBondContact O-NH1 2.83Å
768	W	92.6	Very high	89.1	Confident	31 Å²	31	31.7 Å²	31.7	12%	0.117	15%	0.152	C	C	.	.	S	Bend	trans	-82.7	-17.3	-175.5	-57.6	112.5	0	0	0	114.2	N766 E815 L818 A819 K847 L848 R1025	N766-W768 PolarHBondContact OD1-N 2.91Å; W768-E815 HydrophobicContact CH2-CB 4.38Å; W768-E815 HydrophobicContact CH2-CG 4.23Å; W768-E815 HydrophobicContact CZ3-CB 3.83Å; W768-E815 HydrophobicContact CZ3-CG 3.99Å; W768-L818 HydrophobicContact CD2-CB 4.42Å; W768-L818 HydrophobicContact CH2-CB 4.2Å; W768-L818 HydrophobicContact CH2-CD1 4.01Å; W768-L818 HydrophobicContact CZ2-CB 3.74Å; W768-L818 HydrophobicContact CZ2-CD1 3.76Å; W768-L818 HydrophobicContact CZ2-CG 4.4Å; W768-A819 HydrophobicContact CB-CB 3.77Å; W768-A819 HydrophobicContact CD2-CB 4.21Å; W768-A819 HydrophobicContact CE3-CB 4.08Å; W768-A819 HydrophobicContact CG-CB 4.09Å; W768-K847 CarbonylContact O-C 3.52Å; W768-K847 WeakPolarHBondContact O-CA 3.24Å; W768-L848 PolarHBondContact O-N 2.97Å; W768-R1025 HydrophobicContact CH2-CB 4.09Å; W768-R1025 HydrophobicContact CH2-CG 4.24Å; W768-R1025 HydrophobicContact CZ2-CB 4.48Å
769	V	93.2	Very high	88.9	Confident	4 Å²	4	35.8 Å²	35.8	2%	0.024	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-109.7	136.5	-179.7	174.5	0	0	0	0	109.2	L761 A764 N766 R771 V823 M826 F851	L761-V769 HydrophobicContact CD2-CG1 3.79Å; A764-V769 HydrophobicContact CB-CB 4.07Å; A764-V769 HydrophobicContact CB-CG1 3.81Å; A764-V769 HydrophobicContact CB-CG2 4.35Å; N766-V769 WeakPolarHBondContact OD1-CG2 3.22Å; N766-V769 PolarHBondContact OD1-N 3.19Å; V769-R771 PolarHBondContact O-N 3.33Å; V769-V823 HydrophobicContact CG2-CG2 4.14Å; V769-M826 HydrophobicContact CG2-CE 4.35Å; V769-F851 HydrophobicContact CB-CZ 4.26Å; V769-F851 HydrophobicContact CG1-CE2 3.67Å; V769-F851 HydrophobicContact CG1-CZ 3.63Å; V769-F851 HydrophobicContact CG2-CE1 4.42Å; V769-F851 HydrophobicContact CG2-CZ 3.85Å
770	V	92.9	Very high	89	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-54.3	124.2	172.2	165.9	0	0	0	0	110.4	L761 L772 M786 D787 I789 L839 K847 L848	L761-V770 VanDerWaalsContact CD2-O 3.31Å; L761-V770 WeakPolarHBondContact CD2-O 3.49Å; V770-L772 PolarHBondContact O-N 3.49Å; V770-M786 HydrophobicContact CG1-CB 3.76Å; V770-M786 HydrophobicContact CG1-CG 4.12Å; V770-M786 HydrophobicContact CG1-SD 3.83Å; V770-D787 HydrophobicContact CG1-CB 4.36Å; V770-I789 HydrophobicContact CG2-CG1 4.36Å; V770-L839 HydrophobicContact CG2-CD1 3.96Å; V770-K847 HydrophobicContact CG2-CB 3.93Å; V770-L848 WeakPolarHBondContact CG2-O 3.28Å; V770-L848 PolarHBondContact N-O 3.5Å; V770-L848 VanDerWaalsContact N-O 3.13Å
771	R	91.3	Very high	89.2	Confident	85 Å²	85	39.3 Å²	39.3	32%	0.321	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-78.2	116.7	-174.3	-176	178	-75	143.3	-2.9	111.3	V769 Y773 M786 D787	V769-R771 PolarHBondContact O-N 3.33Å; R771-Y773 HydrophobicContact CB-CE2 4.46Å; R771-Y773 HydrophobicContact CG-CD2 4.49Å; R771-Y773 HydrophobicContact CG-CE2 4.28Å; R771-Y773 PolarHBondContact O-N 3.41Å; R771-M786 CarbonylContact O-C 3.51Å; R771-M786 WeakPolarHBondContact O-CA 3.32Å; R771-D787 WeakPolarHBondContact CB-OD2 3.36Å; R771-D787 PolarHBondContact N-OD2 3.44Å; R771-D787 PolarHBondContact O-N 2.77Å; R771-D787 VanDerWaalsContact O-N 3.08Å
772	L	92.8	Very high	89.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	118.3	164.3	-179.3	72.5	0	0	0	110	L761 A762 V770 Y774 F784 F1086 R1088	L761-L772 HydrophobicContact CB-CB 3.68Å; L761-L772 HydrophobicContact CB-CD2 4.01Å; L761-L772 HydrophobicContact CB-CG 4.43Å; L761-L772 WeakPolarHBondContact O-CB 3.32Å; A762-L772 HydrophobicContact CB-CD2 4.42Å; V770-L772 PolarHBondContact O-N 3.49Å; L772-Y774 WeakPolarHBondContact CD1-O 3.19Å; L772-F784 HydrophobicContact CD1-CB 3.83Å; L772-F784 HydrophobicContact CD1-CD1 3.87Å; L772-F784 HydrophobicContact CD1-CG 4.35Å; L772-F784 HydrophobicContact CD2-CD1 4.4Å; L772-F1086 HydrophobicContact CD2-CD1 3.67Å; L772-F1086 HydrophobicContact CD2-CE1 4.13Å; L772-F1086 HydrophobicContact CG-CD1 4.04Å; L772-F1086 HydrophobicContact CG-CE1 4.23Å; L772-R1088 PolarHBondContact O-NE 2.98Å
773	Y	89.9	Confident	89.7	Confident	13 Å²	13	38.6 Å²	38.6	5%	0.051	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-47.8	170.7	-74.4	-92.4	0	0	0	110.9	Y735 R771 V785 D787 R1088 D1091 P1096	Y735-Y773 AromaticContact CD1-CD2 3.87Å; Y735-Y773 HydrophobicContact CD1-CD2 3.87Å; Y735-Y773 HydrophobicContact CD1-CE2 4.3Å; Y735-Y773 HydrophobicContact CD1-CG 4.3Å; Y735-Y773 HydrophobicContact CE1-CD1 4.11Å; Y735-Y773 AromaticContact CE1-CD2 3.6Å; Y735-Y773 HydrophobicContact CE1-CD2 3.6Å; Y735-Y773 HydrophobicContact CE1-CE1 4.43Å; Y735-Y773 AromaticContact CE1-CE2 3.96Å; Y735-Y773 HydrophobicContact CE1-CE2 3.96Å; Y735-Y773 AromaticContact CE1-CG 3.67Å; Y735-Y773 HydrophobicContact CE1-CG 3.67Å; R771-Y773 HydrophobicContact CB-CE2 4.46Å; R771-Y773 HydrophobicContact CG-CD2 4.49Å; R771-Y773 HydrophobicContact CG-CE2 4.28Å; R771-Y773 PolarHBondContact O-N 3.41Å; Y773-V785 PolarHBondContact N-O 3.25Å; Y773-D787 WeakPolarHBondContact CE2-OD1 2.89Å; Y773-R1088 WeakPolarHBondContact O-CB 3.11Å; Y773-R1088 PolarHBondContact O-N 3.47Å; Y773-D1091 WeakPolarHBondContact CD1-OD1 3.43Å; Y773-D1091 WeakPolarHBondContact CE1-OD1 3.2Å; Y773-P1096 HydrophobicContact CE2-CB 3.95Å; Y773-P1096 HydrophobicContact CE2-CG 4.18Å
774	Y	91	Very high	90.2	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	142.6	-173	-41	-62.7	0	0	0	110.5	M704 F709 K728 Y735 L772 V785 R1087	M704-Y774 HydrophobicContact CE-CD1 4.06Å; M704-Y774 HydrophobicContact CE-CD2 3.64Å; M704-Y774 HydrophobicContact CE-CE2 4.36Å; M704-Y774 HydrophobicContact CE-CG 3.46Å; M704-Y774 VanDerWaalsContact CE-CG 3.46Å; M704-Y774 HydrophobicContact SD-CD1 3.75Å; M704-Y774 HydrophobicContact SD-CD2 4.43Å; M704-Y774 HydrophobicContact SD-CG 3.71Å; F709-Y774 AromaticContact CZ-CD2 3.95Å; F709-Y774 HydrophobicContact CZ-CD2 3.95Å; F709-Y774 HydrophobicContact CZ-CE2 4.33Å; K728-Y774 HydrophobicContact CD-CE2 3.95Å; Y735-Y774 HydrophobicContact CE1-CE2 4.32Å; L772-Y774 WeakPolarHBondContact CD1-O 3.19Å; Y774-V785 HydrophobicContact CD2-CB 3.98Å; Y774-V785 HydrophobicContact CD2-CG1 3.92Å; Y774-V785 PolarHBondContact N-O 3.48Å; Y774-V785 VanDerWaalsContact N-O 3.15Å; Y774-V785 PolarHBondContact O-N 3.38Å; Y774-R1087 HydrophobicContact CD1-CB 4.44Å; Y774-R1087 HydrophobicContact CD1-CG 3.92Å; Y774-R1087 HydrophobicContact CE1-CG 4.14Å
775	S	93	Very high	90.7	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.4	158.1	64.9	0	0	0	0	110	Y783 F1084 T1085 F1086	S775-Y783 CarbonylContact C-O 3.53Å; S775-Y783 WeakPolarHBondContact CA-O 3.3Å; S775-Y783 VanDerWaalsContact CB-O 3.32Å; S775-Y783 WeakPolarHBondContact CB-O 3.36Å; S775-F1084 PolarHBondContact OG-O 3.19Å; S775-T1085 CarbonylContact O-C 3.48Å; S775-T1085 VanDerWaalsContact O-CA 3.23Å; S775-T1085 WeakPolarHBondContact O-CA 3.41Å; S775-F1086 PolarHBondContact N-O 2.94Å; S775-F1086 PolarHBondContact O-N 2.98Å; S775-F1086 WeakPolarHBondContact OG-CB 3.49Å; S775-F1086 PolarHBondContact OG-N 3.04Å; S775-F1086 VanDerWaalsContact OG-N 3.09Å
776	F	92.5	Very high	91.5	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.018	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	175	-178	64.6	-84.3	0	0	0	111.2	M704 F709 M737 Y783 V785 F1084	M704-F776 HydrophobicContact CB-CB 4.06Å; M704-F776 HydrophobicContact CB-CD1 4.05Å; M704-F776 HydrophobicContact CB-CD2 4.35Å; M704-F776 HydrophobicContact CB-CG 3.91Å; M704-F776 HydrophobicContact CE-CD1 4.03Å; M704-F776 HydrophobicContact CE-CE1 4.1Å; M704-F776 WeakPolarHBondContact O-CD2 3.36Å; F709-F776 HydrophobicContact CD2-CE1 4.3Å; F709-F776 HydrophobicContact CD2-CZ 4.09Å; F709-F776 AromaticContact CE2-CE1 3.81Å; F709-F776 HydrophobicContact CE2-CE1 3.81Å; F709-F776 HydrophobicContact CE2-CZ 4.01Å; M737-F776 HydrophobicContact CE-CE1 4.44Å; M737-F776 HydrophobicContact CE-CZ 3.79Å; F776-Y783 AromaticContact CD2-CD2 3.57Å; F776-Y783 HydrophobicContact CD2-CD2 3.57Å; F776-Y783 HydrophobicContact CD2-CE2 4.35Å; F776-Y783 HydrophobicContact CD2-CG 4.22Å; F776-Y783 HydrophobicContact CE1-CG 4.38Å; F776-Y783 AromaticContact CE2-CD2 3.33Å; F776-Y783 HydrophobicContact CE2-CD2 3.33Å; F776-Y783 AromaticContact CE2-CE2 3.95Å; F776-Y783 HydrophobicContact CE2-CE2 3.95Å; F776-Y783 AromaticContact CE2-CG 3.77Å; F776-Y783 HydrophobicContact CE2-CG 3.77Å; F776-Y783 HydrophobicContact CG-CD2 4.32Å; F776-Y783 AromaticContact CZ-CD2 3.94Å; F776-Y783 HydrophobicContact CZ-CD2 3.94Å; F776-Y783 AromaticContact CZ-CG 3.87Å; F776-Y783 HydrophobicContact CZ-CG 3.87Å; F776-Y783 PolarHBondContact N-O 3.47Å; F776-Y783 PolarHBondContact O-N 2.62Å; F776-V785 HydrophobicContact CE1-CG2 3.79Å; F776-F1084 VanDerWaalsContact O-CE1 3.28Å; F776-F1084 WeakPolarHBondContact O-CE1 3.4Å
777	Q	91.9	Very high	91.9	Very high	59 Å²	59	28.9 Å²	28.9	28%	0.276	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	147.6	-174.6	62.5	179.5	-58.2	0	0	110.6	S781 L782 F1081 F1084	Q777-S781 WeakPolarHBondContact CA-O 3.44Å; Q777-S781 WeakPolarHBondContact CB-O 3.28Å; Q777-L782 HydrophobicContact CB-CD2 3.76Å; Q777-F1081 PolarHBondContact NE2-O 2.66Å; Q777-F1084 HydrophobicContact CB-CD1 4.32Å
778	D	90	Very high	92.2	Very high	68 Å²	68	24 Å²	24	36%	0.364	11%	0.108	S	C	.	.			trans	-106.2	-145.3	170.1	60	32.4	0	0	0	110	K742 D780 S781 Y783	K742-D778 PolarHBondContact NZ-O 3.02Å; D778-D780 PolarHBondContact OD1-N 2.85Å; D778-S781 PolarHBondContact N-O 3.1Å; D778-S781 PolarHBondContact OD1-N 3.2Å; D778-Y783 HydrophobicContact CB-CE2 4.41Å; D778-Y783 WeakPolarHBondContact OD2-CE2 3.41Å; D778-Y783 PolarHBondContact OD2-OH 2.76Å
779	R	86.8	Confident	92.3	Very high	121 Å²	121	23 Å²	23	46%	0.457	11%	0.105	S	C	.	.	S	Bend	trans	-68.6	-46	173.7	-177.1	-170.1	-177.9	156	2.8	111.4	K742 L1066 D1067	K742-R779 WeakPolarHBondContact CD-O 3.48Å; K742-R779 PolarHBondContact NZ-O 3.16Å; R779-L1066 HydrophobicContact CG-CD2 4.26Å; R779-D1067 IonicContact NH2-OD1 2.66Å; R779-D1067 PolarHBondContact NH2-OD1 3.32Å; R779-D1067 IonicContact NH2-OD2 3.19Å; R779-D1067 PolarHBondContact NH2-OD2 3.15Å
780	D	87.8	Confident	92.3	Very high	61 Å²	61	22.9 Å²	22.9	33%	0.326	11%	0.105	S	C	.	.	S	Bend	trans	-118.9	-17.7	-156.5	-55.7	-60.4	0	0	0	113.4	K742 D778	K742-D780 VanDerWaalsContact CB-O 3.25Å; K742-D780 WeakPolarHBondContact CB-O 3.38Å; K742-D780 WeakPolarHBondContact CG-O 3.37Å; K742-D780 PolarHBondContact N-O 3Å; D778-D780 PolarHBondContact OD1-N 2.85Å
781	S	91.7	Very high	92.3	Very high	21 Å²	21	22.9 Å²	22.9	15%	0.147	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	158.3	-175.5	-66.6	0	0	0	0	113.7	L740 K742 Q777 D778 Y783	L740-S781 CarbonylContact O-C 3.5Å; L740-S781 WeakPolarHBondContact O-CA 3.44Å; K742-S781 VanDerWaalsContact CE-O 3.3Å; K742-S781 WeakPolarHBondContact CE-O 3.25Å; Q777-S781 WeakPolarHBondContact CA-O 3.44Å; Q777-S781 WeakPolarHBondContact CB-O 3.28Å; D778-S781 PolarHBondContact N-O 3.1Å; D778-S781 PolarHBondContact OD1-N 3.2Å; S781-Y783 WeakPolarHBondContact CB-OH 3.45Å
782	L	93.4	Very high	92.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	144.1	168.7	-56	175	0	0	0	108.7	T739 L740 K742 V754 Q777 F1081 F1084	T739-L782 CarbonylContact C-O 3.47Å; T739-L782 WeakPolarHBondContact CA-O 3.28Å; L740-L782 HydrophobicContact CB-CB 4.39Å; L740-L782 PolarHBondContact N-O 2.85Å; L740-L782 PolarHBondContact O-N 3.28Å; K742-L782 HydrophobicContact CD-CD2 4.3Å; K742-L782 HydrophobicContact CG-CD1 4.45Å; K742-L782 HydrophobicContact CG-CD2 3.96Å; K742-L782 HydrophobicContact CG-CG 3.79Å; V754-L782 HydrophobicContact CG1-CD1 3.72Å; Q777-L782 HydrophobicContact CB-CD2 3.76Å; L782-F1081 HydrophobicContact CD1-CD1 3.62Å; L782-F1081 HydrophobicContact CD1-CE1 3.62Å; L782-F1081 HydrophobicContact CD1-CG 4.18Å; L782-F1081 HydrophobicContact CD1-CZ 4.14Å; L782-F1081 HydrophobicContact CD2-CB 4.04Å; L782-F1081 HydrophobicContact CD2-CD1 4.12Å; L782-F1081 HydrophobicContact CD2-CD2 4.35Å; L782-F1081 HydrophobicContact CD2-CG 3.89Å; L782-F1081 HydrophobicContact CG-CD1 4.49Å; L782-F1084 HydrophobicContact CB-CD1 4.36Å; L782-F1084 HydrophobicContact CB-CE1 3.81Å; L782-F1084 HydrophobicContact CB-CE2 4.47Å; L782-F1084 HydrophobicContact CB-CZ 3.89Å; L782-F1084 HydrophobicContact CD1-CE2 4.41Å; L782-F1084 HydrophobicContact CD2-CD1 3.8Å; L782-F1084 HydrophobicContact CD2-CD2 4.47Å; L782-F1084 HydrophobicContact CD2-CE1 4.14Å; L782-F1084 HydrophobicContact CD2-CG 4Å; L782-F1084 HydrophobicContact CG-CE1 4.48Å
783	Y	94.5	Very high	92.3	Very high	4 Å²	4	20.2 Å²	20.2	2%	0.016	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130	-177.1	-57	-74.9	0	0	0	110.7	K706 M737 K738 T739 S775 F776 D778 S781 F1084	K706-Y783 HydrophobicContact CD-CE1 4.36Å; K706-Y783 HydrophobicContact CG-CE1 4.32Å; M737-Y783 HydrophobicContact CE-CD1 3.24Å; M737-Y783 HydrophobicContact CE-CE1 3.76Å; M737-Y783 HydrophobicContact CE-CG 3.78Å; K738-Y783 WeakPolarHBondContact O-CA 3.34Å; T739-Y783 HydrophobicContact CG2-CD1 3.92Å; T739-Y783 HydrophobicContact CG2-CE1 3.46Å; T739-Y783 VanDerWaalsContact CG2-CE1 3.46Å; T739-Y783 WeakPolarHBondContact OG1-CD1 3.21Å; T739-Y783 WeakPolarHBondContact OG1-CE1 3.26Å; S775-Y783 CarbonylContact C-O 3.53Å; S775-Y783 WeakPolarHBondContact CA-O 3.3Å; S775-Y783 VanDerWaalsContact CB-O 3.32Å; S775-Y783 WeakPolarHBondContact CB-O 3.36Å; F776-Y783 AromaticContact CD2-CD2 3.57Å; F776-Y783 HydrophobicContact CD2-CD2 3.57Å; F776-Y783 HydrophobicContact CD2-CE2 4.35Å; F776-Y783 HydrophobicContact CD2-CG 4.22Å; F776-Y783 HydrophobicContact CE1-CG 4.38Å; F776-Y783 AromaticContact CE2-CD2 3.33Å; F776-Y783 HydrophobicContact CE2-CD2 3.33Å; F776-Y783 AromaticContact CE2-CE2 3.95Å; F776-Y783 HydrophobicContact CE2-CE2 3.95Å; F776-Y783 AromaticContact CE2-CG 3.77Å; F776-Y783 HydrophobicContact CE2-CG 3.77Å; F776-Y783 HydrophobicContact CG-CD2 4.32Å; F776-Y783 AromaticContact CZ-CD2 3.94Å; F776-Y783 HydrophobicContact CZ-CD2 3.94Å; F776-Y783 AromaticContact CZ-CG 3.87Å; F776-Y783 HydrophobicContact CZ-CG 3.87Å; F776-Y783 PolarHBondContact N-O 3.47Å; F776-Y783 PolarHBondContact O-N 2.62Å; D778-Y783 HydrophobicContact CB-CE2 4.41Å; D778-Y783 WeakPolarHBondContact OD2-CE2 3.41Å; D778-Y783 PolarHBondContact OD2-OH 2.76Å; S781-Y783 WeakPolarHBondContact CB-OH 3.45Å; Y783-F1084 WeakPolarHBondContact O-CE1 3.29Å
784	F	94.9	Very high	92.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138.9	161.8	-58.2	-106.2	0	0	0	108.3	M737 K738 L740 V754 E757 R758 L761 L772 M786 F1084	M737-F784 CarbonylContact C-O 3.56Å; M737-F784 VanDerWaalsContact CA-O 3.25Å; M737-F784 WeakPolarHBondContact CA-O 3.43Å; K738-F784 HydrophobicContact CB-CB 4.19Å; K738-F784 HydrophobicContact CB-CD2 4.34Å; K738-F784 HydrophobicContact CD-CD2 4.34Å; K738-F784 PolarHBondContact N-O 3.09Å; K738-F784 PolarHBondContact O-N 3.15Å; L740-F784 HydrophobicContact CD1-CD2 3.61Å; L740-F784 HydrophobicContact CD1-CE2 3.54Å; L740-F784 HydrophobicContact CD2-CE2 4.44Å; V754-F784 HydrophobicContact CG1-CE2 4.28Å; V754-F784 HydrophobicContact CG1-CZ 4.09Å; E757-F784 HydrophobicContact CB-CE1 4.35Å; E757-F784 HydrophobicContact CB-CZ 4.24Å; E757-F784 HydrophobicContact CG-CE1 3.91Å; E757-F784 HydrophobicContact CG-CZ 4.01Å; R758-F784 HydrophobicContact CB-CE1 3.81Å; R758-F784 HydrophobicContact CB-CZ 4.35Å; R758-F784 HydrophobicContact CG-CE1 4.41Å; L761-F784 HydrophobicContact CD1-CD1 4.42Å; L772-F784 HydrophobicContact CD1-CB 3.83Å; L772-F784 HydrophobicContact CD1-CD1 3.87Å; L772-F784 HydrophobicContact CD1-CG 4.35Å; L772-F784 HydrophobicContact CD2-CD1 4.4Å; F784-M786 HydrophobicContact CB-CE 3.94Å; F784-F1084 HydrophobicContact CD1-CZ 4.36Å; F784-F1084 AromaticContact CD2-CZ 3.94Å; F784-F1084 HydrophobicContact CD2-CZ 3.94Å; F784-F1084 HydrophobicContact CE1-CE2 4.07Å; F784-F1084 HydrophobicContact CE1-CZ 4.06Å; F784-F1084 AromaticContact CE2-CE2 3.89Å; F784-F1084 HydrophobicContact CE2-CE2 3.89Å; F784-F1084 AromaticContact CE2-CZ 3.61Å; F784-F1084 HydrophobicContact CE2-CZ 3.61Å; F784-F1084 HydrophobicContact CG-CZ 4.32Å; F784-F1084 AromaticContact CZ-CE2 3.58Å; F784-F1084 HydrophobicContact CZ-CE2 3.58Å; F784-F1084 AromaticContact CZ-CZ 3.69Å; F784-F1084 HydrophobicContact CZ-CZ 3.69Å
785	V	94.8	Very high	92.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	114.4	175.8	-175.6	0	0	0	0	107.9	F709 Y735 M737 Y773 Y774 F776	F709-V785 HydrophobicContact CD1-CG1 4.44Å; F709-V785 HydrophobicContact CE1-CG1 3.67Å; F709-V785 HydrophobicContact CE1-CG2 4.12Å; F709-V785 HydrophobicContact CE2-CG2 4.26Å; F709-V785 HydrophobicContact CZ-CB 4.49Å; F709-V785 HydrophobicContact CZ-CG1 4.06Å; F709-V785 HydrophobicContact CZ-CG2 3.9Å; Y735-V785 VanDerWaalsContact CB-CG1 3.5Å; Y735-V785 HydrophobicContact CD1-CG1 3.65Å; Y735-V785 HydrophobicContact CD2-CG1 4.19Å; Y735-V785 HydrophobicContact CE1-CG1 4.38Å; Y735-V785 HydrophobicContact CG-CG1 3.52Å; M737-V785 HydrophobicContact CG-CG2 4.19Å; M737-V785 HydrophobicContact SD-CG2 4.31Å; Y773-V785 PolarHBondContact N-O 3.25Å; Y774-V785 HydrophobicContact CD2-CB 3.98Å; Y774-V785 HydrophobicContact CD2-CG1 3.92Å; Y774-V785 PolarHBondContact N-O 3.48Å; Y774-V785 VanDerWaalsContact N-O 3.15Å; Y774-V785 PolarHBondContact O-N 3.38Å; F776-V785 HydrophobicContact CE1-CG2 3.79Å
786	M	94.4	Very high	92.4	Very high	11 Å²	11	22.4 Å²	22.4	5%	0.054	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	172.7	-165.5	55	177.3	64.3	0	0	111.6	Y735 A736 K738 L761 V770 R771 F784 Y788	Y735-M786 WeakPolarHBondContact CA-O 3.43Å; Y735-M786 WeakPolarHBondContact CB-O 3.12Å; A736-M786 HydrophobicContact CB-CG 4Å; A736-M786 PolarHBondContact N-O 3.18Å; A736-M786 VanDerWaalsContact N-O 3.07Å; A736-M786 WeakPolarHBondContact O-CG 3.18Å; A736-M786 PolarHBondContact O-N 2.73Å; K738-M786 HydrophobicContact CB-CE 4.49Å; L761-M786 HydrophobicContact CD1-CE 4.13Å; V770-M786 HydrophobicContact CG1-CB 3.76Å; V770-M786 HydrophobicContact CG1-CG 4.12Å; V770-M786 HydrophobicContact CG1-SD 3.83Å; R771-M786 CarbonylContact O-C 3.51Å; R771-M786 WeakPolarHBondContact O-CA 3.32Å; F784-M786 HydrophobicContact CB-CE 3.94Å; M786-Y788 PolarHBondContact O-N 2.88Å
787	D	92.3	Very high	92.4	Very high	13 Å²	13	22.3 Å²	22.3	7%	0.07	11%	0.109	C	C	.	.			trans	-46.5	140.4	172.3	-65.8	-37	0	0	0	110.9	A736 V770 R771 Y773 I789	A736-D787 WeakPolarHBondContact CB-O 3.47Å; V770-D787 HydrophobicContact CG1-CB 4.36Å; R771-D787 WeakPolarHBondContact CB-OD2 3.36Å; R771-D787 PolarHBondContact N-OD2 3.44Å; R771-D787 PolarHBondContact O-N 2.77Å; R771-D787 VanDerWaalsContact O-N 3.08Å; Y773-D787 WeakPolarHBondContact CE2-OD1 2.89Å; D787-I789 HydrophobicContact CB-CD1 3.62Å; D787-I789 HydrophobicContact CB-CG1 4.16Å
788	Y	94.3	Very high	92.4	Very high	4 Å²	4	20 Å²	20	2%	0.016	10%	0.099	C	C	.	.			trans	-92.8	118.8	164.7	176.5	-126.2	0	0	0	109.4	L715 L725 A736 M786 P790 D1040 T1041 F1044 F1097	L715-Y788 HydrophobicContact CD1-CD2 3.89Å; L715-Y788 HydrophobicContact CD1-CE2 3.64Å; L715-Y788 HydrophobicContact CD2-CE2 3.96Å; L715-Y788 HydrophobicContact CG-CE2 4.48Å; L725-Y788 HydrophobicContact CD1-CD1 3.59Å; L725-Y788 HydrophobicContact CD1-CD2 3.82Å; L725-Y788 HydrophobicContact CD1-CE1 3.79Å; L725-Y788 HydrophobicContact CD1-CE2 4.06Å; L725-Y788 HydrophobicContact CD1-CG 3.59Å; L725-Y788 HydrophobicContact CD2-CE1 4.19Å; A736-Y788 HydrophobicContact CB-CD2 4.45Å; M786-Y788 PolarHBondContact O-N 2.88Å; Y788-P790 HydrophobicContact CE1-CB 4.17Å; Y788-P790 WeakPolarHBondContact O-CD 3.46Å; Y788-D1040 PolarHBondContact OH-O 3.45Å; Y788-T1041 WeakPolarHBondContact OH-CG2 3.21Å; Y788-F1044 AromaticContact CE2-CE2 3.94Å; Y788-F1044 HydrophobicContact CE2-CE2 3.94Å; Y788-F1044 AromaticContact CE2-CZ 3.93Å; Y788-F1044 HydrophobicContact CE2-CZ 3.93Å; Y788-F1097 HydrophobicContact CD1-CD2 4.05Å; Y788-F1097 HydrophobicContact CD1-CE2 4.35Å
789	I	94.6	Very high	92.3	Very high	10 Å²	10	22.2 Å²	22.2	5%	0.051	11%	0.109	C	C	.	.			trans	-109	102.3	-173.7	-56.2	-53.5	0	0	0	108.7	V770 D787 L839 I840 D841 K847 F1044	V770-I789 HydrophobicContact CG2-CG1 4.36Å; D787-I789 HydrophobicContact CB-CD1 3.62Å; D787-I789 HydrophobicContact CB-CG1 4.16Å; I789-L839 HydrophobicContact CB-CB 4.22Å; I789-L839 HydrophobicContact CB-CD1 4.07Å; I789-L839 HydrophobicContact CG1-CD1 4.11Å; I789-L839 HydrophobicContact CG2-CB 3.66Å; I789-L839 HydrophobicContact CG2-CD1 4.43Å; I789-I840 VanDerWaalsContact CG2-C 3.46Å; I789-I840 WeakPolarHBondContact CG2-O 3.18Å; I789-D841 HydrophobicContact CG2-CB 4.36Å; I789-K847 HydrophobicContact CD1-CD 3.62Å; I789-K847 HydrophobicContact CG1-CD 4.34Å; I789-F1044 VanDerWaalsContact O-CZ 3.26Å; I789-F1044 WeakPolarHBondContact O-CZ 3.45Å
790	P	92.9	Very high	92.5	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.013	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.4	-164.9	33.8	-41.1	0	0	0	115.6	Y788 G792 L842 I1035 N1043 F1097	Y788-P790 HydrophobicContact CE1-CB 4.17Å; Y788-P790 WeakPolarHBondContact O-CD 3.46Å; P790-G792 PolarHBondContact O-N 2.99Å; P790-L842 HydrophobicContact CG-CB 3.97Å; P790-I1035 HydrophobicContact CB-CD1 3.89Å; P790-I1035 HydrophobicContact CB-CG1 4.19Å; P790-I1035 HydrophobicContact CB-CG2 4.32Å; P790-I1035 HydrophobicContact CG-CD1 3.51Å; P790-I1035 HydrophobicContact CG-CG1 4.35Å; P790-N1043 PolarHBondContact O-ND2 3.28Å; P790-F1097 HydrophobicContact CB-CE2 4.02Å; P790-F1097 HydrophobicContact CG-CE2 3.77Å
791	G	92.8	Very high	92.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.1	-177.8	0	0	0	0	0	114.8	I840 N1043	G791-I840 WeakPolarHBondContact CA-O 3.35Å; G791-I840 PolarHBondContact N-O 3.27Å; G791-I840 VanDerWaalsContact N-O 3.09Å; G791-N1043 VanDerWaalsContact C-CB 3.45Å; G791-N1043 WeakPolarHBondContact O-CB 3.19Å
792	G	92.4	Very high	92.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.			trans	78.3	-155.2	-174.4	0	0	0	0	0	112.3	P790 L839 I840 N1043	P790-G792 PolarHBondContact O-N 2.99Å; G792-L839 WeakPolarHBondContact O-CA 3.4Å; G792-I840 PolarHBondContact O-N 2.96Å; G792-N1043 VanDerWaalsContact CA-O 3.28Å; G792-N1043 WeakPolarHBondContact CA-O 3.26Å
793	D	93.3	Very high	92.5	Very high	30 Å²	30	27.2 Å²	27.2	16%	0.16	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-113.1	169.1	175.8	63.5	76.2	0	0	0	112.9	M795 S796 L797 I838 L839	D793-M795 VanDerWaalsContact C-N 3.31Å; D793-M795 PolarHBondContact O-N 3.01Å; D793-M795 WeakPolarHBondContact OD1-CA 3.48Å; D793-M795 WeakPolarHBondContact OD1-CB 3.42Å; D793-M795 PolarHBondContact OD1-N 3.04Å; D793-S796 PolarHBondContact OD1-N 3.44Å; D793-L797 PolarHBondContact O-N 3.03Å; D793-I838 CarbonylContact C-O 3.58Å; D793-I838 WeakPolarHBondContact CA-O 3.36Å; D793-L839 HydrophobicContact CB-CD2 3.74Å
794	M	95	Very high	92.6	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-70.6	-26.6	-177.8	-167.2	63.3	70.3	0	0	112	L797 L798 F804 Y812 P835 I838 I840 I846 M948	M794-L797 PolarHBondContact O-N 3.19Å; M794-L797 HydrophobicContact SD-CD2 4.2Å; M794-L798 HydrophobicContact CG-CD1 3.63Å; M794-L798 WeakPolarHBondContact O-CD1 3.39Å; M794-L798 PolarHBondContact O-N 2.89Å; M794-L798 HydrophobicContact SD-CD1 4.06Å; M794-F804 HydrophobicContact SD-CE2 3.63Å; M794-F804 HydrophobicContact SD-CZ 3.73Å; M794-Y812 HydrophobicContact CE-CD1 3.77Å; M794-Y812 HydrophobicContact CE-CD2 3.66Å; M794-Y812 HydrophobicContact CE-CE1 3.99Å; M794-Y812 HydrophobicContact CE-CE2 3.85Å; M794-Y812 HydrophobicContact CE-CG 3.62Å; M794-Y812 HydrophobicContact SD-CD2 4.05Å; M794-Y812 HydrophobicContact SD-CE2 4.19Å; M794-P835 HydrophobicContact CB-CB 4.11Å; M794-P835 WeakPolarHBondContact CB-O 3.12Å; M794-P835 HydrophobicContact CG-CB 4.34Å; M794-P835 PolarHBondContact N-O 2.76Å; M794-I838 HydrophobicContact CB-CB 3.89Å; M794-I838 HydrophobicContact CB-CG2 4.07Å; M794-I838 WeakPolarHBondContact CB-O 3.38Å; M794-I838 HydrophobicContact CE-CG2 4.01Å; M794-I838 PolarHBondContact N-O 2.92Å; M794-I840 HydrophobicContact CE-CD1 3.84Å; M794-I840 HydrophobicContact CE-CG1 4.1Å; M794-I840 HydrophobicContact SD-CD1 4.1Å; M794-I846 HydrophobicContact CE-CG2 3.84Å; M794-M948 HydrophobicContact CE-CE 4.36Å; M794-M948 HydrophobicContact CG-CE 3.82Å; M794-M948 HydrophobicContact SD-CE 3.85Å
795	M	90.4	Very high	92.6	Very high	53 Å²	53	31 Å²	31	26%	0.261	17%	0.169	S	C	.	.	H	α-helix	trans	-66.1	-49.4	175.9	-167.5	62.9	-173.2	0	0	110.1	D793 L797 L798 I799 P835	D793-M795 VanDerWaalsContact C-N 3.31Å; D793-M795 PolarHBondContact O-N 3.01Å; D793-M795 WeakPolarHBondContact OD1-CA 3.48Å; D793-M795 WeakPolarHBondContact OD1-CB 3.42Å; D793-M795 PolarHBondContact OD1-N 3.04Å; M795-L797 PolarHBondContact O-N 2.97Å; M795-L798 PolarHBondContact O-N 3.09Å; M795-I799 HydrophobicContact CE-CD1 4.16Å; M795-I799 HydrophobicContact CE-CG1 4.34Å; M795-I799 HydrophobicContact CG-CD1 3.99Å; M795-I799 VanDerWaalsContact O-CG1 3.29Å; M795-I799 WeakPolarHBondContact O-CG1 3.49Å; M795-I799 PolarHBondContact O-N 2.93Å; M795-P835 HydrophobicContact CB-CB 3.88Å; M795-P835 HydrophobicContact SD-CB 3.99Å; M795-P835 HydrophobicContact SD-CG 4.24Å
796	S	89.8	Confident	92.6	Very high	9 Å²	9	33.3 Å²	33.3	6%	0.063	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-20.9	173.7	-60.5	0	0	0	0	113.3	D793 R800	D793-S796 PolarHBondContact OD1-N 3.44Å; S796-R800 VanDerWaalsContact O-CG 3.26Å; S796-R800 WeakPolarHBondContact O-CG 3.35Å; S796-R800 PolarHBondContact O-N 3.21Å; S796-R800 PolarHBondContact O-NE 3.23Å
797	L	92.5	Very high	92.6	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-80.1	-45.1	170.4	-172.3	59.4	0	0	0	112.4	D793 M794 M795 I799 R800 M801 F804 Y812 I840 Y1031	D793-L797 PolarHBondContact O-N 3.03Å; M794-L797 PolarHBondContact O-N 3.19Å; M794-L797 HydrophobicContact SD-CD2 4.2Å; M795-L797 PolarHBondContact O-N 2.97Å; L797-I799 PolarHBondContact O-N 3.43Å; L797-R800 PolarHBondContact O-N 3.04Å; L797-M801 HydrophobicContact CD1-CG 4.13Å; L797-M801 HydrophobicContact CD1-SD 3.86Å; L797-M801 HydrophobicContact CG-SD 4.11Å; L797-M801 PolarHBondContact O-N 3.09Å; L797-F804 HydrophobicContact CB-CZ 4.21Å; L797-F804 HydrophobicContact CD2-CE1 4.38Å; L797-F804 HydrophobicContact CD2-CZ 3.75Å; L797-F804 HydrophobicContact CG-CE1 3.94Å; L797-F804 HydrophobicContact CG-CZ 3.68Å; L797-Y812 HydrophobicContact CD2-CE2 4.1Å; L797-I840 HydrophobicContact CB-CD1 4.14Å; L797-I840 HydrophobicContact CD2-CD1 3.5Å; L797-I840 VanDerWaalsContact CD2-CD1 3.5Å; L797-I840 HydrophobicContact CG-CD1 4.44Å; L797-Y1031 HydrophobicContact CD1-CD1 4.3Å; L797-Y1031 HydrophobicContact CD1-CD2 4.27Å; L797-Y1031 HydrophobicContact CD1-CE1 3.78Å; L797-Y1031 HydrophobicContact CD1-CE2 3.74Å; L797-Y1031 VanDerWaalsContact CD1-CZ 3.47Å; L797-Y1031 HydrophobicContact CD2-CD1 3.71Å; L797-Y1031 HydrophobicContact CD2-CE1 3.83Å; L797-Y1031 HydrophobicContact CD2-CG 4.16Å; L797-Y1031 HydrophobicContact CG-CE1 4.47Å
798	L	91.7	Very high	92.7	Very high	11 Å²	11	37.8 Å²	37.8	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-59	-45.5	174.2	-90.6	85.3	0	0	0	111.2	M794 M795 R800 M801 G802 F804 E947 M948	M794-L798 HydrophobicContact CG-CD1 3.63Å; M794-L798 WeakPolarHBondContact O-CD1 3.39Å; M794-L798 PolarHBondContact O-N 2.89Å; M794-L798 HydrophobicContact SD-CD1 4.06Å; M795-L798 PolarHBondContact O-N 3.09Å; L798-R800 VanDerWaalsContact C-N 3.27Å; L798-R800 PolarHBondContact O-N 2.83Å; L798-M801 PolarHBondContact O-N 3.09Å; L798-G802 WeakPolarHBondContact O-CA 3.28Å; L798-G802 PolarHBondContact O-N 2.64Å; L798-F804 HydrophobicContact CD1-CE1 3.97Å; L798-F804 HydrophobicContact CD1-CE2 3.83Å; L798-F804 HydrophobicContact CD1-CZ 3.45Å; L798-F804 VanDerWaalsContact CD1-CZ 3.45Å; L798-F804 HydrophobicContact CG-CD1 4.48Å; L798-F804 HydrophobicContact CG-CE1 3.96Å; L798-F804 HydrophobicContact CG-CZ 3.97Å; L798-E947 HydrophobicContact CD2-CB 4.42Å; L798-E947 HydrophobicContact CD2-CG 3.73Å; L798-M948 HydrophobicContact CD1-CE 4.35Å; L798-M948 HydrophobicContact CD1-CG 4.13Å; L798-M948 HydrophobicContact CD2-CG 4.18Å; L798-M948 HydrophobicContact CG-CG 4.48Å
799	I	88.8	Confident	92.8	Very high	114 Å²	114	37.6 Å²	37.6	59%	0.585	20%	0.203	S	C	*	.	H	α-helix	trans	-58	-39.3	177.4	-68	165.8	0	0	0	111.6	M795 L797	M795-I799 HydrophobicContact CE-CD1 4.16Å; M795-I799 HydrophobicContact CE-CG1 4.34Å; M795-I799 HydrophobicContact CG-CD1 3.99Å; M795-I799 VanDerWaalsContact O-CG1 3.29Å; M795-I799 WeakPolarHBondContact O-CG1 3.49Å; M795-I799 PolarHBondContact O-N 2.93Å; L797-I799 PolarHBondContact O-N 3.43Å
800	R	89.2	Confident	93	Very high	120 Å²	120	38.5 Å²	38.5	45%	0.453	21%	0.206	S	C	.	.	H	α-helix	trans	-75.3	-28.6	179.9	-76.4	-177.7	-65.9	173.5	0.3	114.1	S796 L797 L798 N1043	S796-R800 VanDerWaalsContact O-CG 3.26Å; S796-R800 WeakPolarHBondContact O-CG 3.35Å; S796-R800 PolarHBondContact O-N 3.21Å; S796-R800 PolarHBondContact O-NE 3.23Å; L797-R800 PolarHBondContact O-N 3.04Å; L798-R800 VanDerWaalsContact C-N 3.27Å; L798-R800 PolarHBondContact O-N 2.83Å; R800-N1043 PolarHBondContact NH1-OD1 3.29Å
801	M	91.4	Very high	93.1	Very high	75 Å²	75	39.2 Å²	39.2	37%	0.369	21%	0.208	S	C	.	.	H	α-helix	trans	-98.9	-21	-178.5	-65.9	-172.6	63.6	0	0	113.8	L797 L798 V803 F804 L808	L797-M801 HydrophobicContact CD1-CG 4.13Å; L797-M801 HydrophobicContact CD1-SD 3.86Å; L797-M801 HydrophobicContact CG-SD 4.11Å; L797-M801 PolarHBondContact O-N 3.09Å; L798-M801 PolarHBondContact O-N 3.09Å; M801-V803 PolarHBondContact O-N 3.21Å; M801-F804 HydrophobicContact CB-CD1 4.01Å; M801-F804 HydrophobicContact CB-CE1 3.99Å; M801-F804 HydrophobicContact CE-CD1 4.23Å; M801-F804 HydrophobicContact CG-CE1 4.21Å; M801-F804 HydrophobicContact SD-CD1 3.9Å; M801-F804 HydrophobicContact SD-CE1 3.68Å; M801-L808 HydrophobicContact CE-CD2 3.7Å; M801-L808 HydrophobicContact SD-CD2 3.89Å
802	G	89.4	Confident	93.3	Very high	40 Å²	40	39.3 Å²	39.3	41%	0.412	21%	0.209	S	C	.	.	S	Bend	trans	72.9	-58.2	-172.6	0	0	0	0	0	113.1	L798 G951	L798-G802 WeakPolarHBondContact O-CA 3.28Å; L798-G802 PolarHBondContact O-N 2.64Å; G802-G951 VanDerWaalsContact O-CA 3.26Å; G802-G951 WeakPolarHBondContact O-CA 3.43Å
803	V	93.3	Very high	93.6	Very high	73 Å²	73	39.3 Å²	39.3	44%	0.442	21%	0.209	S	C	.	.	S	Bend	trans	-139.1	139.1	178.1	-177.2	0	0	0	0	109.1	M801 L949	M801-V803 PolarHBondContact O-N 3.21Å; V803-L949 WeakPolarHBondContact CG1-O 3.37Å
804	F	95.9	Very high	93.8	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.022	20%	0.201	C	C	.	.			trans	-87.3	138.6	176.3	-74.7	7	0	0	0	111.3	M794 L797 L798 M801 L808 A809 Y812 M948	M794-F804 HydrophobicContact SD-CE2 3.63Å; M794-F804 HydrophobicContact SD-CZ 3.73Å; L797-F804 HydrophobicContact CB-CZ 4.21Å; L797-F804 HydrophobicContact CD2-CE1 4.38Å; L797-F804 HydrophobicContact CD2-CZ 3.75Å; L797-F804 HydrophobicContact CG-CE1 3.94Å; L797-F804 HydrophobicContact CG-CZ 3.68Å; L798-F804 HydrophobicContact CD1-CE1 3.97Å; L798-F804 HydrophobicContact CD1-CE2 3.83Å; L798-F804 HydrophobicContact CD1-CZ 3.45Å; L798-F804 VanDerWaalsContact CD1-CZ 3.45Å; L798-F804 HydrophobicContact CG-CD1 4.48Å; L798-F804 HydrophobicContact CG-CE1 3.96Å; L798-F804 HydrophobicContact CG-CZ 3.97Å; M801-F804 HydrophobicContact CB-CD1 4.01Å; M801-F804 HydrophobicContact CB-CE1 3.99Å; M801-F804 HydrophobicContact CE-CD1 4.23Å; M801-F804 HydrophobicContact CG-CE1 4.21Å; M801-F804 HydrophobicContact SD-CD1 3.9Å; M801-F804 HydrophobicContact SD-CE1 3.68Å; F804-L808 HydrophobicContact CB-CD2 4.27Å; F804-L808 HydrophobicContact CD1-CD2 4.14Å; F804-L808 HydrophobicContact CD2-CD2 3.97Å; F804-L808 HydrophobicContact CD2-CG 4.08Å; F804-L808 HydrophobicContact CE1-CD2 4.46Å; F804-L808 HydrophobicContact CE2-CD2 4.3Å; F804-L808 HydrophobicContact CE2-CG 4.49Å; F804-L808 HydrophobicContact CG-CD2 3.88Å; F804-L808 HydrophobicContact CG-CG 4.38Å; F804-A809 HydrophobicContact CB-CB 4.38Å; F804-Y812 HydrophobicContact CD2-CD2 4.38Å; F804-Y812 AromaticContact CE2-CD2 3.85Å; F804-Y812 HydrophobicContact CE2-CD2 3.85Å; F804-Y812 HydrophobicContact CE2-CE2 4.2Å; F804-M948 HydrophobicContact CB-CB 4.27Å; F804-M948 HydrophobicContact CD2-CB 4.07Å; F804-M948 HydrophobicContact CD2-CE 4.31Å; F804-M948 HydrophobicContact CD2-CG 3.71Å; F804-M948 HydrophobicContact CD2-SD 3.91Å; F804-M948 HydrophobicContact CE2-CE 3.92Å; F804-M948 HydrophobicContact CE2-CG 4.04Å; F804-M948 HydrophobicContact CE2-SD 4.15Å; F804-M948 HydrophobicContact CG-CB 4.35Å; F804-M948 HydrophobicContact CG-CG 4.37Å; F804-M948 PolarHBondContact N-O 2.64Å
805	P	95.3	Very high	93.8	Very high	78 Å²	78	37.9 Å²	37.9	51%	0.506	20%	0.201	S	C	.	.			trans	-56.4	143.7	163.2	-22.9	33.8	0	0	0	110.9	L807 L808 A809	P805-L807 PolarHBondContact O-N 2.87Å; P805-L807 VanDerWaalsContact O-N 3.12Å; P805-L808 WeakPolarHBondContact O-CB 3.46Å; P805-L808 PolarHBondContact O-N 2.86Å; P805-A809 PolarHBondContact O-N 3.45Å; P805-A809 VanDerWaalsContact O-N 3.1Å
806	E	94.6	Very high	94.1	Very high	48 Å²	48	35.4 Å²	35.4	22%	0.224	19%	0.189	C	C	.	.	H	α-helix	trans	-57.4	-35	-173.8	-166.9	-179.3	140.4	0	0	113.2	L808 A809 R810 L949 S983 S986 F1014	E806-L808 VanDerWaalsContact C-N 3.35Å; E806-L808 PolarHBondContact O-N 3.31Å; E806-A809 PolarHBondContact O-N 3.21Å; E806-R810 WeakPolarHBondContact O-CB 3.36Å; E806-R810 PolarHBondContact O-N 3.29Å; E806-R810 IonicContact OE1-CZ 2.92Å; E806-R810 IonicContact OE1-NH2 3.2Å; E806-R810 PolarHBondContact OE1-NH2 3.15Å; E806-L949 HydrophobicContact CB-CD2 4.15Å; E806-L949 HydrophobicContact CG-CD2 4.17Å; E806-S983 WeakPolarHBondContact OE1-CB 3.38Å; E806-S983 PolarHBondContact OE1-OG 2.9Å; E806-S983 VanDerWaalsContact OE2-CB 3.26Å; E806-S983 WeakPolarHBondContact OE2-CB 3.32Å; E806-S983 PolarHBondContact OE2-OG 3.49Å; E806-S986 PolarHBondContact OE1-OG 3.42Å; E806-S986 VanDerWaalsContact OE1-OG 3.08Å; E806-S986 PolarHBondContact OE2-OG 3.36Å; E806-F1014 HydrophobicContact CG-CE2 3.94Å
807	L	93.9	Very high	94.5	Very high	104 Å²	104	35 Å²	35	55%	0.545	19%	0.186	S	C	.	.	H	α-helix	trans	-62.5	-37.4	174.8	-176.4	63.2	0	0	0	113.1	P805 F811	P805-L807 PolarHBondContact O-N 2.87Å; P805-L807 VanDerWaalsContact O-N 3.12Å; L807-F811 PolarHBondContact O-N 3.1Å; L807-F811 VanDerWaalsContact O-N 3.08Å
808	L	95.9	Very high	94.6	Very high	14 Å²	14	36.1 Å²	36.1	7%	0.073	19%	0.192	C	C	.	.	H	α-helix	trans	-72.4	-42.9	177.5	-177	66.4	0	0	0	110.9	M801 F804 P805 E806 F811 Y812 P1030	M801-L808 HydrophobicContact CE-CD2 3.7Å; M801-L808 HydrophobicContact SD-CD2 3.89Å; F804-L808 HydrophobicContact CB-CD2 4.27Å; F804-L808 HydrophobicContact CD1-CD2 4.14Å; F804-L808 HydrophobicContact CD2-CD2 3.97Å; F804-L808 HydrophobicContact CD2-CG 4.08Å; F804-L808 HydrophobicContact CE1-CD2 4.46Å; F804-L808 HydrophobicContact CE2-CD2 4.3Å; F804-L808 HydrophobicContact CE2-CG 4.49Å; F804-L808 HydrophobicContact CG-CD2 3.88Å; F804-L808 HydrophobicContact CG-CG 4.38Å; P805-L808 WeakPolarHBondContact O-CB 3.46Å; P805-L808 PolarHBondContact O-N 2.86Å; E806-L808 VanDerWaalsContact C-N 3.35Å; E806-L808 PolarHBondContact O-N 3.31Å; L808-F811 PolarHBondContact O-N 3.42Å; L808-Y812 HydrophobicContact CD1-CD2 3.99Å; L808-Y812 HydrophobicContact CD1-CE2 3.56Å; L808-Y812 HydrophobicContact CG-CD2 4.03Å; L808-Y812 HydrophobicContact CG-CE2 3.95Å; L808-Y812 PolarHBondContact O-N 2.83Å; L808-P1030 HydrophobicContact CD1-CB 3.99Å
809	A	96.9	Very high	94.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-44	173.6	0	0	0	0	0	111.4	F804 P805 E806 F811 Y812 I813 L945 M948 L949	F804-A809 HydrophobicContact CB-CB 4.38Å; P805-A809 PolarHBondContact O-N 3.45Å; P805-A809 VanDerWaalsContact O-N 3.1Å; E806-A809 PolarHBondContact O-N 3.21Å; A809-F811 PolarHBondContact O-N 3.32Å; A809-Y812 PolarHBondContact O-N 3.23Å; A809-I813 WeakPolarHBondContact O-CB 3.48Å; A809-I813 VanDerWaalsContact O-CG1 3.28Å; A809-I813 WeakPolarHBondContact O-CG1 3.5Å; A809-I813 PolarHBondContact O-N 3.17Å; A809-L945 HydrophobicContact CB-CD1 4.04Å; A809-M948 HydrophobicContact CB-CB 4.06Å; A809-M948 HydrophobicContact CB-SD 4.16Å; A809-L949 HydrophobicContact CB-CD2 3.8Å; A809-L949 HydrophobicContact CB-CG 4.29Å
810	R	96.9	Very high	95	Very high	30 Å²	30	30.2 Å²	30.2	11%	0.113	16%	0.162	C	C	.	.	H	α-helix	trans	-56.6	-46.2	175.8	-176.6	-178.3	-62.8	138.1	6.4	111.9	E806 A814 F1014 F1015 E1017 V1018	E806-R810 WeakPolarHBondContact O-CB 3.36Å; E806-R810 PolarHBondContact O-N 3.29Å; E806-R810 IonicContact OE1-CZ 2.92Å; E806-R810 IonicContact OE1-NH2 3.2Å; E806-R810 PolarHBondContact OE1-NH2 3.15Å; R810-A814 VanDerWaalsContact O-CB 3.26Å; R810-A814 WeakPolarHBondContact O-CB 3.44Å; R810-A814 PolarHBondContact O-N 2.98Å; R810-F1014 HydrophobicContact CB-CE1 4.05Å; R810-F1014 HydrophobicContact CB-CE2 4.45Å; R810-F1014 HydrophobicContact CB-CZ 3.79Å; R810-F1014 WeakPolarHBondContact CD-O 3.35Å; R810-F1014 HydrophobicContact CG-CE1 4.1Å; R810-F1014 HydrophobicContact CG-CZ 4.23Å; R810-F1014 WeakPolarHBondContact CG-O 3.41Å; R810-F1014 PolarHBondContact NE-O 3.01Å; R810-F1015 HydrophobicContact CG-CD1 4.26Å; R810-E1017 IonicContact CZ-OE2 2.84Å; R810-E1017 IonicContact NH1-OE1 2.73Å; R810-E1017 IonicContact NH1-OE2 2.7Å; R810-E1017 PolarHBondContact NH1-OE2 2.91Å; R810-V1018 HydrophobicContact CG-CG2 3.92Å
811	F	96.2	Very high	95.2	Very high	16 Å²	16	26.1 Å²	26.1	7%	0.07	15%	0.147	C	C	.	.	H	α-helix	trans	-60.6	-53.2	174.7	178.2	-93.5	0	0	0	112	L807 L808 A809 I813 A814 E815 H845 L1024 A1029 P1030	L807-F811 PolarHBondContact O-N 3.1Å; L807-F811 VanDerWaalsContact O-N 3.08Å; L808-F811 PolarHBondContact O-N 3.42Å; A809-F811 PolarHBondContact O-N 3.32Å; F811-I813 PolarHBondContact O-N 3.5Å; F811-A814 WeakPolarHBondContact O-CB 3.28Å; F811-A814 PolarHBondContact O-N 2.74Å; F811-E815 HydrophobicContact CE1-CG 4.08Å; F811-E815 HydrophobicContact CZ-CG 4.11Å; F811-E815 PolarHBondContact O-N 3.44Å; F811-H845 AromaticContact CZ-CE1 3.9Å; F811-H845 AromaticContact CZ-ND1 3.79Å; F811-L1024 HydrophobicContact CD2-CD1 4.25Å; F811-L1024 HydrophobicContact CE2-CD1 4Å; F811-L1024 HydrophobicContact CE2-CG 4.27Å; F811-A1029 HydrophobicContact CE1-CB 3.83Å; F811-A1029 HydrophobicContact CZ-CB 3.8Å; F811-P1030 HydrophobicContact CB-CG 3.96Å; F811-P1030 VanDerWaalsContact CD1-CD 3.49Å; F811-P1030 HydrophobicContact CD1-CG 4.27Å; F811-P1030 HydrophobicContact CD2-CG 4.05Å; F811-P1030 VanDerWaalsContact CG-CD 3.44Å; F811-P1030 HydrophobicContact CG-CG 3.83Å
812	Y	97.4	Very high	95.3	Very high	3 Å²	3	23.6 Å²	23.6	1%	0.012	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-33.4	-176.1	-76.2	-43.9	0	0	0	113.8	M794 L797 F804 L808 A809 L816 G844 I846	M794-Y812 HydrophobicContact CE-CD1 3.77Å; M794-Y812 HydrophobicContact CE-CD2 3.66Å; M794-Y812 HydrophobicContact CE-CE1 3.99Å; M794-Y812 HydrophobicContact CE-CE2 3.85Å; M794-Y812 HydrophobicContact CE-CG 3.62Å; M794-Y812 HydrophobicContact SD-CD2 4.05Å; M794-Y812 HydrophobicContact SD-CE2 4.19Å; L797-Y812 HydrophobicContact CD2-CE2 4.1Å; F804-Y812 HydrophobicContact CD2-CD2 4.38Å; F804-Y812 AromaticContact CE2-CD2 3.85Å; F804-Y812 HydrophobicContact CE2-CD2 3.85Å; F804-Y812 HydrophobicContact CE2-CE2 4.2Å; L808-Y812 HydrophobicContact CD1-CD2 3.99Å; L808-Y812 HydrophobicContact CD1-CE2 3.56Å; L808-Y812 HydrophobicContact CG-CD2 4.03Å; L808-Y812 HydrophobicContact CG-CE2 3.95Å; L808-Y812 PolarHBondContact O-N 2.83Å; A809-Y812 PolarHBondContact O-N 3.23Å; Y812-L816 VanDerWaalsContact O-CB 3.22Å; Y812-L816 WeakPolarHBondContact O-CB 3.37Å; Y812-L816 PolarHBondContact O-N 3.35Å; Y812-G844 WeakPolarHBondContact CE1-O 3.39Å; Y812-G844 PolarHBondContact OH-O 2.78Å; Y812-I846 HydrophobicContact CD1-CG2 3.46Å; Y812-I846 VanDerWaalsContact CD1-CG2 3.46Å; Y812-I846 HydrophobicContact CE1-CG2 3.72Å; Y812-I846 HydrophobicContact CG-CG2 4.44Å
813	I	97.8	Very high	95.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-74.3	-30.3	174.3	-61.7	-60.8	0	0	0	111.6	A809 F811 L816 T817 V941 I944 L945 M948 F1015	A809-I813 WeakPolarHBondContact O-CB 3.48Å; A809-I813 VanDerWaalsContact O-CG1 3.28Å; A809-I813 WeakPolarHBondContact O-CG1 3.5Å; A809-I813 PolarHBondContact O-N 3.17Å; F811-I813 PolarHBondContact O-N 3.5Å; I813-L816 HydrophobicContact CD1-CD2 4Å; I813-L816 PolarHBondContact O-N 3.24Å; I813-T817 WeakPolarHBondContact O-CB 3.46Å; I813-T817 PolarHBondContact O-N 2.7Å; I813-T817 PolarHBondContact O-OG1 2.96Å; I813-V941 HydrophobicContact CD1-CG1 4.21Å; I813-V941 HydrophobicContact CG2-CG1 3.7Å; I813-I944 HydrophobicContact CD1-CG2 4.12Å; I813-L945 HydrophobicContact CD1-CB 4.1Å; I813-L945 HydrophobicContact CG1-CB 4.02Å; I813-L945 HydrophobicContact CG1-CD1 3.99Å; I813-L945 HydrophobicContact CG1-CG 4.41Å; I813-M948 HydrophobicContact CD1-CE 4.47Å; I813-M948 HydrophobicContact CD1-SD 4.04Å; I813-M948 HydrophobicContact CG1-SD 4.15Å; I813-F1015 HydrophobicContact CB-CE1 4.5Å; I813-F1015 HydrophobicContact CG2-CE1 4.22Å; I813-F1015 HydrophobicContact CG2-CZ 3.93Å
814	A	96.8	Very high	95.2	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.9	-45.9	170.3	0	0	0	0	0	111.9	R810 F811 T817 L818 F1015 V1018 F1020 L1024	R810-A814 VanDerWaalsContact O-CB 3.26Å; R810-A814 WeakPolarHBondContact O-CB 3.44Å; R810-A814 PolarHBondContact O-N 2.98Å; F811-A814 WeakPolarHBondContact O-CB 3.28Å; F811-A814 PolarHBondContact O-N 2.74Å; A814-T817 WeakPolarHBondContact O-CB 3.07Å; A814-T817 PolarHBondContact O-N 2.84Å; A814-L818 PolarHBondContact O-N 3.1Å; A814-F1015 HydrophobicContact CB-CD1 4.06Å; A814-F1015 HydrophobicContact CB-CE1 4.02Å; A814-V1018 HydrophobicContact CB-CG1 3.88Å; A814-V1018 HydrophobicContact CB-CG2 4.49Å; A814-F1020 HydrophobicContact CB-CE1 3.73Å; A814-F1020 HydrophobicContact CB-CZ 3.83Å; A814-L1024 HydrophobicContact CB-CD2 3.88Å
815	E	96.4	Very high	94.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.7	-43.2	172.2	-71.1	-144.6	129.2	0	0	112.1	W768 F811 T817 L818 A819 H845 I846 L1024	W768-E815 HydrophobicContact CH2-CB 4.38Å; W768-E815 HydrophobicContact CH2-CG 4.23Å; W768-E815 HydrophobicContact CZ3-CB 3.83Å; W768-E815 HydrophobicContact CZ3-CG 3.99Å; F811-E815 HydrophobicContact CE1-CG 4.08Å; F811-E815 HydrophobicContact CZ-CG 4.11Å; F811-E815 PolarHBondContact O-N 3.44Å; E815-T817 VanDerWaalsContact C-N 3.27Å; E815-T817 PolarHBondContact O-N 3.16Å; E815-L818 PolarHBondContact O-N 2.93Å; E815-L818 VanDerWaalsContact O-N 3.1Å; E815-A819 WeakPolarHBondContact O-CB 3.21Å; E815-A819 PolarHBondContact O-N 2.75Å; E815-H845 IonicContact OE1-CE1 3.26Å; E815-H845 IonicContact OE1-CG 2.82Å; E815-H845 IonicContact OE1-ND1 2.74Å; E815-H845 PolarHBondContact OE1-ND1 3.36Å; E815-H845 WeakPolarHBondContact OE2-CA 3.03Å; E815-H845 IonicContact OE2-ND1 2.79Å; E815-I846 HydrophobicContact CB-CD1 3.71Å; E815-I846 HydrophobicContact CB-CG1 3.84Å; E815-I846 PolarHBondContact OE2-N 2.9Å; E815-L1024 HydrophobicContact CG-CD2 3.88Å; E815-L1024 HydrophobicContact CG-CG 4.35Å
816	L	97.2	Very high	94.4	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-63	-35.1	178.8	-173.7	59.2	0	0	0	111.7	Y812 I813 A819 I820 I838 I846 L848 V941 I944	Y812-L816 VanDerWaalsContact O-CB 3.22Å; Y812-L816 WeakPolarHBondContact O-CB 3.37Å; Y812-L816 PolarHBondContact O-N 3.35Å; I813-L816 HydrophobicContact CD1-CD2 4Å; I813-L816 PolarHBondContact O-N 3.24Å; L816-A819 PolarHBondContact O-N 3.08Å; L816-I820 HydrophobicContact CD1-CD1 3.79Å; L816-I820 HydrophobicContact CD1-CG1 4.07Å; L816-I820 HydrophobicContact CG-CD1 3.79Å; L816-I820 HydrophobicContact CG-CG1 4.43Å; L816-I820 WeakPolarHBondContact O-CB 3.23Å; L816-I820 WeakPolarHBondContact O-CG1 3.37Å; L816-I820 PolarHBondContact O-N 3.24Å; L816-I838 HydrophobicContact CD1-CD1 3.86Å; L816-I838 HydrophobicContact CD1-CG1 4.27Å; L816-I838 HydrophobicContact CD2-CD1 3.9Å; L816-I846 HydrophobicContact CB-CD1 3.9Å; L816-I846 HydrophobicContact CD1-CD1 4.23Å; L816-L848 HydrophobicContact CD1-CD2 3.88Å; L816-V941 HydrophobicContact CD2-CG1 4.36Å; L816-V941 HydrophobicContact CD2-CG2 3.94Å; L816-V941 HydrophobicContact CG-CG2 4.12Å; L816-I944 HydrophobicContact CD2-CD1 4.29Å
817	T	96.4	Very high	94	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.9	-41.2	173.2	-59.4	0	0	0	0	111.7	I813 A814 E815 E821 W938 A1006 I1009 K1010	I813-T817 WeakPolarHBondContact O-CB 3.46Å; I813-T817 PolarHBondContact O-N 2.7Å; I813-T817 PolarHBondContact O-OG1 2.96Å; A814-T817 WeakPolarHBondContact O-CB 3.07Å; A814-T817 PolarHBondContact O-N 2.84Å; E815-T817 VanDerWaalsContact C-N 3.27Å; E815-T817 PolarHBondContact O-N 3.16Å; T817-E821 WeakPolarHBondContact O-CB 3.3Å; T817-E821 PolarHBondContact O-N 3.32Å; T817-E821 VanDerWaalsContact O-N 3.1Å; T817-W938 HydrophobicContact CG2-CH2 4.27Å; T817-W938 HydrophobicContact CG2-CZ3 4.26Å; T817-A1006 HydrophobicContact CG2-CB 4.2Å; T817-I1009 HydrophobicContact CG2-CB 4.18Å; T817-I1009 HydrophobicContact CG2-CG2 3.81Å; T817-K1010 HydrophobicContact CG2-CG 4.07Å
818	L	95	Very high	93.6	Very high	26 Å²	26	20.2 Å²	20.2	14%	0.136	11%	0.107	C	C	.	.	H	α-helix	trans	-68.9	-38.8	174	-66.3	173	0	0	0	112.2	W768 A814 E815 S822 F1020 L1024	W768-L818 HydrophobicContact CD2-CB 4.42Å; W768-L818 HydrophobicContact CH2-CB 4.2Å; W768-L818 HydrophobicContact CH2-CD1 4.01Å; W768-L818 HydrophobicContact CZ2-CB 3.74Å; W768-L818 HydrophobicContact CZ2-CD1 3.76Å; W768-L818 HydrophobicContact CZ2-CG 4.4Å; A814-L818 PolarHBondContact O-N 3.1Å; E815-L818 PolarHBondContact O-N 2.93Å; E815-L818 VanDerWaalsContact O-N 3.1Å; L818-S822 WeakPolarHBondContact O-CB 3.32Å; L818-S822 PolarHBondContact O-N 2.79Å; L818-F1020 HydrophobicContact CD1-CD1 4.32Å; L818-F1020 HydrophobicContact CD2-CD1 4.17Å; L818-F1020 HydrophobicContact CG-CD1 4.24Å; L818-F1020 HydrophobicContact CG-CE1 4.49Å; L818-L1024 HydrophobicContact CD1-CB 4.22Å; L818-L1024 HydrophobicContact CD1-CD2 4.12Å
819	A	95.1	Very high	93.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.4	-51.1	179.6	0	0	0	0	0	112.4	W768 E815 L816 S822 V823 L848	W768-A819 HydrophobicContact CB-CB 3.77Å; W768-A819 HydrophobicContact CD2-CB 4.21Å; W768-A819 HydrophobicContact CE3-CB 4.08Å; W768-A819 HydrophobicContact CG-CB 4.09Å; E815-A819 WeakPolarHBondContact O-CB 3.21Å; E815-A819 PolarHBondContact O-N 2.75Å; L816-A819 PolarHBondContact O-N 3.08Å; A819-S822 VanDerWaalsContact O-CB 3.3Å; A819-S822 WeakPolarHBondContact O-CB 3.13Å; A819-S822 PolarHBondContact O-N 3.2Å; A819-S822 VanDerWaalsContact O-N 3.15Å; A819-V823 PolarHBondContact O-N 3.33Å; A819-V823 VanDerWaalsContact O-N 3.09Å; A819-L848 HydrophobicContact CB-CD1 3.79Å; A819-L848 HydrophobicContact CB-CG 4.05Å
820	I	94.8	Very high	93.1	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-66.7	-40.7	179.1	-67.7	170.6	0	0	0	110.7	L816 S822 V823 H824 I833 L848 D937 W938 V941	L816-I820 HydrophobicContact CD1-CD1 3.79Å; L816-I820 HydrophobicContact CD1-CG1 4.07Å; L816-I820 HydrophobicContact CG-CD1 3.79Å; L816-I820 HydrophobicContact CG-CG1 4.43Å; L816-I820 WeakPolarHBondContact O-CB 3.23Å; L816-I820 WeakPolarHBondContact O-CG1 3.37Å; L816-I820 PolarHBondContact O-N 3.24Å; I820-S822 PolarHBondContact O-N 3.1Å; I820-V823 PolarHBondContact O-N 2.8Å; I820-V823 VanDerWaalsContact O-N 3.09Å; I820-H824 VanDerWaalsContact CG2-CE1 3.41Å; I820-H824 WeakPolarHBondContact CG2-CE1 3.41Å; I820-H824 WeakPolarHBondContact CG2-NE2 3.4Å; I820-H824 PolarHBondContact O-CD2 3.02Å; I820-H824 PolarHBondContact O-N 3.19Å; I820-I833 HydrophobicContact CD1-CD1 3.83Å; I820-I833 HydrophobicContact CD1-CG1 3.98Å; I820-I833 HydrophobicContact CD1-CG2 4.14Å; I820-I833 HydrophobicContact CG1-CD1 3.87Å; I820-I833 HydrophobicContact CG1-CG1 4.41Å; I820-L848 HydrophobicContact CG1-CD1 4.31Å; I820-D937 HydrophobicContact CG2-CB 3.99Å; I820-W938 HydrophobicContact CB-CH2 3.76Å; I820-W938 HydrophobicContact CB-CZ3 3.84Å; I820-W938 HydrophobicContact CD1-CZ3 4.3Å; I820-W938 HydrophobicContact CG2-CD2 4.47Å; I820-W938 HydrophobicContact CG2-CE3 4.19Å; I820-W938 HydrophobicContact CG2-CH2 3.53Å; I820-W938 HydrophobicContact CG2-CZ2 3.86Å; I820-W938 HydrophobicContact CG2-CZ3 3.72Å; I820-V941 HydrophobicContact CD1-CG2 3.29Å
821	E	93.7	Very high	92.8	Very high	33 Å²	33	19.5 Å²	19.5	15%	0.154	10%	0.104	C	C	.	.	H	α-helix	trans	-59	-36.6	173.2	-171.3	-159.1	-143.8	0	0	111.5	T817 K825 W938 A1006 K1010	T817-E821 WeakPolarHBondContact O-CB 3.3Å; T817-E821 PolarHBondContact O-N 3.32Å; T817-E821 VanDerWaalsContact O-N 3.1Å; E821-K825 VanDerWaalsContact CD-CE 3.42Å; E821-K825 HydrophobicContact CG-CD 4.04Å; E821-K825 VanDerWaalsContact O-CB 3.28Å; E821-K825 WeakPolarHBondContact O-CB 3.2Å; E821-K825 WeakPolarHBondContact O-CG 3.28Å; E821-K825 PolarHBondContact O-N 2.76Å; E821-K825 WeakPolarHBondContact OE1-CE 3.49Å; E821-K825 IonicContact OE1-NZ 3.66Å; E821-K825 PolarHBondContact OE1-NZ 2.91Å; E821-K825 IonicContact OE2-NZ 2.74Å; E821-K825 PolarHBondContact OE2-NZ 3.24Å; E821-W938 HydrophobicContact CB-CH2 4.48Å; E821-A1006 HydrophobicContact CB-CB 3.87Å; E821-A1006 HydrophobicContact CG-CB 3.71Å; E821-K1010 IonicContact OE1-NZ 3.63Å; E821-K1010 PolarHBondContact OE1-NZ 3.46Å; E821-K1010 IonicContact OE2-NZ 2.91Å; E821-K1010 PolarHBondContact OE2-NZ 3Å
822	S	92	Very high	92.6	Very high	23 Å²	23	19 Å²	19	16%	0.161	10%	0.102	C	C	.	.	H	α-helix	trans	-65.1	-42.1	174.4	-159	0	0	0	0	112.3	N766 L818 A819 I820 K825 M826	N766-S822 PolarHBondContact ND2-OG 3.18Å; L818-S822 WeakPolarHBondContact O-CB 3.32Å; L818-S822 PolarHBondContact O-N 2.79Å; A819-S822 VanDerWaalsContact O-CB 3.3Å; A819-S822 WeakPolarHBondContact O-CB 3.13Å; A819-S822 PolarHBondContact O-N 3.2Å; A819-S822 VanDerWaalsContact O-N 3.15Å; I820-S822 PolarHBondContact O-N 3.1Å; S822-K825 PolarHBondContact O-N 2.84Å; S822-M826 WeakPolarHBondContact O-CG 3.37Å; S822-M826 PolarHBondContact O-N 2.81Å
823	V	91.1	Very high	92.5	Very high	1 Å²	1	19 Å²	19	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-64.1	-45.7	175.7	177.1	0	0	0	0	111.3	V769 A819 I820 K825 M826 F828 L848 F851	V769-V823 HydrophobicContact CG2-CG2 4.14Å; A819-V823 PolarHBondContact O-N 3.33Å; A819-V823 VanDerWaalsContact O-N 3.09Å; I820-V823 PolarHBondContact O-N 2.8Å; I820-V823 VanDerWaalsContact O-N 3.09Å; V823-K825 PolarHBondContact O-N 3.39Å; V823-M826 HydrophobicContact CG2-CE 4.39Å; V823-M826 PolarHBondContact O-N 3.4Å; V823-M826 VanDerWaalsContact O-N 3.17Å; V823-F828 CarbonylContact C-O 3.56Å; V823-F828 HydrophobicContact CG1-CB 3.89Å; V823-F828 PolarHBondContact O-N 3.29Å; V823-L848 HydrophobicContact CG2-CD1 4Å; V823-F851 HydrophobicContact CG2-CE1 4.04Å
824	H	90.4	Very high	92.3	Very high	16 Å²	16	20.2 Å²	20.2	7%	0.074	11%	0.108	C	C	.	.	H	α-helix	trans	-63.6	-40.7	176.7	-66.8	-178	0	0	0	112	I820 M826 G827 F828 Q934 D937 W938	I820-H824 VanDerWaalsContact CG2-CE1 3.41Å; I820-H824 WeakPolarHBondContact CG2-CE1 3.41Å; I820-H824 WeakPolarHBondContact CG2-NE2 3.4Å; I820-H824 PolarHBondContact O-CD2 3.02Å; I820-H824 PolarHBondContact O-N 3.19Å; H824-M826 PolarHBondContact O-N 2.97Å; H824-G827 WeakPolarHBondContact O-CA 3.29Å; H824-G827 PolarHBondContact O-N 2.91Å; H824-F828 WeakPolarHBondContact CA-O 3.4Å; H824-F828 PolarHBondContact CD2-O 3.11Å; H824-Q934 PolarHBondContact CE1-O 3.01Å; H824-Q934 VanDerWaalsContact CE1-O 3.27Å; H824-D937 IonicContact CD2-OD2 3.95Å; H824-D937 IonicContact CE1-OD2 2.66Å; H824-D937 IonicContact NE2-OD2 2.63Å; H824-D937 PolarHBondContact NE2-OD2 3.36Å; H824-W938 AromaticContact CE1-CE2 3.9Å; H824-W938 AromaticContact CE1-NE1 3.89Å; H824-W938 AromaticContact ND1-CZ2 3.85Å; H824-W938 AromaticContact ND1-NE1 4Å
825	K	89.1	Confident	92.2	Very high	147 Å²	147	20.2 Å²	20.2	64%	0.639	11%	0.108	S	C	*	.	H	α-helix	trans	-63.1	-24.5	175	-79.1	169.4	179.1	169.1	0	113.6	E821 S822 V823 G827	E821-K825 VanDerWaalsContact CD-CE 3.42Å; E821-K825 HydrophobicContact CG-CD 4.04Å; E821-K825 VanDerWaalsContact O-CB 3.28Å; E821-K825 WeakPolarHBondContact O-CB 3.2Å; E821-K825 WeakPolarHBondContact O-CG 3.28Å; E821-K825 PolarHBondContact O-N 2.76Å; E821-K825 WeakPolarHBondContact OE1-CE 3.49Å; E821-K825 IonicContact OE1-NZ 3.66Å; E821-K825 PolarHBondContact OE1-NZ 2.91Å; E821-K825 IonicContact OE2-NZ 2.74Å; E821-K825 PolarHBondContact OE2-NZ 3.24Å; S822-K825 PolarHBondContact O-N 2.84Å; V823-K825 PolarHBondContact O-N 3.39Å; K825-G827 VanDerWaalsContact C-N 3.27Å
826	M	85.2	Confident	91.9	Very high	57 Å²	57	23.6 Å²	23.6	28%	0.281	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-1.5	171.7	-66.7	-176.1	-62.6	0	0	113.4	A764 N766 V769 S822 V823 H824 F828	A764-M826 HydrophobicContact CB-CE 4.02Å; A764-M826 HydrophobicContact CB-SD 3.98Å; N766-M826 WeakPolarHBondContact ND2-CE 3.45Å; V769-M826 HydrophobicContact CG2-CE 4.35Å; S822-M826 WeakPolarHBondContact O-CG 3.37Å; S822-M826 PolarHBondContact O-N 2.81Å; V823-M826 HydrophobicContact CG2-CE 4.39Å; V823-M826 PolarHBondContact O-N 3.4Å; V823-M826 VanDerWaalsContact O-N 3.17Å; H824-M826 PolarHBondContact O-N 2.97Å; M826-F828 HydrophobicContact CB-CD2 3.67Å; M826-F828 HydrophobicContact CB-CE2 4Å
827	G	84.9	Confident	91.8	Very high	46 Å²	46	24 Å²	24	47%	0.474	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	18.8	-179.7	0	0	0	0	0	114.4	H824 K825 G856	H824-G827 WeakPolarHBondContact O-CA 3.29Å; H824-G827 PolarHBondContact O-N 2.91Å; K825-G827 VanDerWaalsContact C-N 3.27Å; G827-G856 WeakPolarHBondContact O-CA 3.11Å
828	F	86.9	Confident	91.8	Very high	10 Å²	10	24.1 Å²	24.1	4%	0.044	13%	0.128	C	C	.	.			trans	-113.1	149.4	179.6	-58.7	-72.3	0	0	0	112	I760 V823 H824 M826 T855 G856	I760-F828 HydrophobicContact CD1-CB 4.14Å; I760-F828 HydrophobicContact CD1-CD1 3.64Å; I760-F828 HydrophobicContact CD1-CE1 4.17Å; I760-F828 HydrophobicContact CD1-CG 3.86Å; I760-F828 HydrophobicContact CG1-CB 4.38Å; I760-F828 HydrophobicContact CG1-CD1 3.42Å; I760-F828 VanDerWaalsContact CG1-CD1 3.42Å; I760-F828 HydrophobicContact CG1-CD2 3.85Å; I760-F828 HydrophobicContact CG1-CE1 3.5Å; I760-F828 HydrophobicContact CG1-CE2 3.91Å; I760-F828 HydrophobicContact CG1-CG 3.62Å; I760-F828 HydrophobicContact CG1-CZ 3.75Å; I760-F828 HydrophobicContact CG2-CD2 4.34Å; V823-F828 CarbonylContact C-O 3.56Å; V823-F828 HydrophobicContact CG1-CB 3.89Å; V823-F828 PolarHBondContact O-N 3.29Å; H824-F828 WeakPolarHBondContact CA-O 3.4Å; H824-F828 PolarHBondContact CD2-O 3.11Å; M826-F828 HydrophobicContact CB-CD2 3.67Å; M826-F828 HydrophobicContact CB-CE2 4Å; F828-T855 CarbonylContact C-O 3.39Å; F828-T855 VanDerWaalsContact CA-O 3.29Å; F828-T855 WeakPolarHBondContact CA-O 3.48Å; F828-G856 VanDerWaalsContact CD1-CA 3.43Å
829	I	89.7	Confident	91.8	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-113.4	136.4	169.5	-48.9	175.5	0	0	0	107.7	R831 C854 T855 F857 Q934 D937	I829-R831 HydrophobicContact CB-CG 4.06Å; I829-R831 HydrophobicContact CG2-CG 3.55Å; I829-C854 WeakPolarHBondContact O-CA 3.03Å; I829-C854 VanDerWaalsContact O-CB 3.28Å; I829-C854 WeakPolarHBondContact O-CB 3.47Å; I829-T855 HydrophobicContact CB-CG2 4.06Å; I829-T855 HydrophobicContact CD1-CG2 4.2Å; I829-T855 HydrophobicContact CG1-CG2 4.34Å; I829-T855 PolarHBondContact N-O 3.45Å; I829-T855 PolarHBondContact O-N 3.29Å; I829-F857 HydrophobicContact CD1-CE2 3.73Å; I829-F857 HydrophobicContact CD1-CZ 3.49Å; I829-F857 VanDerWaalsContact CD1-CZ 3.49Å; I829-F857 HydrophobicContact CG1-CE2 4.26Å; I829-F857 HydrophobicContact CG1-CZ 4.44Å; I829-Q934 HydrophobicContact CD1-CB 4.11Å; I829-Q934 HydrophobicContact CG1-CB 3.82Å; I829-Q934 HydrophobicContact CG2-CB 4.36Å; I829-D937 VanDerWaalsContact CG2-OD2 3.28Å; I829-D937 WeakPolarHBondContact CG2-OD2 3.22Å
830	H	91.8	Very high	91.9	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.009	13%	0.129	C	C	.	.			trans	-78.1	-52.1	-172.8	-163.3	-92.8	0	0	0	113	D832 I833 T849 F851 C854 D937	H830-D832 PolarHBondContact CE1-O 2.91Å; H830-D832 PolarHBondContact ND1-O 3.32Å; H830-D832 PolarHBondContact O-N 3.46Å; H830-I833 HydrophobicContact CB-CD1 3.8Å; H830-I833 HydrophobicContact CB-CG1 3.77Å; H830-I833 VanDerWaalsContact CG-CD1 3.47Å; H830-I833 VanDerWaalsContact ND1-CD1 3.34Å; H830-I833 WeakPolarHBondContact ND1-CD1 3.04Å; H830-I833 PolarHBondContact ND1-N 3.21Å; H830-T849 PolarHBondContact NE2-O 2.78Å; H830-F851 AromaticContact CD2-CD1 3.67Å; H830-F851 AromaticContact CD2-CE1 3.57Å; H830-F851 AromaticContact NE2-CD1 3.86Å; H830-F851 AromaticContact NE2-CE1 3.84Å; H830-C854 VanDerWaalsContact CA-SG 3.57Å; H830-C854 WeakPolarHBondContact O-CA 3.42Å; H830-C854 PolarHBondContact O-SG 3.27Å; H830-D937 PolarHBondContact N-OD1 3.37Å; H830-D937 PolarHBondContact N-OD2 2.98Å
831	R	91.3	Very high	91.8	Very high	22 Å²	22	25.1 Å²	25.1	8%	0.083	13%	0.133	C	C	.	.	S	Bend	trans	67.3	1.1	173.9	-45.4	-170.6	-64.8	167.8	1.5	117.6	I829 L853 S913 V915 G916 Y932 D937	I829-R831 HydrophobicContact CB-CG 4.06Å; I829-R831 HydrophobicContact CG2-CG 3.55Å; R831-L853 PolarHBondContact NE-O 2.81Å; R831-L853 PolarHBondContact NH2-O 2.76Å; R831-S913 PolarHBondContact NH1-OG 3.39Å; R831-V915 HydrophobicContact CB-CG2 3.87Å; R831-G916 WeakPolarHBondContact O-CA 3.4Å; R831-Y932 WeakPolarHBondContact CD-OH 3.25Å; R831-Y932 HydrophobicContact CG-CE2 4.24Å; R831-Y932 PolarHBondContact NH1-OH 3.09Å; R831-D937 PolarHBondContact N-OD1 2.85Å
832	D	91.3	Very high	91.7	Very high	7 Å²	7	24.7 Å²	24.7	4%	0.037	13%	0.132	C	C	.	.			trans	-144.1	55.1	167.2	-164.1	44.5	0	0	0	109.3	H830 K834 N837 L853 G916 T917	H830-D832 PolarHBondContact CE1-O 2.91Å; H830-D832 PolarHBondContact ND1-O 3.32Å; H830-D832 PolarHBondContact O-N 3.46Å; D832-K834 IonicContact OD1-NZ 3.93Å; D832-K834 WeakPolarHBondContact OD2-CE 3.36Å; D832-K834 IonicContact OD2-NZ 3.49Å; D832-K834 PolarHBondContact OD2-NZ 3.13Å; D832-N837 PolarHBondContact O-ND2 3.43Å; D832-N837 PolarHBondContact OD2-ND2 2.59Å; D832-L853 HydrophobicContact CB-CB 4.2Å; D832-L853 HydrophobicContact CB-CD1 3.79Å; D832-G916 WeakPolarHBondContact OD1-CA 3.35Å; D832-T917 WeakPolarHBondContact OD1-CB 3.4Å; D832-T917 PolarHBondContact OD1-N 3.22Å; D832-T917 PolarHBondContact OD1-OG1 2.84Å
833	I	95.6	Very high	91.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.138	C	C	.	.			trans	-74.7	121.9	169.7	-69.2	-68.5	0	0	0	107.8	I820 H830 L848 Y920 D937 S940 I944	I820-I833 HydrophobicContact CD1-CD1 3.83Å; I820-I833 HydrophobicContact CD1-CG1 3.98Å; I820-I833 HydrophobicContact CD1-CG2 4.14Å; I820-I833 HydrophobicContact CG1-CD1 3.87Å; I820-I833 HydrophobicContact CG1-CG1 4.41Å; H830-I833 HydrophobicContact CB-CD1 3.8Å; H830-I833 HydrophobicContact CB-CG1 3.77Å; H830-I833 VanDerWaalsContact CG-CD1 3.47Å; H830-I833 VanDerWaalsContact ND1-CD1 3.34Å; H830-I833 WeakPolarHBondContact ND1-CD1 3.04Å; H830-I833 PolarHBondContact ND1-N 3.21Å; I833-L848 HydrophobicContact CD1-CD1 4.41Å; I833-L848 HydrophobicContact CD1-CD2 4.1Å; I833-Y920 WeakPolarHBondContact O-CB 3.21Å; I833-D937 HydrophobicContact CG1-CB 4.25Å; I833-S940 WeakPolarHBondContact O-CB 3.34Å; I833-I944 HydrophobicContact CG2-CD1 3.6Å
834	K	94.1	Very high	91.8	Very high	27 Å²	27	26 Å²	26	12%	0.117	14%	0.138	C	C	.	.	S	Bend	trans	-165	162.9	-176.6	64.7	-172.7	-165.1	-152.1	0	109.3	D832 D836 N837 T917 Y920	D832-K834 IonicContact OD1-NZ 3.93Å; D832-K834 WeakPolarHBondContact OD2-CE 3.36Å; D832-K834 IonicContact OD2-NZ 3.49Å; D832-K834 PolarHBondContact OD2-NZ 3.13Å; K834-D836 VanDerWaalsContact C-N 3.31Å; K834-D836 HydrophobicContact CD-CB 4.47Å; K834-D836 WeakPolarHBondContact CD-OD2 3.34Å; K834-D836 WeakPolarHBondContact CE-OD2 3.31Å; K834-D836 HydrophobicContact CG-CB 4.35Å; K834-D836 WeakPolarHBondContact CG-OD2 3.28Å; K834-D836 PolarHBondContact O-N 3.34Å; K834-N837 WeakPolarHBondContact CE-ND2 3.46Å; K834-N837 HydrophobicContact CG-CB 4.12Å; K834-N837 PolarHBondContact O-N 2.6Å; K834-N837 VanDerWaalsContact O-N 3.13Å; K834-T917 HydrophobicContact CD-CG2 4.35Å; K834-T917 WeakPolarHBondContact CD-OG1 3.01Å; K834-T917 PolarHBondContact NZ-OG1 3.39Å; K834-T917 VanDerWaalsContact NZ-OG1 3.14Å; K834-Y920 HydrophobicContact CB-CD1 4.36Å; K834-Y920 HydrophobicContact CB-CD2 3.69Å; K834-Y920 HydrophobicContact CB-CE1 4.4Å; K834-Y920 HydrophobicContact CB-CE2 3.71Å; K834-Y920 HydrophobicContact CB-CG 4.02Å
835	P	94.2	Very high	92.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-57.3	-37.8	-177.8	-25.5	35.8	0	0	0	114.3	M794 M795 N837 I838 Y920 I944 E947	M794-P835 HydrophobicContact CB-CB 4.11Å; M794-P835 WeakPolarHBondContact CB-O 3.12Å; M794-P835 HydrophobicContact CG-CB 4.34Å; M794-P835 PolarHBondContact N-O 2.76Å; M795-P835 HydrophobicContact CB-CB 3.88Å; M795-P835 HydrophobicContact SD-CB 3.99Å; M795-P835 HydrophobicContact SD-CG 4.24Å; P835-N837 PolarHBondContact O-N 2.78Å; P835-N837 VanDerWaalsContact O-N 3.15Å; P835-I838 PolarHBondContact O-N 2.8Å; P835-I838 VanDerWaalsContact O-N 3.1Å; P835-Y920 VanDerWaalsContact CD-CZ 3.48Å; P835-Y920 VanDerWaalsContact CD-OH 3.31Å; P835-Y920 WeakPolarHBondContact CD-OH 3.22Å; P835-Y920 HydrophobicContact CG-CE1 4.34Å; P835-I944 HydrophobicContact CG-CG1 4.39Å; P835-E947 VanDerWaalsContact CG-OE2 3.3Å; P835-E947 WeakPolarHBondContact CG-OE2 3.35Å
836	D	90.2	Very high	92.4	Very high	70 Å²	70	18.8 Å²	18.8	37%	0.374	11%	0.106	S	C	.	.	G	3₁₀ helix	trans	-61	-27.3	-179.8	-26.5	-123.9	0	0	0	112.8	K834	K834-D836 VanDerWaalsContact C-N 3.31Å; K834-D836 HydrophobicContact CD-CB 4.47Å; K834-D836 WeakPolarHBondContact CD-OD2 3.34Å; K834-D836 WeakPolarHBondContact CE-OD2 3.31Å; K834-D836 HydrophobicContact CG-CB 4.35Å; K834-D836 WeakPolarHBondContact CG-OD2 3.28Å; K834-D836 PolarHBondContact O-N 3.34Å
837	N	94.3	Very high	92.9	Very high	10 Å²	10	17.3 Å²	17.3	5%	0.053	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-94.6	8	-177	-70.1	-11.9	0	0	0	112.8	D832 K834 P835 T849	D832-N837 PolarHBondContact O-ND2 3.43Å; D832-N837 PolarHBondContact OD2-ND2 2.59Å; K834-N837 WeakPolarHBondContact CE-ND2 3.46Å; K834-N837 HydrophobicContact CG-CB 4.12Å; K834-N837 PolarHBondContact O-N 2.6Å; K834-N837 VanDerWaalsContact O-N 3.13Å; P835-N837 PolarHBondContact O-N 2.78Å; P835-N837 VanDerWaalsContact O-N 3.15Å; N837-T849 PolarHBondContact O-N 2.9Å
838	I	96.8	Very high	93.4	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.015	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	101.9	178.3	-59.3	169.7	0	0	0	107.9	D793 M794 L816 P835 I846 L848 I944	D793-I838 CarbonylContact C-O 3.58Å; D793-I838 WeakPolarHBondContact CA-O 3.36Å; M794-I838 HydrophobicContact CB-CB 3.89Å; M794-I838 HydrophobicContact CB-CG2 4.07Å; M794-I838 WeakPolarHBondContact CB-O 3.38Å; M794-I838 HydrophobicContact CE-CG2 4.01Å; M794-I838 PolarHBondContact N-O 2.92Å; L816-I838 HydrophobicContact CD1-CD1 3.86Å; L816-I838 HydrophobicContact CD1-CG1 4.27Å; L816-I838 HydrophobicContact CD2-CD1 3.9Å; P835-I838 PolarHBondContact O-N 2.8Å; P835-I838 VanDerWaalsContact O-N 3.1Å; I838-I846 HydrophobicContact CG2-CB 3.78Å; I838-I846 HydrophobicContact CG2-CD1 4.19Å; I838-I846 HydrophobicContact CG2-CG2 3.85Å; I838-L848 HydrophobicContact CG1-CD2 3.98Å; I838-I944 HydrophobicContact CD1-CD1 4.04Å
839	L	96.3	Very high	93.7	Very high	30 Å²	30	15.7 Å²	15.7	16%	0.157	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	152.4	178.5	-52.1	-174.1	0	0	0	111.7	V770 I789 G792 D793 I846 K847 T849	V770-L839 HydrophobicContact CG2-CD1 3.96Å; I789-L839 HydrophobicContact CB-CB 4.22Å; I789-L839 HydrophobicContact CB-CD1 4.07Å; I789-L839 HydrophobicContact CG1-CD1 4.11Å; I789-L839 HydrophobicContact CG2-CB 3.66Å; I789-L839 HydrophobicContact CG2-CD1 4.43Å; G792-L839 WeakPolarHBondContact O-CA 3.4Å; D793-L839 HydrophobicContact CB-CD2 3.74Å; L839-I846 CarbonylContact O-C 3.57Å; L839-I846 VanDerWaalsContact O-CA 3.23Å; L839-I846 WeakPolarHBondContact O-CA 3.2Å; L839-K847 PolarHBondContact N-O 3.22Å; L839-K847 PolarHBondContact O-N 2.82Å; L839-T849 HydrophobicContact CD1-CG2 4Å; L839-T849 HydrophobicContact CD2-CG2 3.91Å; L839-T849 HydrophobicContact CG-CG2 3.71Å
840	I	95.6	Very high	93.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.3	-178.6	-55.1	179.1	0	0	0	110.2	I789 G791 G792 M794 L797 P1033	I789-I840 VanDerWaalsContact CG2-C 3.46Å; I789-I840 WeakPolarHBondContact CG2-O 3.18Å; G791-I840 WeakPolarHBondContact CA-O 3.35Å; G791-I840 PolarHBondContact N-O 3.27Å; G791-I840 VanDerWaalsContact N-O 3.09Å; G792-I840 PolarHBondContact O-N 2.96Å; M794-I840 HydrophobicContact CE-CD1 3.84Å; M794-I840 HydrophobicContact CE-CG1 4.1Å; M794-I840 HydrophobicContact SD-CD1 4.1Å; L797-I840 HydrophobicContact CB-CD1 4.14Å; L797-I840 HydrophobicContact CD2-CD1 3.5Å; L797-I840 VanDerWaalsContact CD2-CD1 3.5Å; L797-I840 HydrophobicContact CG-CD1 4.44Å; I840-P1033 HydrophobicContact CG2-CG 4.32Å
841	D	93.1	Very high	93.1	Very high	18 Å²	18	18 Å²	18	10%	0.096	9%	0.092	C	C	.	.			trans	-82.3	173.5	-179.8	74.4	34	0	0	0	114.1	I789 D843 G844 H845 K847 R1025 P1033	I789-D841 HydrophobicContact CG2-CB 4.36Å; D841-D843 PolarHBondContact O-N 3.26Å; D841-D843 VanDerWaalsContact O-N 3.14Å; D841-D843 PolarHBondContact OD1-N 2.81Å; D841-G844 WeakPolarHBondContact O-CA 3.48Å; D841-G844 PolarHBondContact O-N 2.78Å; D841-G844 PolarHBondContact OD1-N 2.83Å; D841-H845 PolarHBondContact N-O 3.12Å; D841-H845 PolarHBondContact OD1-N 3.06Å; D841-H845 VanDerWaalsContact OD1-N 3.17Å; D841-K847 VanDerWaalsContact OD2-CE 3.32Å; D841-K847 WeakPolarHBondContact OD2-CE 3.25Å; D841-K847 IonicContact OD2-NZ 2.73Å; D841-R1025 IonicContact OD2-CZ 3.74Å; D841-R1025 IonicContact OD2-NE 3.63Å; D841-R1025 IonicContact OD2-NH2 2.88Å; D841-R1025 PolarHBondContact OD2-NH2 3.33Å; D841-P1033 WeakPolarHBondContact O-CG 3.41Å
842	L	91.7	Very high	92.4	Very high	25 Å²	25	17.3 Å²	17.3	13%	0.131	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-16.7	-171.1	69.4	105.9	0	0	0	114.7	P790 R1032 I1035 R1098	P790-L842 HydrophobicContact CG-CB 3.97Å; L842-R1032 PolarHBondContact O-NE 3.46Å; L842-I1035 HydrophobicContact CB-CD1 3.85Å; L842-R1098 HydrophobicContact CD1-CB 4.44Å; L842-R1098 HydrophobicContact CD2-CB 4.05Å
843	D	92.1	Very high	91.8	Very high	52 Å²	52	18.7 Å²	18.7	28%	0.278	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-0.9	175.2	-66	-43.4	0	0	0	111.5	D841 A1029 R1032 R1098	D841-D843 PolarHBondContact O-N 3.26Å; D841-D843 VanDerWaalsContact O-N 3.14Å; D841-D843 PolarHBondContact OD1-N 2.81Å; D843-A1029 WeakPolarHBondContact O-CB 3.17Å; D843-R1032 IonicContact OD1-CZ 2.83Å; D843-R1032 IonicContact OD1-NE 2.73Å; D843-R1032 IonicContact OD1-NH2 3.31Å; D843-R1032 PolarHBondContact OD1-NH2 2.85Å; D843-R1098 IonicContact OD2-NH1 3.95Å
844	G	93.9	Very high	91.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	99.3	3.1	172.9	0	0	0	0	0	115.3	Y812 D841 Y1031	Y812-G844 WeakPolarHBondContact CE1-O 3.39Å; Y812-G844 PolarHBondContact OH-O 2.78Å; D841-G844 WeakPolarHBondContact O-CA 3.48Å; D841-G844 PolarHBondContact O-N 2.78Å; D841-G844 PolarHBondContact OD1-N 2.83Å; G844-Y1031 WeakPolarHBondContact CA-O 3.41Å
845	H	95.8	Very high	90.4	Very high	10 Å²	10	18 Å²	18	5%	0.046	10%	0.097	C	C	.	.			trans	-91.5	151.3	-175.4	-62.3	-86.3	0	0	0	112.8	F811 E815 D841 R1025 Q1027	F811-H845 AromaticContact CZ-CE1 3.9Å; F811-H845 AromaticContact CZ-ND1 3.79Å; E815-H845 IonicContact OE1-CE1 3.26Å; E815-H845 IonicContact OE1-CG 2.82Å; E815-H845 IonicContact OE1-ND1 2.74Å; E815-H845 PolarHBondContact OE1-ND1 3.36Å; E815-H845 WeakPolarHBondContact OE2-CA 3.03Å; E815-H845 IonicContact OE2-ND1 2.79Å; D841-H845 PolarHBondContact N-O 3.12Å; D841-H845 PolarHBondContact OD1-N 3.06Å; D841-H845 VanDerWaalsContact OD1-N 3.17Å; H845-R1025 HydrophobicContact CB-CG 3.95Å; H845-Q1027 PolarHBondContact CE1-O 2.96Å; H845-Q1027 PolarHBondContact NE2-O 3.24Å
846	I	96.3	Very high	88.9	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	153.5	-172.6	75.1	177.7	0	0	0	114.2	M794 Y812 E815 L816 I838 L839 R1025	M794-I846 HydrophobicContact CE-CG2 3.84Å; Y812-I846 HydrophobicContact CD1-CG2 3.46Å; Y812-I846 VanDerWaalsContact CD1-CG2 3.46Å; Y812-I846 HydrophobicContact CE1-CG2 3.72Å; Y812-I846 HydrophobicContact CG-CG2 4.44Å; E815-I846 HydrophobicContact CB-CD1 3.71Å; E815-I846 HydrophobicContact CB-CG1 3.84Å; E815-I846 PolarHBondContact OE2-N 2.9Å; L816-I846 HydrophobicContact CB-CD1 3.9Å; L816-I846 HydrophobicContact CD1-CD1 4.23Å; I838-I846 HydrophobicContact CG2-CB 3.78Å; I838-I846 HydrophobicContact CG2-CD1 4.19Å; I838-I846 HydrophobicContact CG2-CG2 3.85Å; L839-I846 CarbonylContact O-C 3.57Å; L839-I846 VanDerWaalsContact O-CA 3.23Å; L839-I846 WeakPolarHBondContact O-CA 3.2Å; I846-R1025 VanDerWaalsContact O-CZ 3.27Å; I846-R1025 PolarHBondContact O-NH1 3.38Å; I846-R1025 PolarHBondContact O-NH2 3.25Å
847	K	95.6	Very high	87.7	Confident	26 Å²	26	18.3 Å²	18.3	11%	0.113	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	131.3	168.2	-63.3	-178.7	-175	-68.1	0	111	E767 W768 V770 I789 L839 D841	E767-K847 PolarHBondContact O-NZ 3.39Å; W768-K847 CarbonylContact O-C 3.52Å; W768-K847 WeakPolarHBondContact O-CA 3.24Å; V770-K847 HydrophobicContact CG2-CB 3.93Å; I789-K847 HydrophobicContact CD1-CD 3.62Å; I789-K847 HydrophobicContact CG1-CD 4.34Å; L839-K847 PolarHBondContact N-O 3.22Å; L839-K847 PolarHBondContact O-N 2.82Å; D841-K847 VanDerWaalsContact OD2-CE 3.32Å; D841-K847 WeakPolarHBondContact OD2-CE 3.25Å; D841-K847 IonicContact OD2-NZ 2.73Å
848	L	95.8	Very high	86.5	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	142.3	176.6	-65.5	178.5	0	0	0	111.8	W768 V770 L816 A819 I820 V823 I833 I838 F851	W768-L848 PolarHBondContact O-N 2.97Å; V770-L848 WeakPolarHBondContact CG2-O 3.28Å; V770-L848 PolarHBondContact N-O 3.5Å; V770-L848 VanDerWaalsContact N-O 3.13Å; L816-L848 HydrophobicContact CD1-CD2 3.88Å; A819-L848 HydrophobicContact CB-CD1 3.79Å; A819-L848 HydrophobicContact CB-CG 4.05Å; I820-L848 HydrophobicContact CG1-CD1 4.31Å; V823-L848 HydrophobicContact CG2-CD1 4Å; I833-L848 HydrophobicContact CD1-CD1 4.41Å; I833-L848 HydrophobicContact CD1-CD2 4.1Å; I838-L848 HydrophobicContact CG1-CD2 3.98Å; L848-F851 HydrophobicContact CB-CE2 4.37Å; L848-F851 HydrophobicContact CB-CZ 3.71Å; L848-F851 WeakPolarHBondContact O-CE2 3.41Å
849	T	92.4	Very high	84.7	Confident	21 Å²	21	24.2 Å²	24.2	13%	0.129	12%	0.121	C	C	.	.			trans	-137.4	178.6	178.8	-163.1	0	0	0	0	112.7	H830 N837 L839	H830-T849 PolarHBondContact NE2-O 2.78Å; N837-T849 PolarHBondContact O-N 2.9Å; L839-T849 HydrophobicContact CD1-CG2 4Å; L839-T849 HydrophobicContact CD2-CG2 3.91Å; L839-T849 HydrophobicContact CG-CG2 3.71Å
850	D	84.8	Confident	83.3	Confident	54 Å²	54	23 Å²	23	29%	0.289	12%	0.115	S	C	.	.			trans	50.5	56.7	-178.9	-155.4	37.5	0	0	0	116.7	K738 G852	K738-D850 IonicContact NZ-OD1 3.82Å; K738-D850 PolarHBondContact NZ-OD1 2.76Å; D850-G852 PolarHBondContact O-N 2.94Å
851	F	85.2	Confident	82.2	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-68	18.1	176.9	-62.3	-95.2	0	0	0	115	E757 I760 L761 V769 V823 H830 L848 L853 C854	E757-F851 HydrophobicContact CG-CB 4.44Å; E757-F851 PolarHBondContact N-O 2.83Å; I760-F851 HydrophobicContact CB-CB 4.31Å; I760-F851 HydrophobicContact CB-CD1 4.35Å; I760-F851 HydrophobicContact CB-CG 4.41Å; I760-F851 HydrophobicContact CD1-CB 4.16Å; I760-F851 HydrophobicContact CD1-CD1 4.29Å; I760-F851 HydrophobicContact CG2-CB 4.36Å; I760-F851 HydrophobicContact CG2-CD1 3.53Å; I760-F851 HydrophobicContact CG2-CE1 3.97Å; I760-F851 HydrophobicContact CG2-CG 3.94Å; L761-F851 HydrophobicContact CD2-CD2 3.5Å; L761-F851 HydrophobicContact CD2-CE2 3.68Å; L761-F851 HydrophobicContact CD2-CG 4.48Å; L761-F851 HydrophobicContact CG-CD2 4.03Å; V769-F851 HydrophobicContact CB-CZ 4.26Å; V769-F851 HydrophobicContact CG1-CE2 3.67Å; V769-F851 HydrophobicContact CG1-CZ 3.63Å; V769-F851 HydrophobicContact CG2-CE1 4.42Å; V769-F851 HydrophobicContact CG2-CZ 3.85Å; V823-F851 HydrophobicContact CG2-CE1 4.04Å; H830-F851 AromaticContact CD2-CD1 3.67Å; H830-F851 AromaticContact CD2-CE1 3.57Å; H830-F851 AromaticContact NE2-CD1 3.86Å; H830-F851 AromaticContact NE2-CE1 3.84Å; L848-F851 HydrophobicContact CB-CE2 4.37Å; L848-F851 HydrophobicContact CB-CZ 3.71Å; L848-F851 WeakPolarHBondContact O-CE2 3.41Å; F851-L853 PolarHBondContact O-N 3.28Å; F851-C854 WeakPolarHBondContact CA-SG 3.48Å; F851-C854 HydrophobicContact CB-CB 4.42Å; F851-C854 VanDerWaalsContact CD1-SG 3.57Å; F851-C854 WeakPolarHBondContact O-CB 3.01Å; F851-C854 PolarHBondContact O-N 2.88Å; F851-C854 PolarHBondContact O-SG 3.49Å
852	G	75.8	Confident	81.2	Confident	8 Å²	8	25.5 Å²	25.5	8%	0.082	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-63.2	-38.8	-178.7	0	0	0	0	0	113.2	H753 D850 C854	H753-G852 WeakPolarHBondContact CA-O 3.22Å; H753-G852 WeakPolarHBondContact CB-O 3.46Å; H753-G852 PolarHBondContact CD2-O 2.91Å; H753-G852 VanDerWaalsContact CG-O 3.28Å; D850-G852 PolarHBondContact O-N 2.94Å; G852-C854 VanDerWaalsContact C-N 3.33Å
853	L	79.6	Confident	80.3	Confident	36 Å²	36	25.7 Å²	25.7	19%	0.188	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-86.6	0.9	179.3	-66.8	179.6	0	0	0	113.8	R831 D832 F851 V915	R831-L853 PolarHBondContact NE-O 2.81Å; R831-L853 PolarHBondContact NH2-O 2.76Å; D832-L853 HydrophobicContact CB-CB 4.2Å; D832-L853 HydrophobicContact CB-CD1 3.79Å; F851-L853 PolarHBondContact O-N 3.28Å; L853-V915 HydrophobicContact CD1-CB 4.37Å; L853-V915 HydrophobicContact CD2-CB 4.17Å; L853-V915 HydrophobicContact CD2-CG1 4.09Å
854	C	81.6	Confident	79.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.			trans	-69.5	162.6	-177.1	-58.6	0	0	0	0	113.8	I760 I829 H830 F851 G852	I760-C854 HydrophobicContact CD1-CB 3.23Å; I829-C854 WeakPolarHBondContact O-CA 3.03Å; I829-C854 VanDerWaalsContact O-CB 3.28Å; I829-C854 WeakPolarHBondContact O-CB 3.47Å; H830-C854 VanDerWaalsContact CA-SG 3.57Å; H830-C854 WeakPolarHBondContact O-CA 3.42Å; H830-C854 PolarHBondContact O-SG 3.27Å; F851-C854 WeakPolarHBondContact CA-SG 3.48Å; F851-C854 HydrophobicContact CB-CB 4.42Å; F851-C854 VanDerWaalsContact CD1-SG 3.57Å; F851-C854 WeakPolarHBondContact O-CB 3.01Å; F851-C854 PolarHBondContact O-N 2.88Å; F851-C854 PolarHBondContact O-SG 3.49Å; G852-C854 VanDerWaalsContact C-N 3.33Å
855	T	77.8	Confident	78.1	Confident	14 Å²	14	30.2 Å²	30.2	9%	0.086	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-135.8	142.4	169.7	-179.4	0	0	0	0	110.5	F828 I829 F857 A911	F828-T855 CarbonylContact C-O 3.39Å; F828-T855 VanDerWaalsContact CA-O 3.29Å; F828-T855 WeakPolarHBondContact CA-O 3.48Å; I829-T855 HydrophobicContact CB-CG2 4.06Å; I829-T855 HydrophobicContact CD1-CG2 4.2Å; I829-T855 HydrophobicContact CG1-CG2 4.34Å; I829-T855 PolarHBondContact N-O 3.45Å; I829-T855 PolarHBondContact O-N 3.29Å; T855-F857 HydrophobicContact CG2-CE1 4.26Å; T855-F857 HydrophobicContact CG2-CZ 4.13Å; T855-F857 PolarHBondContact OG1-N 2.87Å; T855-A911 HydrophobicContact CG2-CB 4.27Å
856	G	62.2	Low	76.9	Confident	14 Å²	14	30.3 Å²	30.3	14%	0.144	15%	0.148	C	C	.	.			trans	-125	24.7	167.6	0	0	0	0	0	111.6	G827 F828 R858	G827-G856 WeakPolarHBondContact O-CA 3.11Å; F828-G856 VanDerWaalsContact CD1-CA 3.43Å; G856-R858 PolarHBondContact O-N 2.75Å
857	F	65.1	Low	75.6	Confident	63 Å²	63	34.3 Å²	34.3	28%	0.276	17%	0.167	S	C	.	.	S	Bend	trans	58.3	-6.3	-177.6	-55.8	-71.4	0	0	0	117	I829 T855 W859 R908 C909 A911	I829-F857 HydrophobicContact CD1-CE2 3.73Å; I829-F857 HydrophobicContact CD1-CZ 3.49Å; I829-F857 VanDerWaalsContact CD1-CZ 3.49Å; I829-F857 HydrophobicContact CG1-CE2 4.26Å; I829-F857 HydrophobicContact CG1-CZ 4.44Å; T855-F857 HydrophobicContact CG2-CE1 4.26Å; T855-F857 HydrophobicContact CG2-CZ 4.13Å; T855-F857 PolarHBondContact OG1-N 2.87Å; F857-W859 PolarHBondContact O-N 3.19Å; F857-R908 WeakPolarHBondContact CB-O 3.39Å; F857-R908 WeakPolarHBondContact CD1-O 3.03Å; F857-R908 WeakPolarHBondContact CG-O 3.14Å; F857-C909 HydrophobicContact CE2-CB 4.34Å; F857-C909 WeakPolarHBondContact CZ-O 3.39Å; F857-A911 HydrophobicContact CE1-CB 4.16Å; F857-A911 HydrophobicContact CZ-CB 4.45Å
858	R	68.5	Low	73.4	Confident	79 Å²	79	42.5 Å²	42.5	30%	0.298	20%	0.202	S	C	.	.			trans	-54.1	125.1	166.9	-66.5	176.8	56.5	-157.5	-19.9	110.2	D759 E763 G856 T860 H861	D759-R858 IonicContact OD2-CZ 2.87Å; D759-R858 IonicContact OD2-NH1 3.57Å; D759-R858 PolarHBondContact OD2-NH1 2.83Å; D759-R858 IonicContact OD2-NH2 2.64Å; D759-R858 PolarHBondContact OD2-NH2 3.04Å; E763-R858 IonicContact OE2-NH1 2.65Å; E763-R858 PolarHBondContact OE2-NH1 2.88Å; G856-R858 PolarHBondContact O-N 2.75Å; R858-T860 PolarHBondContact NH2-OG1 3.42Å; R858-T860 PolarHBondContact O-N 2.89Å; R858-H861 PolarHBondContact O-N 3.48Å
859	W	58.8	Low	71.2	Confident	58 Å²	58	44.6 Å²	44.6	22%	0.22	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-53.4	-27.5	179.6	62.1	-90.2	0	0	0	113.8	F645 F857 H861 N862 Y865	F645-W859 AromaticContact CD2-CH2 3.76Å; F645-W859 HydrophobicContact CD2-CH2 3.76Å; F645-W859 HydrophobicContact CD2-CZ3 4.04Å; F645-W859 AromaticContact CE2-CH2 3.46Å; F645-W859 HydrophobicContact CE2-CH2 3.46Å; F645-W859 VanDerWaalsContact CE2-CH2 3.46Å; F645-W859 AromaticContact CE2-CZ3 3.66Å; F645-W859 HydrophobicContact CE2-CZ3 3.66Å; F645-W859 HydrophobicContact CZ-CH2 4.49Å; F857-W859 PolarHBondContact O-N 3.19Å; W859-H861 PolarHBondContact O-N 3.44Å; W859-N862 PolarHBondContact O-N 3.38Å; W859-N862 VanDerWaalsContact O-N 3.15Å; W859-Y865 HydrophobicContact CE3-CD1 4.37Å; W859-Y865 HydrophobicContact CE3-CD2 4.04Å; W859-Y865 HydrophobicContact CE3-CE1 4.32Å; W859-Y865 AromaticContact CE3-CE2 3.97Å; W859-Y865 HydrophobicContact CE3-CE2 3.97Å; W859-Y865 HydrophobicContact CE3-CG 4.25Å; W859-Y865 HydrophobicContact CZ3-CD1 4.27Å; W859-Y865 HydrophobicContact CZ3-CD2 4.3Å; W859-Y865 AromaticContact CZ3-CE1 3.78Å; W859-Y865 HydrophobicContact CZ3-CE1 3.78Å; W859-Y865 AromaticContact CZ3-CE2 3.81Å; W859-Y865 HydrophobicContact CZ3-CE2 3.81Å; W859-Y865 AromaticContact CZ3-CZ 3.54Å
860	T	66.9	Low	68.7	Low	5 Å²	5	49.6 Å²	49.6	3%	0.031	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-60.5	-21.8	173.8	45.4	0	0	0	0	114.3	R858 Y866	R858-T860 PolarHBondContact NH2-OG1 3.42Å; R858-T860 PolarHBondContact O-N 2.89Å; T860-Y866 WeakPolarHBondContact O-CE2 3.35Å; T860-Y866 PolarHBondContact O-OH 3.47Å
861	H	73.2	Confident	67	Low	8 Å²	8	51.5 Å²	51.5	4%	0.037	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-101.1	3.8	-179.3	-51.8	175	0	0	0	112	A756 R858 W859	A756-H861 HydrophobicContact CB-CB 4.11Å; R858-H861 PolarHBondContact O-N 3.48Å; W859-H861 PolarHBondContact O-N 3.44Å
862	N	71.9	Confident	65.1	Low	62 Å²	62	57 Å²	57	33%	0.332	30%	0.295	S	S	.	.			trans	-92.8	111.6	177.9	-173.9	-16.8	0	0	0	110.7	W859 K864 Y865	W859-N862 PolarHBondContact O-N 3.38Å; W859-N862 VanDerWaalsContact O-N 3.15Å; N862-K864 PolarHBondContact O-N 2.78Å; N862-K864 VanDerWaalsContact O-N 3.08Å; N862-K864 WeakPolarHBondContact OD1-CB 3.27Å; N862-K864 WeakPolarHBondContact OD1-CG 3.31Å; N862-K864 PolarHBondContact OD1-N 2.72Å; N862-K864 VanDerWaalsContact OD1-N 3.09Å; N862-Y865 WeakPolarHBondContact O-CB 3.28Å; N862-Y865 PolarHBondContact O-N 2.72Å
863	S	72.2	Confident	63.8	Low	28 Å²	28	59 Å²	59	20%	0.196	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-56.9	-26.7	-178.4	-47.3	0	0	0	0	113.8	Y865 Y866 Q867	S863-Y865 PolarHBondContact O-N 2.94Å; S863-Y866 PolarHBondContact O-N 2.87Å; S863-Q867 WeakPolarHBondContact O-CG 3.36Å; S863-Q867 PolarHBondContact O-N 2.88Å
864	K	72.1	Confident	62.3	Low	120 Å²	120	65.9 Å²	65.9	52%	0.522	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-59.7	-31.7	174.9	-62.1	-179.9	-179.6	179.4	0	112.6	N862 Y866 Q867 H871	N862-K864 PolarHBondContact O-N 2.78Å; N862-K864 VanDerWaalsContact O-N 3.08Å; N862-K864 WeakPolarHBondContact OD1-CB 3.27Å; N862-K864 WeakPolarHBondContact OD1-CG 3.31Å; N862-K864 PolarHBondContact OD1-N 2.72Å; N862-K864 VanDerWaalsContact OD1-N 3.09Å; K864-Y866 VanDerWaalsContact C-N 3.26Å; K864-Y866 PolarHBondContact O-N 3.12Å; K864-Q867 PolarHBondContact O-N 2.63Å; K864-H871 PolarHBondContact O-CD2 2.73Å
865	Y	68	Low	60.5	Low	28 Å²	28	69.6 Å²	69.6	11%	0.11	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-65.6	-27.9	179.6	179.8	-93.8	0	0	0	113.3	F641 F645 W859 N862 S863	F641-Y865 HydrophobicContact CE1-CE2 4.48Å; F641-Y865 AromaticContact CE1-CZ 3.84Å; F641-Y865 WeakPolarHBondContact CE1-OH 3.47Å; F641-Y865 AromaticContact CZ-CE2 3.91Å; F641-Y865 HydrophobicContact CZ-CE2 3.91Å; F641-Y865 AromaticContact CZ-CZ 3.72Å; F641-Y865 WeakPolarHBondContact CZ-OH 3.34Å; F645-Y865 HydrophobicContact CD2-CE1 4.39Å; F645-Y865 WeakPolarHBondContact CD2-OH 3.4Å; F645-Y865 HydrophobicContact CE2-CE1 4.27Å; W859-Y865 HydrophobicContact CE3-CD1 4.37Å; W859-Y865 HydrophobicContact CE3-CD2 4.04Å; W859-Y865 HydrophobicContact CE3-CE1 4.32Å; W859-Y865 AromaticContact CE3-CE2 3.97Å; W859-Y865 HydrophobicContact CE3-CE2 3.97Å; W859-Y865 HydrophobicContact CE3-CG 4.25Å; W859-Y865 HydrophobicContact CZ3-CD1 4.27Å; W859-Y865 HydrophobicContact CZ3-CD2 4.3Å; W859-Y865 AromaticContact CZ3-CE1 3.78Å; W859-Y865 HydrophobicContact CZ3-CE1 3.78Å; W859-Y865 AromaticContact CZ3-CE2 3.81Å; W859-Y865 HydrophobicContact CZ3-CE2 3.81Å; W859-Y865 AromaticContact CZ3-CZ 3.54Å; N862-Y865 WeakPolarHBondContact O-CB 3.28Å; N862-Y865 PolarHBondContact O-N 2.72Å; S863-Y865 PolarHBondContact O-N 2.94Å
866	Y	70.8	Confident	58.8	Low	12 Å²	12	70 Å²	70	5%	0.047	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-98.8	1.6	179.3	-53.8	-82.6	0	0	0	113.1	V751 A752 K755 T860 S863 K864	V751-Y866 HydrophobicContact CB-CD1 4.13Å; V751-Y866 HydrophobicContact CB-CD2 4.3Å; V751-Y866 HydrophobicContact CB-CE1 4.5Å; V751-Y866 HydrophobicContact CB-CG 4.02Å; V751-Y866 HydrophobicContact CG1-CD1 3.67Å; V751-Y866 HydrophobicContact CG1-CD2 4.34Å; V751-Y866 HydrophobicContact CG1-CE1 3.63Å; V751-Y866 HydrophobicContact CG1-CE2 4.3Å; V751-Y866 HydrophobicContact CG1-CG 4.04Å; A752-Y866 HydrophobicContact CB-CD2 3.9Å; A752-Y866 HydrophobicContact CB-CE2 3.86Å; K755-Y866 WeakPolarHBondContact CD-OH 3.21Å; K755-Y866 WeakPolarHBondContact CE-OH 3.42Å; K755-Y866 PolarHBondContact NZ-OH 2.87Å; T860-Y866 WeakPolarHBondContact O-CE2 3.35Å; T860-Y866 PolarHBondContact O-OH 3.47Å; S863-Y866 PolarHBondContact O-N 2.87Å; K864-Y866 VanDerWaalsContact C-N 3.26Å; K864-Y866 PolarHBondContact O-N 3.12Å
867	Q	68.9	Low	57.5	Low	85 Å²	85	78.7 Å²	78.7	40%	0.397	39%	0.394	S	S	.	.	S	Bend	trans	-87.3	149.6	174.5	-72.3	167.6	-1.4	0	0	110.2	S863 K864 G869	S863-Q867 WeakPolarHBondContact O-CG 3.36Å; S863-Q867 PolarHBondContact O-N 2.88Å; K864-Q867 PolarHBondContact O-N 2.63Å; Q867-G869 PolarHBondContact O-N 2.57Å
868	K	50.2	Low	56.2	Low	197 Å²	197	80.3 Å²	80.3	86%	0.857	40%	0.402	S	S	*	.	S	Bend	trans	-65.6	95.8	-176	-72.7	-179.6	178	175.3	0	111.8
869	G	49	Very low	54.4	Low	45 Å²	45	81.2 Å²	81.2	46%	0.464	42%	0.418	S	S	.	.	S	Bend	trans	-167.2	159.8	174.5	0	0	0	0	0	112.3	Q867 H871	Q867-G869 PolarHBondContact O-N 2.57Å; G869-H871 PolarHBondContact O-N 3.01Å
870	S	39.3	Very low	53.4	Low	126 Å²	126	81.7 Å²	81.7	88%	0.881	43%	0.43	S	S	*	.			trans	-80.2	69	172.4	-172.3	0	0	0	0	110.3	I872	S870-I872 PolarHBondContact O-N 3.25Å
871	H	50.1	Low	52.2	Low	94 Å²	94	87.5 Å²	87.5	44%	0.435	46%	0.461	S	S	.	.			trans	-78.5	102.1	-177.5	-72.4	-60.1	0	0	0	111.9	K864 G869 R873	K864-H871 PolarHBondContact O-CD2 2.73Å; G869-H871 PolarHBondContact O-N 3.01Å; H871-R873 PolarHBondContact O-N 3.15Å
872	I	45	Very low	50.6	Low	116 Å²	116	91.6 Å²	91.6	60%	0.595	50%	0.496	S	S	*	.			trans	-55.2	131.8	160.1	-57.4	171.6	0	0	0	107.7	S870	S870-I872 PolarHBondContact O-N 3.25Å
873	R	48.4	Very low	49.2	Very low	50 Å²	50	96.4 Å²	96.4	19%	0.189	51%	0.51	C	S	.	.			trans	-74.8	133.3	-179.2	-26.2	153.4	86.2	152.1	12.5	108.1	E648 H871 D875 S876	E648-R873 IonicContact OE1-CZ 2.86Å; E648-R873 IonicContact OE1-NH1 3.6Å; E648-R873 PolarHBondContact OE1-NH1 3.27Å; E648-R873 IonicContact OE2-CZ 2.73Å; E648-R873 IonicContact OE2-NH1 2.93Å; E648-R873 PolarHBondContact OE2-NH1 3.11Å; E648-R873 IonicContact OE2-NH2 3.26Å; E648-R873 PolarHBondContact OE2-NH2 3.26Å; H871-R873 PolarHBondContact O-N 3.15Å; R873-D875 PolarHBondContact O-N 2.76Å; R873-S876 VanDerWaalsContact CD-OG 3.27Å; R873-S876 WeakPolarHBondContact CD-OG 3.31Å; R873-S876 WeakPolarHBondContact O-CB 3.43Å; R873-S876 PolarHBondContact O-N 3.49Å
874	Q	47.8	Very low	47.6	Very low	179 Å²	179	102.2 Å²	102.2	84%	0.836	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.7	175.1	-69.2	180	-81.6	0	0	113
875	D	45.1	Very low	46.2	Very low	79 Å²	79	100.5 Å²	100.5	42%	0.422	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	33.1	169.6	-55.8	-64	0	0	0	111.9	R873 R908	R873-D875 PolarHBondContact O-N 2.76Å; D875-R908 IonicContact OD1-CZ 3.51Å; D875-R908 IonicContact OD1-NE 2.73Å; D875-R908 IonicContact OD1-NH2 3.66Å; D875-R908 PolarHBondContact OD1-NH2 2.66Å
876	S	41.5	Very low	45	Very low	23 Å²	23	104.5 Å²	104.5	16%	0.161	56%	0.562	C	S	.	*			trans	-74.4	138.9	169.4	-146.7	0	0	0	0	109.4	R873 E878	R873-S876 VanDerWaalsContact CD-OG 3.27Å; R873-S876 WeakPolarHBondContact CD-OG 3.31Å; R873-S876 WeakPolarHBondContact O-CB 3.43Å; R873-S876 PolarHBondContact O-N 3.49Å; S876-E878 WeakPolarHBondContact CB-OE2 3.33Å; S876-E878 PolarHBondContact O-N 3.27Å; S876-E878 VanDerWaalsContact OG-CD 3.31Å; S876-E878 PolarHBondContact OG-OE2 2.8Å
877	M	33.9	Very low	43.9	Very low	195 Å²	195	109.5 Å²	109.5	96%	0.961	60%	0.599	S	S	*	*	S	Bend	trans	-84.7	21.6	167.8	-159.3	153.4	64.6	0	0	112
878	E	38.5	Very low	42.7	Very low	98 Å²	98	111.4 Å²	111.4	46%	0.458	61%	0.612	S	S	.	*	S	Bend	trans	-81.4	124.8	160.4	-74.5	147.2	171.9	0	0	107.4	K644 S876 S880	K644-E878 IonicContact NZ-OE1 3.98Å; K644-E878 PolarHBondContact NZ-OE1 3.49Å; K644-E878 IonicContact NZ-OE2 3.9Å; S876-E878 WeakPolarHBondContact CB-OE2 3.33Å; S876-E878 PolarHBondContact O-N 3.27Å; S876-E878 VanDerWaalsContact OG-CD 3.31Å; S876-E878 PolarHBondContact OG-OE2 2.8Å; E878-S880 PolarHBondContact O-N 2.9Å
879	P	30.5	Very low	42.4	Very low	98 Å²	98	105 Å²	105	64%	0.636	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-55	129.8	168.5	-22.1	33.3	0	0	0	109.3	W883	P879-W883 HydrophobicContact CB-CB 4.17Å; P879-W883 HydrophobicContact CB-CG 4.03Å
880	S	37.6	Very low	42	Very low	67 Å²	67	112.8 Å²	112.8	47%	0.469	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-59.2	146.4	171.9	50.7	0	0	0	0	110.8	E878 A882 W883	E878-S880 PolarHBondContact O-N 2.9Å; S880-A882 PolarHBondContact O-N 3.14Å; S880-W883 VanDerWaalsContact O-CD1 3.22Å; S880-W883 PolarHBondContact O-N 3.39Å
881	D	41.7	Very low	42.1	Very low	128 Å²	128	112 Å²	112	68%	0.684	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-58.3	-12.2	-174.9	-45.7	-66.7	0	0	0	114.4	W883 D884	D881-W883 PolarHBondContact O-N 3.2Å; D881-D884 PolarHBondContact O-N 3.05Å
882	A	39.8	Very low	41.6	Very low	93 Å²	93	110.3 Å²	110.3	77%	0.769	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-65.2	-2.8	166.4	0	0	0	0	0	115.7	S880	S880-A882 PolarHBondContact O-N 3.14Å
883	W	43.4	Very low	41.3	Very low	164 Å²	164	111.6 Å²	111.6	62%	0.621	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-92.1	-7.3	174.3	-72.9	98.7	0	0	0	114.1	P879 S880 D881 D885 V886	P879-W883 HydrophobicContact CB-CB 4.17Å; P879-W883 HydrophobicContact CB-CG 4.03Å; S880-W883 VanDerWaalsContact O-CD1 3.22Å; S880-W883 PolarHBondContact O-N 3.39Å; D881-W883 PolarHBondContact O-N 3.2Å; W883-D885 VanDerWaalsContact C-N 3.28Å; W883-D885 PolarHBondContact O-N 3.23Å; W883-V886 WeakPolarHBondContact O-CG2 2.97Å
884	D	38.7	Very low	41.1	Very low	149 Å²	149	119.6 Å²	119.6	80%	0.797	65%	0.646	S	S	*	*	S	Bend	trans	-69.1	-20.7	-178.5	-96.6	2.7	0	0	0	113.6	D881 V886	D881-D884 PolarHBondContact O-N 3.05Å; D884-V886 VanDerWaalsContact C-N 3.26Å; D884-V886 PolarHBondContact O-N 2.85Å; D884-V886 VanDerWaalsContact O-N 3.11Å
885	D	41.4	Very low	40.9	Very low	85 Å²	85	118.3 Å²	118.3	46%	0.455	64%	0.644	S	S	.	*			trans	-87.5	62.5	171.4	-168.1	14.4	0	0	0	112.2	W883 S887 N888	W883-D885 VanDerWaalsContact C-N 3.28Å; W883-D885 PolarHBondContact O-N 3.23Å; D885-S887 PolarHBondContact O-N 2.97Å; D885-S887 VanDerWaalsContact O-N 3.08Å; D885-S887 WeakPolarHBondContact OD1-CB 3.36Å; D885-N888 PolarHBondContact O-N 2.86Å; D885-N888 VanDerWaalsContact O-N 3.1Å; D885-N888 WeakPolarHBondContact OD2-CB 3.27Å; D885-N888 PolarHBondContact OD2-ND2 3.43Å
886	V	42.4	Very low	41.2	Very low	112 Å²	112	117.8 Å²	117.8	68%	0.679	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-56	-24.2	176.1	-178.6	0	0	0	0	111.8	W883 D884 N888 C889	W883-V886 WeakPolarHBondContact O-CG2 2.97Å; D884-V886 VanDerWaalsContact C-N 3.26Å; D884-V886 PolarHBondContact O-N 2.85Å; D884-V886 VanDerWaalsContact O-N 3.11Å; V886-N888 VanDerWaalsContact C-N 3.26Å; V886-N888 PolarHBondContact O-N 3.34Å; V886-C889 PolarHBondContact O-N 3.44Å
887	S	48.2	Very low	41.9	Very low	116 Å²	116	119.7 Å²	119.7	81%	0.811	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-64.7	-23.6	178.2	-42.1	0	0	0	0	114	D885	D885-S887 PolarHBondContact O-N 2.97Å; D885-S887 VanDerWaalsContact O-N 3.08Å; D885-S887 WeakPolarHBondContact OD1-CB 3.36Å
888	N	45	Very low	42.5	Very low	125 Å²	125	117.3 Å²	117.3	67%	0.668	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-99.3	3.1	-178.9	-101.9	-50.8	0	0	0	114.3	D885 V886 R890	D885-N888 PolarHBondContact O-N 2.86Å; D885-N888 VanDerWaalsContact O-N 3.1Å; D885-N888 WeakPolarHBondContact OD2-CB 3.27Å; D885-N888 PolarHBondContact OD2-ND2 3.43Å; V886-N888 VanDerWaalsContact C-N 3.26Å; V886-N888 PolarHBondContact O-N 3.34Å; N888-R890 PolarHBondContact O-N 3.44Å
889	C	42.3	Very low	43	Very low	63 Å²	63	119 Å²	119	43%	0.426	65%	0.649	S	S	.	*			trans	-77.3	79.1	-171.8	-161.7	0	0	0	0	113.1	V886 C891	V886-C889 PolarHBondContact O-N 3.44Å; C889-C891 PolarHBondContact O-N 3.46Å
890	R	42.2	Very low	43.9	Very low	209 Å²	209	118.5 Å²	118.5	79%	0.789	64%	0.638	S	S	*	*			trans	-72.9	60.8	169.2	-68.2	-173.6	67.8	-177.4	-0.7	111.9	N888 G892	N888-R890 PolarHBondContact O-N 3.44Å; R890-G892 PolarHBondContact O-N 2.9Å
891	C	41.3	Very low	44.4	Very low	108 Å²	108	122.4 Å²	122.4	73%	0.73	64%	0.643	S	S	*	*			trans	-78.8	41.8	-178.7	62.1	0	0	0	0	114.3	C889	C889-C891 PolarHBondContact O-N 3.46Å
892	G	39.1	Very low	44.9	Very low	59 Å²	59	118.7 Å²	118.7	61%	0.608	63%	0.63	S	S	*	*	S	Bend	trans	-97.9	-62.1	170.4	0	0	0	0	0	111.7	R890	R890-G892 PolarHBondContact O-N 2.9Å
893	D	38.1	Very low	45.4	Very low	143 Å²	143	118.6 Å²	118.6	77%	0.765	62%	0.616	S	S	*	*	S	Bend	trans	-91.3	2.2	-168.7	-54.8	-61.8	0	0	0	114.9	L895	D893-L895 PolarHBondContact O-N 2.93Å
894	R	44.7	Very low	46.1	Very low	219 Å²	219	117 Å²	117	83%	0.826	61%	0.61	S	S	*	*			trans	-96.7	62.8	176.9	-64.9	-164.8	-173.2	-157.1	4.3	112.4	M896	R894-M896 PolarHBondContact O-N 3.23Å
895	L	43.6	Very low	46.9	Very low	152 Å²	152	116 Å²	116	80%	0.796	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-55.6	124.8	141.9	-90.1	81.9	0	0	0	106.6	D893 T897	D893-L895 PolarHBondContact O-N 2.93Å; L895-T897 PolarHBondContact O-N 2.9Å; L895-T897 VanDerWaalsContact O-N 3.11Å
896	M	50.9	Low	47.6	Very low	67 Å²	67	117 Å²	117	33%	0.33	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-54.7	121.5	168.7	-88.1	-168	63	0	0	108.6	R894 Q900 R901 R904	R894-M896 PolarHBondContact O-N 3.23Å; M896-Q900 VanDerWaalsContact CE-C 3.43Å; M896-Q900 HydrophobicContact CE-CB 4.01Å; M896-Q900 WeakPolarHBondContact CE-O 3.4Å; M896-R901 VanDerWaalsContact CE-CA 3.44Å; M896-R901 HydrophobicContact CE-CB 3.84Å; M896-R901 HydrophobicContact CE-CG 4.47Å; M896-R904 VanDerWaalsContact CE-NE 3.25Å; M896-R904 VanDerWaalsContact CE-NH2 3.34Å; M896-R904 PolarHBondContact SD-NH2 3.4Å
897	T	56.6	Low	48.3	Very low	63 Å²	63	117.9 Å²	117.9	39%	0.387	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-57.9	146.8	171.6	63.8	0	0	0	0	108.9	L895 E899 Q900 R901	L895-T897 PolarHBondContact O-N 2.9Å; L895-T897 VanDerWaalsContact O-N 3.11Å; T897-E899 PolarHBondContact O-N 3.12Å; T897-Q900 PolarHBondContact O-N 2.76Å; T897-Q900 WeakPolarHBondContact OG1-CB 3.46Å; T897-Q900 VanDerWaalsContact OG1-CG 3.31Å; T897-Q900 WeakPolarHBondContact OG1-CG 3.5Å; T897-Q900 PolarHBondContact OG1-N 3.34Å; T897-R901 PolarHBondContact O-N 3.28Å
898	L	47.3	Very low	48.5	Very low	146 Å²	146	119.7 Å²	119.7	76%	0.764	59%	0.588	S	S	*	*	H	α-helix	trans	-56.9	-33.9	176.6	-71.3	172.3	0	0	0	110.8	R901 A902	L898-R901 CarbonylContact O-C 3.52Å; L898-R901 WeakPolarHBondContact O-CB 3.43Å; L898-R901 PolarHBondContact O-N 3.23Å; L898-A902 VanDerWaalsContact O-CB 3.31Å; L898-A902 WeakPolarHBondContact O-CB 3.32Å; L898-A902 PolarHBondContact O-N 3.26Å
899	E	48.7	Very low	49.3	Very low	132 Å²	132	116.6 Å²	116.6	62%	0.617	58%	0.576	S	S	*	*	H	α-helix	trans	-59.4	-49.6	168.8	-178	-172.9	-154.8	0	0	113.3	T897 R901 A902 N903	T897-E899 PolarHBondContact O-N 3.12Å; E899-R901 PolarHBondContact O-N 3.22Å; E899-A902 PolarHBondContact O-N 2.98Å; E899-N903 WeakPolarHBondContact O-CB 3.35Å; E899-N903 PolarHBondContact O-N 3.2Å; E899-N903 PolarHBondContact O-OD1 3.01Å
900	Q	49.3	Very low	50.2	Low	89 Å²	89	114.8 Å²	114.8	42%	0.416	56%	0.561	S	S	.	*	H	α-helix	trans	-64	-27.3	174.7	-76.8	176.4	18.4	0	0	112.7	M896 T897 R904	M896-Q900 VanDerWaalsContact CE-C 3.43Å; M896-Q900 HydrophobicContact CE-CB 4.01Å; M896-Q900 WeakPolarHBondContact CE-O 3.4Å; T897-Q900 PolarHBondContact O-N 2.76Å; T897-Q900 WeakPolarHBondContact OG1-CB 3.46Å; T897-Q900 VanDerWaalsContact OG1-CG 3.31Å; T897-Q900 WeakPolarHBondContact OG1-CG 3.5Å; T897-Q900 PolarHBondContact OG1-N 3.34Å; Q900-R904 WeakPolarHBondContact O-CB 3.44Å; Q900-R904 WeakPolarHBondContact O-CG 3.38Å; Q900-R904 PolarHBondContact O-N 3.3Å; Q900-R904 VanDerWaalsContact O-N 3.15Å
901	R	48.9	Very low	51.2	Low	149 Å²	149	105.1 Å²	105.1	56%	0.562	53%	0.526	S	S	*	.	H	α-helix	trans	-74.3	-45.6	172.7	-170.5	176.9	-70.2	-175.8	-1.2	111.1	M896 T897 L898 E899 R904 Q905	M896-R901 VanDerWaalsContact CE-CA 3.44Å; M896-R901 HydrophobicContact CE-CB 3.84Å; M896-R901 HydrophobicContact CE-CG 4.47Å; T897-R901 PolarHBondContact O-N 3.28Å; L898-R901 CarbonylContact O-C 3.52Å; L898-R901 WeakPolarHBondContact O-CB 3.43Å; L898-R901 PolarHBondContact O-N 3.23Å; E899-R901 PolarHBondContact O-N 3.22Å; R901-R904 PolarHBondContact O-N 2.98Å; R901-Q905 WeakPolarHBondContact O-CB 3.49Å; R901-Q905 PolarHBondContact O-N 3.11Å
902	A	50.2	Low	52.1	Low	49 Å²	49	105.6 Å²	105.6	41%	0.405	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-44.3	175.2	0	0	0	0	0	111	L898 E899 Q905 H906	L898-A902 VanDerWaalsContact O-CB 3.31Å; L898-A902 WeakPolarHBondContact O-CB 3.32Å; L898-A902 PolarHBondContact O-N 3.26Å; E899-A902 PolarHBondContact O-N 2.98Å; A902-Q905 CarbonylContact O-C 3.59Å; A902-Q905 PolarHBondContact O-N 3.34Å; A902-Q905 VanDerWaalsContact O-N 3.12Å; A902-H906 VanDerWaalsContact O-CB 3.25Å; A902-H906 WeakPolarHBondContact O-CB 3.48Å; A902-H906 PolarHBondContact O-N 3.11Å
903	N	50.5	Low	53.3	Low	92 Å²	92	105.1 Å²	105.1	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-40.5	177.4	-67.5	-8.6	0	0	0	111.6	E899 Q905 Q907	E899-N903 WeakPolarHBondContact O-CB 3.35Å; E899-N903 PolarHBondContact O-N 3.2Å; E899-N903 PolarHBondContact O-OD1 3.01Å; N903-Q905 VanDerWaalsContact C-N 3.31Å; N903-Q905 PolarHBondContact O-N 2.87Å; N903-Q907 WeakPolarHBondContact O-CB 3.37Å; N903-Q907 PolarHBondContact O-N 3.1Å
904	R	58.5	Low	54.9	Low	130 Å²	130	102.1 Å²	102.1	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-66.6	-29.3	171.1	-81.8	-159.4	-102.9	-87.6	5.6	113.4	M896 Q900 R901 R908	M896-R904 VanDerWaalsContact CE-NE 3.25Å; M896-R904 VanDerWaalsContact CE-NH2 3.34Å; M896-R904 PolarHBondContact SD-NH2 3.4Å; Q900-R904 WeakPolarHBondContact O-CB 3.44Å; Q900-R904 WeakPolarHBondContact O-CG 3.38Å; Q900-R904 PolarHBondContact O-N 3.3Å; Q900-R904 VanDerWaalsContact O-N 3.15Å; R901-R904 PolarHBondContact O-N 2.98Å; R904-R908 WeakPolarHBondContact O-CB 3.41Å; R904-R908 WeakPolarHBondContact O-CG 3.31Å; R904-R908 PolarHBondContact O-N 3.31Å
905	Q	55.9	Low	56.1	Low	128 Å²	128	92.7 Å²	92.7	60%	0.598	46%	0.455	S	S	*	.	H	α-helix	trans	-78.1	-45.7	176.7	-178.5	173.3	-17.6	0	0	111.4	R901 A902 N903 R908 C909	R901-Q905 WeakPolarHBondContact O-CB 3.49Å; R901-Q905 PolarHBondContact O-N 3.11Å; A902-Q905 CarbonylContact O-C 3.59Å; A902-Q905 PolarHBondContact O-N 3.34Å; A902-Q905 VanDerWaalsContact O-N 3.12Å; N903-Q905 VanDerWaalsContact C-N 3.31Å; N903-Q905 PolarHBondContact O-N 2.87Å; Q905-R908 WeakPolarHBondContact O-CA 3.35Å; Q905-R908 WeakPolarHBondContact O-CB 3.48Å; Q905-R908 PolarHBondContact O-N 2.76Å; Q905-R908 VanDerWaalsContact O-N 3.11Å; Q905-C909 PolarHBondContact O-N 3.26Å; Q905-C909 VanDerWaalsContact O-N 3.1Å; Q905-C909 PolarHBondContact O-SG 3.43Å
906	H	56.6	Low	57.3	Low	105 Å²	105	86.5 Å²	86.5	49%	0.486	43%	0.428	S	S	.	.	H	α-helix	trans	-57.4	-50.9	173	175.5	86.3	0	0	0	110.6	A902 R908 C909 L910	A902-H906 VanDerWaalsContact O-CB 3.25Å; A902-H906 WeakPolarHBondContact O-CB 3.48Å; A902-H906 PolarHBondContact O-N 3.11Å; H906-R908 PolarHBondContact O-N 3.08Å; H906-C909 CarbonylContact O-C 3.56Å; H906-C909 WeakPolarHBondContact O-CA 3.45Å; H906-C909 PolarHBondContact O-N 2.75Å; H906-L910 WeakPolarHBondContact O-CG 3.49Å; H906-L910 PolarHBondContact O-N 3.1Å
907	Q	55.9	Low	58.7	Low	132 Å²	132	85.4 Å²	85.4	62%	0.617	43%	0.425	S	S	*	.	H	α-helix	trans	-62.3	-25.1	176.2	-168.2	174.4	38.4	0	0	113.4	N903	N903-Q907 WeakPolarHBondContact O-CB 3.37Å; N903-Q907 PolarHBondContact O-N 3.1Å
908	R	54.1	Low	60	Low	154 Å²	154	84.3 Å²	84.3	58%	0.581	42%	0.419	S	S	*	.	H	α-helix	trans	-76.2	-20.6	169.8	-87.6	173.5	156.6	161.9	-6.8	113.6	F857 D875 R904 Q905 H906	F857-R908 WeakPolarHBondContact CB-O 3.39Å; F857-R908 WeakPolarHBondContact CD1-O 3.03Å; F857-R908 WeakPolarHBondContact CG-O 3.14Å; D875-R908 IonicContact OD1-CZ 3.51Å; D875-R908 IonicContact OD1-NE 2.73Å; D875-R908 IonicContact OD1-NH2 3.66Å; D875-R908 PolarHBondContact OD1-NH2 2.66Å; R904-R908 WeakPolarHBondContact O-CB 3.41Å; R904-R908 WeakPolarHBondContact O-CG 3.31Å; R904-R908 PolarHBondContact O-N 3.31Å; Q905-R908 WeakPolarHBondContact O-CA 3.35Å; Q905-R908 WeakPolarHBondContact O-CB 3.48Å; Q905-R908 PolarHBondContact O-N 2.76Å; Q905-R908 VanDerWaalsContact O-N 3.11Å; H906-R908 PolarHBondContact O-N 3.08Å
909	C	60.4	Low	62	Low	60 Å²	60	78.9 Å²	78.9	41%	0.405	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	10.8	173.7	-60.9	0	0	0	0	113.2	F857 Q905 H906	F857-C909 HydrophobicContact CE2-CB 4.34Å; F857-C909 WeakPolarHBondContact CZ-O 3.39Å; Q905-C909 PolarHBondContact O-N 3.26Å; Q905-C909 VanDerWaalsContact O-N 3.1Å; Q905-C909 PolarHBondContact O-SG 3.43Å; H906-C909 CarbonylContact O-C 3.56Å; H906-C909 WeakPolarHBondContact O-CA 3.45Å; H906-C909 PolarHBondContact O-N 2.75Å
910	L	62.5	Low	64.2	Low	24 Å²	24	73.1 Å²	73.1	13%	0.126	36%	0.364	C	S	.	.			trans	-96.9	121.5	175.8	-68.3	-164.7	0	0	0	111.6	H906 H912 T933	H906-L910 WeakPolarHBondContact O-CG 3.49Å; H906-L910 PolarHBondContact O-N 3.1Å; L910-H912 PolarHBondContact O-CD2 3.47Å; L910-T933 HydrophobicContact CD2-CG2 3.63Å
911	A	61.9	Low	66.3	Low	6 Å²	6	69.4 Å²	69.4	5%	0.05	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-89	143.6	171.4	0	0	0	0	0	110.6	T855 F857 G931 Y932	T855-A911 HydrophobicContact CG2-CB 4.27Å; F857-A911 HydrophobicContact CE1-CB 4.16Å; F857-A911 HydrophobicContact CZ-CB 4.45Å; A911-G931 CarbonylContact O-C 3.38Å; A911-G931 WeakPolarHBondContact O-CA 3.37Å; A911-Y932 HydrophobicContact CB-CD1 4.38Å; A911-Y932 HydrophobicContact CB-CD2 3.89Å; A911-Y932 HydrophobicContact CB-CE1 3.97Å; A911-Y932 HydrophobicContact CB-CE2 3.43Å; A911-Y932 VanDerWaalsContact CB-CE2 3.43Å; A911-Y932 HydrophobicContact CB-CG 4.34Å; A911-Y932 VanDerWaalsContact CB-CZ 3.46Å; A911-Y932 PolarHBondContact N-O 3.19Å; A911-Y932 WeakPolarHBondContact O-CD1 3.36Å; A911-Y932 WeakPolarHBondContact O-CE1 3.49Å; A911-Y932 PolarHBondContact O-N 2.85Å
912	H	60.5	Low	68.4	Low	119 Å²	119	62.4 Å²	62.4	55%	0.551	32%	0.32	S	S	*	.			trans	-129.6	9.2	-171.8	-66.9	-78.2	0	0	0	114	L910 G931	L910-H912 PolarHBondContact O-CD2 3.47Å; H912-G931 VanDerWaalsContact CE1-CA 3.48Å; H912-G931 WeakPolarHBondContact CE1-CA 3.24Å; H912-G931 PolarHBondContact CE1-N 2.89Å; H912-G931 WeakPolarHBondContact ND1-CA 3.47Å
913	S	63.8	Low	70.4	Confident	48 Å²	48	60.4 Å²	60.4	34%	0.336	30%	0.303	S	S	.	.			trans	-102.1	128.6	179	59.8	0	0	0	0	111	R831 V915 Y932	R831-S913 PolarHBondContact NH1-OG 3.39Å; S913-V915 PolarHBondContact O-N 2.9Å; S913-Y932 WeakPolarHBondContact O-CE1 3.45Å; S913-Y932 PolarHBondContact O-OH 3.06Å
914	L	72	Confident	72.3	Confident	80 Å²	80	57.5 Å²	57.5	42%	0.419	29%	0.287	S	S	.	.			trans	-68.4	113.8	166.9	177.4	60.6	0	0	0	108.7	V925 L926	L914-V925 HydrophobicContact CD1-CG1 4.21Å; L914-L926 HydrophobicContact CD1-CD2 3.76Å
915	V	69.3	Low	73.7	Confident	22 Å²	22	51.6 Å²	51.6	13%	0.133	27%	0.265	C	S	.	.			trans	-147.8	168.7	179.5	-64.7	0	0	0	0	109	R831 L853 S913	R831-V915 HydrophobicContact CB-CG2 3.87Å; L853-V915 HydrophobicContact CD1-CB 4.37Å; L853-V915 HydrophobicContact CD2-CB 4.17Å; L853-V915 HydrophobicContact CD2-CG1 4.09Å; S913-V915 PolarHBondContact O-N 2.9Å
916	G	70.5	Confident	75.2	Confident	22 Å²	22	46.1 Å²	46.1	23%	0.227	24%	0.24	C	C	.	.	S	Bend	trans	103.1	173.3	178.3	0	0	0	0	0	113.5	R831 D832	R831-G916 WeakPolarHBondContact O-CA 3.4Å; D832-G916 WeakPolarHBondContact OD1-CA 3.35Å
917	T	80.3	Confident	76.3	Confident	43 Å²	43	45 Å²	45	26%	0.264	24%	0.237	S	C	.	.			trans	-94.6	119.7	-177.7	-57	0	0	0	0	110.4	D832 K834 N919 Y920	D832-T917 WeakPolarHBondContact OD1-CB 3.4Å; D832-T917 PolarHBondContact OD1-N 3.22Å; D832-T917 PolarHBondContact OD1-OG1 2.84Å; K834-T917 HydrophobicContact CD-CG2 4.35Å; K834-T917 WeakPolarHBondContact CD-OG1 3.01Å; K834-T917 PolarHBondContact NZ-OG1 3.39Å; K834-T917 VanDerWaalsContact NZ-OG1 3.14Å; T917-N919 VanDerWaalsContact C-N 3.33Å; T917-N919 PolarHBondContact O-N 2.82Å; T917-Y920 HydrophobicContact CG2-CD2 3.96Å; T917-Y920 HydrophobicContact CG2-CE2 4.01Å; T917-Y920 PolarHBondContact O-N 3.06Å
918	P	83.8	Confident	76.9	Confident	41 Å²	41	47 Å²	47	27%	0.266	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-49.2	-35.2	-159	-34.2	36.2	0	0	0	118.9	Y920 P960 T963	P918-Y920 PolarHBondContact O-N 3.48Å; P918-P960 HydrophobicContact CG-CB 4.33Å; P918-T963 HydrophobicContact CB-CG2 4.05Å; P918-T963 WeakPolarHBondContact O-CG2 3.32Å
919	N	89.1	Confident	77.2	Confident	32 Å²	32	49.1 Å²	49.1	17%	0.171	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-63.8	-29	179	-65.5	-20.6	0	0	0	113	T917 V943 P953	T917-N919 VanDerWaalsContact C-N 3.33Å; T917-N919 PolarHBondContact O-N 2.82Å; N919-V943 WeakPolarHBondContact O-CG1 3.49Å; N919-P953 HydrophobicContact CB-CB 4.15Å; N919-P953 HydrophobicContact CB-CG 4.03Å
920	Y	94.8	Very high	77.3	Confident	11 Å²	11	49.6 Å²	49.6	4%	0.043	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-106.5	-2.9	-172.4	-45.1	-85.2	0	0	0	113.7	I833 K834 P835 T917 P918 S940 V943 I944 E947	I833-Y920 WeakPolarHBondContact O-CB 3.21Å; K834-Y920 HydrophobicContact CB-CD1 4.36Å; K834-Y920 HydrophobicContact CB-CD2 3.69Å; K834-Y920 HydrophobicContact CB-CE1 4.4Å; K834-Y920 HydrophobicContact CB-CE2 3.71Å; K834-Y920 HydrophobicContact CB-CG 4.02Å; P835-Y920 VanDerWaalsContact CD-CZ 3.48Å; P835-Y920 VanDerWaalsContact CD-OH 3.31Å; P835-Y920 WeakPolarHBondContact CD-OH 3.22Å; P835-Y920 HydrophobicContact CG-CE1 4.34Å; T917-Y920 HydrophobicContact CG2-CD2 3.96Å; T917-Y920 HydrophobicContact CG2-CE2 4.01Å; T917-Y920 PolarHBondContact O-N 3.06Å; P918-Y920 PolarHBondContact O-N 3.48Å; Y920-S940 PolarHBondContact O-OG 3.43Å; Y920-V943 HydrophobicContact CD1-CB 4.19Å; Y920-V943 HydrophobicContact CD1-CG1 3.42Å; Y920-V943 VanDerWaalsContact CD1-CG1 3.42Å; Y920-V943 HydrophobicContact CE1-CG1 3.96Å; Y920-V943 HydrophobicContact CG-CG1 4.23Å; Y920-I944 HydrophobicContact CD1-CG1 4.02Å; Y920-I944 HydrophobicContact CE1-CG1 4.08Å; Y920-E947 WeakPolarHBondContact CE1-OE2 3.18Å; Y920-E947 PolarHBondContact OH-OE1 3.21Å; Y920-E947 PolarHBondContact OH-OE2 3.33Å
921	I	92.6	Very high	77.6	Confident	11 Å²	11	49 Å²	49	6%	0.056	26%	0.261	C	S	.	.			trans	-72.8	134.3	-179.8	-60.3	177.7	0	0	0	109.9	V925 L926 W939 V967	I921-V925 HydrophobicContact CG2-CB 3.6Å; I921-V925 HydrophobicContact CG2-CG1 3.77Å; I921-V925 HydrophobicContact CG2-CG2 4.26Å; I921-L926 HydrophobicContact CB-CD2 4.41Å; I921-L926 HydrophobicContact CD1-CD2 4.36Å; I921-L926 HydrophobicContact CG2-CD2 3.71Å; I921-L926 HydrophobicContact CG2-CG 3.95Å; I921-W939 PolarHBondContact O-NE1 3.47Å; I921-W939 VanDerWaalsContact O-NE1 3.17Å; I921-V967 VanDerWaalsContact O-CG1 3.28Å; I921-V967 WeakPolarHBondContact O-CG1 3.09Å
922	A	93.4	Very high	78.5	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.008	26%	0.26	C	S	.	.			trans	-75.5	146.8	175.3	0	0	0	0	0	112.9	E924 V925 C936 W939	A922-E924 VanDerWaalsContact C-N 3.28Å; A922-E924 VanDerWaalsContact CB-CD 3.45Å; A922-E924 WeakPolarHBondContact CB-OE1 3.39Å; A922-E924 WeakPolarHBondContact CB-OE2 3.24Å; A922-E924 PolarHBondContact O-N 2.82Å; A922-V925 HydrophobicContact CB-CG2 4.23Å; A922-V925 WeakPolarHBondContact O-CB 3.37Å; A922-V925 PolarHBondContact O-N 2.94Å; A922-C936 HydrophobicContact CB-CB 3.83Å; A922-W939 VanDerWaalsContact CA-CD1 3.46Å; A922-W939 HydrophobicContact CB-CB 3.59Å; A922-W939 HydrophobicContact CB-CD2 4.09Å; A922-W939 HydrophobicContact CB-CG 3.54Å
923	P	92.6	Very high	79.8	Confident	7 Å²	7	45.2 Å²	45.2	5%	0.045	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-35.4	-173.8	21.7	-33	0	0	0	113.3	V925 L926 L927 W939 V967	P923-V925 PolarHBondContact O-N 2.67Å; P923-L926 PolarHBondContact O-N 3.06Å; P923-L926 VanDerWaalsContact O-N 3.11Å; P923-L927 HydrophobicContact CB-CD1 4.5Å; P923-L927 WeakPolarHBondContact O-CB 3.32Å; P923-L927 VanDerWaalsContact O-CG 3.26Å; P923-L927 WeakPolarHBondContact O-CG 3.4Å; P923-L927 PolarHBondContact O-N 2.92Å; P923-W939 HydrophobicContact CG-CE3 4.19Å; P923-W939 HydrophobicContact CG-CH2 3.88Å; P923-W939 HydrophobicContact CG-CZ2 4.36Å; P923-W939 HydrophobicContact CG-CZ3 3.77Å; P923-V967 HydrophobicContact CB-CG1 4.21Å
924	E	90.7	Very high	81.1	Confident	31 Å²	31	46.4 Å²	46.4	15%	0.145	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-30.7	177.5	67.1	-83.5	-170.5	0	0	113.3	A922 R928 C936 A997 R1000	A922-E924 VanDerWaalsContact C-N 3.28Å; A922-E924 VanDerWaalsContact CB-CD 3.45Å; A922-E924 WeakPolarHBondContact CB-OE1 3.39Å; A922-E924 WeakPolarHBondContact CB-OE2 3.24Å; A922-E924 PolarHBondContact O-N 2.82Å; E924-R928 PolarHBondContact O-N 3.13Å; E924-C936 WeakPolarHBondContact OE1-CA 3.22Å; E924-A997 HydrophobicContact CB-CB 4.5Å; E924-A997 HydrophobicContact CG-CB 4.32Å; E924-R1000 IonicContact OE1-CZ 2.78Å; E924-R1000 IonicContact OE1-NH1 2.72Å; E924-R1000 PolarHBondContact OE1-NH1 2.86Å; E924-R1000 IonicContact OE1-NH2 3.15Å; E924-R1000 IonicContact OE2-CZ 2.93Å; E924-R1000 IonicContact OE2-NH1 3.41Å; E924-R1000 IonicContact OE2-NH2 3.02Å; E924-R1000 PolarHBondContact OE2-NH2 2.73Å
925	V	88.1	Confident	82.1	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-70.2	-35.3	177	-176.4	0	0	0	0	111.1	L914 I921 A922 P923 R928 Y932 C936	L914-V925 HydrophobicContact CD1-CG1 4.21Å; I921-V925 HydrophobicContact CG2-CB 3.6Å; I921-V925 HydrophobicContact CG2-CG1 3.77Å; I921-V925 HydrophobicContact CG2-CG2 4.26Å; A922-V925 HydrophobicContact CB-CG2 4.23Å; A922-V925 WeakPolarHBondContact O-CB 3.37Å; A922-V925 PolarHBondContact O-N 2.94Å; P923-V925 PolarHBondContact O-N 2.67Å; V925-R928 WeakPolarHBondContact O-CG 3.18Å; V925-Y932 HydrophobicContact CB-CD1 4.16Å; V925-Y932 HydrophobicContact CB-CE1 4.25Å; V925-Y932 HydrophobicContact CG1-CD1 4.21Å; V925-Y932 HydrophobicContact CG1-CE1 3.78Å; V925-Y932 HydrophobicContact CG2-CD1 3.87Å; V925-Y932 HydrophobicContact CG2-CD2 3.87Å; V925-Y932 HydrophobicContact CG2-CE1 4.11Å; V925-Y932 HydrophobicContact CG2-CE2 4.1Å; V925-Y932 HydrophobicContact CG2-CG 3.75Å; V925-C936 HydrophobicContact CG2-CB 3.8Å
926	L	85.6	Confident	83.2	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.063	23%	0.225	C	C	.	.	H	α-helix	trans	-75.2	-41.6	177.4	-58.5	-177.6	0	0	0	111.9	L914 I921 P923 R928 Q964 V967 I968	L914-L926 HydrophobicContact CD1-CD2 3.76Å; I921-L926 HydrophobicContact CB-CD2 4.41Å; I921-L926 HydrophobicContact CD1-CD2 4.36Å; I921-L926 HydrophobicContact CG2-CD2 3.71Å; I921-L926 HydrophobicContact CG2-CG 3.95Å; P923-L926 PolarHBondContact O-N 3.06Å; P923-L926 VanDerWaalsContact O-N 3.11Å; L926-R928 WeakPolarHBondContact O-CG 3.32Å; L926-R928 PolarHBondContact O-N 3.05Å; L926-R928 PolarHBondContact O-NE 3.42Å; L926-R928 VanDerWaalsContact O-NE 3.17Å; L926-Q964 HydrophobicContact CD1-CB 4.02Å; L926-Q964 HydrophobicContact CD1-CG 3.96Å; L926-Q964 HydrophobicContact CD2-CG 3.99Å; L926-V967 HydrophobicContact CD1-CB 3.87Å; L926-V967 HydrophobicContact CD1-CG1 3.57Å; L926-I968 HydrophobicContact CB-CD1 4.25Å; L926-I968 HydrophobicContact CB-CG1 4.24Å; L926-I968 HydrophobicContact CD1-CD1 4.37Å; L926-I968 HydrophobicContact CD1-CG1 4.03Å
927	L	81.1	Confident	84.4	Confident	83 Å²	83	41.7 Å²	41.7	44%	0.435	21%	0.214	S	C	.	.	H	α-helix	trans	-69	-27.9	-172.8	-73.8	168.8	0	0	0	113.8	P923 K929 I968	P923-L927 HydrophobicContact CB-CD1 4.5Å; P923-L927 WeakPolarHBondContact O-CB 3.32Å; P923-L927 VanDerWaalsContact O-CG 3.26Å; P923-L927 WeakPolarHBondContact O-CG 3.4Å; P923-L927 PolarHBondContact O-N 2.92Å; L927-K929 PolarHBondContact O-N 3.47Å; L927-I968 HydrophobicContact CD2-CG1 4.46Å; L927-I968 HydrophobicContact CD2-CG2 4.32Å
928	R	68.6	Low	85.2	Confident	173 Å²	173	39.7 Å²	39.7	65%	0.653	20%	0.202	S	C	*	.			trans	57.6	1.4	167.8	-69.5	176.7	-77.2	168.5	-4.5	118.1	E924 V925 L926 A930	E924-R928 PolarHBondContact O-N 3.13Å; V925-R928 WeakPolarHBondContact O-CG 3.18Å; L926-R928 WeakPolarHBondContact O-CG 3.32Å; L926-R928 PolarHBondContact O-N 3.05Å; L926-R928 PolarHBondContact O-NE 3.42Å; L926-R928 VanDerWaalsContact O-NE 3.17Å; R928-A930 CarbonylContact C-O 3.58Å
929	K	60.5	Low	85.9	Confident	198 Å²	198	37.8 Å²	37.8	86%	0.861	19%	0.189	S	C	*	.	S	Bend	trans	-74.1	-43	-176.7	-72.6	170.6	-176.4	173.8	0	112.9	L927	L927-K929 PolarHBondContact O-N 3.47Å
930	A	61.8	Low	86.3	Confident	71 Å²	71	36.5 Å²	36.5	59%	0.587	18%	0.183	S	C	*	.	S	Bend	trans	-106.2	164.6	160.8	0	0	0	0	0	108.6	R928	R928-A930 CarbonylContact C-O 3.58Å
931	G	69.1	Low	86.4	Confident	12 Å²	12	36 Å²	36	12%	0.124	18%	0.181	C	C	.	.			trans	-78.1	160.7	165.4	0	0	0	0	0	110.8	A911 H912	A911-G931 CarbonylContact O-C 3.38Å; A911-G931 WeakPolarHBondContact O-CA 3.37Å; H912-G931 VanDerWaalsContact CE1-CA 3.48Å; H912-G931 WeakPolarHBondContact CE1-CA 3.24Å; H912-G931 PolarHBondContact CE1-N 2.89Å; H912-G931 WeakPolarHBondContact ND1-CA 3.47Å
932	Y	80.9	Confident	86.7	Confident	8 Å²	8	35.5 Å²	35.5	3%	0.031	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-106.8	155.8	-176.9	59.5	-91.5	0	0	0	112	R831 A911 S913 V925 C936	R831-Y932 WeakPolarHBondContact CD-OH 3.25Å; R831-Y932 HydrophobicContact CG-CE2 4.24Å; R831-Y932 PolarHBondContact NH1-OH 3.09Å; A911-Y932 HydrophobicContact CB-CD1 4.38Å; A911-Y932 HydrophobicContact CB-CD2 3.89Å; A911-Y932 HydrophobicContact CB-CE1 3.97Å; A911-Y932 HydrophobicContact CB-CE2 3.43Å; A911-Y932 VanDerWaalsContact CB-CE2 3.43Å; A911-Y932 HydrophobicContact CB-CG 4.34Å; A911-Y932 VanDerWaalsContact CB-CZ 3.46Å; A911-Y932 PolarHBondContact N-O 3.19Å; A911-Y932 WeakPolarHBondContact O-CD1 3.36Å; A911-Y932 WeakPolarHBondContact O-CE1 3.49Å; A911-Y932 PolarHBondContact O-N 2.85Å; S913-Y932 WeakPolarHBondContact O-CE1 3.45Å; S913-Y932 PolarHBondContact O-OH 3.06Å; V925-Y932 HydrophobicContact CB-CD1 4.16Å; V925-Y932 HydrophobicContact CB-CE1 4.25Å; V925-Y932 HydrophobicContact CG1-CD1 4.21Å; V925-Y932 HydrophobicContact CG1-CE1 3.78Å; V925-Y932 HydrophobicContact CG2-CD1 3.87Å; V925-Y932 HydrophobicContact CG2-CD2 3.87Å; V925-Y932 HydrophobicContact CG2-CE1 4.11Å; V925-Y932 HydrophobicContact CG2-CE2 4.1Å; V925-Y932 HydrophobicContact CG2-CG 3.75Å; Y932-C936 HydrophobicContact CD2-CB 4.2Å; Y932-C936 VanDerWaalsContact CD2-SG 3.58Å
933	T	87.9	Confident	86.9	Confident	36 Å²	36	35.4 Å²	35.4	22%	0.221	18%	0.178	C	C	.	.			trans	-104	-169.5	-177.4	59.2	0	0	0	0	111	L910 L935 C936	L910-T933 HydrophobicContact CD2-CG2 3.63Å; T933-L935 PolarHBondContact O-N 2.9Å; T933-L935 VanDerWaalsContact O-N 3.13Å; T933-L935 WeakPolarHBondContact OG1-CG 3.21Å; T933-C936 PolarHBondContact O-SG 2.87Å
934	Q	90.5	Very high	87.2	Confident	73 Å²	73	35.1 Å²	35.1	34%	0.341	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-12	176.2	78.7	-167.6	32.1	0	0	114.4	H824 I829 C936 D937	H824-Q934 PolarHBondContact CE1-O 3.01Å; H824-Q934 VanDerWaalsContact CE1-O 3.27Å; I829-Q934 HydrophobicContact CD1-CB 4.11Å; I829-Q934 HydrophobicContact CG1-CB 3.82Å; I829-Q934 HydrophobicContact CG2-CB 4.36Å; Q934-C936 PolarHBondContact O-N 3.23Å; Q934-D937 PolarHBondContact O-N 2.77Å
935	L	92.6	Very high	87.5	Confident	19 Å²	19	33.6 Å²	33.6	10%	0.099	17%	0.169	C	C	.	.	H	α-helix	trans	-69.1	-15.5	-177.9	-52.8	-178.4	0	0	0	113.5	T933 D937 W938 W939 A997 R1000 G1002 A1003	T933-L935 PolarHBondContact O-N 2.9Å; T933-L935 VanDerWaalsContact O-N 3.13Å; T933-L935 WeakPolarHBondContact OG1-CG 3.21Å; L935-D937 PolarHBondContact O-N 3.26Å; L935-W938 PolarHBondContact O-N 3.38Å; L935-W939 PolarHBondContact O-N 2.89Å; L935-A997 VanDerWaalsContact CD1-O 3.26Å; L935-A997 WeakPolarHBondContact CD1-O 3.26Å; L935-R1000 PolarHBondContact O-NH1 3.44Å; L935-G1002 VanDerWaalsContact CD2-O 3.25Å; L935-G1002 WeakPolarHBondContact CD2-O 3.5Å; L935-A1003 HydrophobicContact CD1-CB 4.21Å
936	C	93.6	Very high	88	Confident	6 Å²	6	33.5 Å²	33.5	4%	0.041	17%	0.168	C	C	.	.	H	α-helix	trans	-63.8	-29.1	171.8	62.1	0	0	0	0	112.7	A922 E924 V925 Y932 T933 Q934 W939 S940	A922-C936 HydrophobicContact CB-CB 3.83Å; E924-C936 WeakPolarHBondContact OE1-CA 3.22Å; V925-C936 HydrophobicContact CG2-CB 3.8Å; Y932-C936 HydrophobicContact CD2-CB 4.2Å; Y932-C936 VanDerWaalsContact CD2-SG 3.58Å; T933-C936 PolarHBondContact O-SG 2.87Å; Q934-C936 PolarHBondContact O-N 3.23Å; C936-W939 PolarHBondContact O-N 3Å; C936-S940 PolarHBondContact O-N 3.09Å; C936-S940 PolarHBondContact O-OG 3.09Å
937	D	95.8	Very high	88.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.9	-34.2	174.8	-66.2	-27.3	0	0	0	111.2	I820 H824 I829 H830 R831 I833 Q934 L935 S940 V941	I820-D937 HydrophobicContact CG2-CB 3.99Å; H824-D937 IonicContact CD2-OD2 3.95Å; H824-D937 IonicContact CE1-OD2 2.66Å; H824-D937 IonicContact NE2-OD2 2.63Å; H824-D937 PolarHBondContact NE2-OD2 3.36Å; I829-D937 VanDerWaalsContact CG2-OD2 3.28Å; I829-D937 WeakPolarHBondContact CG2-OD2 3.22Å; H830-D937 PolarHBondContact N-OD1 3.37Å; H830-D937 PolarHBondContact N-OD2 2.98Å; R831-D937 PolarHBondContact N-OD1 2.85Å; I833-D937 HydrophobicContact CG1-CB 4.25Å; Q934-D937 PolarHBondContact O-N 2.77Å; L935-D937 PolarHBondContact O-N 3.26Å; D937-S940 WeakPolarHBondContact O-CB 3.49Å; D937-S940 PolarHBondContact O-N 3.38Å; D937-V941 WeakPolarHBondContact O-CG2 3.46Å; D937-V941 PolarHBondContact O-N 3.41Å; D937-V941 VanDerWaalsContact O-N 3.1Å
938	W	97.2	Very high	89.2	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-70.5	-31.8	178.1	-61.6	134.3	0	0	0	113.3	T817 I820 E821 H824 L935 S940 V941 G942 L993 A1006 I1009	T817-W938 HydrophobicContact CG2-CH2 4.27Å; T817-W938 HydrophobicContact CG2-CZ3 4.26Å; I820-W938 HydrophobicContact CB-CH2 3.76Å; I820-W938 HydrophobicContact CB-CZ3 3.84Å; I820-W938 HydrophobicContact CD1-CZ3 4.3Å; I820-W938 HydrophobicContact CG2-CD2 4.47Å; I820-W938 HydrophobicContact CG2-CE3 4.19Å; I820-W938 HydrophobicContact CG2-CH2 3.53Å; I820-W938 HydrophobicContact CG2-CZ2 3.86Å; I820-W938 HydrophobicContact CG2-CZ3 3.72Å; E821-W938 HydrophobicContact CB-CH2 4.48Å; H824-W938 AromaticContact CE1-CE2 3.9Å; H824-W938 AromaticContact CE1-NE1 3.89Å; H824-W938 AromaticContact ND1-CZ2 3.85Å; H824-W938 AromaticContact ND1-NE1 4Å; L935-W938 PolarHBondContact O-N 3.38Å; W938-S940 VanDerWaalsContact C-N 3.35Å; W938-V941 HydrophobicContact CE3-CG2 3.93Å; W938-V941 HydrophobicContact CZ3-CG2 4.28Å; W938-V941 WeakPolarHBondContact O-CB 3.37Å; W938-V941 PolarHBondContact O-N 3.01Å; W938-G942 PolarHBondContact O-N 2.85Å; W938-L993 HydrophobicContact CB-CD2 4.22Å; W938-A1006 HydrophobicContact CH2-CB 3.96Å; W938-A1006 HydrophobicContact CZ2-CB 3.82Å; W938-I1009 HydrophobicContact CD2-CD1 3.4Å; W938-I1009 HydrophobicContact CE3-CD1 3.4Å; W938-I1009 VanDerWaalsContact CE3-CD1 3.4Å; W938-I1009 HydrophobicContact CG-CD1 3.89Å; W938-I1009 HydrophobicContact CH2-CD1 4.18Å; W938-I1009 HydrophobicContact CZ2-CD1 4.16Å; W938-I1009 HydrophobicContact CZ3-CD1 3.81Å
939	W	97.3	Very high	90.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.7	-47.1	168	174.1	-81.7	0	0	0	111.1	I921 A922 P923 L935 C936 V941 G942 V943 F955 V967 W970 C994 C995	I921-W939 PolarHBondContact O-NE1 3.47Å; I921-W939 VanDerWaalsContact O-NE1 3.17Å; A922-W939 VanDerWaalsContact CA-CD1 3.46Å; A922-W939 HydrophobicContact CB-CB 3.59Å; A922-W939 HydrophobicContact CB-CD2 4.09Å; A922-W939 HydrophobicContact CB-CG 3.54Å; P923-W939 HydrophobicContact CG-CE3 4.19Å; P923-W939 HydrophobicContact CG-CH2 3.88Å; P923-W939 HydrophobicContact CG-CZ2 4.36Å; P923-W939 HydrophobicContact CG-CZ3 3.77Å; L935-W939 PolarHBondContact O-N 2.89Å; C936-W939 PolarHBondContact O-N 3Å; W939-V941 VanDerWaalsContact C-N 3.26Å; W939-V941 PolarHBondContact O-N 3.04Å; W939-G942 PolarHBondContact O-N 2.9Å; W939-V943 WeakPolarHBondContact O-CG2 3.32Å; W939-V943 PolarHBondContact O-N 3.31Å; W939-F955 HydrophobicContact CH2-CE2 4.24Å; W939-F955 HydrophobicContact CH2-CZ 4.1Å; W939-F955 HydrophobicContact CZ2-CD2 4.33Å; W939-F955 AromaticContact CZ2-CE2 3.41Å; W939-F955 HydrophobicContact CZ2-CE2 3.41Å; W939-F955 VanDerWaalsContact CZ2-CE2 3.41Å; W939-F955 AromaticContact CZ2-CZ 3.71Å; W939-F955 HydrophobicContact CZ2-CZ 3.71Å; W939-V967 HydrophobicContact CZ2-CG1 4.16Å; W939-W970 HydrophobicContact CH2-CB 3.65Å; W939-W970 AromaticContact CH2-CD1 4Å; W939-W970 HydrophobicContact CH2-CD2 4.19Å; W939-W970 AromaticContact CH2-CG 3.64Å; W939-W970 HydrophobicContact CH2-CG 3.64Å; W939-W970 HydrophobicContact CZ2-CB 4.4Å; W939-W970 HydrophobicContact CZ3-CD2 4.36Å; W939-W970 HydrophobicContact CZ3-CG 4.21Å; W939-C994 HydrophobicContact CE3-CB 4.34Å; W939-C994 HydrophobicContact CH2-CB 4.36Å; W939-C994 HydrophobicContact CZ3-CB 4.19Å; W939-C994 WeakPolarHBondContact CZ3-O 3.44Å; W939-C995 WeakPolarHBondContact CZ3-O 3.43Å
940	S	97.4	Very high	92.2	Very high	6 Å²	6	13 Å²	13	4%	0.042	8%	0.082	C	C	.	.	H	α-helix	trans	-61.1	-34.1	178.2	-50.7	0	0	0	0	112.3	I833 Y920 C936 D937 W938 V943 I944	I833-S940 WeakPolarHBondContact O-CB 3.34Å; Y920-S940 PolarHBondContact O-OG 3.43Å; C936-S940 PolarHBondContact O-N 3.09Å; C936-S940 PolarHBondContact O-OG 3.09Å; D937-S940 WeakPolarHBondContact O-CB 3.49Å; D937-S940 PolarHBondContact O-N 3.38Å; W938-S940 VanDerWaalsContact C-N 3.35Å; S940-V943 PolarHBondContact O-N 3.18Å; S940-I944 VanDerWaalsContact O-CG1 3.26Å; S940-I944 WeakPolarHBondContact O-CG1 3.49Å; S940-I944 PolarHBondContact O-N 2.78Å
941	V	97.9	Very high	93.6	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.6	-44	171.2	177	0	0	0	0	111.8	I813 L816 I820 D937 W938 W939 I944 L945 L993	I813-V941 HydrophobicContact CD1-CG1 4.21Å; I813-V941 HydrophobicContact CG2-CG1 3.7Å; L816-V941 HydrophobicContact CD2-CG1 4.36Å; L816-V941 HydrophobicContact CD2-CG2 3.94Å; L816-V941 HydrophobicContact CG-CG2 4.12Å; I820-V941 HydrophobicContact CD1-CG2 3.29Å; D937-V941 WeakPolarHBondContact O-CG2 3.46Å; D937-V941 PolarHBondContact O-N 3.41Å; D937-V941 VanDerWaalsContact O-N 3.1Å; W938-V941 HydrophobicContact CE3-CG2 3.93Å; W938-V941 HydrophobicContact CZ3-CG2 4.28Å; W938-V941 WeakPolarHBondContact O-CB 3.37Å; W938-V941 PolarHBondContact O-N 3.01Å; W939-V941 VanDerWaalsContact C-N 3.26Å; W939-V941 PolarHBondContact O-N 3.04Å; V941-I944 PolarHBondContact O-N 2.87Å; V941-L945 PolarHBondContact O-N 3.28Å; V941-L993 HydrophobicContact CG1-CD1 4.19Å
942	G	97.8	Very high	94.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.1	-40	175.9	0	0	0	0	0	113.1	W938 W939 L945 F946	W938-G942 PolarHBondContact O-N 2.85Å; W939-G942 PolarHBondContact O-N 2.9Å; G942-L945 PolarHBondContact O-N 2.75Å; G942-F946 PolarHBondContact O-N 3.25Å
943	V	98	Very high	95.2	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62	-45.5	174.4	174.4	0	0	0	0	111.2	N919 Y920 W939 S940 F946 E947 P953 P954 F955	N919-V943 WeakPolarHBondContact O-CG1 3.49Å; Y920-V943 HydrophobicContact CD1-CB 4.19Å; Y920-V943 HydrophobicContact CD1-CG1 3.42Å; Y920-V943 VanDerWaalsContact CD1-CG1 3.42Å; Y920-V943 HydrophobicContact CE1-CG1 3.96Å; Y920-V943 HydrophobicContact CG-CG1 4.23Å; W939-V943 WeakPolarHBondContact O-CG2 3.32Å; W939-V943 PolarHBondContact O-N 3.31Å; S940-V943 PolarHBondContact O-N 3.18Å; V943-F946 PolarHBondContact O-N 2.98Å; V943-E947 WeakPolarHBondContact O-CB 3.36Å; V943-E947 PolarHBondContact O-N 2.83Å; V943-P953 HydrophobicContact CG1-CB 4.11Å; V943-P954 HydrophobicContact CG1-CG 4.47Å; V943-F955 HydrophobicContact CG2-CE2 4.21Å
944	I	97.9	Very high	95.6	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.5	-38.9	178.2	-67.2	167.1	0	0	0	111.3	I813 L816 I833 P835 I838 Y920 S940 V941 E947 M948	I813-I944 HydrophobicContact CD1-CG2 4.12Å; L816-I944 HydrophobicContact CD2-CD1 4.29Å; I833-I944 HydrophobicContact CG2-CD1 3.6Å; P835-I944 HydrophobicContact CG-CG1 4.39Å; I838-I944 HydrophobicContact CD1-CD1 4.04Å; Y920-I944 HydrophobicContact CD1-CG1 4.02Å; Y920-I944 HydrophobicContact CE1-CG1 4.08Å; S940-I944 VanDerWaalsContact O-CG1 3.26Å; S940-I944 WeakPolarHBondContact O-CG1 3.49Å; S940-I944 PolarHBondContact O-N 2.78Å; V941-I944 PolarHBondContact O-N 2.87Å; I944-E947 PolarHBondContact O-N 3.16Å; I944-M948 HydrophobicContact CG2-CE 3.69Å; I944-M948 HydrophobicContact CG2-CG 4.32Å; I944-M948 HydrophobicContact CG2-SD 4.17Å; I944-M948 WeakPolarHBondContact O-CB 3.36Å; I944-M948 VanDerWaalsContact O-CG 3.31Å; I944-M948 WeakPolarHBondContact O-CG 3.45Å; I944-M948 PolarHBondContact O-N 2.91Å
945	L	98.2	Very high	95.8	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.5	-41.6	175.7	176.8	54.7	0	0	0	111.8	A809 I813 V941 G942 L949 I989 I990 F1014	A809-L945 HydrophobicContact CB-CD1 4.04Å; I813-L945 HydrophobicContact CD1-CB 4.1Å; I813-L945 HydrophobicContact CG1-CB 4.02Å; I813-L945 HydrophobicContact CG1-CD1 3.99Å; I813-L945 HydrophobicContact CG1-CG 4.41Å; V941-L945 PolarHBondContact O-N 3.28Å; G942-L945 PolarHBondContact O-N 2.75Å; L945-L949 HydrophobicContact CD1-CD1 3.63Å; L945-L949 HydrophobicContact CD1-CG 3.96Å; L945-L949 HydrophobicContact CG-CD1 4.19Å; L945-L949 WeakPolarHBondContact O-CB 3.46Å; L945-L949 WeakPolarHBondContact O-CG 3.48Å; L945-L949 PolarHBondContact O-N 2.99Å; L945-L949 VanDerWaalsContact O-N 3.15Å; L945-I989 HydrophobicContact CD2-CG2 3.48Å; L945-I989 VanDerWaalsContact CD2-CG2 3.48Å; L945-I990 HydrophobicContact CB-CG1 4.41Å; L945-I990 HydrophobicContact CD2-CG1 4.03Å; L945-I990 HydrophobicContact CG-CD1 4.24Å; L945-I990 HydrophobicContact CG-CG1 3.95Å; L945-F1014 HydrophobicContact CD1-CE1 4.36Å; L945-F1014 HydrophobicContact CD1-CZ 3.81Å; L945-F1014 HydrophobicContact CD2-CE1 4.08Å; L945-F1014 HydrophobicContact CD2-CZ 4.14Å
946	F	97.6	Very high	95.7	Very high	4 Å²	4	13.9 Å²	13.9	2%	0.018	8%	0.082	C	C	.	.	H	α-helix	trans	-60.2	-47.2	171.5	-176.6	-74.1	0	0	0	110.7	G942 V943 M948 L949 V950 Q952 P954 L974 V976 I990	G942-F946 PolarHBondContact O-N 3.25Å; V943-F946 PolarHBondContact O-N 2.98Å; F946-M948 PolarHBondContact O-N 2.79Å; F946-L949 PolarHBondContact O-N 3.06Å; F946-L949 VanDerWaalsContact O-N 3.16Å; F946-V950 HydrophobicContact CD1-CB 3.84Å; F946-V950 HydrophobicContact CD1-CG1 4.31Å; F946-V950 HydrophobicContact CD1-CG2 3.85Å; F946-V950 HydrophobicContact CD2-CG2 4.23Å; F946-V950 HydrophobicContact CE1-CB 3.64Å; F946-V950 HydrophobicContact CE1-CG1 3.6Å; F946-V950 HydrophobicContact CE1-CG2 3.74Å; F946-V950 HydrophobicContact CE2-CG2 4.12Å; F946-V950 HydrophobicContact CG-CG2 4.13Å; F946-V950 HydrophobicContact CZ-CB 4.22Å; F946-V950 HydrophobicContact CZ-CG1 3.98Å; F946-V950 HydrophobicContact CZ-CG2 3.89Å; F946-V950 VanDerWaalsContact O-CB 3.24Å; F946-V950 WeakPolarHBondContact O-CB 3.39Å; F946-V950 WeakPolarHBondContact O-CG2 3.19Å; F946-V950 PolarHBondContact O-N 3.14Å; F946-Q952 VanDerWaalsContact CD1-O 3.32Å; F946-Q952 WeakPolarHBondContact CD1-O 3.45Å; F946-Q952 WeakPolarHBondContact CE1-O 3.4Å; F946-P954 HydrophobicContact CB-CG 4.25Å; F946-P954 HydrophobicContact CD1-CB 3.79Å; F946-P954 VanDerWaalsContact CD1-CD 3.4Å; F946-P954 HydrophobicContact CD1-CG 3.97Å; F946-P954 HydrophobicContact CD2-CB 4.06Å; F946-P954 HydrophobicContact CD2-CG 4.41Å; F946-P954 HydrophobicContact CE1-CB 3.7Å; F946-P954 HydrophobicContact CE1-CG 4.38Å; F946-P954 HydrophobicContact CE2-CB 3.98Å; F946-P954 HydrophobicContact CG-CB 3.96Å; F946-P954 HydrophobicContact CG-CG 3.97Å; F946-P954 HydrophobicContact CZ-CB 3.79Å; F946-L974 HydrophobicContact CD2-CD1 4.25Å; F946-L974 HydrophobicContact CE2-CD1 4.33Å; F946-V976 HydrophobicContact CE2-CG2 4.09Å; F946-I990 HydrophobicContact CB-CD1 4.06Å; F946-I990 HydrophobicContact CB-CG2 4.34Å; F946-I990 HydrophobicContact CD2-CD1 4.37Å; F946-I990 HydrophobicContact CD2-CG2 4.18Å
947	E	96.3	Very high	95.6	Very high	11 Å²	11	14.5 Å²	14.5	5%	0.051	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-42.7	-179.8	-172.4	176.8	-139.1	0	0	112.6	L798 P835 Y920 V943 I944 L949 G951 P953	L798-E947 HydrophobicContact CD2-CB 4.42Å; L798-E947 HydrophobicContact CD2-CG 3.73Å; P835-E947 VanDerWaalsContact CG-OE2 3.3Å; P835-E947 WeakPolarHBondContact CG-OE2 3.35Å; Y920-E947 WeakPolarHBondContact CE1-OE2 3.18Å; Y920-E947 PolarHBondContact OH-OE1 3.21Å; Y920-E947 PolarHBondContact OH-OE2 3.33Å; V943-E947 WeakPolarHBondContact O-CB 3.36Å; V943-E947 PolarHBondContact O-N 2.83Å; I944-E947 PolarHBondContact O-N 3.16Å; E947-L949 VanDerWaalsContact C-N 3.3Å; E947-L949 PolarHBondContact O-N 3.32Å; E947-G951 VanDerWaalsContact O-CA 3.28Å; E947-G951 WeakPolarHBondContact O-CA 3.06Å; E947-G951 PolarHBondContact O-N 3.38Å; E947-P953 HydrophobicContact CB-CB 4.39Å; E947-P953 HydrophobicContact CG-CB 4.4Å; E947-P953 VanDerWaalsContact OE1-CD 3.28Å; E947-P953 WeakPolarHBondContact OE1-CD 3.32Å
948	M	97	Very high	95.2	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-39.4	173.4	-76.6	177.7	176	0	0	112.5	M794 L798 F804 A809 I813 I944 F946	M794-M948 HydrophobicContact CE-CE 4.36Å; M794-M948 HydrophobicContact CG-CE 3.82Å; M794-M948 HydrophobicContact SD-CE 3.85Å; L798-M948 HydrophobicContact CD1-CE 4.35Å; L798-M948 HydrophobicContact CD1-CG 4.13Å; L798-M948 HydrophobicContact CD2-CG 4.18Å; L798-M948 HydrophobicContact CG-CG 4.48Å; F804-M948 HydrophobicContact CB-CB 4.27Å; F804-M948 HydrophobicContact CD2-CB 4.07Å; F804-M948 HydrophobicContact CD2-CE 4.31Å; F804-M948 HydrophobicContact CD2-CG 3.71Å; F804-M948 HydrophobicContact CD2-SD 3.91Å; F804-M948 HydrophobicContact CE2-CE 3.92Å; F804-M948 HydrophobicContact CE2-CG 4.04Å; F804-M948 HydrophobicContact CE2-SD 4.15Å; F804-M948 HydrophobicContact CG-CB 4.35Å; F804-M948 HydrophobicContact CG-CG 4.37Å; F804-M948 PolarHBondContact N-O 2.64Å; A809-M948 HydrophobicContact CB-CB 4.06Å; A809-M948 HydrophobicContact CB-SD 4.16Å; I813-M948 HydrophobicContact CD1-CE 4.47Å; I813-M948 HydrophobicContact CD1-SD 4.04Å; I813-M948 HydrophobicContact CG1-SD 4.15Å; I944-M948 HydrophobicContact CG2-CE 3.69Å; I944-M948 HydrophobicContact CG2-CG 4.32Å; I944-M948 HydrophobicContact CG2-SD 4.17Å; I944-M948 WeakPolarHBondContact O-CB 3.36Å; I944-M948 VanDerWaalsContact O-CG 3.31Å; I944-M948 WeakPolarHBondContact O-CG 3.45Å; I944-M948 PolarHBondContact O-N 2.91Å; F946-M948 PolarHBondContact O-N 2.79Å
949	L	96.6	Very high	94.8	Very high	7 Å²	7	23.2 Å²	23.2	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-92	-17.4	-174.5	-65.6	179.2	0	0	0	114.7	V803 E806 A809 L945 F946 E947 L982 I990	V803-L949 WeakPolarHBondContact CG1-O 3.37Å; E806-L949 HydrophobicContact CB-CD2 4.15Å; E806-L949 HydrophobicContact CG-CD2 4.17Å; A809-L949 HydrophobicContact CB-CD2 3.8Å; A809-L949 HydrophobicContact CB-CG 4.29Å; L945-L949 HydrophobicContact CD1-CD1 3.63Å; L945-L949 HydrophobicContact CD1-CG 3.96Å; L945-L949 HydrophobicContact CG-CD1 4.19Å; L945-L949 WeakPolarHBondContact O-CB 3.46Å; L945-L949 WeakPolarHBondContact O-CG 3.48Å; L945-L949 PolarHBondContact O-N 2.99Å; L945-L949 VanDerWaalsContact O-N 3.15Å; F946-L949 PolarHBondContact O-N 3.06Å; F946-L949 VanDerWaalsContact O-N 3.16Å; E947-L949 VanDerWaalsContact C-N 3.3Å; E947-L949 PolarHBondContact O-N 3.32Å; L949-L982 HydrophobicContact CB-CD1 4.47Å; L949-L982 HydrophobicContact CB-CD2 3.73Å; L949-L982 HydrophobicContact CD1-CD2 4.29Å; L949-L982 HydrophobicContact CG-CD2 4.49Å; L949-I990 HydrophobicContact CD1-CD1 4.36Å
950	V	94.9	Very high	94.2	Very high	17 Å²	17	27 Å²	27	10%	0.103	17%	0.168	C	C	.	.	H	α-helix	trans	-117.2	-16.3	-175.4	-179.4	0	0	0	0	112.4	F946 Q952 P977 V980 L982	F946-V950 HydrophobicContact CD1-CB 3.84Å; F946-V950 HydrophobicContact CD1-CG1 4.31Å; F946-V950 HydrophobicContact CD1-CG2 3.85Å; F946-V950 HydrophobicContact CD2-CG2 4.23Å; F946-V950 HydrophobicContact CE1-CB 3.64Å; F946-V950 HydrophobicContact CE1-CG1 3.6Å; F946-V950 HydrophobicContact CE1-CG2 3.74Å; F946-V950 HydrophobicContact CE2-CG2 4.12Å; F946-V950 HydrophobicContact CG-CG2 4.13Å; F946-V950 HydrophobicContact CZ-CB 4.22Å; F946-V950 HydrophobicContact CZ-CG1 3.98Å; F946-V950 HydrophobicContact CZ-CG2 3.89Å; F946-V950 VanDerWaalsContact O-CB 3.24Å; F946-V950 WeakPolarHBondContact O-CB 3.39Å; F946-V950 WeakPolarHBondContact O-CG2 3.19Å; F946-V950 PolarHBondContact O-N 3.14Å; V950-Q952 VanDerWaalsContact C-N 3.33Å; V950-Q952 HydrophobicContact CG1-CG 4.34Å; V950-P977 HydrophobicContact CG1-CG 3.91Å; V950-V980 HydrophobicContact CG1-CG2 4.38Å; V950-V980 HydrophobicContact CG2-CG1 4.37Å; V950-L982 HydrophobicContact CG2-CD1 4.31Å
951	G	90.1	Very high	93.8	Very high	38 Å²	38	31 Å²	31	39%	0.392	19%	0.193	S	C	.	.	S	Bend	trans	81.5	4.2	180	0	0	0	0	0	115.2	G802 E947	G802-G951 VanDerWaalsContact O-CA 3.26Å; G802-G951 WeakPolarHBondContact O-CA 3.43Å; E947-G951 VanDerWaalsContact O-CA 3.28Å; E947-G951 WeakPolarHBondContact O-CA 3.06Å; E947-G951 PolarHBondContact O-N 3.38Å
952	Q	90.9	Very high	93.5	Very high	95 Å²	95	34.4 Å²	34.4	44%	0.444	21%	0.208	S	C	.	.	S	Bend	trans	-157	152.1	173.5	59	174.6	-6	0	0	110.3	F946 V950 L956	F946-Q952 VanDerWaalsContact CD1-O 3.32Å; F946-Q952 WeakPolarHBondContact CD1-O 3.45Å; F946-Q952 WeakPolarHBondContact CE1-O 3.4Å; V950-Q952 VanDerWaalsContact C-N 3.33Å; V950-Q952 HydrophobicContact CG1-CG 4.34Å; Q952-L956 HydrophobicContact CB-CD2 4.32Å
953	P	93.9	Very high	93.3	Very high	7 Å²	7	34.5 Å²	34.5	5%	0.045	21%	0.209	C	C	.	.			trans	-75.2	144.9	-179.5	27.7	-27.9	0	0	0	111.2	N919 V943 E947 F955 L956	N919-P953 HydrophobicContact CB-CB 4.15Å; N919-P953 HydrophobicContact CB-CG 4.03Å; V943-P953 HydrophobicContact CG1-CB 4.11Å; E947-P953 HydrophobicContact CB-CB 4.39Å; E947-P953 HydrophobicContact CG-CB 4.4Å; E947-P953 VanDerWaalsContact OE1-CD 3.28Å; E947-P953 WeakPolarHBondContact OE1-CD 3.32Å; P953-F955 VanDerWaalsContact C-N 3.26Å; P953-F955 PolarHBondContact O-N 2.97Å; P953-F955 VanDerWaalsContact O-N 3.1Å; P953-L956 HydrophobicContact CG-CB 4.24Å; P953-L956 HydrophobicContact CG-CD1 4.44Å; P953-L956 WeakPolarHBondContact O-CB 3.32Å; P953-L956 PolarHBondContact O-N 3.44Å; P953-L956 VanDerWaalsContact O-N 3.16Å
954	P	95.1	Very high	92.9	Very high	21 Å²	21	37.4 Å²	37.4	14%	0.136	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.2	-166.6	21.3	-31.7	0	0	0	114.7	V943 F946 L974	V943-P954 HydrophobicContact CG1-CG 4.47Å; F946-P954 HydrophobicContact CB-CG 4.25Å; F946-P954 HydrophobicContact CD1-CB 3.79Å; F946-P954 VanDerWaalsContact CD1-CD 3.4Å; F946-P954 HydrophobicContact CD1-CG 3.97Å; F946-P954 HydrophobicContact CD2-CB 4.06Å; F946-P954 HydrophobicContact CD2-CG 4.41Å; F946-P954 HydrophobicContact CE1-CB 3.7Å; F946-P954 HydrophobicContact CE1-CG 4.38Å; F946-P954 HydrophobicContact CE2-CB 3.98Å; F946-P954 HydrophobicContact CG-CB 3.96Å; F946-P954 HydrophobicContact CG-CG 3.97Å; F946-P954 HydrophobicContact CZ-CB 3.79Å; P954-L974 HydrophobicContact CB-CD1 3.65Å; P954-L974 HydrophobicContact CG-CD1 4.06Å
955	F	95.3	Very high	92.7	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	16.8	-175.7	-48.5	-63.3	0	0	0	113.4	W939 V943 P953 A957 T963 K966 V967 W970 L974	W939-F955 HydrophobicContact CH2-CE2 4.24Å; W939-F955 HydrophobicContact CH2-CZ 4.1Å; W939-F955 HydrophobicContact CZ2-CD2 4.33Å; W939-F955 AromaticContact CZ2-CE2 3.41Å; W939-F955 HydrophobicContact CZ2-CE2 3.41Å; W939-F955 VanDerWaalsContact CZ2-CE2 3.41Å; W939-F955 AromaticContact CZ2-CZ 3.71Å; W939-F955 HydrophobicContact CZ2-CZ 3.71Å; V943-F955 HydrophobicContact CG2-CE2 4.21Å; P953-F955 VanDerWaalsContact C-N 3.26Å; P953-F955 PolarHBondContact O-N 2.97Å; P953-F955 VanDerWaalsContact O-N 3.1Å; F955-A957 PolarHBondContact O-N 3.12Å; F955-T963 HydrophobicContact CB-CG2 4.4Å; F955-T963 WeakPolarHBondContact O-CA 3.49Å; F955-T963 WeakPolarHBondContact O-CB 3.35Å; F955-T963 WeakPolarHBondContact O-CG2 3.48Å; F955-T963 PolarHBondContact O-OG1 2.85Å; F955-K966 HydrophobicContact CB-CB 4.03Å; F955-K966 HydrophobicContact CD1-CB 4.04Å; F955-K966 HydrophobicContact CG-CB 4.48Å; F955-V967 HydrophobicContact CB-CG2 3.68Å; F955-V967 HydrophobicContact CD1-CG2 4.47Å; F955-V967 HydrophobicContact CD2-CG2 3.66Å; F955-V967 HydrophobicContact CE2-CG2 4.46Å; F955-V967 HydrophobicContact CG-CG2 3.67Å; F955-W970 HydrophobicContact CE1-CB 3.94Å; F955-W970 HydrophobicContact CZ-CB 3.93Å; F955-L974 HydrophobicContact CE1-CB 4.05Å; F955-L974 HydrophobicContact CE1-CD1 4.48Å; F955-L974 HydrophobicContact CZ-CB 4.17Å; F955-L974 HydrophobicContact CZ-CD1 4.08Å
956	L	91.1	Very high	92.5	Very high	75 Å²	75	44.6 Å²	44.6	39%	0.393	26%	0.257	S	S	.	.			trans	-56.5	138.4	179.6	-171.6	62.4	0	0	0	111.4	Q952 P953 K966	Q952-L956 HydrophobicContact CB-CD2 4.32Å; P953-L956 HydrophobicContact CG-CB 4.24Å; P953-L956 HydrophobicContact CG-CD1 4.44Å; P953-L956 WeakPolarHBondContact O-CB 3.32Å; P953-L956 PolarHBondContact O-N 3.44Å; P953-L956 VanDerWaalsContact O-N 3.16Å; L956-K966 PolarHBondContact O-NZ 3.21Å
957	A	91.4	Very high	92.4	Very high	20 Å²	20	44.4 Å²	44.4	17%	0.165	26%	0.256	C	S	.	.			trans	-153.5	157.7	179.2	0	0	0	0	0	111.8	F955 T959 E962 T963 K966	F955-A957 PolarHBondContact O-N 3.12Å; A957-T959 PolarHBondContact O-N 3.14Å; A957-T959 VanDerWaalsContact O-N 3.16Å; A957-E962 HydrophobicContact CB-CB 3.72Å; A957-E962 HydrophobicContact CB-CG 3.77Å; A957-E962 WeakPolarHBondContact CB-OE1 3.49Å; A957-T963 WeakPolarHBondContact CB-OG1 3.5Å; A957-T963 PolarHBondContact N-OG1 2.85Å; A957-K966 HydrophobicContact CB-CD 4.38Å
958	P	87.6	Confident	92.2	Very high	119 Å²	119	47.1 Å²	47.1	77%	0.773	27%	0.27	S	S	*	.	S	Bend	trans	-61.5	-18.6	174.6	-24.2	34.8	0	0	0	114.9
959	T	88.4	Confident	92.1	Very high	65 Å²	65	50.7 Å²	50.7	40%	0.399	29%	0.29	S	S	.	.	S	Bend	trans	-133.3	142.9	177.3	72.7	0	0	0	0	112.1	A957 T961 E962 T963	A957-T959 PolarHBondContact O-N 3.14Å; A957-T959 VanDerWaalsContact O-N 3.16Å; T959-T961 PolarHBondContact O-N 2.82Å; T959-T961 VanDerWaalsContact O-N 3.16Å; T959-E962 PolarHBondContact O-N 3.06Å; T959-E962 WeakPolarHBondContact OG1-CB 3.5Å; T959-E962 PolarHBondContact OG1-N 3.37Å; T959-T963 PolarHBondContact O-N 3.24Å
960	P	84.9	Confident	92	Very high	81 Å²	81	52.5 Å²	52.5	53%	0.526	30%	0.296	S	S	.	.	H	α-helix	trans	-58.4	-28.9	176.1	-27.1	35.6	0	0	0	114	P918 Q964	P918-P960 HydrophobicContact CG-CB 4.33Å; P960-Q964 WeakPolarHBondContact O-CB 3.47Å; P960-Q964 WeakPolarHBondContact O-CG 3.47Å; P960-Q964 PolarHBondContact O-N 2.9Å
961	T	88.1	Confident	91.9	Very high	90 Å²	90	59.4 Å²	59.4	55%	0.552	33%	0.327	S	S	*	.	H	α-helix	trans	-69.6	-40.1	175.8	-51.8	0	0	0	0	111.6	T959 Q964 I965	T959-T961 PolarHBondContact O-N 2.82Å; T959-T961 VanDerWaalsContact O-N 3.16Å; T961-Q964 PolarHBondContact O-N 3.14Å; T961-I965 HydrophobicContact CG2-CD1 4.28Å; T961-I965 VanDerWaalsContact O-CG1 3.29Å; T961-I965 WeakPolarHBondContact O-CG1 3.47Å; T961-I965 PolarHBondContact O-N 3.1Å
962	E	92.8	Very high	92.1	Very high	70 Å²	70	61.1 Å²	61.1	33%	0.327	33%	0.333	S	S	.	.	H	α-helix	trans	-67.9	-41.5	174.4	-171.8	-164.8	134.4	0	0	111.2	A957 T959 Q964 I965 K966	A957-E962 HydrophobicContact CB-CB 3.72Å; A957-E962 HydrophobicContact CB-CG 3.77Å; A957-E962 WeakPolarHBondContact CB-OE1 3.49Å; T959-E962 PolarHBondContact O-N 3.06Å; T959-E962 WeakPolarHBondContact OG1-CB 3.5Å; T959-E962 PolarHBondContact OG1-N 3.37Å; E962-Q964 VanDerWaalsContact C-N 3.33Å; E962-Q964 PolarHBondContact O-N 3.01Å; E962-I965 CarbonylContact O-C 3.6Å; E962-I965 PolarHBondContact O-N 3.25Å; E962-I965 VanDerWaalsContact O-N 3.1Å; E962-K966 WeakPolarHBondContact O-CG 3.16Å; E962-K966 PolarHBondContact O-N 3.42Å; E962-K966 WeakPolarHBondContact OE1-CE 3.38Å; E962-K966 IonicContact OE1-NZ 2.76Å; E962-K966 PolarHBondContact OE1-NZ 3.15Å
963	T	92.3	Very high	92.2	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	33%	0.325	C	S	.	.	H	α-helix	trans	-56.2	-46	170.7	-72	0	0	0	0	111.5	P918 F955 A957 T959 I965 K966 V967	P918-T963 HydrophobicContact CB-CG2 4.05Å; P918-T963 WeakPolarHBondContact O-CG2 3.32Å; F955-T963 HydrophobicContact CB-CG2 4.4Å; F955-T963 WeakPolarHBondContact O-CA 3.49Å; F955-T963 WeakPolarHBondContact O-CB 3.35Å; F955-T963 WeakPolarHBondContact O-CG2 3.48Å; F955-T963 PolarHBondContact O-OG1 2.85Å; A957-T963 WeakPolarHBondContact CB-OG1 3.5Å; A957-T963 PolarHBondContact N-OG1 2.85Å; T959-T963 PolarHBondContact O-N 3.24Å; T963-I965 VanDerWaalsContact C-N 3.3Å; T963-I965 PolarHBondContact O-N 2.88Å; T963-K966 PolarHBondContact O-N 3.19Å; T963-K966 VanDerWaalsContact O-N 3.16Å; T963-V967 HydrophobicContact CG2-CG2 4.34Å; T963-V967 WeakPolarHBondContact O-CG2 3.32Å; T963-V967 PolarHBondContact O-N 3.35Å
964	Q	91.5	Very high	92.3	Very high	62 Å²	62	60.2 Å²	60.2	29%	0.29	33%	0.333	S	S	.	.	H	α-helix	trans	-61.4	-36.9	175.9	-74	167.6	14.4	0	0	112.5	L926 P960 T961 E962 I968	L926-Q964 HydrophobicContact CD1-CB 4.02Å; L926-Q964 HydrophobicContact CD1-CG 3.96Å; L926-Q964 HydrophobicContact CD2-CG 3.99Å; P960-Q964 WeakPolarHBondContact O-CB 3.47Å; P960-Q964 WeakPolarHBondContact O-CG 3.47Å; P960-Q964 PolarHBondContact O-N 2.9Å; T961-Q964 PolarHBondContact O-N 3.14Å; E962-Q964 VanDerWaalsContact C-N 3.33Å; E962-Q964 PolarHBondContact O-N 3.01Å; Q964-I968 WeakPolarHBondContact O-CB 3.41Å; Q964-I968 WeakPolarHBondContact O-CD1 3.31Å; Q964-I968 WeakPolarHBondContact O-CG1 3.36Å; Q964-I968 PolarHBondContact O-N 3.42Å
965	I	92.7	Very high	92.1	Very high	97 Å²	97	65.8 Å²	65.8	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-68.3	-38.8	174.9	-69.6	164.3	0	0	0	111	T961 E962 T963 N969	T961-I965 HydrophobicContact CG2-CD1 4.28Å; T961-I965 VanDerWaalsContact O-CG1 3.29Å; T961-I965 WeakPolarHBondContact O-CG1 3.47Å; T961-I965 PolarHBondContact O-N 3.1Å; E962-I965 CarbonylContact O-C 3.6Å; E962-I965 PolarHBondContact O-N 3.25Å; E962-I965 VanDerWaalsContact O-N 3.1Å; T963-I965 VanDerWaalsContact C-N 3.3Å; T963-I965 PolarHBondContact O-N 2.88Å; I965-N969 WeakPolarHBondContact O-CB 3.27Å; I965-N969 PolarHBondContact O-N 3.07Å; I965-N969 VanDerWaalsContact O-N 3.08Å; I965-N969 PolarHBondContact O-ND2 3.16Å
966	K	94.8	Very high	91.8	Very high	53 Å²	53	68 Å²	68	23%	0.23	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-53.1	172.9	-68.7	177.3	-173.9	170.8	0	111	F955 L956 A957 E962 T963 I968 N969 W970 T973	F955-K966 HydrophobicContact CB-CB 4.03Å; F955-K966 HydrophobicContact CD1-CB 4.04Å; F955-K966 HydrophobicContact CG-CB 4.48Å; L956-K966 PolarHBondContact O-NZ 3.21Å; A957-K966 HydrophobicContact CB-CD 4.38Å; E962-K966 WeakPolarHBondContact O-CG 3.16Å; E962-K966 PolarHBondContact O-N 3.42Å; E962-K966 WeakPolarHBondContact OE1-CE 3.38Å; E962-K966 IonicContact OE1-NZ 2.76Å; E962-K966 PolarHBondContact OE1-NZ 3.15Å; T963-K966 PolarHBondContact O-N 3.19Å; T963-K966 VanDerWaalsContact O-N 3.16Å; K966-I968 VanDerWaalsContact C-N 3.3Å; K966-I968 PolarHBondContact O-N 3.37Å; K966-N969 CarbonylContact O-C 3.11Å; K966-N969 WeakPolarHBondContact O-CA 3.39Å; K966-N969 PolarHBondContact O-N 3.23Å; K966-W970 PolarHBondContact O-N 2.92Å; K966-T973 HydrophobicContact CB-CG2 4.41Å; K966-T973 HydrophobicContact CG-CG2 4.28Å; K966-T973 PolarHBondContact O-OG1 3.09Å
967	V	94.4	Very high	91.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-54.5	-42.1	176.5	172	0	0	0	0	112.3	I921 P923 L926 W939 F955 T963 N969 W970	I921-V967 VanDerWaalsContact O-CG1 3.28Å; I921-V967 WeakPolarHBondContact O-CG1 3.09Å; P923-V967 HydrophobicContact CB-CG1 4.21Å; L926-V967 HydrophobicContact CD1-CB 3.87Å; L926-V967 HydrophobicContact CD1-CG1 3.57Å; W939-V967 HydrophobicContact CZ2-CG1 4.16Å; F955-V967 HydrophobicContact CB-CG2 3.68Å; F955-V967 HydrophobicContact CD1-CG2 4.47Å; F955-V967 HydrophobicContact CD2-CG2 3.66Å; F955-V967 HydrophobicContact CE2-CG2 4.46Å; F955-V967 HydrophobicContact CG-CG2 3.67Å; T963-V967 HydrophobicContact CG2-CG2 4.34Å; T963-V967 WeakPolarHBondContact O-CG2 3.32Å; T963-V967 PolarHBondContact O-N 3.35Å; V967-N969 VanDerWaalsContact C-N 3.34Å; V967-W970 WeakPolarHBondContact O-CB 3.45Å; V967-W970 PolarHBondContact O-N 3.48Å
968	I	92.4	Very high	91.4	Very high	68 Å²	68	71 Å²	71	35%	0.349	39%	0.393	S	S	.	.	H	α-helix	trans	-67	-36.1	177.4	-72.9	166.3	0	0	0	111.7	L926 L927 Q964 K966	L926-I968 HydrophobicContact CB-CD1 4.25Å; L926-I968 HydrophobicContact CB-CG1 4.24Å; L926-I968 HydrophobicContact CD1-CD1 4.37Å; L926-I968 HydrophobicContact CD1-CG1 4.03Å; L927-I968 HydrophobicContact CD2-CG1 4.46Å; L927-I968 HydrophobicContact CD2-CG2 4.32Å; Q964-I968 WeakPolarHBondContact O-CB 3.41Å; Q964-I968 WeakPolarHBondContact O-CD1 3.31Å; Q964-I968 WeakPolarHBondContact O-CG1 3.36Å; Q964-I968 PolarHBondContact O-N 3.42Å; K966-I968 VanDerWaalsContact C-N 3.3Å; K966-I968 PolarHBondContact O-N 3.37Å
969	N	93.9	Very high	91.4	Very high	78 Å²	78	72.7 Å²	72.7	42%	0.417	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	38	178.8	-58.3	-72.7	0	0	0	111.7	I965 K966 V967 E971 S972 T973	I965-N969 WeakPolarHBondContact O-CB 3.27Å; I965-N969 PolarHBondContact O-N 3.07Å; I965-N969 VanDerWaalsContact O-N 3.08Å; I965-N969 PolarHBondContact O-ND2 3.16Å; K966-N969 CarbonylContact O-C 3.11Å; K966-N969 WeakPolarHBondContact O-CA 3.39Å; K966-N969 PolarHBondContact O-N 3.23Å; V967-N969 VanDerWaalsContact C-N 3.34Å; N969-E971 PolarHBondContact O-N 2.86Å; N969-S972 PolarHBondContact O-N 3.47Å; N969-S972 PolarHBondContact O-OG 2.99Å; N969-T973 PolarHBondContact O-N 3.38Å; N969-T973 PolarHBondContact O-OG1 3.48Å; N969-T973 VanDerWaalsContact O-OG1 3.06Å
970	W	94.8	Very high	91.4	Very high	45 Å²	45	71.5 Å²	71.5	17%	0.17	38%	0.383	C	S	.	.	H	α-helix	trans	-55.1	-37.9	-173.1	62.3	-87.3	0	0	0	112.8	W939 F955 K966 V967 S972 T973 L974 C994 C995	W939-W970 HydrophobicContact CH2-CB 3.65Å; W939-W970 AromaticContact CH2-CD1 4Å; W939-W970 HydrophobicContact CH2-CD2 4.19Å; W939-W970 AromaticContact CH2-CG 3.64Å; W939-W970 HydrophobicContact CH2-CG 3.64Å; W939-W970 HydrophobicContact CZ2-CB 4.4Å; W939-W970 HydrophobicContact CZ3-CD2 4.36Å; W939-W970 HydrophobicContact CZ3-CG 4.21Å; F955-W970 HydrophobicContact CE1-CB 3.94Å; F955-W970 HydrophobicContact CZ-CB 3.93Å; K966-W970 PolarHBondContact O-N 2.92Å; V967-W970 WeakPolarHBondContact O-CB 3.45Å; V967-W970 PolarHBondContact O-N 3.48Å; W970-S972 PolarHBondContact O-N 3.35Å; W970-T973 PolarHBondContact O-N 3.05Å; W970-L974 VanDerWaalsContact O-CB 3.3Å; W970-L974 WeakPolarHBondContact O-CB 3.4Å; W970-L974 PolarHBondContact O-N 2.86Å; W970-C994 WeakPolarHBondContact CZ3-O 3.3Å; W970-C995 HydrophobicContact CH2-CB 3.75Å; W970-C995 HydrophobicContact CZ2-CB 4.39Å; W970-C995 HydrophobicContact CZ3-CB 4Å
971	E	93.6	Very high	91.5	Very high	161 Å²	161	77.3 Å²	77.3	75%	0.752	40%	0.4	S	S	*	.	H	α-helix	trans	-51.6	-27.8	176.7	-64	172.3	-157.4	0	0	113.9	N969	N969-E971 PolarHBondContact O-N 2.86Å
972	S	93.3	Very high	91.7	Very high	75 Å²	75	74.6 Å²	74.6	52%	0.524	38%	0.382	S	S	.	.	H	α-helix	trans	-108.2	-15	179.3	58.4	0	0	0	0	114.1	N969 W970 Q975	N969-S972 PolarHBondContact O-N 3.47Å; N969-S972 PolarHBondContact O-OG 2.99Å; W970-S972 PolarHBondContact O-N 3.35Å; S972-Q975 PolarHBondContact O-NE2 3.3Å
973	T	94.5	Very high	91.9	Very high	43 Å²	43	72.2 Å²	72.2	26%	0.264	37%	0.373	S	S	.	.	H	α-helix	trans	-115.1	-18.1	-171.4	59	0	0	0	0	114.6	K966 N969 W970 Q975	K966-T973 HydrophobicContact CB-CG2 4.41Å; K966-T973 HydrophobicContact CG-CG2 4.28Å; K966-T973 PolarHBondContact O-OG1 3.09Å; N969-T973 PolarHBondContact O-N 3.38Å; N969-T973 PolarHBondContact O-OG1 3.48Å; N969-T973 VanDerWaalsContact O-OG1 3.06Å; W970-T973 PolarHBondContact O-N 3.05Å; T973-Q975 PolarHBondContact O-N 3.3Å
974	L	94.8	Very high	92	Very high	40 Å²	40	76.8 Å²	76.8	21%	0.209	40%	0.403	C	S	.	.			trans	-73.8	93.7	170.3	-179.4	63.4	0	0	0	109.2	F946 P954 F955 W970 I990 C994	F946-L974 HydrophobicContact CD2-CD1 4.25Å; F946-L974 HydrophobicContact CE2-CD1 4.33Å; P954-L974 HydrophobicContact CB-CD1 3.65Å; P954-L974 HydrophobicContact CG-CD1 4.06Å; F955-L974 HydrophobicContact CE1-CB 4.05Å; F955-L974 HydrophobicContact CE1-CD1 4.48Å; F955-L974 HydrophobicContact CZ-CB 4.17Å; F955-L974 HydrophobicContact CZ-CD1 4.08Å; W970-L974 VanDerWaalsContact O-CB 3.3Å; W970-L974 WeakPolarHBondContact O-CB 3.4Å; W970-L974 PolarHBondContact O-N 2.86Å; L974-I990 HydrophobicContact CD1-CG2 4.44Å; L974-C994 HydrophobicContact CD2-CB 3.6Å
975	Q	90.6	Very high	92.2	Very high	137 Å²	137	77.7 Å²	77.7	64%	0.64	41%	0.407	S	S	*	.			trans	-131.6	128.7	-179.4	-58.4	-174.4	20.2	0	0	110.1	S972 T973	S972-Q975 PolarHBondContact O-NE2 3.3Å; T973-Q975 PolarHBondContact O-N 3.3Å
976	V	90.3	Very high	92.4	Very high	48 Å²	48	73.1 Å²	73.1	29%	0.291	38%	0.383	S	S	.	.			trans	-74.4	126.1	171	-179.8	0	0	0	0	108	F946 V980 L982 V987	F946-V976 HydrophobicContact CE2-CG2 4.09Å; V976-V980 HydrophobicContact CG1-CB 4.41Å; V976-L982 HydrophobicContact CG1-CD1 3.75Å; V976-L982 HydrophobicContact CG1-CG 4.02Å; V976-L982 HydrophobicContact CG2-CD1 4.03Å; V976-V987 HydrophobicContact CG2-CG2 4.46Å
977	P	89.4	Confident	92.5	Very high	25 Å²	25	73.8 Å²	73.8	16%	0.162	39%	0.392	C	S	.	.			trans	-63.1	132.7	-179.2	-22	33.4	0	0	0	111.4	V950 Q979 V980	V950-P977 HydrophobicContact CG1-CG 3.91Å; P977-Q979 VanDerWaalsContact CB-CD 3.48Å; P977-Q979 HydrophobicContact CB-CG 4.47Å; P977-Q979 PolarHBondContact O-N 2.82Å; P977-V980 HydrophobicContact CB-CG2 4.3Å; P977-V980 PolarHBondContact O-N 3.38Å
978	P	84.9	Confident	92.6	Very high	133 Å²	133	76.4 Å²	76.4	86%	0.864	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.8	-172.5	-28.3	35.7	0	0	0	116.2	V980	P978-V980 VanDerWaalsContact C-N 3.33Å
979	Q	86.2	Confident	92.8	Very high	153 Å²	153	73.2 Å²	73.2	72%	0.715	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.5	174.4	67	-84.7	20.9	0	0	114	P977	P977-Q979 VanDerWaalsContact CB-CD 3.48Å; P977-Q979 HydrophobicContact CB-CG 4.47Å; P977-Q979 PolarHBondContact O-N 2.82Å
980	V	88.6	Confident	93	Very high	40 Å²	40	69.7 Å²	69.7	24%	0.242	37%	0.371	C	S	.	.			trans	-96	116.7	-179.2	-172	0	0	0	0	109.9	V950 V976 P977 P978 L982	V950-V980 HydrophobicContact CG1-CG2 4.38Å; V950-V980 HydrophobicContact CG2-CG1 4.37Å; V976-V980 HydrophobicContact CG1-CB 4.41Å; P977-V980 HydrophobicContact CB-CG2 4.3Å; P977-V980 PolarHBondContact O-N 3.38Å; P978-V980 VanDerWaalsContact C-N 3.33Å; V980-L982 HydrophobicContact CG1-CD2 3.58Å; V980-L982 HydrophobicContact CG1-CG 4Å; V980-L982 PolarHBondContact O-N 3.44Å
981	K	88.1	Confident	93	Very high	203 Å²	203	69.1 Å²	69.1	88%	0.883	38%	0.379	S	S	*	.			trans	-92	91.1	179.1	-64.8	179.4	-177.7	176.3	0	110.3
982	L	92.7	Very high	93.2	Very high	33 Å²	33	66.6 Å²	66.6	17%	0.173	36%	0.362	C	S	.	.			trans	-88.2	153.4	172.9	-56.8	-171.2	0	0	0	111.4	L949 V950 V976 V980 V987 I990	L949-L982 HydrophobicContact CB-CD1 4.47Å; L949-L982 HydrophobicContact CB-CD2 3.73Å; L949-L982 HydrophobicContact CD1-CD2 4.29Å; L949-L982 HydrophobicContact CG-CD2 4.49Å; V950-L982 HydrophobicContact CG2-CD1 4.31Å; V976-L982 HydrophobicContact CG1-CD1 3.75Å; V976-L982 HydrophobicContact CG1-CG 4.02Å; V976-L982 HydrophobicContact CG2-CD1 4.03Å; V980-L982 HydrophobicContact CG1-CD2 3.58Å; V980-L982 HydrophobicContact CG1-CG 4Å; V980-L982 PolarHBondContact O-N 3.44Å; L982-V987 HydrophobicContact CB-CG2 3.87Å; L982-V987 HydrophobicContact CD1-CG2 4.37Å; L982-I990 HydrophobicContact CD1-CD1 4.37Å
983	S	95.2	Very high	93.3	Very high	21 Å²	21	63 Å²	63	15%	0.147	34%	0.337	C	S	.	.			trans	-64.2	150	168.5	65.3	0	0	0	0	111.5	E806 E985 S986 V987	E806-S983 WeakPolarHBondContact OE1-CB 3.38Å; E806-S983 PolarHBondContact OE1-OG 2.9Å; E806-S983 VanDerWaalsContact OE2-CB 3.26Å; E806-S983 WeakPolarHBondContact OE2-CB 3.32Å; E806-S983 PolarHBondContact OE2-OG 3.49Å; S983-E985 PolarHBondContact O-N 3.33Å; S983-S986 WeakPolarHBondContact O-CB 3.49Å; S983-S986 PolarHBondContact O-N 3.11Å; S983-S986 VanDerWaalsContact O-N 3.11Å; S983-S986 VanDerWaalsContact OG-CB 3.3Å; S983-S986 WeakPolarHBondContact OG-CB 3.44Å; S983-S986 PolarHBondContact OG-N 3.25Å; S983-S986 PolarHBondContact OG-OG 3.39Å; S983-V987 PolarHBondContact O-N 3.27Å; S983-V987 VanDerWaalsContact O-N 3.12Å
984	P	95.3	Very high	93.5	Very high	98 Å²	98	61 Å²	61	64%	0.636	33%	0.325	S	S	*	.	H	α-helix	trans	-51.6	-38.9	171.2	-26.4	34.8	0	0	0	112.5	V987 D988	P984-V987 PolarHBondContact O-N 3.41Å; P984-D988 VanDerWaalsContact O-CB 3.24Å; P984-D988 WeakPolarHBondContact O-CB 3.39Å; P984-D988 PolarHBondContact O-N 2.86Å
985	E	96.4	Very high	93.5	Very high	81 Å²	81	59.7 Å²	59.7	38%	0.379	32%	0.319	S	S	.	.	H	α-helix	trans	-66.8	-36.6	-179.9	-63.4	68.1	-150.2	0	0	112.3	S983 I989 P1013 F1014	S983-E985 PolarHBondContact O-N 3.33Å; E985-I989 WeakPolarHBondContact O-CG2 3.47Å; E985-I989 PolarHBondContact O-N 3.4Å; E985-P1013 HydrophobicContact CG-CB 4.16Å; E985-F1014 HydrophobicContact CB-CB 4.23Å
986	S	96.2	Very high	93.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.8	-44.3	172.9	-69.4	0	0	0	0	112.2	E806 S983 I989 I990 F1014	E806-S986 PolarHBondContact OE1-OG 3.42Å; E806-S986 VanDerWaalsContact OE1-OG 3.08Å; E806-S986 PolarHBondContact OE2-OG 3.36Å; S983-S986 WeakPolarHBondContact O-CB 3.49Å; S983-S986 PolarHBondContact O-N 3.11Å; S983-S986 VanDerWaalsContact O-N 3.11Å; S983-S986 VanDerWaalsContact OG-CB 3.3Å; S983-S986 WeakPolarHBondContact OG-CB 3.44Å; S983-S986 PolarHBondContact OG-N 3.25Å; S983-S986 PolarHBondContact OG-OG 3.39Å; S986-I989 WeakPolarHBondContact O-CG2 3.16Å; S986-I990 WeakPolarHBondContact O-CB 3.3Å; S986-I990 WeakPolarHBondContact O-CD1 3.25Å; S986-I990 VanDerWaalsContact O-CG1 3.23Å; S986-I990 WeakPolarHBondContact O-CG1 3.3Å; S986-I990 PolarHBondContact O-N 3.49Å; S986-I990 VanDerWaalsContact O-N 3.08Å; S986-F1014 WeakPolarHBondContact OG-CE2 3.39Å
987	V	95.9	Very high	93.6	Very high	67 Å²	67	52.8 Å²	52.8	41%	0.406	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-41.9	178.5	-179.9	0	0	0	0	110.6	V976 L982 S983 P984 G991	V976-V987 HydrophobicContact CG2-CG2 4.46Å; L982-V987 HydrophobicContact CB-CG2 3.87Å; L982-V987 HydrophobicContact CD1-CG2 4.37Å; S983-V987 PolarHBondContact O-N 3.27Å; S983-V987 VanDerWaalsContact O-N 3.12Å; P984-V987 PolarHBondContact O-N 3.41Å; V987-G991 PolarHBondContact O-N 3.49Å
988	D	96.7	Very high	93.5	Very high	56 Å²	56	59 Å²	59	30%	0.299	32%	0.316	S	S	.	.	H	α-helix	trans	-65.2	-44.6	179	-174.2	48.9	0	0	0	112.3	P984 G991 R992 H1012	P984-D988 VanDerWaalsContact O-CB 3.24Å; P984-D988 WeakPolarHBondContact O-CB 3.39Å; P984-D988 PolarHBondContact O-N 2.86Å; D988-G991 PolarHBondContact O-N 3.16Å; D988-R992 WeakPolarHBondContact O-CB 3.08Å; D988-R992 VanDerWaalsContact O-CG 3.25Å; D988-R992 WeakPolarHBondContact O-CG 3.28Å; D988-R992 PolarHBondContact O-N 2.88Å; D988-R992 IonicContact OD1-CZ 3.66Å; D988-R992 IonicContact OD1-NE 2.83Å; D988-R992 PolarHBondContact OD1-NE 3.3Å; D988-R992 IonicContact OD1-NH2 2.94Å; D988-R992 PolarHBondContact OD1-NH2 3.11Å; D988-R992 IonicContact OD2-CZ 3.63Å; D988-R992 IonicContact OD2-NE 2.64Å; D988-R992 PolarHBondContact OD2-NE 2.92Å; D988-R992 IonicContact OD2-NH1 2.88Å; D988-R992 PolarHBondContact OD2-NH1 3.43Å; D988-R992 IonicContact OD2-NH2 3.49Å; D988-R992 PolarHBondContact OD2-NH2 3.19Å; D988-H1012 IonicContact OD2-CE1 2.63Å; D988-H1012 PolarHBondContact OD2-CE1 3.33Å; D988-H1012 IonicContact OD2-NE2 2.78Å; D988-H1012 PolarHBondContact OD2-NE2 2.87Å
989	I	97.4	Very high	93.8	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-68.5	-39.6	176.7	-165.2	172.9	0	0	0	112.5	L945 E985 S986 G991 R992 L993 H1012 F1014 F1015	L945-I989 HydrophobicContact CD2-CG2 3.48Å; L945-I989 VanDerWaalsContact CD2-CG2 3.48Å; E985-I989 WeakPolarHBondContact O-CG2 3.47Å; E985-I989 PolarHBondContact O-N 3.4Å; S986-I989 WeakPolarHBondContact O-CG2 3.16Å; I989-G991 VanDerWaalsContact C-N 3.35Å; I989-R992 PolarHBondContact O-N 3.14Å; I989-L993 HydrophobicContact CD1-CD1 4.39Å; I989-L993 HydrophobicContact CG1-CD1 3.94Å; I989-L993 HydrophobicContact CG1-CG 4.32Å; I989-L993 WeakPolarHBondContact O-CG 3.37Å; I989-L993 PolarHBondContact O-N 3.27Å; I989-H1012 HydrophobicContact CD1-CB 4.14Å; I989-H1012 PolarHBondContact N-CE1 3.32Å; I989-F1014 HydrophobicContact CB-CB 4.22Å; I989-F1014 HydrophobicContact CB-CG 4.48Å; I989-F1014 HydrophobicContact CD1-CB 4.12Å; I989-F1014 HydrophobicContact CD1-CD1 3.71Å; I989-F1014 HydrophobicContact CD1-CG 4.19Å; I989-F1014 HydrophobicContact CG2-CB 4.07Å; I989-F1014 HydrophobicContact CG2-CD1 4.11Å; I989-F1014 HydrophobicContact CG2-CD2 4.16Å; I989-F1014 HydrophobicContact CG2-CG 3.85Å; I989-F1015 HydrophobicContact CD1-CD2 4.24Å; I989-F1015 HydrophobicContact CD1-CE2 3.37Å; I989-F1015 HydrophobicContact CD1-CZ 3.7Å
990	I	97.4	Very high	94.2	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-47.4	175.3	-71.2	166.9	0	0	0	109.5	L945 F946 L949 L974 L982 S986 R992 L993 C994	L945-I990 HydrophobicContact CB-CG1 4.41Å; L945-I990 HydrophobicContact CD2-CG1 4.03Å; L945-I990 HydrophobicContact CG-CD1 4.24Å; L945-I990 HydrophobicContact CG-CG1 3.95Å; F946-I990 HydrophobicContact CB-CD1 4.06Å; F946-I990 HydrophobicContact CB-CG2 4.34Å; F946-I990 HydrophobicContact CD2-CD1 4.37Å; F946-I990 HydrophobicContact CD2-CG2 4.18Å; L949-I990 HydrophobicContact CD1-CD1 4.36Å; L974-I990 HydrophobicContact CD1-CG2 4.44Å; L982-I990 HydrophobicContact CD1-CD1 4.37Å; S986-I990 WeakPolarHBondContact O-CB 3.3Å; S986-I990 WeakPolarHBondContact O-CD1 3.25Å; S986-I990 VanDerWaalsContact O-CG1 3.23Å; S986-I990 WeakPolarHBondContact O-CG1 3.3Å; S986-I990 PolarHBondContact O-N 3.49Å; S986-I990 VanDerWaalsContact O-N 3.08Å; I990-R992 VanDerWaalsContact C-N 3.28Å; I990-R992 PolarHBondContact O-N 2.65Å; I990-L993 PolarHBondContact O-N 2.93Å; I990-C994 WeakPolarHBondContact O-CB 3.4Å; I990-C994 PolarHBondContact O-N 3.49Å
991	G	95.9	Very high	94.4	Very high	33 Å²	33	52.3 Å²	52.3	34%	0.34	27%	0.271	S	S	.	.	H	α-helix	trans	-59.4	-35.5	177.9	0	0	0	0	0	113.6	V987 D988 I989 C995	V987-G991 PolarHBondContact O-N 3.49Å; D988-G991 PolarHBondContact O-N 3.16Å; I989-G991 VanDerWaalsContact C-N 3.35Å; G991-C995 WeakPolarHBondContact O-CB 3.46Å
992	R	96.6	Very high	94.5	Very high	107 Å²	107	42.6 Å²	42.6	40%	0.404	23%	0.229	S	C	.	.	H	α-helix	trans	-86.5	-8.8	179.8	-65.9	174.1	-168.3	-178.8	-0.2	115.2	D988 I989 I990 C995 L1001 H1012	D988-R992 WeakPolarHBondContact O-CB 3.08Å; D988-R992 VanDerWaalsContact O-CG 3.25Å; D988-R992 WeakPolarHBondContact O-CG 3.28Å; D988-R992 PolarHBondContact O-N 2.88Å; D988-R992 IonicContact OD1-CZ 3.66Å; D988-R992 IonicContact OD1-NE 2.83Å; D988-R992 PolarHBondContact OD1-NE 3.3Å; D988-R992 IonicContact OD1-NH2 2.94Å; D988-R992 PolarHBondContact OD1-NH2 3.11Å; D988-R992 IonicContact OD2-CZ 3.63Å; D988-R992 IonicContact OD2-NE 2.64Å; D988-R992 PolarHBondContact OD2-NE 2.92Å; D988-R992 IonicContact OD2-NH1 2.88Å; D988-R992 PolarHBondContact OD2-NH1 3.43Å; D988-R992 IonicContact OD2-NH2 3.49Å; D988-R992 PolarHBondContact OD2-NH2 3.19Å; I989-R992 PolarHBondContact O-N 3.14Å; I990-R992 VanDerWaalsContact C-N 3.28Å; I990-R992 PolarHBondContact O-N 2.65Å; R992-C995 PolarHBondContact O-SG 2.97Å; R992-L1001 HydrophobicContact CB-CD1 3.47Å; R992-L1001 VanDerWaalsContact CB-CD1 3.47Å; R992-L1001 HydrophobicContact CB-CG 3.82Å; R992-L1001 HydrophobicContact CG-CD1 4.37Å; R992-L1001 PolarHBondContact O-N 3.46Å; R992-H1012 WeakPolarHBondContact CD-NE2 3.25Å; R992-H1012 PolarHBondContact NH1-NE2 3.02Å
993	L	97.1	Very high	94.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-98.6	-37.3	169.8	-70.3	173	0	0	0	111.5	W938 V941 I989 I990 C995 R1000 L1001 I1009	W938-L993 HydrophobicContact CB-CD2 4.22Å; V941-L993 HydrophobicContact CG1-CD1 4.19Å; I989-L993 HydrophobicContact CD1-CD1 4.39Å; I989-L993 HydrophobicContact CG1-CD1 3.94Å; I989-L993 HydrophobicContact CG1-CG 4.32Å; I989-L993 WeakPolarHBondContact O-CG 3.37Å; I989-L993 PolarHBondContact O-N 3.27Å; I990-L993 PolarHBondContact O-N 2.93Å; L993-C995 VanDerWaalsContact C-N 3.35Å; L993-C995 PolarHBondContact O-N 3.4Å; L993-R1000 WeakPolarHBondContact O-CD 3.35Å; L993-R1000 VanDerWaalsContact O-CG 3.32Å; L993-R1000 WeakPolarHBondContact O-CG 3.35Å; L993-R1000 PolarHBondContact O-NE 2.85Å; L993-L1001 HydrophobicContact CD2-CB 4.24Å; L993-I1009 HydrophobicContact CD2-CD1 4.1Å; L993-I1009 HydrophobicContact CD2-CG1 4.26Å
994	C	96.7	Very high	93.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-95.3	47.2	179.8	-64.7	0	0	0	0	112.8	W939 W970 L974 I990	W939-C994 HydrophobicContact CE3-CB 4.34Å; W939-C994 HydrophobicContact CH2-CB 4.36Å; W939-C994 HydrophobicContact CZ3-CB 4.19Å; W939-C994 WeakPolarHBondContact CZ3-O 3.44Å; W970-C994 WeakPolarHBondContact CZ3-O 3.3Å; L974-C994 HydrophobicContact CD2-CB 3.6Å; I990-C994 WeakPolarHBondContact O-CB 3.4Å; I990-C994 PolarHBondContact O-N 3.49Å
995	C	94.9	Very high	93.4	Very high	13 Å²	13	45.5 Å²	45.5	9%	0.088	25%	0.249	C	C	.	.	S	Bend	trans	-123.3	-169.5	178	62.9	0	0	0	0	113.7	W939 W970 G991 R992 L993 R1000	W939-C995 WeakPolarHBondContact CZ3-O 3.43Å; W970-C995 HydrophobicContact CH2-CB 3.75Å; W970-C995 HydrophobicContact CZ2-CB 4.39Å; W970-C995 HydrophobicContact CZ3-CB 4Å; G991-C995 WeakPolarHBondContact O-CB 3.46Å; R992-C995 PolarHBondContact O-SG 2.97Å; L993-C995 VanDerWaalsContact C-N 3.35Å; L993-C995 PolarHBondContact O-N 3.4Å; C995-R1000 PolarHBondContact O-NE 2.93Å; C995-R1000 PolarHBondContact O-NH2 2.9Å; C995-R1000 VanDerWaalsContact SG-CA 3.58Å
996	S	92.3	Very high	93.3	Very high	23 Å²	23	41.9 Å²	41.9	16%	0.161	23%	0.233	C	C	.	.			trans	-48.8	149.5	173.6	73.3	0	0	0	0	111.6	E998 E999 R1000	S996-E998 PolarHBondContact O-N 3.05Å; S996-E999 PolarHBondContact O-N 3.24Å; S996-E999 VanDerWaalsContact OG-CB 3.28Å; S996-E999 WeakPolarHBondContact OG-CB 3.46Å; S996-E999 WeakPolarHBondContact OG-CG 3.36Å; S996-E999 PolarHBondContact OG-N 3.32Å; S996-E999 PolarHBondContact OG-OE2 2.84Å; S996-R1000 WeakPolarHBondContact O-CB 3.3Å; S996-R1000 PolarHBondContact O-N 2.94Å
997	A	90.8	Very high	93.1	Very high	18 Å²	18	44.1 Å²	44.1	15%	0.149	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-20	-176.4	0	0	0	0	0	112.3	E924 L935	E924-A997 HydrophobicContact CB-CB 4.5Å; E924-A997 HydrophobicContact CG-CB 4.32Å; L935-A997 VanDerWaalsContact CD1-O 3.26Å; L935-A997 WeakPolarHBondContact CD1-O 3.26Å
998	E	87.8	Confident	93	Very high	156 Å²	156	43.8 Å²	43.8	73%	0.729	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-30.1	-177.8	-64	71.9	-163.1	0	0	112.8	S996	S996-E998 PolarHBondContact O-N 3.05Å
999	E	90.6	Very high	93	Very high	153 Å²	153	41.1 Å²	41.1	72%	0.715	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-3.2	-177.2	-57.2	164.5	128.9	0	0	112.9	S996	S996-E999 PolarHBondContact O-N 3.24Å; S996-E999 VanDerWaalsContact OG-CB 3.28Å; S996-E999 WeakPolarHBondContact OG-CB 3.46Å; S996-E999 WeakPolarHBondContact OG-CG 3.36Å; S996-E999 PolarHBondContact OG-N 3.32Å; S996-E999 PolarHBondContact OG-OE2 2.84Å
1000	R	95.4	Very high	92.9	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.008	24%	0.244	C	C	.	.			trans	-64.6	134.8	-176.9	-153.6	173	-64.8	154.2	1.6	112.7	E924 L935 L993 C995 S996 G1002 A1003	E924-R1000 IonicContact OE1-CZ 2.78Å; E924-R1000 IonicContact OE1-NH1 2.72Å; E924-R1000 PolarHBondContact OE1-NH1 2.86Å; E924-R1000 IonicContact OE1-NH2 3.15Å; E924-R1000 IonicContact OE2-CZ 2.93Å; E924-R1000 IonicContact OE2-NH1 3.41Å; E924-R1000 IonicContact OE2-NH2 3.02Å; E924-R1000 PolarHBondContact OE2-NH2 2.73Å; L935-R1000 PolarHBondContact O-NH1 3.44Å; L993-R1000 WeakPolarHBondContact O-CD 3.35Å; L993-R1000 VanDerWaalsContact O-CG 3.32Å; L993-R1000 WeakPolarHBondContact O-CG 3.35Å; L993-R1000 PolarHBondContact O-NE 2.85Å; C995-R1000 PolarHBondContact O-NE 2.93Å; C995-R1000 PolarHBondContact O-NH2 2.9Å; C995-R1000 VanDerWaalsContact SG-CA 3.58Å; S996-R1000 WeakPolarHBondContact O-CB 3.3Å; S996-R1000 PolarHBondContact O-N 2.94Å; R1000-G1002 PolarHBondContact O-N 3.31Å; R1000-A1003 VanDerWaalsContact O-CB 3.3Å; R1000-A1003 WeakPolarHBondContact O-CB 3.38Å; R1000-A1003 PolarHBondContact O-N 3.28Å; R1000-A1003 VanDerWaalsContact O-N 3.16Å
1001	L	93.3	Very high	92.8	Very high	29 Å²	29	46.7 Å²	46.7	15%	0.152	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	136.9	169.9	-69.4	169.3	0	0	0	110.6	R992 L993 E1008 I1009	R992-L1001 HydrophobicContact CB-CD1 3.47Å; R992-L1001 VanDerWaalsContact CB-CD1 3.47Å; R992-L1001 HydrophobicContact CB-CG 3.82Å; R992-L1001 HydrophobicContact CG-CD1 4.37Å; R992-L1001 PolarHBondContact O-N 3.46Å; L993-L1001 HydrophobicContact CD2-CB 4.24Å; L1001-E1008 HydrophobicContact CD2-CB 3.92Å; L1001-I1009 HydrophobicContact CB-CG1 3.75Å
1002	G	89.5	Confident	92.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	-4	-173.5	0	0	0	0	0	113.5	L935 R1000 N1004 G1005 E1008	L935-G1002 VanDerWaalsContact CD2-O 3.25Å; L935-G1002 WeakPolarHBondContact CD2-O 3.5Å; R1000-G1002 PolarHBondContact O-N 3.31Å; G1002-N1004 VanDerWaalsContact C-N 3.3Å; G1002-N1004 PolarHBondContact O-N 3.32Å; G1002-G1005 WeakPolarHBondContact O-CA 3.46Å; G1002-G1005 PolarHBondContact O-N 3.01Å; G1002-E1008 WeakPolarHBondContact CA-OE2 3.45Å; G1002-E1008 PolarHBondContact N-OE2 3.24Å
1003	A	86.9	Confident	92.9	Very high	44 Å²	44	43.6 Å²	43.6	36%	0.364	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-43.2	170.6	0	0	0	0	0	112.3	L935 R1000 G1005 E1008	L935-A1003 HydrophobicContact CD1-CB 4.21Å; R1000-A1003 VanDerWaalsContact O-CB 3.3Å; R1000-A1003 WeakPolarHBondContact O-CB 3.38Å; R1000-A1003 PolarHBondContact O-N 3.28Å; R1000-A1003 VanDerWaalsContact O-N 3.16Å; A1003-G1005 VanDerWaalsContact C-N 3.32Å; A1003-E1008 PolarHBondContact N-OE2 3.44Å; A1003-E1008 VanDerWaalsContact N-OE2 3.1Å
1004	N	86.5	Confident	92.9	Very high	145 Å²	145	43.7 Å²	43.7	78%	0.775	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	17.7	173.4	-54.6	-74.2	0	0	0	112.6	G1002 E1008	G1002-N1004 VanDerWaalsContact C-N 3.3Å; G1002-N1004 PolarHBondContact O-N 3.32Å; N1004-E1008 HydrophobicContact CB-CG 4.43Å; N1004-E1008 WeakPolarHBondContact CB-OE1 3.29Å; N1004-E1008 PolarHBondContact N-OE2 2.89Å; N1004-E1008 PolarHBondContact ND2-OE1 3.14Å
1005	G	87.8	Confident	92.9	Very high	23 Å²	23	43.9 Å²	43.9	24%	0.237	26%	0.263	C	S	.	.			trans	97.8	163.9	-179.4	0	0	0	0	0	113.9	G1002 A1003 G1007 E1008	G1002-G1005 WeakPolarHBondContact O-CA 3.46Å; G1002-G1005 PolarHBondContact O-N 3.01Å; A1003-G1005 VanDerWaalsContact C-N 3.32Å; G1005-G1007 PolarHBondContact O-N 3.07Å; G1005-E1008 PolarHBondContact O-N 3.19Å
1006	A	92.8	Very high	92.7	Very high	6 Å²	6	48.2 Å²	48.2	5%	0.05	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-6.1	-169.9	0	0	0	0	0	116	T817 E821 W938 E1008 I1009 K1010	T817-A1006 HydrophobicContact CG2-CB 4.2Å; E821-A1006 HydrophobicContact CB-CB 3.87Å; E821-A1006 HydrophobicContact CG-CB 3.71Å; W938-A1006 HydrophobicContact CH2-CB 3.96Å; W938-A1006 HydrophobicContact CZ2-CB 3.82Å; A1006-E1008 PolarHBondContact O-N 2.91Å; A1006-I1009 PolarHBondContact O-N 3.19Å; A1006-K1010 VanDerWaalsContact O-CG 3.28Å; A1006-K1010 WeakPolarHBondContact O-CG 3.31Å; A1006-K1010 PolarHBondContact O-N 3.01Å
1007	G	92.8	Very high	92.5	Very high	46 Å²	46	53.4 Å²	53.4	47%	0.474	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-33.8	172	0	0	0	0	0	113	G1005 K1010 A1011	G1005-G1007 PolarHBondContact O-N 3.07Å; G1007-K1010 PolarHBondContact O-N 3.1Å; G1007-A1011 WeakPolarHBondContact O-CB 3.49Å; G1007-A1011 PolarHBondContact O-N 3.39Å
1008	E	94.8	Very high	92.5	Very high	60 Å²	60	53.9 Å²	53.9	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-64.5	-41.2	176.4	-59.9	175.9	133.1	0	0	111.8	L1001 G1002 A1003 N1004 G1005 A1006	L1001-E1008 HydrophobicContact CD2-CB 3.92Å; G1002-E1008 WeakPolarHBondContact CA-OE2 3.45Å; G1002-E1008 PolarHBondContact N-OE2 3.24Å; A1003-E1008 PolarHBondContact N-OE2 3.44Å; A1003-E1008 VanDerWaalsContact N-OE2 3.1Å; N1004-E1008 HydrophobicContact CB-CG 4.43Å; N1004-E1008 WeakPolarHBondContact CB-OE1 3.29Å; N1004-E1008 PolarHBondContact N-OE2 2.89Å; N1004-E1008 PolarHBondContact ND2-OE1 3.14Å; G1005-E1008 PolarHBondContact O-N 3.19Å; A1006-E1008 PolarHBondContact O-N 2.91Å
1009	I	96.1	Very high	92.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.5	-47.8	177.1	-59.7	171.2	0	0	0	109.6	T817 W938 L993 L1001 A1006 A1011 H1012 F1015	T817-I1009 HydrophobicContact CG2-CB 4.18Å; T817-I1009 HydrophobicContact CG2-CG2 3.81Å; W938-I1009 HydrophobicContact CD2-CD1 3.4Å; W938-I1009 HydrophobicContact CE3-CD1 3.4Å; W938-I1009 VanDerWaalsContact CE3-CD1 3.4Å; W938-I1009 HydrophobicContact CG-CD1 3.89Å; W938-I1009 HydrophobicContact CH2-CD1 4.18Å; W938-I1009 HydrophobicContact CZ2-CD1 4.16Å; W938-I1009 HydrophobicContact CZ3-CD1 3.81Å; L993-I1009 HydrophobicContact CD2-CD1 4.1Å; L993-I1009 HydrophobicContact CD2-CG1 4.26Å; L1001-I1009 HydrophobicContact CB-CG1 3.75Å; A1006-I1009 PolarHBondContact O-N 3.19Å; I1009-A1011 PolarHBondContact O-N 3.1Å; I1009-H1012 VanDerWaalsContact O-CB 3.22Å; I1009-H1012 WeakPolarHBondContact O-CB 3.36Å; I1009-H1012 PolarHBondContact O-N 3.42Å; I1009-H1012 VanDerWaalsContact O-N 3.07Å; I1009-F1015 HydrophobicContact CG2-CE2 3.8Å; I1009-F1015 HydrophobicContact CG2-CZ 4.29Å; I1009-F1015 WeakPolarHBondContact O-CD2 3.32Å; I1009-F1015 WeakPolarHBondContact O-CE2 3.26Å
1010	K	95.4	Very high	92.5	Very high	42 Å²	42	44.6 Å²	44.6	18%	0.183	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-27.2	179.5	-68.5	169.7	-175.9	176.5	0	113.7	T817 E821 A1006 G1007 H1012 F1020	T817-K1010 HydrophobicContact CG2-CG 4.07Å; E821-K1010 IonicContact OE1-NZ 3.63Å; E821-K1010 PolarHBondContact OE1-NZ 3.46Å; E821-K1010 IonicContact OE2-NZ 2.91Å; E821-K1010 PolarHBondContact OE2-NZ 3Å; A1006-K1010 VanDerWaalsContact O-CG 3.28Å; A1006-K1010 WeakPolarHBondContact O-CG 3.31Å; A1006-K1010 PolarHBondContact O-N 3.01Å; G1007-K1010 PolarHBondContact O-N 3.1Å; K1010-H1012 VanDerWaalsContact C-N 3.29Å; K1010-F1020 HydrophobicContact CB-CD2 3.71Å; K1010-F1020 HydrophobicContact CB-CE2 3.73Å; K1010-F1020 HydrophobicContact CB-CG 4.17Å; K1010-F1020 HydrophobicContact CB-CZ 4.22Å; K1010-F1020 HydrophobicContact CD-CB 4.42Å; K1010-F1020 HydrophobicContact CD-CD1 4.21Å; K1010-F1020 HydrophobicContact CD-CG 4.17Å; K1010-F1020 HydrophobicContact CG-CD1 3.94Å; K1010-F1020 HydrophobicContact CG-CD2 3.93Å; K1010-F1020 HydrophobicContact CG-CE1 3.91Å; K1010-F1020 HydrophobicContact CG-CE2 3.9Å; K1010-F1020 HydrophobicContact CG-CG 3.94Å; K1010-F1020 HydrophobicContact CG-CZ 3.89Å; K1010-F1020 WeakPolarHBondContact O-CE2 3.38Å
1011	A	95.3	Very high	91.8	Very high	81 Å²	81	49.8 Å²	49.8	67%	0.669	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	2	177.2	0	0	0	0	0	114	G1007 I1009	G1007-A1011 WeakPolarHBondContact O-CB 3.49Å; G1007-A1011 PolarHBondContact O-N 3.39Å; I1009-A1011 PolarHBondContact O-N 3.1Å
1012	H	97.2	Very high	90.8	Very high	6 Å²	6	50.9 Å²	50.9	3%	0.028	32%	0.321	C	S	.	.	S	Bend	trans	-70.2	139.4	-177.8	-152.4	-93.5	0	0	0	112.2	D988 I989 R992 I1009 K1010 F1014 F1015	D988-H1012 IonicContact OD2-CE1 2.63Å; D988-H1012 PolarHBondContact OD2-CE1 3.33Å; D988-H1012 IonicContact OD2-NE2 2.78Å; D988-H1012 PolarHBondContact OD2-NE2 2.87Å; I989-H1012 HydrophobicContact CD1-CB 4.14Å; I989-H1012 PolarHBondContact N-CE1 3.32Å; R992-H1012 WeakPolarHBondContact CD-NE2 3.25Å; R992-H1012 PolarHBondContact NH1-NE2 3.02Å; I1009-H1012 VanDerWaalsContact O-CB 3.22Å; I1009-H1012 WeakPolarHBondContact O-CB 3.36Å; I1009-H1012 PolarHBondContact O-N 3.42Å; I1009-H1012 VanDerWaalsContact O-N 3.07Å; K1010-H1012 VanDerWaalsContact C-N 3.29Å; H1012-F1014 PolarHBondContact O-N 3.25Å; H1012-F1015 HydrophobicContact CB-CD2 3.97Å; H1012-F1015 HydrophobicContact CB-CE2 4.3Å; H1012-F1015 PolarHBondContact O-N 2.6Å
1013	P	96.9	Very high	90.3	Very high	68 Å²	68	53.8 Å²	53.8	44%	0.442	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-53.6	-27.9	177.7	-30.2	36.7	0	0	0	115.2	E985 F1015 S1016	E985-P1013 HydrophobicContact CG-CB 4.16Å; P1013-F1015 PolarHBondContact O-N 2.89Å; P1013-S1016 WeakPolarHBondContact O-CB 3.33Å; P1013-S1016 PolarHBondContact O-N 3.29Å; P1013-S1016 PolarHBondContact O-OG 3.45Å
1014	F	96.9	Very high	90.3	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.009	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-56.5	-25.8	172.7	177.3	-103.1	0	0	0	113.8	E806 R810 L945 E985 S986 I989 H1012	E806-F1014 HydrophobicContact CG-CE2 3.94Å; R810-F1014 HydrophobicContact CB-CE1 4.05Å; R810-F1014 HydrophobicContact CB-CE2 4.45Å; R810-F1014 HydrophobicContact CB-CZ 3.79Å; R810-F1014 WeakPolarHBondContact CD-O 3.35Å; R810-F1014 HydrophobicContact CG-CE1 4.1Å; R810-F1014 HydrophobicContact CG-CZ 4.23Å; R810-F1014 WeakPolarHBondContact CG-O 3.41Å; R810-F1014 PolarHBondContact NE-O 3.01Å; L945-F1014 HydrophobicContact CD1-CE1 4.36Å; L945-F1014 HydrophobicContact CD1-CZ 3.81Å; L945-F1014 HydrophobicContact CD2-CE1 4.08Å; L945-F1014 HydrophobicContact CD2-CZ 4.14Å; E985-F1014 HydrophobicContact CB-CB 4.23Å; S986-F1014 WeakPolarHBondContact OG-CE2 3.39Å; I989-F1014 HydrophobicContact CB-CB 4.22Å; I989-F1014 HydrophobicContact CB-CG 4.48Å; I989-F1014 HydrophobicContact CD1-CB 4.12Å; I989-F1014 HydrophobicContact CD1-CD1 3.71Å; I989-F1014 HydrophobicContact CD1-CG 4.19Å; I989-F1014 HydrophobicContact CG2-CB 4.07Å; I989-F1014 HydrophobicContact CG2-CD1 4.11Å; I989-F1014 HydrophobicContact CG2-CD2 4.16Å; I989-F1014 HydrophobicContact CG2-CG 3.85Å; H1012-F1014 PolarHBondContact O-N 3.25Å
1015	F	96.4	Very high	90.4	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.022	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-105.8	18.9	175.7	-53.4	-71.7	0	0	0	113.3	R810 I813 A814 I989 I1009 H1012 P1013 E1017 V1018 F1020	R810-F1015 HydrophobicContact CG-CD1 4.26Å; I813-F1015 HydrophobicContact CB-CE1 4.5Å; I813-F1015 HydrophobicContact CG2-CE1 4.22Å; I813-F1015 HydrophobicContact CG2-CZ 3.93Å; A814-F1015 HydrophobicContact CB-CD1 4.06Å; A814-F1015 HydrophobicContact CB-CE1 4.02Å; I989-F1015 HydrophobicContact CD1-CD2 4.24Å; I989-F1015 HydrophobicContact CD1-CE2 3.37Å; I989-F1015 HydrophobicContact CD1-CZ 3.7Å; I1009-F1015 HydrophobicContact CG2-CE2 3.8Å; I1009-F1015 HydrophobicContact CG2-CZ 4.29Å; I1009-F1015 WeakPolarHBondContact O-CD2 3.32Å; I1009-F1015 WeakPolarHBondContact O-CE2 3.26Å; H1012-F1015 HydrophobicContact CB-CD2 3.97Å; H1012-F1015 HydrophobicContact CB-CE2 4.3Å; H1012-F1015 PolarHBondContact O-N 2.6Å; P1013-F1015 PolarHBondContact O-N 2.89Å; F1015-E1017 PolarHBondContact O-N 2.94Å; F1015-E1017 VanDerWaalsContact O-N 3.09Å; F1015-V1018 HydrophobicContact CB-CB 4.18Å; F1015-V1018 HydrophobicContact CB-CG2 4.31Å; F1015-V1018 HydrophobicContact CD1-CG2 4.33Å; F1015-V1018 PolarHBondContact O-N 3.12Å; F1015-F1020 HydrophobicContact CB-CE2 3.64Å; F1015-F1020 HydrophobicContact CB-CZ 4.08Å; F1015-F1020 HydrophobicContact CD1-CE2 4.4Å; F1015-F1020 AromaticContact CD1-CZ 3.96Å; F1015-F1020 HydrophobicContact CD1-CZ 3.96Å; F1015-F1020 HydrophobicContact CD2-CE2 4.3Å; F1015-F1020 HydrophobicContact CD2-CZ 4.26Å; F1015-F1020 HydrophobicContact CE1-CZ 4.44Å; F1015-F1020 AromaticContact CG-CE2 3.9Å; F1015-F1020 HydrophobicContact CG-CE2 3.9Å; F1015-F1020 AromaticContact CG-CZ 3.86Å; F1015-F1020 HydrophobicContact CG-CZ 3.86Å
1016	S	91.4	Very high	90.3	Very high	104 Å²	104	52.6 Å²	52.6	73%	0.727	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.5	-179.2	49.4	0	0	0	0	114.4	P1013	P1013-S1016 WeakPolarHBondContact O-CB 3.33Å; P1013-S1016 PolarHBondContact O-N 3.29Å; P1013-S1016 PolarHBondContact O-OG 3.45Å
1017	E	88	Confident	90.1	Very high	132 Å²	132	56 Å²	56	62%	0.617	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-8.8	173.9	-62.2	173.9	171.1	0	0	114.1	R810 F1015	R810-E1017 IonicContact CZ-OE2 2.84Å; R810-E1017 IonicContact NH1-OE1 2.73Å; R810-E1017 IonicContact NH1-OE2 2.7Å; R810-E1017 PolarHBondContact NH1-OE2 2.91Å; F1015-E1017 PolarHBondContact O-N 2.94Å; F1015-E1017 VanDerWaalsContact O-N 3.09Å
1018	V	91.1	Very high	89.9	Confident	28 Å²	28	59.6 Å²	59.6	17%	0.17	34%	0.342	C	S	.	.			trans	-104	113.1	-171.1	-175	0	0	0	0	111.1	R810 A814 F1015 F1020 L1024	R810-V1018 HydrophobicContact CG-CG2 3.92Å; A814-V1018 HydrophobicContact CB-CG1 3.88Å; A814-V1018 HydrophobicContact CB-CG2 4.49Å; F1015-V1018 HydrophobicContact CB-CB 4.18Å; F1015-V1018 HydrophobicContact CB-CG2 4.31Å; F1015-V1018 HydrophobicContact CD1-CG2 4.33Å; F1015-V1018 PolarHBondContact O-N 3.12Å; V1018-F1020 HydrophobicContact CB-CE2 4.33Å; V1018-F1020 HydrophobicContact CG1-CD1 4.48Å; V1018-F1020 HydrophobicContact CG1-CD2 4.45Å; V1018-F1020 HydrophobicContact CG1-CE1 4.26Å; V1018-F1020 HydrophobicContact CG1-CE2 4.22Å; V1018-F1020 HydrophobicContact CG1-CZ 4.12Å; V1018-F1020 PolarHBondContact O-N 3.19Å; V1018-L1024 HydrophobicContact CG1-CD1 4.25Å; V1018-L1024 HydrophobicContact CG1-CD2 4.3Å
1019	D	88.5	Confident	89.8	Confident	68 Å²	68	57.3 Å²	57.3	36%	0.364	33%	0.333	S	S	.	.			trans	-79	103.6	171	175.3	33.9	0	0	0	111.8	S1021 S1022	D1019-S1021 VanDerWaalsContact C-N 3.27Å; D1019-S1021 PolarHBondContact O-N 2.85Å; D1019-S1021 WeakPolarHBondContact OD1-CA 3.46Å; D1019-S1021 VanDerWaalsContact OD1-CB 3.24Å; D1019-S1021 WeakPolarHBondContact OD1-CB 3.48Å; D1019-S1021 PolarHBondContact OD1-N 3.05Å; D1019-S1021 PolarHBondContact OD1-OG 3.43Å; D1019-S1021 PolarHBondContact OD2-OG 3.04Å; D1019-S1022 WeakPolarHBondContact OD2-CB 3.3Å; D1019-S1022 PolarHBondContact OD2-N 2.9Å; D1019-S1022 PolarHBondContact OD2-OG 2.89Å
1020	F	88.9	Confident	89.7	Confident	46 Å²	46	60.9 Å²	60.9	20%	0.202	36%	0.357	C	S	.	.	S	Bend	trans	-79.9	0.8	171.3	-66.5	-76.9	0	0	0	114.4	A814 L818 K1010 F1015 V1018	A814-F1020 HydrophobicContact CB-CE1 3.73Å; A814-F1020 HydrophobicContact CB-CZ 3.83Å; L818-F1020 HydrophobicContact CD1-CD1 4.32Å; L818-F1020 HydrophobicContact CD2-CD1 4.17Å; L818-F1020 HydrophobicContact CG-CD1 4.24Å; L818-F1020 HydrophobicContact CG-CE1 4.49Å; K1010-F1020 HydrophobicContact CB-CD2 3.71Å; K1010-F1020 HydrophobicContact CB-CE2 3.73Å; K1010-F1020 HydrophobicContact CB-CG 4.17Å; K1010-F1020 HydrophobicContact CB-CZ 4.22Å; K1010-F1020 HydrophobicContact CD-CB 4.42Å; K1010-F1020 HydrophobicContact CD-CD1 4.21Å; K1010-F1020 HydrophobicContact CD-CG 4.17Å; K1010-F1020 HydrophobicContact CG-CD1 3.94Å; K1010-F1020 HydrophobicContact CG-CD2 3.93Å; K1010-F1020 HydrophobicContact CG-CE1 3.91Å; K1010-F1020 HydrophobicContact CG-CE2 3.9Å; K1010-F1020 HydrophobicContact CG-CG 3.94Å; K1010-F1020 HydrophobicContact CG-CZ 3.89Å; K1010-F1020 WeakPolarHBondContact O-CE2 3.38Å; F1015-F1020 HydrophobicContact CB-CE2 3.64Å; F1015-F1020 HydrophobicContact CB-CZ 4.08Å; F1015-F1020 HydrophobicContact CD1-CE2 4.4Å; F1015-F1020 AromaticContact CD1-CZ 3.96Å; F1015-F1020 HydrophobicContact CD1-CZ 3.96Å; F1015-F1020 HydrophobicContact CD2-CE2 4.3Å; F1015-F1020 HydrophobicContact CD2-CZ 4.26Å; F1015-F1020 HydrophobicContact CE1-CZ 4.44Å; F1015-F1020 AromaticContact CG-CE2 3.9Å; F1015-F1020 HydrophobicContact CG-CE2 3.9Å; F1015-F1020 AromaticContact CG-CZ 3.86Å; F1015-F1020 HydrophobicContact CG-CZ 3.86Å; V1018-F1020 HydrophobicContact CB-CE2 4.33Å; V1018-F1020 HydrophobicContact CG1-CD1 4.48Å; V1018-F1020 HydrophobicContact CG1-CD2 4.45Å; V1018-F1020 HydrophobicContact CG1-CE1 4.26Å; V1018-F1020 HydrophobicContact CG1-CE2 4.22Å; V1018-F1020 HydrophobicContact CG1-CZ 4.12Å; V1018-F1020 PolarHBondContact O-N 3.19Å
1021	S	80.8	Confident	89.6	Confident	111 Å²	111	61.3 Å²	61.3	78%	0.776	36%	0.357	S	S	*	.	S	Bend	trans	-94	-35.7	-179.5	78.8	0	0	0	0	113.4	D1019	D1019-S1021 VanDerWaalsContact C-N 3.27Å; D1019-S1021 PolarHBondContact O-N 2.85Å; D1019-S1021 WeakPolarHBondContact OD1-CA 3.46Å; D1019-S1021 VanDerWaalsContact OD1-CB 3.24Å; D1019-S1021 WeakPolarHBondContact OD1-CB 3.48Å; D1019-S1021 PolarHBondContact OD1-N 3.05Å; D1019-S1021 PolarHBondContact OD1-OG 3.43Å; D1019-S1021 PolarHBondContact OD2-OG 3.04Å
1022	S	73.3	Confident	89.5	Confident	52 Å²	52	63.5 Å²	63.5	36%	0.364	35%	0.348	S	S	.	.	S	Bend	trans	-73.3	165.8	161.2	65.4	0	0	0	0	111.3	D1019 L1024 Q1027	D1019-S1022 WeakPolarHBondContact OD2-CB 3.3Å; D1019-S1022 PolarHBondContact OD2-N 2.9Å; D1019-S1022 PolarHBondContact OD2-OG 2.89Å; S1022-L1024 PolarHBondContact O-N 3.42Å; S1022-L1024 VanDerWaalsContact O-N 3.1Å; S1022-Q1027 PolarHBondContact OG-NE2 2.68Å
1023	N	79.4	Confident	89.3	Confident	60 Å²	60	63.6 Å²	63.6	32%	0.321	35%	0.349	S	S	.	.			trans	-78.8	96.2	174.2	-172.1	-1.1	0	0	0	109	R1025 Q1026	N1023-R1025 PolarHBondContact O-N 3.4Å; N1023-R1025 WeakPolarHBondContact OD1-CB 3.28Å; N1023-R1025 PolarHBondContact OD1-N 2.89Å; N1023-Q1026 HydrophobicContact CB-CB 4.47Å; N1023-Q1026 HydrophobicContact CB-CG 3.96Å; N1023-Q1026 PolarHBondContact ND2-NE2 3.38Å; N1023-Q1026 WeakPolarHBondContact O-CB 3.28Å; N1023-Q1026 PolarHBondContact O-N 2.97Å
1024	L	86.4	Confident	89.1	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.021	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-46.7	-33.2	175.4	-175.7	60.7	0	0	0	112.5	F811 A814 E815 L818 V1018 S1022 Q1026 Q1027	F811-L1024 HydrophobicContact CD2-CD1 4.25Å; F811-L1024 HydrophobicContact CE2-CD1 4Å; F811-L1024 HydrophobicContact CE2-CG 4.27Å; A814-L1024 HydrophobicContact CB-CD2 3.88Å; E815-L1024 HydrophobicContact CG-CD2 3.88Å; E815-L1024 HydrophobicContact CG-CG 4.35Å; L818-L1024 HydrophobicContact CD1-CB 4.22Å; L818-L1024 HydrophobicContact CD1-CD2 4.12Å; V1018-L1024 HydrophobicContact CG1-CD1 4.25Å; V1018-L1024 HydrophobicContact CG1-CD2 4.3Å; S1022-L1024 PolarHBondContact O-N 3.42Å; S1022-L1024 VanDerWaalsContact O-N 3.1Å; L1024-Q1026 PolarHBondContact O-N 2.76Å; L1024-Q1026 VanDerWaalsContact O-N 3.15Å; L1024-Q1027 WeakPolarHBondContact O-CB 3.27Å; L1024-Q1027 PolarHBondContact O-N 3.37Å; L1024-Q1027 VanDerWaalsContact O-N 3.16Å
1025	R	88	Confident	88.9	Confident	27 Å²	27	70.4 Å²	70.4	10%	0.102	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-74.8	7.4	177.5	-143.1	-168.2	-178.3	95.7	7.9	115.4	E767 W768 D841 H845 I846 N1023	E767-R1025 PolarHBondContact O-NH1 2.83Å; W768-R1025 HydrophobicContact CH2-CB 4.09Å; W768-R1025 HydrophobicContact CH2-CG 4.24Å; W768-R1025 HydrophobicContact CZ2-CB 4.48Å; D841-R1025 IonicContact OD2-CZ 3.74Å; D841-R1025 IonicContact OD2-NE 3.63Å; D841-R1025 IonicContact OD2-NH2 2.88Å; D841-R1025 PolarHBondContact OD2-NH2 3.33Å; H845-R1025 HydrophobicContact CB-CG 3.95Å; I846-R1025 VanDerWaalsContact O-CZ 3.27Å; I846-R1025 PolarHBondContact O-NH1 3.38Å; I846-R1025 PolarHBondContact O-NH2 3.25Å; N1023-R1025 PolarHBondContact O-N 3.4Å; N1023-R1025 WeakPolarHBondContact OD1-CB 3.28Å; N1023-R1025 PolarHBondContact OD1-N 2.89Å
1026	Q	86.6	Confident	88.6	Confident	157 Å²	157	74.5 Å²	74.5	73%	0.734	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-112	-10.3	171.2	-65.2	176.7	-4.8	0	0	112.3	N1023 L1024	N1023-Q1026 HydrophobicContact CB-CB 4.47Å; N1023-Q1026 HydrophobicContact CB-CG 3.96Å; N1023-Q1026 PolarHBondContact ND2-NE2 3.38Å; N1023-Q1026 WeakPolarHBondContact O-CB 3.28Å; N1023-Q1026 PolarHBondContact O-N 2.97Å; L1024-Q1026 PolarHBondContact O-N 2.76Å; L1024-Q1026 VanDerWaalsContact O-N 3.15Å
1027	Q	87.2	Confident	88.5	Confident	77 Å²	77	74 Å²	74	36%	0.36	39%	0.394	S	S	.	.	S	Bend	trans	-80.8	145.5	170.2	-54.5	180	8.6	0	0	108.3	H845 S1022 L1024 A1029	H845-Q1027 PolarHBondContact CE1-O 2.96Å; H845-Q1027 PolarHBondContact NE2-O 3.24Å; S1022-Q1027 PolarHBondContact OG-NE2 2.68Å; L1024-Q1027 WeakPolarHBondContact O-CB 3.27Å; L1024-Q1027 PolarHBondContact O-N 3.37Å; L1024-Q1027 VanDerWaalsContact O-N 3.16Å; Q1027-A1029 PolarHBondContact O-N 3.49Å
1028	P	89.4	Confident	88.4	Confident	121 Å²	121	69.4 Å²	69.4	79%	0.786	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-65	130.9	177.5	27.4	-34	0	0	0	110.8
1029	A	93	Very high	88.4	Confident	13 Å²	13	71.1 Å²	71.1	11%	0.107	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-65.7	139.5	177	0	0	0	0	0	111.5	F811 D843 Q1027 Y1031	F811-A1029 HydrophobicContact CE1-CB 3.83Å; F811-A1029 HydrophobicContact CZ-CB 3.8Å; D843-A1029 WeakPolarHBondContact O-CB 3.17Å; Q1027-A1029 PolarHBondContact O-N 3.49Å; A1029-Y1031 PolarHBondContact O-N 2.89Å
1030	P	92.8	Very high	88.5	Confident	75 Å²	75	68.8 Å²	68.8	49%	0.487	37%	0.37	S	S	.	.	S	Bend	trans	-65.5	-21.1	-178.4	-22.1	33.4	0	0	0	114.6	L808 F811	L808-P1030 HydrophobicContact CD1-CB 3.99Å; F811-P1030 HydrophobicContact CB-CG 3.96Å; F811-P1030 VanDerWaalsContact CD1-CD 3.49Å; F811-P1030 HydrophobicContact CD1-CG 4.27Å; F811-P1030 HydrophobicContact CD2-CG 4.05Å; F811-P1030 VanDerWaalsContact CG-CD 3.44Å; F811-P1030 HydrophobicContact CG-CG 3.83Å
1031	Y	93.4	Very high	88.6	Confident	51 Å²	51	67.4 Å²	67.4	20%	0.2	37%	0.365	C	S	.	.	S	Bend	trans	-120	127.9	167.6	170.9	-92.2	0	0	0	109.2	L797 G844 A1029 P1033	L797-Y1031 HydrophobicContact CD1-CD1 4.3Å; L797-Y1031 HydrophobicContact CD1-CD2 4.27Å; L797-Y1031 HydrophobicContact CD1-CE1 3.78Å; L797-Y1031 HydrophobicContact CD1-CE2 3.74Å; L797-Y1031 VanDerWaalsContact CD1-CZ 3.47Å; L797-Y1031 HydrophobicContact CD2-CD1 3.71Å; L797-Y1031 HydrophobicContact CD2-CE1 3.83Å; L797-Y1031 HydrophobicContact CD2-CG 4.16Å; L797-Y1031 HydrophobicContact CG-CE1 4.47Å; G844-Y1031 WeakPolarHBondContact CA-O 3.41Å; A1029-Y1031 PolarHBondContact O-N 2.89Å; Y1031-P1033 HydrophobicContact CE1-CB 4.07Å
1032	R	93.5	Very high	89.1	Confident	126 Å²	126	65.8 Å²	65.8	48%	0.475	35%	0.354	S	S	.	.			trans	-114.2	126.1	170.4	-163	-178.9	-168.3	-167.8	14.3	109.6	L842 D843	L842-R1032 PolarHBondContact O-NE 3.46Å; D843-R1032 IonicContact OD1-CZ 2.83Å; D843-R1032 IonicContact OD1-NE 2.73Å; D843-R1032 IonicContact OD1-NH2 3.31Å; D843-R1032 PolarHBondContact OD1-NH2 2.85Å
1033	P	92.9	Very high	89.9	Confident	8 Å²	8	63.7 Å²	63.7	5%	0.052	34%	0.339	C	S	.	.			trans	-64.7	138.8	179	25.8	-34.1	0	0	0	111.3	I840 D841 Y1031 I1035	I840-P1033 HydrophobicContact CG2-CG 4.32Å; D841-P1033 WeakPolarHBondContact O-CG 3.41Å; Y1031-P1033 HydrophobicContact CE1-CB 4.07Å; P1033-I1035 HydrophobicContact CB-CD1 4.31Å; P1033-I1035 HydrophobicContact CB-CG1 4.34Å; P1033-I1035 HydrophobicContact CG-CD1 3.88Å; P1033-I1035 HydrophobicContact CG-CG1 4.45Å; P1033-I1035 PolarHBondContact O-N 2.82Å
1034	K	92.1	Very high	90.4	Very high	184 Å²	184	62.6 Å²	62.6	80%	0.8	33%	0.331	S	S	*	.			trans	-72.6	124.2	170	-65.3	-175.8	179.4	-177.4	0	108.3	N1043	K1034-N1043 PolarHBondContact O-ND2 3.39Å
1035	I	93.1	Very high	90.2	Very high	29 Å²	29	67.9 Å²	67.9	15%	0.149	36%	0.359	C	S	.	.			trans	-139.1	109.1	-176.3	-62.3	160.2	0	0	0	107.1	P790 L842 P1033 D1040 P1100	P790-I1035 HydrophobicContact CB-CD1 3.89Å; P790-I1035 HydrophobicContact CB-CG1 4.19Å; P790-I1035 HydrophobicContact CB-CG2 4.32Å; P790-I1035 HydrophobicContact CG-CD1 3.51Å; P790-I1035 HydrophobicContact CG-CG1 4.35Å; L842-I1035 HydrophobicContact CB-CD1 3.85Å; P1033-I1035 HydrophobicContact CB-CD1 4.31Å; P1033-I1035 HydrophobicContact CB-CG1 4.34Å; P1033-I1035 HydrophobicContact CG-CD1 3.88Å; P1033-I1035 HydrophobicContact CG-CG1 4.45Å; P1033-I1035 PolarHBondContact O-N 2.82Å; I1035-D1040 WeakPolarHBondContact CA-OD2 3.43Å; I1035-D1040 HydrophobicContact CG2-CB 4.14Å; I1035-P1100 HydrophobicContact CG2-CG 4.32Å
1036	A	90.3	Very high	89.9	Confident	91 Å²	91	72.1 Å²	72.1	75%	0.752	39%	0.391	S	S	*	.			trans	-75.6	-37.2	-175.2	0	0	0	0	0	113.1	D1040	A1036-D1040 PolarHBondContact N-OD2 3.25Å
1037	H	89.5	Confident	89.7	Confident	95 Å²	95	66.8 Å²	66.8	44%	0.44	37%	0.369	S	S	.	.	S	Bend	trans	-155.8	165.8	-176.9	65.2	24.4	0	0	0	112.5	M1039 D1040	H1037-M1039 VanDerWaalsContact CE1-C 3.41Å; H1037-M1039 PolarHBondContact ND1-N 2.71Å; H1037-M1039 PolarHBondContact O-N 2.92Å; H1037-D1040 VanDerWaalsContact CE1-CA 3.49Å; H1037-D1040 WeakPolarHBondContact CE1-CA 3.46Å; H1037-D1040 PolarHBondContact CE1-N 2.78Å; H1037-D1040 WeakPolarHBondContact ND1-CA 3.48Å; H1037-D1040 WeakPolarHBondContact ND1-CB 3.47Å; H1037-D1040 PolarHBondContact ND1-N 3.46Å; H1037-D1040 WeakPolarHBondContact O-CB 3.31Å; H1037-D1040 PolarHBondContact O-N 2.84Å
1038	P	86.5	Confident	88.9	Confident	35 Å²	35	70.7 Å²	70.7	23%	0.227	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.1	-174.2	-30.3	37.3	0	0	0	117.8	L734 F1097 Y1099	L734-P1038 HydrophobicContact CD1-CB 3.92Å; L734-P1038 WeakPolarHBondContact CD1-O 3.25Å; P1038-F1097 VanDerWaalsContact CA-CE1 3.45Å; P1038-F1097 VanDerWaalsContact CA-CZ 3.47Å; P1038-F1097 HydrophobicContact CB-CD1 3.86Å; P1038-F1097 HydrophobicContact CB-CE1 3.44Å; P1038-F1097 VanDerWaalsContact CB-CE1 3.44Å; P1038-F1097 HydrophobicContact CB-CZ 4.02Å; P1038-F1097 HydrophobicContact CG-CD1 4.44Å; P1038-F1097 HydrophobicContact CG-CE1 3.83Å; P1038-Y1099 HydrophobicContact CG-CD1 3.6Å; P1038-Y1099 HydrophobicContact CG-CE1 3.73Å
1039	M	90.6	Very high	87.7	Confident	63 Å²	63	71 Å²	71	31%	0.31	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	19.8	178.3	-57.4	-179.3	-60.8	0	0	112.3	I712 L725 R727 L734 H1037 T1041	I712-M1039 HydrophobicContact CD1-CG 4.3Å; I712-M1039 HydrophobicContact CD1-SD 3.76Å; I712-M1039 HydrophobicContact CG2-SD 4.34Å; L725-M1039 HydrophobicContact CD2-CB 3.94Å; L725-M1039 HydrophobicContact CD2-CG 4.39Å; R727-M1039 PolarHBondContact NH2-SD 3.07Å; L734-M1039 HydrophobicContact CD1-CG 3.77Å; L734-M1039 HydrophobicContact CD2-CG 4.1Å; L734-M1039 HydrophobicContact CD2-SD 4.47Å; H1037-M1039 VanDerWaalsContact CE1-C 3.41Å; H1037-M1039 PolarHBondContact ND1-N 2.71Å; H1037-M1039 PolarHBondContact O-N 2.92Å; M1039-T1041 PolarHBondContact O-N 3.34Å
1040	D	90.9	Very high	85.5	Confident	19 Å²	19	78.1 Å²	78.1	10%	0.102	41%	0.409	C	S	.	.			trans	-73.8	125.3	-173.6	-174.2	3.9	0	0	0	110.8	Y788 I1035 A1036 H1037 S1042	Y788-D1040 PolarHBondContact OH-O 3.45Å; I1035-D1040 WeakPolarHBondContact CA-OD2 3.43Å; I1035-D1040 HydrophobicContact CG2-CB 4.14Å; A1036-D1040 PolarHBondContact N-OD2 3.25Å; H1037-D1040 VanDerWaalsContact CE1-CA 3.49Å; H1037-D1040 WeakPolarHBondContact CE1-CA 3.46Å; H1037-D1040 PolarHBondContact CE1-N 2.78Å; H1037-D1040 WeakPolarHBondContact ND1-CA 3.48Å; H1037-D1040 WeakPolarHBondContact ND1-CB 3.47Å; H1037-D1040 PolarHBondContact ND1-N 3.46Å; H1037-D1040 WeakPolarHBondContact O-CB 3.31Å; H1037-D1040 PolarHBondContact O-N 2.84Å; D1040-S1042 VanDerWaalsContact CG-OG 3.24Å; D1040-S1042 WeakPolarHBondContact OD1-CB 3.43Å; D1040-S1042 PolarHBondContact OD1-N 2.64Å; D1040-S1042 PolarHBondContact OD1-OG 3.18Å; D1040-S1042 PolarHBondContact OD2-OG 3.09Å; D1040-S1042 VanDerWaalsContact OD2-OG 3.1Å
1041	T	91.9	Very high	83.3	Confident	17 Å²	17	76.7 Å²	76.7	10%	0.104	41%	0.408	C	S	.	.			trans	-119.7	17.8	-175.9	48.3	0	0	0	0	111.9	K713 L715 L725 Y788 M1039 N1043 F1044	K713-T1041 HydrophobicContact CD-CG2 4.18Å; K713-T1041 VanDerWaalsContact CD-OG1 3.31Å; K713-T1041 WeakPolarHBondContact CD-OG1 3.35Å; K713-T1041 PolarHBondContact NZ-OG1 2.94Å; L715-T1041 HydrophobicContact CD2-CG2 3.46Å; L715-T1041 VanDerWaalsContact CD2-CG2 3.46Å; L725-T1041 HydrophobicContact CD2-CG2 4.25Å; Y788-T1041 WeakPolarHBondContact OH-CG2 3.21Å; M1039-T1041 PolarHBondContact O-N 3.34Å; T1041-N1043 PolarHBondContact O-N 3.42Å; T1041-F1044 PolarHBondContact O-N 2.96Å; T1041-F1044 VanDerWaalsContact O-N 3.15Å
1042	S	90.6	Very high	80.7	Confident	77 Å²	77	76.1 Å²	76.1	54%	0.538	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.5	178	57.8	0	0	0	0	114.3	D1040 F1044	D1040-S1042 VanDerWaalsContact CG-OG 3.24Å; D1040-S1042 WeakPolarHBondContact OD1-CB 3.43Å; D1040-S1042 PolarHBondContact OD1-N 2.64Å; D1040-S1042 PolarHBondContact OD1-OG 3.18Å; D1040-S1042 PolarHBondContact OD2-OG 3.09Å; D1040-S1042 VanDerWaalsContact OD2-OG 3.1Å; S1042-F1044 VanDerWaalsContact C-N 3.3Å
1043	N	90.9	Very high	78.2	Confident	8 Å²	8	76.7 Å²	76.7	4%	0.043	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	12.1	172.6	-59.5	-67.6	0	0	0	113.7	P790 G791 G792 R800 K1034 T1041	P790-N1043 PolarHBondContact O-ND2 3.28Å; G791-N1043 VanDerWaalsContact C-CB 3.45Å; G791-N1043 WeakPolarHBondContact O-CB 3.19Å; G792-N1043 VanDerWaalsContact CA-O 3.28Å; G792-N1043 WeakPolarHBondContact CA-O 3.26Å; R800-N1043 PolarHBondContact NH1-OD1 3.29Å; K1034-N1043 PolarHBondContact O-ND2 3.39Å; T1041-N1043 PolarHBondContact O-N 3.42Å
1044	F	87.9	Confident	76.1	Confident	37 Å²	37	78 Å²	78	16%	0.162	45%	0.452	C	S	.	.	S	Bend	trans	-118.7	144.4	174.1	-66.7	-98	0	0	0	109.7	L715 Y788 I789 T1041 S1042	L715-F1044 HydrophobicContact CB-CD1 4.13Å; L715-F1044 HydrophobicContact CB-CE1 4.19Å; L715-F1044 HydrophobicContact CD1-CE1 4.43Å; L715-F1044 HydrophobicContact CD1-CZ 4.42Å; L715-F1044 HydrophobicContact CD2-CD1 4.18Å; L715-F1044 HydrophobicContact CD2-CD2 4.07Å; L715-F1044 HydrophobicContact CD2-CE1 4.2Å; L715-F1044 HydrophobicContact CD2-CE2 4.09Å; L715-F1044 HydrophobicContact CD2-CG 4.11Å; L715-F1044 HydrophobicContact CD2-CZ 4.14Å; Y788-F1044 AromaticContact CE2-CE2 3.94Å; Y788-F1044 HydrophobicContact CE2-CE2 3.94Å; Y788-F1044 AromaticContact CE2-CZ 3.93Å; Y788-F1044 HydrophobicContact CE2-CZ 3.93Å; I789-F1044 VanDerWaalsContact O-CZ 3.26Å; I789-F1044 WeakPolarHBondContact O-CZ 3.45Å; T1041-F1044 PolarHBondContact O-N 2.96Å; T1041-F1044 VanDerWaalsContact O-N 3.15Å; S1042-F1044 VanDerWaalsContact C-N 3.3Å
1045	D	84	Confident	74.1	Confident	115 Å²	115	72.2 Å²	72.2	62%	0.615	44%	0.435	S	S	*	.			trans	-58.2	140.1	175.6	-72.1	-18.2	0	0	0	111.6	V1047	D1045-V1047 PolarHBondContact O-N 3.42Å
1046	P	81.9	Confident	72.1	Confident	117 Å²	117	75 Å²	75	76%	0.76	44%	0.444	S	S	*	.			trans	-62.7	101.1	175.5	-23.6	34.8	0	0	0	112	E1048	P1046-E1048 PolarHBondContact O-N 3.05Å; P1046-E1048 VanDerWaalsContact O-N 3.12Å
1047	V	80.6	Confident	70.1	Confident	45 Å²	45	74.4 Å²	74.4	27%	0.273	43%	0.434	S	S	.	.			trans	-68.4	107.4	167.5	-177.9	0	0	0	0	108.7	T714 I717 D1045 E1049	T714-V1047 HydrophobicContact CG2-CB 4.47Å; T714-V1047 HydrophobicContact CG2-CG1 4Å; T714-V1047 HydrophobicContact CG2-CG2 4.4Å; I717-V1047 HydrophobicContact CD1-CG1 3.63Å; I717-V1047 HydrophobicContact CG1-CG1 3.83Å; D1045-V1047 PolarHBondContact O-N 3.42Å; V1047-E1049 PolarHBondContact O-N 3.3Å
1048	E	71.9	Confident	67.9	Low	158 Å²	158	76.1 Å²	76.1	74%	0.738	45%	0.446	S	S	*	.			trans	-57.9	124.8	169.8	-65	-175.4	153.6	0	0	109.9	P1046 E1050	P1046-E1048 PolarHBondContact O-N 3.05Å; P1046-E1048 VanDerWaalsContact O-N 3.12Å; E1048-E1050 HydrophobicContact CB-CG 4.47Å; E1048-E1050 PolarHBondContact O-N 3.1Å
1049	E	63.4	Low	65.8	Low	127 Å²	127	77.7 Å²	77.7	59%	0.593	46%	0.458	S	S	*	.			trans	-83.1	53.4	177.1	-159	161.8	-136.9	0	0	110.7	V1047 G1051	V1047-E1049 PolarHBondContact O-N 3.3Å; E1049-G1051 CarbonylContact O-C 3.35Å; E1049-G1051 PolarHBondContact O-N 3.26Å
1050	E	47.3	Very low	63.6	Low	163 Å²	163	79 Å²	79	76%	0.762	47%	0.474	S	S	*	.	S	Bend	trans	-58.3	95.9	175.3	-99.5	-92.9	104.9	0	0	110	E1048	E1048-E1050 HydrophobicContact CB-CG 4.47Å; E1048-E1050 PolarHBondContact O-N 3.1Å
1051	G	46.5	Very low	61.5	Low	45 Å²	45	83.4 Å²	83.4	46%	0.464	50%	0.497	S	S	.	.	S	Bend	trans	85.7	105.9	-164.6	0	0	0	0	0	111.4	E1049 S1055	E1049-G1051 CarbonylContact O-C 3.35Å; E1049-G1051 PolarHBondContact O-N 3.26Å; G1051-S1055 WeakPolarHBondContact O-CB 3.13Å
1052	G	38.9	Very low	59.4	Low	40 Å²	40	84.4 Å²	84.4	41%	0.412	51%	0.505	S	S	.	.			trans	-61.3	-168.4	-178.5	0	0	0	0	0	115.5	G1054 S1055	G1052-G1054 VanDerWaalsContact C-N 3.31Å; G1052-G1054 WeakPolarHBondContact O-CA 3.45Å; G1052-G1054 PolarHBondContact O-N 3.28Å; G1052-S1055 PolarHBondContact O-N 3.12Å
1053	P	40.7	Very low	57.4	Low	138 Å²	138	83.2 Å²	83.2	90%	0.896	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	81.4	-161.4	24.8	-36	0	0	0	114
1054	G	48	Very low	55.4	Low	34 Å²	34	92 Å²	92	35%	0.351	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	163.5	-27	-165.1	0	0	0	0	0	114.2	G1052 W1056 S1057 D1058	G1052-G1054 VanDerWaalsContact C-N 3.31Å; G1052-G1054 WeakPolarHBondContact O-CA 3.45Å; G1052-G1054 PolarHBondContact O-N 3.28Å; G1054-W1056 PolarHBondContact O-N 2.96Å; G1054-W1056 VanDerWaalsContact O-N 3.13Å; G1054-S1057 CarbonylContact O-C 3.43Å; G1054-S1057 PolarHBondContact O-N 3.33Å; G1054-D1058 PolarHBondContact O-N 3.07Å
1055	S	50	Low	53.3	Low	64 Å²	64	91.6 Å²	91.6	45%	0.448	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-34.8	179.6	-175.3	0	0	0	0	113.7	G1051 G1052	G1051-S1055 WeakPolarHBondContact O-CB 3.13Å; G1052-S1055 PolarHBondContact O-N 3.12Å
1056	W	51.8	Low	51.6	Low	87 Å²	87	87.3 Å²	87.3	33%	0.33	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	8.3	171.9	-69.2	77.3	0	0	0	114	I717 R741 G1054	I717-W1056 HydrophobicContact CG2-CH2 4.07Å; I717-W1056 HydrophobicContact CG2-CZ2 3.68Å; R741-W1056 VanDerWaalsContact CZ-CE3 3.48Å; R741-W1056 VanDerWaalsContact NE-CE3 3.35Å; R741-W1056 VanDerWaalsContact NE-CZ3 3.32Å; R741-W1056 VanDerWaalsContact NH2-CD2 3.25Å; G1054-W1056 PolarHBondContact O-N 2.96Å; G1054-W1056 VanDerWaalsContact O-N 3.13Å
1057	S	48.8	Very low	50.1	Low	79 Å²	79	85.9 Å²	85.9	55%	0.552	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.9	21.1	-170.5	-77.3	0	0	0	0	117.6	G1054	G1054-S1057 CarbonylContact O-C 3.43Å; G1054-S1057 PolarHBondContact O-N 3.33Å
1058	D	43.4	Very low	48.5	Very low	130 Å²	130	86.9 Å²	86.9	70%	0.695	51%	0.507	S	S	*	.			trans	-138.7	130.1	137.1	-157.5	-22.1	0	0	0	112	G1054 S1060	G1054-D1058 PolarHBondContact O-N 3.07Å; D1058-S1060 PolarHBondContact OD1-N 3.21Å
1059	S	42.4	Very low	47.3	Very low	68 Å²	68	82.9 Å²	82.9	48%	0.476	49%	0.49	S	S	.	.			trans	-156.2	79.4	156.1	-175.5	0	0	0	0	107.8	D1061 S1062	S1059-D1061 PolarHBondContact O-N 2.83Å; S1059-S1062 WeakPolarHBondContact O-CB 3.34Å; S1059-S1062 PolarHBondContact O-N 3.3Å; S1059-S1062 PolarHBondContact O-OG 2.8Å
1060	S	43.4	Very low	46.4	Very low	91 Å²	91	79.9 Å²	79.9	64%	0.636	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.1	-24.6	174.7	-178.8	0	0	0	0	114.4	D1058 S1062 T1063	D1058-S1060 PolarHBondContact OD1-N 3.21Å; S1060-S1062 VanDerWaalsContact C-N 3.29Å; S1060-S1062 PolarHBondContact O-N 3.44Å; S1060-T1063 WeakPolarHBondContact O-CB 3.24Å; S1060-T1063 PolarHBondContact O-N 2.98Å; S1060-T1063 PolarHBondContact O-OG1 3.37Å
1061	D	46.6	Very low	46	Very low	112 Å²	112	75 Å²	75	60%	0.599	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.9	177.4	-155.4	34.3	0	0	0	113.4	S1059 T1063 R1064 A1065	S1059-D1061 PolarHBondContact O-N 2.83Å; D1061-T1063 PolarHBondContact O-N 2.79Å; D1061-T1063 VanDerWaalsContact O-N 3.13Å; D1061-R1064 PolarHBondContact O-N 3.05Å; D1061-R1064 VanDerWaalsContact O-N 3.11Å; D1061-A1065 PolarHBondContact O-N 2.76Å
1062	S	48.6	Very low	45.7	Very low	37 Å²	37	78.8 Å²	78.8	26%	0.259	48%	0.482	S	S	.	.	H	α-helix	trans	-53.8	-32.8	170.6	-59.8	0	0	0	0	112.5	S1059 S1060 R1064 A1065 L1066	S1059-S1062 WeakPolarHBondContact O-CB 3.34Å; S1059-S1062 PolarHBondContact O-N 3.3Å; S1059-S1062 PolarHBondContact O-OG 2.8Å; S1060-S1062 VanDerWaalsContact C-N 3.29Å; S1060-S1062 PolarHBondContact O-N 3.44Å; S1062-R1064 VanDerWaalsContact C-N 3.33Å; S1062-R1064 PolarHBondContact O-N 2.81Å; S1062-A1065 PolarHBondContact O-N 2.8Å; S1062-L1066 PolarHBondContact O-N 3.39Å
1063	T	47.8	Very low	45.8	Very low	52 Å²	52	85.2 Å²	85.2	32%	0.319	50%	0.502	S	S	.	.	H	α-helix	trans	-55	-46.4	177.6	-41.6	0	0	0	0	112	S1060 D1061 D1067	S1060-T1063 WeakPolarHBondContact O-CB 3.24Å; S1060-T1063 PolarHBondContact O-N 2.98Å; S1060-T1063 PolarHBondContact O-OG1 3.37Å; D1061-T1063 PolarHBondContact O-N 2.79Å; D1061-T1063 VanDerWaalsContact O-N 3.13Å; T1063-D1067 PolarHBondContact O-N 3.16Å
1064	R	48.8	Very low	46	Very low	193 Å²	193	80.3 Å²	80.3	73%	0.728	48%	0.476	S	S	*	.	H	α-helix	trans	-73.8	-36.5	179.8	-71.7	179.3	169.9	-179.6	-2.5	111.6	D1061 S1062 A1068	D1061-R1064 PolarHBondContact O-N 3.05Å; D1061-R1064 VanDerWaalsContact O-N 3.11Å; S1062-R1064 VanDerWaalsContact C-N 3.33Å; S1062-R1064 PolarHBondContact O-N 2.81Å; R1064-A1068 VanDerWaalsContact O-CB 3.25Å; R1064-A1068 WeakPolarHBondContact O-CB 3.25Å; R1064-A1068 PolarHBondContact O-N 3.09Å
1065	A	45.3	Very low	46.2	Very low	29 Å²	29	87 Å²	87	24%	0.24	50%	0.496	C	S	.	.	H	α-helix	trans	-66.4	-40.3	178.5	0	0	0	0	0	112.9	K743 D1061 S1062 L1069	K743-A1065 HydrophobicContact CD-CB 4.45Å; D1061-A1065 PolarHBondContact O-N 2.76Å; S1062-A1065 PolarHBondContact O-N 2.8Å; A1065-L1069 WeakPolarHBondContact O-CG 3.3Å; A1065-L1069 PolarHBondContact O-N 3.21Å
1066	L	48	Very low	46.3	Very low	24 Å²	24	86.5 Å²	86.5	13%	0.126	49%	0.486	C	S	.	.	H	α-helix	trans	-66.5	-45	177.3	-164	83.1	0	0	0	111.5	R779 S1062 A1068 L1069 C1070	R779-L1066 HydrophobicContact CG-CD2 4.26Å; S1062-L1066 PolarHBondContact O-N 3.39Å; L1066-A1068 VanDerWaalsContact C-N 3.33Å; L1066-A1068 PolarHBondContact O-N 2.96Å; L1066-L1069 PolarHBondContact O-N 2.98Å; L1066-C1070 PolarHBondContact O-N 3.4Å; L1066-C1070 VanDerWaalsContact O-N 3.07Å; L1066-C1070 PolarHBondContact O-SG 2.92Å
1067	D	49.7	Very low	46.4	Very low	87 Å²	87	83.7 Å²	83.7	47%	0.465	48%	0.479	S	S	.	.	H	α-helix	trans	-68.9	-32.5	179.9	-64.6	-11.9	0	0	0	111.1	R779 T1063 C1070 S1071	R779-D1067 IonicContact NH2-OD1 2.66Å; R779-D1067 PolarHBondContact NH2-OD1 3.32Å; R779-D1067 IonicContact NH2-OD2 3.19Å; R779-D1067 PolarHBondContact NH2-OD2 3.15Å; T1063-D1067 PolarHBondContact O-N 3.16Å; D1067-C1070 CarbonylContact O-C 3.54Å; D1067-C1070 WeakPolarHBondContact O-CA 3.46Å; D1067-C1070 PolarHBondContact O-N 3.17Å; D1067-C1070 VanDerWaalsContact O-N 3.16Å; D1067-S1071 PolarHBondContact O-N 3.4Å
1068	A	47.1	Very low	46.6	Very low	67 Å²	67	84.3 Å²	84.3	55%	0.554	47%	0.473	S	S	*	.	H	α-helix	trans	-67.5	-37.4	171.2	0	0	0	0	0	113.4	R1064 L1066 C1070 S1071	R1064-A1068 VanDerWaalsContact O-CB 3.25Å; R1064-A1068 WeakPolarHBondContact O-CB 3.25Å; R1064-A1068 PolarHBondContact O-N 3.09Å; L1066-A1068 VanDerWaalsContact C-N 3.33Å; L1066-A1068 PolarHBondContact O-N 2.96Å; A1068-C1070 PolarHBondContact O-N 2.83Å; A1068-S1071 VanDerWaalsContact O-CB 3.28Å; A1068-S1071 WeakPolarHBondContact O-CB 3.5Å; A1068-S1071 PolarHBondContact O-N 3.08Å
1069	L	46.6	Very low	47.7	Very low	74 Å²	74	78.6 Å²	78.6	39%	0.387	44%	0.442	S	S	.	.	H	α-helix	trans	-69.3	-17.3	171.1	-71.4	169.2	0	0	0	112.6	K743 N747 A1065 L1066 S1071	K743-L1069 HydrophobicContact CG-CD1 4.31Å; N747-L1069 WeakPolarHBondContact OD1-CD1 3.49Å; A1065-L1069 WeakPolarHBondContact O-CG 3.3Å; A1065-L1069 PolarHBondContact O-N 3.21Å; L1066-L1069 PolarHBondContact O-N 2.98Å; L1069-S1071 VanDerWaalsContact C-N 3.35Å
1070	C	44.3	Very low	48.9	Very low	64 Å²	64	75.4 Å²	75.4	43%	0.432	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	22.8	172	-61	0	0	0	0	113	L1066 D1067 A1068	L1066-C1070 PolarHBondContact O-N 3.4Å; L1066-C1070 VanDerWaalsContact O-N 3.07Å; L1066-C1070 PolarHBondContact O-SG 2.92Å; D1067-C1070 CarbonylContact O-C 3.54Å; D1067-C1070 WeakPolarHBondContact O-CA 3.46Å; D1067-C1070 PolarHBondContact O-N 3.17Å; D1067-C1070 VanDerWaalsContact O-N 3.16Å; A1068-C1070 PolarHBondContact O-N 2.83Å
1071	S	38.2	Very low	50.7	Low	61 Å²	61	71.9 Å²	71.9	43%	0.427	39%	0.393	S	S	.	.			trans	-51.2	143.8	175	173.7	0	0	0	0	112.5	D1067 A1068 L1069 H1073 G1074	D1067-S1071 PolarHBondContact O-N 3.4Å; A1068-S1071 VanDerWaalsContact O-CB 3.28Å; A1068-S1071 WeakPolarHBondContact O-CB 3.5Å; A1068-S1071 PolarHBondContact O-N 3.08Å; L1069-S1071 VanDerWaalsContact C-N 3.35Å; S1071-H1073 PolarHBondContact O-N 3.5Å; S1071-G1074 PolarHBondContact O-N 3.28Å
1072	P	41.3	Very low	51.9	Low	123 Å²	123	69.5 Å²	69.5	80%	0.799	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-8.7	-170.7	-27.1	35.9	0	0	0	117.4
1073	H	41.1	Very low	53.1	Low	176 Å²	176	70.2 Å²	70.2	82%	0.815	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-6.2	176	-57.1	-25.8	0	0	0	112.8	S1071 K1075	S1071-H1073 PolarHBondContact O-N 3.5Å; H1073-K1075 PolarHBondContact O-N 3.37Å; H1073-K1075 VanDerWaalsContact O-N 3.09Å
1074	G	45.4	Very low	54.8	Low	35 Å²	35	67.9 Å²	67.9	36%	0.361	36%	0.361	S	S	.	.			trans	-81	69.6	174.3	0	0	0	0	0	112.9	S1071 H1076	S1071-G1074 PolarHBondContact O-N 3.28Å; G1074-H1076 PolarHBondContact O-N 3.02Å
1075	K	51.1	Low	56.6	Low	175 Å²	175	62.8 Å²	62.8	76%	0.761	35%	0.352	S	S	*	.			trans	-59.5	100	167.8	-62.2	177	-174.6	174.4	0	109.7	H1073	H1073-K1075 PolarHBondContact O-N 3.37Å; H1073-K1075 VanDerWaalsContact O-N 3.09Å
1076	H	53.5	Low	58.6	Low	52 Å²	52	63.5 Å²	63.5	24%	0.241	35%	0.349	C	S	.	.	S	Bend	trans	-172.4	-28.9	146.2	-108.9	-67	0	0	0	119.2	G1074 E1078 H1079	G1074-H1076 PolarHBondContact O-N 3.02Å; H1076-E1078 PolarHBondContact O-N 2.98Å; H1076-H1079 PolarHBondContact O-CE1 3.39Å
1077	P	53.3	Low	60.2	Low	28 Å²	28	64.9 Å²	64.9	18%	0.182	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-77.8	-26.9	-163.5	28.4	-34.7	0	0	0	115.4	L746 H1079 A1080	L746-P1077 HydrophobicContact CD1-CB 3.94Å; L746-P1077 HydrophobicContact CD2-CB 4.26Å; P1077-H1079 VanDerWaalsContact C-N 3.33Å; P1077-H1079 PolarHBondContact O-N 3.15Å; P1077-H1079 VanDerWaalsContact O-N 3.16Å; P1077-A1080 WeakPolarHBondContact O-CB 3.42Å; P1077-A1080 PolarHBondContact O-N 3.37Å
1078	E	53.5	Low	61.6	Low	92 Å²	92	61.9 Å²	61.9	43%	0.43	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-63.2	-29	-163.3	-58	-170.6	115.9	0	0	116	Y638 S639 H1076	Y638-E1078 WeakPolarHBondContact CA-OE2 3.34Å; Y638-E1078 HydrophobicContact CD1-CB 4.31Å; S639-E1078 PolarHBondContact N-OE2 3.48Å; H1076-E1078 PolarHBondContact O-N 2.98Å
1079	H	65.3	Low	62.2	Low	10 Å²	10	60.6 Å²	60.6	5%	0.046	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-107.4	-3.2	-178.5	65.6	-80.7	0	0	0	112.9	A642 F645 H1076 P1077 F1081 Y1082	A642-H1079 HydrophobicContact CB-CB 3.98Å; F645-H1079 HydrophobicContact CD1-CB 4Å; F645-H1079 HydrophobicContact CE1-CB 4.4Å; F645-H1079 HydrophobicContact CG-CB 4.47Å; H1076-H1079 PolarHBondContact O-CE1 3.39Å; P1077-H1079 VanDerWaalsContact C-N 3.33Å; P1077-H1079 PolarHBondContact O-N 3.15Å; P1077-H1079 VanDerWaalsContact O-N 3.16Å; H1079-F1081 VanDerWaalsContact C-N 3.27Å; H1079-F1081 PolarHBondContact O-N 3.18Å; H1079-Y1082 PolarHBondContact O-N 2.89Å
1080	A	68.9	Low	62.5	Low	2 Å²	2	62.3 Å²	62.3	2%	0.017	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-42.7	-176	0	0	0	0	0	112.2	L746 V751 K755 P1077	L746-A1080 HydrophobicContact CD2-CB 3.93Å; V751-A1080 HydrophobicContact CG1-CB 3.74Å; V751-A1080 WeakPolarHBondContact CG1-O 3.48Å; V751-A1080 HydrophobicContact CG2-CB 3.95Å; K755-A1080 WeakPolarHBondContact CE-O 3.43Å; K755-A1080 PolarHBondContact NZ-O 3.17Å; P1077-A1080 WeakPolarHBondContact O-CB 3.42Å; P1077-A1080 PolarHBondContact O-N 3.37Å
1081	F	79.3	Confident	62.5	Low	17 Å²	17	62.9 Å²	62.9	8%	0.075	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	20.8	-177.9	-47.5	-57.9	0	0	0	113.2	K742 V745 L746 V751 Q777 L782 H1079 F1084	K742-F1081 HydrophobicContact CB-CE2 3.96Å; K742-F1081 HydrophobicContact CD-CD2 4.16Å; K742-F1081 HydrophobicContact CD-CE2 4.38Å; K742-F1081 HydrophobicContact CG-CD2 4.04Å; K742-F1081 HydrophobicContact CG-CE2 3.87Å; V745-F1081 HydrophobicContact CB-CZ 4.17Å; V745-F1081 HydrophobicContact CG1-CE1 3.81Å; V745-F1081 HydrophobicContact CG1-CZ 3.77Å; L746-F1081 HydrophobicContact CD1-CE2 4.07Å; L746-F1081 HydrophobicContact CD2-CE2 4.16Å; L746-F1081 HydrophobicContact CD2-CZ 4.16Å; L746-F1081 HydrophobicContact CG-CE2 3.91Å; L746-F1081 HydrophobicContact CG-CZ 3.99Å; V751-F1081 HydrophobicContact CG1-CE1 4.27Å; V751-F1081 HydrophobicContact CG2-CE1 4.15Å; V751-F1081 HydrophobicContact CG2-CZ 4.14Å; Q777-F1081 PolarHBondContact NE2-O 2.66Å; L782-F1081 HydrophobicContact CD1-CD1 3.62Å; L782-F1081 HydrophobicContact CD1-CE1 3.62Å; L782-F1081 HydrophobicContact CD1-CG 4.18Å; L782-F1081 HydrophobicContact CD1-CZ 4.14Å; L782-F1081 HydrophobicContact CD2-CB 4.04Å; L782-F1081 HydrophobicContact CD2-CD1 4.12Å; L782-F1081 HydrophobicContact CD2-CD2 4.35Å; L782-F1081 HydrophobicContact CD2-CG 3.89Å; L782-F1081 HydrophobicContact CG-CD1 4.49Å; H1079-F1081 VanDerWaalsContact C-N 3.27Å; H1079-F1081 PolarHBondContact O-N 3.18Å; F1081-F1084 HydrophobicContact CB-CB 4.22Å; F1081-F1084 WeakPolarHBondContact O-CB 3.45Å; F1081-F1084 PolarHBondContact O-N 3.31Å
1082	Y	72.3	Confident	62.5	Low	62 Å²	62	65 Å²	65	24%	0.243	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	141.2	167	-175.8	-108.4	0	0	0	109.7	F645 Y646 Q649 H1079 F1084	F645-Y1082 HydrophobicContact CD1-CD1 4.3Å; F645-Y1082 AromaticContact CE1-CD1 3.88Å; F645-Y1082 HydrophobicContact CE1-CD1 3.88Å; F645-Y1082 HydrophobicContact CE1-CG 4.41Å; Y646-Y1082 HydrophobicContact CD2-CD2 4.05Å; Y646-Y1082 HydrophobicContact CD2-CE1 4.06Å; Y646-Y1082 AromaticContact CD2-CE2 3.32Å; Y646-Y1082 HydrophobicContact CD2-CE2 3.32Å; Y646-Y1082 AromaticContact CD2-CZ 3.32Å; Y646-Y1082 WeakPolarHBondContact CD2-OH 3.48Å; Y646-Y1082 HydrophobicContact CE2-CD2 4.49Å; Y646-Y1082 AromaticContact CE2-CE2 3.43Å; Y646-Y1082 HydrophobicContact CE2-CE2 3.43Å; Y646-Y1082 VanDerWaalsContact CE2-CE2 3.43Å; Y646-Y1082 AromaticContact CE2-CZ 3.48Å; Y646-Y1082 VanDerWaalsContact CE2-CZ 3.48Å; Y646-Y1082 WeakPolarHBondContact CE2-OH 3.1Å; Y646-Y1082 HydrophobicContact CG-CE2 4.48Å; Q649-Y1082 HydrophobicContact CB-CE1 4.48Å; H1079-Y1082 PolarHBondContact O-N 2.89Å; Y1082-F1084 PolarHBondContact O-N 2.89Å; Y1082-F1084 VanDerWaalsContact O-N 3.08Å
1083	E	74.4	Confident	62.4	Low	52 Å²	52	67.3 Å²	67.3	24%	0.243	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	10.1	-172.2	-74.7	177.7	-177.3	0	0	117	Q649 N653 R758 T1085	Q649-E1083 WeakPolarHBondContact CG-OE2 3.22Å; N653-E1083 PolarHBondContact ND2-OE1 3.12Å; N653-E1083 PolarHBondContact ND2-OE2 2.69Å; R758-E1083 PolarHBondContact NH1-O 2.85Å; E1083-T1085 PolarHBondContact O-N 3.36Å
1084	F	84.1	Confident	62.3	Low	3 Å²	3	61.3 Å²	61.3	1%	0.013	31%	0.312	C	S	.	.			trans	-56.7	-23.3	173.5	-176.5	-93.4	0	0	0	113.2	V754 R758 S775 F776 Q777 L782 Y783 F784 F1081 Y1082 F1086	V754-F1084 HydrophobicContact CG1-CD2 4.21Å; V754-F1084 HydrophobicContact CG1-CE2 3.69Å; R758-F1084 HydrophobicContact CB-CD2 4.5Å; R758-F1084 HydrophobicContact CB-CE2 4.22Å; R758-F1084 WeakPolarHBondContact CD-O 3.3Å; R758-F1084 HydrophobicContact CG-CD2 4.41Å; R758-F1084 HydrophobicContact CG-CE2 4.33Å; S775-F1084 PolarHBondContact OG-O 3.19Å; F776-F1084 VanDerWaalsContact O-CE1 3.28Å; F776-F1084 WeakPolarHBondContact O-CE1 3.4Å; Q777-F1084 HydrophobicContact CB-CD1 4.32Å; L782-F1084 HydrophobicContact CB-CD1 4.36Å; L782-F1084 HydrophobicContact CB-CE1 3.81Å; L782-F1084 HydrophobicContact CB-CE2 4.47Å; L782-F1084 HydrophobicContact CB-CZ 3.89Å; L782-F1084 HydrophobicContact CD1-CE2 4.41Å; L782-F1084 HydrophobicContact CD2-CD1 3.8Å; L782-F1084 HydrophobicContact CD2-CD2 4.47Å; L782-F1084 HydrophobicContact CD2-CE1 4.14Å; L782-F1084 HydrophobicContact CD2-CG 4Å; L782-F1084 HydrophobicContact CG-CE1 4.48Å; Y783-F1084 WeakPolarHBondContact O-CE1 3.29Å; F784-F1084 HydrophobicContact CD1-CZ 4.36Å; F784-F1084 AromaticContact CD2-CZ 3.94Å; F784-F1084 HydrophobicContact CD2-CZ 3.94Å; F784-F1084 HydrophobicContact CE1-CE2 4.07Å; F784-F1084 HydrophobicContact CE1-CZ 4.06Å; F784-F1084 AromaticContact CE2-CE2 3.89Å; F784-F1084 HydrophobicContact CE2-CE2 3.89Å; F784-F1084 AromaticContact CE2-CZ 3.61Å; F784-F1084 HydrophobicContact CE2-CZ 3.61Å; F784-F1084 HydrophobicContact CG-CZ 4.32Å; F784-F1084 AromaticContact CZ-CE2 3.58Å; F784-F1084 HydrophobicContact CZ-CE2 3.58Å; F784-F1084 AromaticContact CZ-CZ 3.69Å; F784-F1084 HydrophobicContact CZ-CZ 3.69Å; F1081-F1084 HydrophobicContact CB-CB 4.22Å; F1081-F1084 WeakPolarHBondContact O-CB 3.45Å; F1081-F1084 PolarHBondContact O-N 3.31Å; Y1082-F1084 PolarHBondContact O-N 2.89Å; Y1082-F1084 VanDerWaalsContact O-N 3.08Å; F1084-F1086 PolarHBondContact O-N 3.45Å
1085	T	85.8	Confident	62.1	Low	86 Å²	86	63.5 Å²	63.5	53%	0.528	32%	0.321	S	S	.	.			trans	-74.5	111.9	177.7	-53.6	0	0	0	0	112.5	S775 E1083	S775-T1085 CarbonylContact O-C 3.48Å; S775-T1085 VanDerWaalsContact O-CA 3.23Å; S775-T1085 WeakPolarHBondContact O-CA 3.41Å; E1083-T1085 PolarHBondContact O-N 3.36Å
1086	F	86.5	Confident	62.1	Low	44 Å²	44	56.1 Å²	56.1	19%	0.193	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	155.4	172.1	166.7	-97.4	0	0	0	111	A762 L772 S775 F1084 R1088	A762-F1086 HydrophobicContact CB-CD1 4.02Å; A762-F1086 HydrophobicContact CB-CD2 3.72Å; A762-F1086 HydrophobicContact CB-CE1 4Å; A762-F1086 HydrophobicContact CB-CE2 3.7Å; A762-F1086 HydrophobicContact CB-CG 3.87Å; A762-F1086 HydrophobicContact CB-CZ 3.84Å; L772-F1086 HydrophobicContact CD2-CD1 3.67Å; L772-F1086 HydrophobicContact CD2-CE1 4.13Å; L772-F1086 HydrophobicContact CG-CD1 4.04Å; L772-F1086 HydrophobicContact CG-CE1 4.23Å; S775-F1086 PolarHBondContact N-O 2.94Å; S775-F1086 PolarHBondContact O-N 2.98Å; S775-F1086 WeakPolarHBondContact OG-CB 3.49Å; S775-F1086 PolarHBondContact OG-N 3.04Å; S775-F1086 VanDerWaalsContact OG-N 3.09Å; F1084-F1086 PolarHBondContact O-N 3.45Å; F1086-R1088 HydrophobicContact CE1-CB 3.91Å; F1086-R1088 HydrophobicContact CZ-CB 3.93Å; F1086-R1088 HydrophobicContact CZ-CG 4.46Å
1087	R	83.4	Confident	61.8	Low	53 Å²	53	54.2 Å²	54.2	20%	0.2	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	122	171.3	175.8	160.5	-164.8	157.9	11.8	107.4	Y774 F1089	Y774-R1087 HydrophobicContact CD1-CB 4.44Å; Y774-R1087 HydrophobicContact CD1-CG 3.92Å; Y774-R1087 HydrophobicContact CE1-CG 4.14Å; R1087-F1089 HydrophobicContact CB-CE2 4.01Å; R1087-F1089 HydrophobicContact CB-CZ 4.04Å; R1087-F1089 HydrophobicContact CG-CE1 4.1Å; R1087-F1089 HydrophobicContact CG-CE2 4.07Å; R1087-F1089 HydrophobicContact CG-CZ 3.84Å; R1087-F1089 WeakPolarHBondContact O-CD2 3.3Å; R1087-F1089 WeakPolarHBondContact O-CE2 3.47Å
1088	R	78	Confident	61.7	Low	24 Å²	24	61.3 Å²	61.3	9%	0.091	31%	0.305	C	S	.	.			trans	-67.9	147.1	165.5	-161.7	168.6	-68.5	-112.6	0.4	107.9	L761 A764 D765 L772 Y773 F1086	L761-R1088 PolarHBondContact O-NH2 2.93Å; A764-R1088 VanDerWaalsContact O-CZ 3.3Å; A764-R1088 PolarHBondContact O-NH1 3Å; A764-R1088 PolarHBondContact O-NH2 3.3Å; D765-R1088 IonicContact OD1-NH1 3.6Å; D765-R1088 PolarHBondContact OD1-NH1 3.4Å; L772-R1088 PolarHBondContact O-NE 2.98Å; Y773-R1088 WeakPolarHBondContact O-CB 3.11Å; Y773-R1088 PolarHBondContact O-N 3.47Å; F1086-R1088 HydrophobicContact CE1-CB 3.91Å; F1086-R1088 HydrophobicContact CZ-CB 3.93Å; F1086-R1088 HydrophobicContact CZ-CG 4.46Å
1089	F	60.2	Low	61.4	Low	39 Å²	39	65.2 Å²	65.2	17%	0.171	32%	0.317	C	S	.	.			trans	-128.3	155.1	177.1	-63	-90.8	0	0	0	106.9	Y696 L699 R700 R1087	Y696-F1089 HydrophobicContact CD2-CB 4.29Å; Y696-F1089 AromaticContact CD2-CD1 3.76Å; Y696-F1089 HydrophobicContact CD2-CD1 3.76Å; Y696-F1089 HydrophobicContact CD2-CD2 4.05Å; Y696-F1089 HydrophobicContact CD2-CE1 4.04Å; Y696-F1089 HydrophobicContact CD2-CE2 4.31Å; Y696-F1089 AromaticContact CD2-CG 3.77Å; Y696-F1089 HydrophobicContact CD2-CG 3.77Å; Y696-F1089 HydrophobicContact CD2-CZ 4.31Å; Y696-F1089 HydrophobicContact CE2-CB 4.17Å; Y696-F1089 AromaticContact CE2-CD1 3.95Å; Y696-F1089 HydrophobicContact CE2-CD1 3.95Å; Y696-F1089 AromaticContact CE2-CD2 3.37Å; Y696-F1089 HydrophobicContact CE2-CD2 3.37Å; Y696-F1089 HydrophobicContact CE2-CE1 4.16Å; Y696-F1089 AromaticContact CE2-CE2 3.6Å; Y696-F1089 HydrophobicContact CE2-CE2 3.6Å; Y696-F1089 AromaticContact CE2-CG 3.56Å; Y696-F1089 HydrophobicContact CE2-CG 3.56Å; Y696-F1089 AromaticContact CE2-CZ 4Å; Y696-F1089 HydrophobicContact CE2-CZ 4Å; L699-F1089 HydrophobicContact CB-CE1 4.03Å; L699-F1089 HydrophobicContact CD2-CD1 4Å; L699-F1089 HydrophobicContact CD2-CE1 3.87Å; L699-F1089 HydrophobicContact CG-CE1 3.92Å; R700-F1089 HydrophobicContact CB-CZ 3.94Å; R700-F1089 HydrophobicContact CG-CZ 4.19Å; R1087-F1089 HydrophobicContact CB-CE2 4.01Å; R1087-F1089 HydrophobicContact CB-CZ 4.04Å; R1087-F1089 HydrophobicContact CG-CE1 4.1Å; R1087-F1089 HydrophobicContact CG-CE2 4.07Å; R1087-F1089 HydrophobicContact CG-CZ 3.84Å; R1087-F1089 WeakPolarHBondContact O-CD2 3.3Å; R1087-F1089 WeakPolarHBondContact O-CE2 3.47Å
1090	F	52.6	Low	60.4	Low	110 Å²	110	66.9 Å²	66.9	48%	0.482	33%	0.329	S	S	.	.			trans	70.7	64.4	-164.2	-47.6	-80.4	0	0	0	112.4	A8 D1092	A8-F1090 HydrophobicContact CB-CD2 4.15Å; A8-F1090 HydrophobicContact CB-CE1 4.35Å; A8-F1090 HydrophobicContact CB-CE2 3.47Å; A8-F1090 VanDerWaalsContact CB-CE2 3.47Å; A8-F1090 HydrophobicContact CB-CZ 3.59Å; F1090-D1092 VanDerWaalsContact C-N 3.27Å; F1090-D1092 PolarHBondContact O-N 3.36Å
1091	D	44.9	Very low	58.9	Low	77 Å²	77	73 Å²	73	41%	0.412	36%	0.355	S	S	.	.			trans	-70.3	86.8	157.7	-60.4	-48.5	0	0	0	107.5	Y773 H1093	Y773-D1091 WeakPolarHBondContact CD1-OD1 3.43Å; Y773-D1091 WeakPolarHBondContact CE1-OD1 3.2Å; D1091-H1093 PolarHBondContact O-N 3.17Å
1092	D	38.2	Very low	56.7	Low	105 Å²	105	77 Å²	77	56%	0.561	38%	0.383	S	S	*	.			trans	-74.1	62.6	-177.1	-83.6	-20.2	0	0	0	112.1	F1090 G1094	F1090-D1092 VanDerWaalsContact C-N 3.27Å; F1090-D1092 PolarHBondContact O-N 3.36Å; D1092-G1094 PolarHBondContact O-N 3.49Å
1093	H	38.5	Very low	54.9	Low	171 Å²	171	80.3 Å²	80.3	79%	0.792	41%	0.412	S	S	*	.	S	Bend	trans	56	-5.1	176.1	-80.9	-71.7	0	0	0	118.1	D1091 C1095	D1091-H1093 PolarHBondContact O-N 3.17Å; H1093-C1095 PolarHBondContact O-N 3.33Å; H1093-C1095 VanDerWaalsContact O-N 3.13Å
1094	G	39.8	Very low	53.1	Low	50 Å²	50	84.5 Å²	84.5	52%	0.515	43%	0.432	S	S	.	.			trans	-59.8	113.8	166.1	0	0	0	0	0	110.6	D1092	D1092-G1094 PolarHBondContact O-N 3.49Å
1095	C	40.3	Very low	50.6	Low	81 Å²	81	88.7 Å²	88.7	55%	0.547	47%	0.467	S	S	.	.			trans	-55.3	135.6	150.3	-66.4	0	0	0	0	106.8	H1093 F1097	H1093-C1095 PolarHBondContact O-N 3.33Å; H1093-C1095 VanDerWaalsContact O-N 3.13Å; C1095-F1097 WeakPolarHBondContact CB-O 3.3Å; C1095-F1097 PolarHBondContact O-N 3.01Å
1096	P	50.7	Low	48.2	Very low	21 Å²	21	92.1 Å²	92.1	14%	0.136	48%	0.482	C	S	.	.	S	Bend	trans	-57.6	-21.3	179.2	-19.2	28.8	0	0	0	112.6	A733 L734 Y735 Y773	A733-P1096 HydrophobicContact CB-CG 4.22Å; L734-P1096 WeakPolarHBondContact O-CB 3.33Å; Y735-P1096 HydrophobicContact CD1-CB 4.22Å; Y735-P1096 HydrophobicContact CD1-CG 3.88Å; Y735-P1096 HydrophobicContact CE1-CB 4.07Å; Y735-P1096 HydrophobicContact CE1-CG 3.3Å; Y735-P1096 HydrophobicContact CE2-CG 4.25Å; Y773-P1096 HydrophobicContact CE2-CB 3.95Å; Y773-P1096 HydrophobicContact CE2-CG 4.18Å
1097	F	47.2	Very low	45.5	Very low	11 Å²	11	94.8 Å²	94.8	5%	0.048	51%	0.512	C	S	.	.	S	Bend	trans	-115.6	122.2	172.7	-170.9	-90.1	0	0	0	109	Y788 P790 P1038 C1095	Y788-F1097 HydrophobicContact CD1-CD2 4.05Å; Y788-F1097 HydrophobicContact CD1-CE2 4.35Å; P790-F1097 HydrophobicContact CB-CE2 4.02Å; P790-F1097 HydrophobicContact CG-CE2 3.77Å; P1038-F1097 VanDerWaalsContact CA-CE1 3.45Å; P1038-F1097 VanDerWaalsContact CA-CZ 3.47Å; P1038-F1097 HydrophobicContact CB-CD1 3.86Å; P1038-F1097 HydrophobicContact CB-CE1 3.44Å; P1038-F1097 VanDerWaalsContact CB-CE1 3.44Å; P1038-F1097 HydrophobicContact CB-CZ 4.02Å; P1038-F1097 HydrophobicContact CG-CD1 4.44Å; P1038-F1097 HydrophobicContact CG-CE1 3.83Å; C1095-F1097 WeakPolarHBondContact CB-O 3.3Å; C1095-F1097 PolarHBondContact O-N 3.01Å
1098	R	52.3	Low	43	Very low	177 Å²	177	98 Å²	98	67%	0.668	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-79.3	132.1	161.3	-74.6	-179.8	174.3	163.4	-1.9	107.6	L842 D843	L842-R1098 HydrophobicContact CD1-CB 4.44Å; L842-R1098 HydrophobicContact CD2-CB 4.05Å; D843-R1098 IonicContact OD2-NH1 3.95Å
1099	Y	46.8	Very low	40.8	Very low	174 Å²	174	104.6 Å²	104.6	68%	0.682	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-55.8	138.8	167.5	-67.2	-89.8	0	0	0	109.4	P1038 K1101	P1038-Y1099 HydrophobicContact CG-CD1 3.6Å; P1038-Y1099 HydrophobicContact CG-CE1 3.73Å; Y1099-K1101 PolarHBondContact O-N 3.26Å
1100	P	43.5	Very low	39.2	Very low	45 Å²	45	108.6 Å²	108.6	29%	0.292	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-50.3	133.4	165.2	-24.4	33.1	0	0	0	108.8	I1035	I1035-P1100 HydrophobicContact CG2-CG 4.32Å
1101	K	37.8	Very low	38.2	Very low	130 Å²	130	109.4 Å²	109.4	57%	0.565	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-56.7	136.2	160.8	-75.6	-178.1	158.6	-155.2	0	107.2	Y1099 E1104	Y1099-K1101 PolarHBondContact O-N 3.26Å; K1101-E1104 WeakPolarHBondContact CD-OE1 3.45Å; K1101-E1104 VanDerWaalsContact CE-OE1 3.28Å; K1101-E1104 WeakPolarHBondContact CE-OE1 3.47Å; K1101-E1104 IonicContact NZ-OE1 2.92Å; K1101-E1104 PolarHBondContact NZ-OE1 3.33Å; K1101-E1104 IonicContact NZ-OE2 3.7Å; K1101-E1104 PolarHBondContact NZ-OE2 3.5Å
1102	P	34.2	Very low	37.6	Very low	102 Å²	102	111.6 Å²	111.6	66%	0.662	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-56.5	153.3	161.1	28.7	-34.3	0	0	0	108.7	E1104	P1102-E1104 PolarHBondContact O-N 2.92Å
1103	P	33.9	Very low	37.1	Very low	132 Å²	132	111.8 Å²	111.8	86%	0.857	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-57.3	117.8	173.4	24.7	-32.7	0	0	0	109	A1105	P1103-A1105 PolarHBondContact O-N 3.41Å
1104	E	35.6	Very low	36.7	Very low	140 Å²	140	108.5 Å²	108.5	65%	0.654	66%	0.661	S	S	*	*			trans	-71.6	109.5	171.7	-74.1	167.2	-163.6	0	0	106.3	K1101 P1102	K1101-E1104 WeakPolarHBondContact CD-OE1 3.45Å; K1101-E1104 VanDerWaalsContact CE-OE1 3.28Å; K1101-E1104 WeakPolarHBondContact CE-OE1 3.47Å; K1101-E1104 IonicContact NZ-OE1 2.92Å; K1101-E1104 PolarHBondContact NZ-OE1 3.33Å; K1101-E1104 IonicContact NZ-OE2 3.7Å; K1101-E1104 PolarHBondContact NZ-OE2 3.5Å; P1102-E1104 PolarHBondContact O-N 2.92Å
1105	A	32.2	Very low	36.2	Very low	91 Å²	91	109.6 Å²	109.6	75%	0.752	67%	0.673	S	S	*	*			trans	-63.1	144.3	175.3	0	0	0	0	0	110	P1103 A1107	P1103-A1105 PolarHBondContact O-N 3.41Å; A1105-A1107 PolarHBondContact O-N 3.5Å
1106	D	35.7	Very low	36.3	Very low	158 Å²	158	111.7 Å²	111.7	85%	0.845	69%	0.685	S	S	*	*			trans	-60.7	95.4	-169.8	-73.2	-69.7	0	0	0	113.5	C1108	D1106-C1108 PolarHBondContact O-N 3.37Å; D1106-C1108 VanDerWaalsContact O-N 3.15Å
1107	A	29.8	Very low	35.3	Very low	100 Å²	100	120.2 Å²	120.2	83%	0.826	72%	0.723	S	S	*	*			trans	-81.3	86.5	169.9	0	0	0	0	0	109.5	A1105	A1105-A1107 PolarHBondContact O-N 3.5Å
1108	C	30.3	Very low	34.5	Very low	119 Å²	119	129.5 Å²	129.5	80%	0.804	77%	0.767	S	S	*	*			trans	-57.4	155.3	-179.7	-76.6	0	0	0	0	114.3	D1106	D1106-C1108 PolarHBondContact O-N 3.37Å; D1106-C1108 VanDerWaalsContact O-N 3.15Å
1109	L	32.6	Very low	33.3	Very low	163 Å²	163	124 Å²	124	85%	0.853	77%	0.766	S	S	*	*			trans	-39.7	129.7	-178.5	-63.6	163.2	0	0	0	115.1	V1111	L1109-V1111 PolarHBondContact O-N 3.1Å
1110	S	27	Very low	32.6	Very low	123 Å²	123	124.2 Å²	124.2	86%	0.86	77%	0.773	S	S	*	*			trans	-74.1	111.8	166.7	59.9	0	0	0	0	111.4
1111	V	30.5	Very low	31.8	Very low	128 Å²	128	130.4 Å²	130.4	78%	0.776	80%	0.798	S	S	*	*			trans	-109.5	135.3	165.7	-179.1	0	0	0	0	107.8	L1109	L1109-V1111 PolarHBondContact O-N 3.1Å
1112	P	31.8	Very low	31.4	Very low	123 Å²	123	129.1 Å²	129.1	80%	0.799	80%	0.801	S	S	*	*			trans	-72.4	150.4	-173.8	29.4	-35.8	0	0	0	112.8
1113	A	29.3	Very low	31.1	Very low	108 Å²	108	132 Å²	132	89%	0.893	81%	0.806	S	S	*	*			trans	-71.1	143	-171.5	0	0	0	0	0	114.7
1114	A	29.5	Very low	30.8	Very low	102 Å²	102	134.6 Å²	134.6	84%	0.843	81%	0.806	S	S	*	*			trans	-130.5	167.3	157.8	0	0	0	0	0	108.7
1115	G	28.7	Very low	30.6	Very low	74 Å²	74	135.8 Å²	135.8	76%	0.763	81%	0.812	S	S	*	*			trans	-75.8	172.6	-168.2	0	0	0	0	0	116.4
1116	P	42.4	Very low	30.7	Very low	125 Å²	125	139 Å²	139	81%	0.812	81%	0.811	S	S	*	*			trans	-95	157	-171.5	38	-35.7	0	0	0	114.4
1117	E	29.2	Very low	30.6	Very low	199 Å²	199	138.8 Å²	138.8	93%	0.93	81%	0.805	S	S	*	*			trans	-143.4	176.1	152.6	-73.1	-159.9	151.8	0	0	109.5
1118	E	30.6	Very low	30.9	Very low	206 Å²	206	139.3 Å²	139.3	96%	0.963	80%	0.798	S	S	*	*			trans	-114.9	173.2	-157.6	-56.7	174.4	146.2	0	0	114
1119	G	28.7	Very low	31.2	Very low	63 Å²	63	142.7 Å²	142.7	65%	0.649	80%	0.802	S	S	*	*			trans	137.4	111.7	177.6	0	0	0	0	0	111.6
1120	E	30.5	Very low	31.3	Very low	177 Å²	177	141.6 Å²	141.6	83%	0.827	80%	0.797	S	S	*	*				68.8	106.5	82.5	-70.6	-180	172.2	0	0	111.8
1121	E	28.3	Very low	31.6	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	80%	0.796	S	S	*	*				74.4	143.6	98.9	-70.9	-177.5	-170.5	0	0	112.8
1122	T	27.6	Very low	31.7	Very low	104 Å²	104	145.1 Å²	145.1	64%	0.638	80%	0.796	S	S	*	*			cis	-153.6	-173.1	16.3	-13	0	0	0	0	110.7
1123	E	29.1	Very low	31.8	Very low	163 Å²	163	148.2 Å²	148.2	76%	0.762	80%	0.8	S	S	*	*			trans	69.5	116.5	152.4	-73.9	147.6	-123.5	0	0	116.3
1124	E	28.1	Very low	32.1	Very low	185 Å²	185	151.7 Å²	151.7	86%	0.864	80%	0.798	S	S	*	*			cis	53.8	117.9	30.4	-65.2	-179.9	-177.3	0	0	111.7
1125	E	31.3	Very low	32.3	Very low	165 Å²	165	150.5 Å²	150.5	77%	0.771	80%	0.795	S	S	*	*				-154.5	135.7	78.3	-83.1	170.4	176.4	0	0	110.1
1126	E	34	Very low	32.5	Very low	158 Å²	158	156.3 Å²	156.3	74%	0.738	80%	0.803	S	S	*	*				82.1	150.6	100.5	-65.1	-171.3	165.7	0	0	115.6
1127	E	32.7	Very low	31.9	Very low	155 Å²	155	154 Å²	154	72%	0.724	80%	0.802	S	S	*	*			cis	-158.9	171.8	-0.9	-128.7	-168.5	164.9	0	0	112
1128	V	35.9	Very low	32	Very low	111 Å²	111	148.3 Å²	148.3	67%	0.673	80%	0.796	S	S	*	*			trans	56	121.4	145.3	170.8	0	0	0	0	121.8
1129	E	36.2	Very low	31.9	Very low	190 Å²	190	148.2 Å²	148.2	89%	0.888	80%	0.796	S	S	*	*				-160	152.2	125.1	-155.6	167.8	-128.4	0	0	108.5
1130	D	34.7	Very low	31.9	Very low	139 Å²	139	148.3 Å²	148.3	74%	0.743	80%	0.797	S	S	*	*			trans	-97.2	170.2	-161.1	-23.5	-99.8	0	0	0	114.6
1131	D	33.5	Very low	31.9	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	80%	0.801	S	S	*	*			cis	-159.9	175.4	3.8	-149.7	-20.4	0	0	0	111.1
1132	E	33.9	Very low	32.2	Very low	169 Å²	169	146.1 Å²	146.1	79%	0.79	80%	0.8	S	S	*	*			trans	-111.3	163.8	-171.8	-59.8	-172.4	131.5	0	0	117
1133	E	34.3	Very low	32.6	Very low	188 Å²	188	146.8 Å²	146.8	88%	0.879	81%	0.806	S	S	*	*			trans	173.6	100.7	141.3	-98.8	-171.9	167.7	0	0	107
1134	E	35.8	Very low	32.6	Very low	182 Å²	182	144.8 Å²	144.8	85%	0.85	81%	0.805	S	S	*	*				56.6	132.4	82.2	-64.9	-139.5	128.5	0	0	114.8
1135	G	32	Very low	32.8	Very low	76 Å²	76	146.6 Å²	146.6	78%	0.784	81%	0.805	S	S	*	*			cis	-165.8	-165.6	-2.4	0	0	0	0	0	108.8
1136	E	34.5	Very low	33	Very low	197 Å²	197	148.7 Å²	148.7	92%	0.921	83%	0.829	S	S	*	*			cis	-162.3	158	-3.5	-163.1	-155.5	166.5	0	0	108.1
1137	G	29.3	Very low	32.9	Very low	77 Å²	77	148.2 Å²	148.2	79%	0.794	83%	0.833	S	S	*	*			trans	89.7	123.8	150.2	0	0	0	0	0	119
1138	G	29.9	Very low	32.9	Very low	79 Å²	79	147.8 Å²	147.8	81%	0.814	84%	0.839	S	S	*	*			trans	148.9	64.6	161.9	0	0	0	0	0	117.5
1139	E	30.2	Very low	32.8	Very low	203 Å²	203	149.9 Å²	149.9	95%	0.949	85%	0.848	S	S	*	*			trans	-57.5	151.6	157.4	-55.4	168.4	117.2	0	0	110.2
1140	G	28.5	Very low	32.6	Very low	65 Å²	65	147.5 Å²	147.5	67%	0.67	85%	0.846	S	S	*	*			cis	165.5	-168.5	0.8	0	0	0	0	0	110.5
1141	C	29.6	Very low	32.4	Very low	135 Å²	135	148.1 Å²	148.1	91%	0.912	85%	0.852	S	S	*	*			trans	64.3	129.1	167.1	-60	0	0	0	0	119.6
1142	E	34.6	Very low	32.4	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.804	85%	0.853	S	S	*	*			trans	-63.3	171.6	151.8	-53.7	-172	138.7	0	0	110.9
1143	P	35.8	Very low	32.3	Very low	117 Å²	117	146 Å²	146	76%	0.76	86%	0.858	S	S	*	*				-142.4	136	94.2	35.1	-20.6	0	0	0	116.2
1144	V	29.9	Very low	32.1	Very low	122 Å²	122	142.8 Å²	142.8	74%	0.739	86%	0.856	S	S	*	*				45.4	127	124.9	-171.2	0	0	0	0	119.7
1145	Y	32.3	Very low	31.8	Very low	222 Å²	222	139.5 Å²	139.5	87%	0.871	86%	0.857	S	S	*	*			trans	-63.8	160.4	173.5	-88	-100.6	0	0	0	116.1
1146	V	34.9	Very low	31.8	Very low	209 Å²	209	145.3 Å²	145.3	100%	1.267	86%	0.864	S	S	*	*			trans	-121.8	0	151.2	-177.5	0	0	0	0	108.8

Retrieved 1,146 of 1,146 residues in 702.5 ms (Link to these results)

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