A0A087XBH4_POEFO Loading...

RNA binding motif protein 27

May be involved in the turnover of nuclear polyadenylated (pA+) RNA.

AlphaFold DB , UniProt , Accession A0A087XBH4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,048 aa.

						>A0A087XBH4_POEFO|A0A087XBH4
MIIENVEAFKSWLAKLLEPICDADPAALANYVVALVKKDKPEKELKALCADQLDVFLQKETVGFVDKLFESLTTKSYLGNPAAKEGPKEEVKPATLKVDVVEAETPEEERENRRRRSPLRNRADFNESRSREDRRRDERKRRDFERHSKAGEAHRERERHERRRGSPRGRSYSRSRSRSRSGSRGKSRDREHRGGRDFKSKFEVERKDNDGYNTSQTSGPQQQHPPPLLPLPTPPHPHPFSSATSSAGVGGVPVVTPAHLPDSTTDSWSSYYIAQRQDGVGKPFGGKNTPLKQRCRDYDEKGFCVLGDMCPFDHGSDPLIVDDVTLPKMIPFPPPPVMPPAGMPMPPITEPPPSLRMPAMPPYAQPPPPGVFPMTGPPLIATSGIDTPNHQSAITSSPPIGPPGVGLPSTLPPPPPPAPPQPPSSSSSVSLRPQYVQSEYNYDPEGYNPESPGLTAAGRNTYRQFIPRVQTQRSNLIGLTSSEGQGSRAANIVIQTEPASASNSPGNNVSRFNTEQDSRKRTMGASLADGPAAKKPWMEKPDFAGQGKNIFPKRNHYVNTKLEVRKIPRELNNITKLNEHFSKFGTIVNIQVVFGGDPEAALIQYTKNEEARRAISSIEAVLNNRFIRVYWHREPSTNTAGQEPTSGSQGIGSVPGQGLPHSNMHKGIKQHSPGAYVLNKTVPKHHLNAAPGTTIATKTNGMNPNSDALTVAPNTQKGPYTPTAAKSSSKSLGKTGKVLEVQEAIKKKQEAMKLQQDMRKKKQEMLKTQIECQKALINRLEKNRAMKPEERANIMKTLKELTEKITQLQNEMNPTSQVSSGKTNHSQPKTKTDAQKELLDAELDFHKKISSGEDTTDLKRKLVELRVEAKRLGLIIPPPGRGRGRGKMAPDPGAMHAGRGRSRSREMMTRSGVVNRMVVDHRPRTLAILGVAQEEKEELMLHFTKFGEIEELRYQDANTVIMTFKSRSEAENAANQGAKFKSRVLQISWYKPKSLSVTSEPEAEETKDEEKAKEASSYLPGNEEGREDEEEEEDDDEDDENESRSWRR
					

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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	65.6	Low	77.4	Confident	63 Å²	63	69 Å²	69	31%	0.31	36%	0.363	S	S	.	.				0	150.7	0	-164.2	171.9	-174.3	0	0	108.5	V36 F69 L72 T73	M1-V36 HydrophobicContact CB-CG1 3.98Å; M1-V36 PolarHBondContact N-O 3.26Å; M1-F69 HydrophobicContact SD-CD1 4.02Å; M1-F69 HydrophobicContact SD-CE1 4.11Å; M1-L72 HydrophobicContact CE-CB 3.57Å; M1-L72 HydrophobicContact SD-CB 3.83Å; M1-L72 HydrophobicContact SD-CD1 3.99Å; M1-L72 HydrophobicContact SD-CG 4.44Å; M1-T73 HydrophobicContact CE-CG2 3.73Å
2	I	65.6	Low	78.3	Confident	146 Å²	146	68.6 Å²	68.6	75%	0.749	35%	0.353	S	S	*	.			trans	-83.4	127.3	-179.2	-57.4	178.1	0	0	0	109.5	E4	I2-E4 HydrophobicContact CG2-CG 4.47Å
3	I	75.9	Confident	78.9	Confident	22 Å²	22	63.4 Å²	63.4	11%	0.113	33%	0.326	C	S	.	.			trans	-110.9	121.6	172.7	-53.1	173.1	0	0	0	106.8	V6 F9 V36 K37 L72 Y77	I3-V6 HydrophobicContact CB-CG2 4.35Å; I3-V6 HydrophobicContact CG2-CG2 4.11Å; I3-F9 HydrophobicContact CD1-CD1 4.07Å; I3-F9 HydrophobicContact CD1-CE1 3.99Å; I3-F9 HydrophobicContact CG2-CB 3.97Å; I3-F9 HydrophobicContact CG2-CD1 4.08Å; I3-F9 HydrophobicContact CG2-CG 4.08Å; I3-V36 HydrophobicContact CD1-CB 4.28Å; I3-V36 HydrophobicContact CD1-CG1 3.86Å; I3-V36 HydrophobicContact CG1-CG1 4.07Å; I3-K37 HydrophobicContact CD1-CG 4.24Å; I3-L72 HydrophobicContact CG1-CD2 4.07Å; I3-Y77 HydrophobicContact CG2-CE2 4.3Å
4	E	69.9	Low	79.4	Confident	111 Å²	111	60.5 Å²	60.5	52%	0.519	32%	0.316	S	S	.	.	S	Bend	trans	-85.7	-35.8	-170.5	-65.9	-176	160.4	0	0	112.7	I2 K75 Y77 L78	I2-E4 HydrophobicContact CG2-CG 4.47Å; E4-K75 WeakPolarHBondContact OE1-CE 3.16Å; E4-K75 IonicContact OE1-NZ 3.77Å; E4-K75 PolarHBondContact OE1-NZ 3.35Å; E4-K75 WeakPolarHBondContact OE2-CD 3.34Å; E4-K75 VanDerWaalsContact OE2-CE 3.25Å; E4-K75 WeakPolarHBondContact OE2-CE 3.16Å; E4-K75 IonicContact OE2-NZ 3.12Å; E4-K75 PolarHBondContact OE2-NZ 2.73Å; E4-Y77 PolarHBondContact N-OH 3.1Å; E4-L78 HydrophobicContact CB-CD1 4.37Å
5	N	77.9	Confident	79.7	Confident	64 Å²	64	67 Å²	67	34%	0.342	34%	0.341	S	S	.	.			trans	-130.3	108.9	167.4	-174.5	-24	0	0	0	109.9	E7 A8 F9 L78	N5-E7 VanDerWaalsContact C-N 3.33Å; N5-E7 PolarHBondContact OD1-N 3Å; N5-A8 HydrophobicContact CB-CB 3.99Å; N5-A8 PolarHBondContact OD1-N 3.44Å; N5-F9 WeakPolarHBondContact O-CB 3.34Å; N5-F9 PolarHBondContact O-N 2.96Å; N5-F9 VanDerWaalsContact O-N 3.11Å; N5-L78 HydrophobicContact CB-CD2 3.51Å
6	V	80.3	Confident	80	Confident	40 Å²	40	65.4 Å²	65.4	24%	0.242	33%	0.333	C	S	.	.	H	α-helix	trans	-71.7	-27.2	-177.2	175.4	0	0	0	0	112.2	I3 K10 V33	I3-V6 HydrophobicContact CB-CG2 4.35Å; I3-V6 HydrophobicContact CG2-CG2 4.11Å; V6-K10 WeakPolarHBondContact O-CB 3.21Å; V6-K10 VanDerWaalsContact O-CG 3.24Å; V6-K10 WeakPolarHBondContact O-CG 3.46Å; V6-K10 PolarHBondContact O-N 3.15Å; V6-K10 VanDerWaalsContact O-N 3.07Å; V6-V33 HydrophobicContact CG1-CG1 4.06Å
7	E	80.5	Confident	80.2	Confident	148 Å²	148	61.5 Å²	61.5	69%	0.692	31%	0.314	S	S	*	.	H	α-helix	trans	-85.5	-42.4	-176.4	-65.3	176.4	172.7	0	0	111.6	N5 F9 K10 S11	N5-E7 VanDerWaalsContact C-N 3.33Å; N5-E7 PolarHBondContact OD1-N 3Å; E7-F9 VanDerWaalsContact C-N 3.34Å; E7-K10 PolarHBondContact O-N 3.05Å; E7-S11 WeakPolarHBondContact O-CB 3.27Å; E7-S11 PolarHBondContact O-N 3.23Å; E7-S11 PolarHBondContact O-OG 2.71Å
8	A	81.2	Confident	80.3	Confident	29 Å²	29	65.6 Å²	65.6	24%	0.24	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-45.1	168.6	0	0	0	0	0	111	N5 K10 S11 W12	N5-A8 HydrophobicContact CB-CB 3.99Å; N5-A8 PolarHBondContact OD1-N 3.44Å; A8-K10 PolarHBondContact O-N 3.03Å; A8-S11 PolarHBondContact O-N 2.88Å; A8-W12 WeakPolarHBondContact O-CB 3.35Å; A8-W12 PolarHBondContact O-N 2.73Å
9	F	84.6	Confident	80.3	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.2	-45.2	176.9	-177.5	-115.1	0	0	0	112.8	I3 N5 E7 S11 W12 L13 V33 L68 L72 Y77	I3-F9 HydrophobicContact CD1-CD1 4.07Å; I3-F9 HydrophobicContact CD1-CE1 3.99Å; I3-F9 HydrophobicContact CG2-CB 3.97Å; I3-F9 HydrophobicContact CG2-CD1 4.08Å; I3-F9 HydrophobicContact CG2-CG 4.08Å; N5-F9 WeakPolarHBondContact O-CB 3.34Å; N5-F9 PolarHBondContact O-N 2.96Å; N5-F9 VanDerWaalsContact O-N 3.11Å; E7-F9 VanDerWaalsContact C-N 3.34Å; F9-S11 VanDerWaalsContact C-N 3.32Å; F9-S11 PolarHBondContact O-N 3.22Å; F9-W12 HydrophobicContact CD2-CE3 4.14Å; F9-W12 HydrophobicContact CD2-CZ3 4.49Å; F9-W12 HydrophobicContact CE2-CE3 4.13Å; F9-W12 HydrophobicContact CE2-CZ3 4.04Å; F9-W12 PolarHBondContact O-N 3.45Å; F9-L13 HydrophobicContact CE2-CD1 4.34Å; F9-L13 HydrophobicContact CZ-CD1 4.05Å; F9-L13 VanDerWaalsContact O-CB 3.24Å; F9-L13 WeakPolarHBondContact O-CB 3.39Å; F9-L13 PolarHBondContact O-N 3.44Å; F9-V33 HydrophobicContact CD1-CG2 3.62Å; F9-V33 HydrophobicContact CE1-CG2 3.77Å; F9-L68 HydrophobicContact CE2-CD1 3.91Å; F9-L68 HydrophobicContact CZ-CD1 3.56Å; F9-L72 HydrophobicContact CD2-CD2 4.14Å; F9-L72 HydrophobicContact CE1-CD2 4.39Å; F9-L72 HydrophobicContact CE2-CD1 4.32Å; F9-L72 HydrophobicContact CE2-CD2 3.56Å; F9-L72 HydrophobicContact CE2-CG 3.79Å; F9-L72 HydrophobicContact CZ-CD1 3.99Å; F9-L72 HydrophobicContact CZ-CD2 3.69Å; F9-L72 HydrophobicContact CZ-CG 3.95Å; F9-Y77 HydrophobicContact CB-CD2 3.56Å; F9-Y77 HydrophobicContact CB-CE2 3.85Å; F9-Y77 HydrophobicContact CB-CG 4.11Å; F9-Y77 AromaticContact CD2-CD1 3.77Å; F9-Y77 HydrophobicContact CD2-CD1 3.77Å; F9-Y77 AromaticContact CD2-CD2 3.98Å; F9-Y77 HydrophobicContact CD2-CD2 3.98Å; F9-Y77 HydrophobicContact CD2-CE1 4.24Å; F9-Y77 HydrophobicContact CD2-CE2 4.41Å; F9-Y77 AromaticContact CD2-CG 3.63Å; F9-Y77 HydrophobicContact CD2-CG 3.63Å; F9-Y77 HydrophobicContact CE2-CD1 4.38Å; F9-Y77 HydrophobicContact CG-CD2 4.22Å; F9-Y77 HydrophobicContact CG-CE2 4.48Å; F9-Y77 HydrophobicContact CG-CG 4.33Å
10	K	85.9	Confident	80.1	Confident	63 Å²	63	66.5 Å²	66.5	27%	0.274	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-41.6	172.9	-78.2	175.6	-171.1	-173.3	0	112.4	V6 E7 A8 L13 A14 N30 V33	V6-K10 WeakPolarHBondContact O-CB 3.21Å; V6-K10 VanDerWaalsContact O-CG 3.24Å; V6-K10 WeakPolarHBondContact O-CG 3.46Å; V6-K10 PolarHBondContact O-N 3.15Å; V6-K10 VanDerWaalsContact O-N 3.07Å; E7-K10 PolarHBondContact O-N 3.05Å; A8-K10 PolarHBondContact O-N 3.03Å; K10-L13 PolarHBondContact O-N 3.49Å; K10-A14 WeakPolarHBondContact O-CB 3.12Å; K10-A14 PolarHBondContact O-N 2.72Å; K10-N30 WeakPolarHBondContact CE-OD1 3.3Å; K10-N30 PolarHBondContact NZ-OD1 2.82Å; K10-V33 HydrophobicContact CG-CG2 3.9Å
11	S	84.5	Confident	79.9	Confident	73 Å²	73	64 Å²	64	51%	0.51	33%	0.332	S	S	.	.	H	α-helix	trans	-70.1	-38	-176.8	-54.6	0	0	0	0	112.2	E7 A8 F9 K15	E7-S11 WeakPolarHBondContact O-CB 3.27Å; E7-S11 PolarHBondContact O-N 3.23Å; E7-S11 PolarHBondContact O-OG 2.71Å; A8-S11 PolarHBondContact O-N 2.88Å; F9-S11 VanDerWaalsContact C-N 3.32Å; F9-S11 PolarHBondContact O-N 3.22Å; S11-K15 PolarHBondContact O-N 3.2Å
12	W	87.8	Confident	80.1	Confident	64 Å²	64	69.7 Å²	69.7	24%	0.242	36%	0.363	C	S	.	.	H	α-helix	trans	-63.8	-46	169.6	174	80.8	0	0	0	111.3	A8 F9 K15 L16 L68 S71	A8-W12 WeakPolarHBondContact O-CB 3.35Å; A8-W12 PolarHBondContact O-N 2.73Å; F9-W12 HydrophobicContact CD2-CE3 4.14Å; F9-W12 HydrophobicContact CD2-CZ3 4.49Å; F9-W12 HydrophobicContact CE2-CE3 4.13Å; F9-W12 HydrophobicContact CE2-CZ3 4.04Å; F9-W12 PolarHBondContact O-N 3.45Å; W12-K15 PolarHBondContact O-N 2.82Å; W12-L16 HydrophobicContact CH2-CD2 3.51Å; W12-L16 HydrophobicContact CZ2-CD2 3.66Å; W12-L16 HydrophobicContact CZ3-CD2 4.15Å; W12-L16 PolarHBondContact O-N 2.96Å; W12-L16 VanDerWaalsContact O-N 3.12Å; W12-L68 HydrophobicContact CZ3-CD1 4.17Å; W12-S71 VanDerWaalsContact CH2-OG 3.23Å; W12-S71 WeakPolarHBondContact CH2-OG 3.49Å; W12-S71 WeakPolarHBondContact CZ2-OG 3.27Å
13	L	86.5	Confident	80.6	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-69	-36.4	-176.8	-158.2	113.6	0	0	0	112.8	F9 K10 L16 L17 A29 V32 F64 L68	F9-L13 HydrophobicContact CE2-CD1 4.34Å; F9-L13 HydrophobicContact CZ-CD1 4.05Å; F9-L13 VanDerWaalsContact O-CB 3.24Å; F9-L13 WeakPolarHBondContact O-CB 3.39Å; F9-L13 PolarHBondContact O-N 3.44Å; K10-L13 PolarHBondContact O-N 3.49Å; L13-L16 PolarHBondContact O-N 3.41Å; L13-L17 HydrophobicContact CD2-CD1 3.59Å; L13-L17 HydrophobicContact CD2-CG 4.33Å; L13-L17 HydrophobicContact CG-CD1 4.26Å; L13-L17 WeakPolarHBondContact O-CB 3.46Å; L13-L17 WeakPolarHBondContact O-CG 3.35Å; L13-L17 PolarHBondContact O-N 3.05Å; L13-A29 HydrophobicContact CB-CB 4.26Å; L13-A29 VanDerWaalsContact CD2-CA 3.44Å; L13-A29 HydrophobicContact CD2-CB 3.63Å; L13-V32 HydrophobicContact CD1-CG1 3.91Å; L13-V32 HydrophobicContact CD2-CB 3.71Å; L13-V32 HydrophobicContact CD2-CG1 3.99Å; L13-V32 HydrophobicContact CD2-CG2 3.91Å; L13-F64 HydrophobicContact CD1-CZ 3.84Å; L13-F64 HydrophobicContact CD2-CZ 4.27Å; L13-F64 HydrophobicContact CG-CZ 3.98Å; L13-L68 HydrophobicContact CD1-CD1 3.31Å
14	A	85.1	Confident	80.9	Confident	23 Å²	23	68.2 Å²	68.2	19%	0.19	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-48.1	174.4	0	0	0	0	0	111.1	K10 L16 L17 E18 P25	K10-A14 WeakPolarHBondContact O-CB 3.12Å; K10-A14 PolarHBondContact O-N 2.72Å; A14-L16 VanDerWaalsContact C-N 3.25Å; A14-L16 PolarHBondContact O-N 2.73Å; A14-L17 PolarHBondContact O-N 3.12Å; A14-L17 VanDerWaalsContact O-N 3.12Å; A14-E18 VanDerWaalsContact O-CB 3.31Å; A14-E18 WeakPolarHBondContact O-CB 3.26Å; A14-E18 PolarHBondContact O-N 2.86Å; A14-P25 HydrophobicContact CB-CB 4.48Å
15	K	84.5	Confident	81.5	Confident	158 Å²	158	64.6 Å²	64.6	69%	0.687	35%	0.349	S	S	*	.	H	α-helix	trans	-63.2	-27	175.5	-69.2	-178.4	176.4	-170.7	0	114.1	S11 W12 P19	S11-K15 PolarHBondContact O-N 3.2Å; W12-K15 PolarHBondContact O-N 2.82Å; K15-P19 WeakPolarHBondContact O-CD 3.42Å
16	L	83.8	Confident	81.6	Confident	41 Å²	41	64 Å²	64	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-82.5	-23.7	176.4	-172.7	61.3	0	0	0	112.5	W12 L13 A14 I20 F64	W12-L16 HydrophobicContact CH2-CD2 3.51Å; W12-L16 HydrophobicContact CZ2-CD2 3.66Å; W12-L16 HydrophobicContact CZ3-CD2 4.15Å; W12-L16 PolarHBondContact O-N 2.96Å; W12-L16 VanDerWaalsContact O-N 3.12Å; L13-L16 PolarHBondContact O-N 3.41Å; A14-L16 VanDerWaalsContact C-N 3.25Å; A14-L16 PolarHBondContact O-N 2.73Å; L16-I20 VanDerWaalsContact O-CD1 3.22Å; L16-I20 WeakPolarHBondContact O-CD1 3.21Å; L16-I20 WeakPolarHBondContact O-CG1 3.41Å; L16-F64 HydrophobicContact CB-CE2 4.41Å; L16-F64 HydrophobicContact CD2-CD2 3.97Å; L16-F64 HydrophobicContact CD2-CE2 3.72Å; L16-F64 HydrophobicContact CG-CD2 4.08Å; L16-F64 HydrophobicContact CG-CE2 3.86Å
17	L	83.4	Confident	81.9	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-91.6	-31	177.5	-71.5	178.7	0	0	0	113.3	L13 A14 P19 I20 C21 P25 L28 L57 F64	L13-L17 HydrophobicContact CD2-CD1 3.59Å; L13-L17 HydrophobicContact CD2-CG 4.33Å; L13-L17 HydrophobicContact CG-CD1 4.26Å; L13-L17 WeakPolarHBondContact O-CB 3.46Å; L13-L17 WeakPolarHBondContact O-CG 3.35Å; L13-L17 PolarHBondContact O-N 3.05Å; A14-L17 PolarHBondContact O-N 3.12Å; A14-L17 VanDerWaalsContact O-N 3.12Å; L17-P19 VanDerWaalsContact C-CD 3.49Å; L17-P19 VanDerWaalsContact C-N 3.33Å; L17-I20 PolarHBondContact O-N 2.93Å; L17-C21 PolarHBondContact O-N 3.08Å; L17-P25 HydrophobicContact CB-CB 3.88Å; L17-L28 HydrophobicContact CD1-CB 3.91Å; L17-L28 HydrophobicContact CD1-CD1 4.31Å; L17-L28 HydrophobicContact CD1-CD2 4.04Å; L17-L28 HydrophobicContact CD1-CG 4.3Å; L17-L57 HydrophobicContact CD2-CD1 3.86Å; L17-L57 HydrophobicContact CD2-CD2 3.73Å; L17-L57 HydrophobicContact CD2-CG 4.19Å; L17-F64 HydrophobicContact CD1-CZ 4.39Å; L17-F64 HydrophobicContact CD2-CD2 4Å; L17-F64 HydrophobicContact CD2-CE1 4.25Å; L17-F64 HydrophobicContact CD2-CE2 3.38Å; L17-F64 HydrophobicContact CD2-CZ 3.53Å; L17-F64 HydrophobicContact CG-CE2 3.88Å; L17-F64 HydrophobicContact CG-CZ 3.97Å
18	E	82.4	Confident	82.1	Confident	135 Å²	135	58 Å²	58	63%	0.631	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-40.3	178.4	177.7	173.6	-155.5	0	0	114.8	A14 P25	A14-E18 VanDerWaalsContact O-CB 3.31Å; A14-E18 WeakPolarHBondContact O-CB 3.26Å; A14-E18 PolarHBondContact O-N 2.86Å; E18-P25 HydrophobicContact CB-CG 4.49Å
19	P	81.1	Confident	82.4	Confident	104 Å²	104	56.6 Å²	56.6	68%	0.675	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	0.8	175	34.6	-33.8	0	0	0	115.1	K15 L17	K15-P19 WeakPolarHBondContact O-CD 3.42Å; L17-P19 VanDerWaalsContact C-CD 3.49Å; L17-P19 VanDerWaalsContact C-N 3.33Å
20	I	75.7	Confident	82.5	Confident	45 Å²	45	60.3 Å²	60.3	23%	0.231	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-22.5	-172.7	-47.6	-179.1	0	0	0	112.6	L16 L17 L57 E60	L16-I20 VanDerWaalsContact O-CD1 3.22Å; L16-I20 WeakPolarHBondContact O-CD1 3.21Å; L16-I20 WeakPolarHBondContact O-CG1 3.41Å; L17-I20 PolarHBondContact O-N 2.93Å; I20-L57 HydrophobicContact CB-CD2 4.45Å; I20-L57 HydrophobicContact CG2-CD2 3.82Å; I20-L57 HydrophobicContact CG2-CG 4.26Å; I20-E60 HydrophobicContact CG2-CB 3.77Å; I20-E60 HydrophobicContact CG2-CG 4.19Å
21	C	75.1	Confident	82.6	Confident	15 Å²	15	61 Å²	61	10%	0.101	34%	0.342	C	S	.	.			trans	-129.6	126.7	-173.8	-162.8	0	0	0	0	112.6	L17 A23 L28 F56	L17-C21 PolarHBondContact O-N 3.08Å; C21-A23 PolarHBondContact O-N 2.99Å; C21-A23 VanDerWaalsContact O-N 3.1Å; C21-L28 HydrophobicContact CB-CD1 4.13Å; C21-L28 WeakPolarHBondContact SG-CD1 3.42Å; C21-F56 PolarHBondContact SG-O 3.01Å
22	D	71.1	Confident	82.7	Confident	181 Å²	181	57.6 Å²	57.6	97%	0.968	32%	0.317	S	S	*	.	S	Bend	trans	-78.4	18.3	179.2	-156.6	32.8	0	0	0	113.2
23	A	75.1	Confident	82.7	Confident	42 Å²	42	55 Å²	55	35%	0.347	31%	0.309	S	S	.	.	S	Bend	trans	-132	150.1	-178.3	0	0	0	0	0	110.5	C21 P25	C21-A23 PolarHBondContact O-N 2.99Å; C21-A23 VanDerWaalsContact O-N 3.1Å; A23-P25 WeakPolarHBondContact O-CD 3.31Å
24	D	83.4	Confident	82.6	Confident	95 Å²	95	57.4 Å²	57.4	51%	0.508	33%	0.329	S	S	.	.			trans	-41.7	106.1	-172.7	172.6	9.1	0	0	0	113.1	A26 A27 L28	D24-A26 PolarHBondContact O-N 3.06Å; D24-A26 WeakPolarHBondContact OD1-CA 3Å; D24-A26 VanDerWaalsContact OD1-CB 3.31Å; D24-A26 WeakPolarHBondContact OD1-CB 3.13Å; D24-A26 PolarHBondContact OD1-N 3.14Å; D24-A27 HydrophobicContact CB-CB 4Å; D24-A27 PolarHBondContact O-N 3.36Å; D24-A27 PolarHBondContact OD1-N 2.71Å; D24-A27 VanDerWaalsContact OD2-CB 3.23Å; D24-A27 WeakPolarHBondContact OD2-CB 3.43Å; D24-A27 PolarHBondContact OD2-N 2.95Å; D24-L28 WeakPolarHBondContact O-CB 3.12Å; D24-L28 PolarHBondContact O-N 2.82Å
25	P	81.4	Confident	82.6	Confident	36 Å²	36	56.5 Å²	56.5	23%	0.234	32%	0.321	C	S	.	.	H	α-helix	trans	-68.9	-20	-174.8	27.5	-34.6	0	0	0	112.1	A14 L17 E18 A23 A29	A14-P25 HydrophobicContact CB-CB 4.48Å; L17-P25 HydrophobicContact CB-CB 3.88Å; E18-P25 HydrophobicContact CB-CG 4.49Å; A23-P25 WeakPolarHBondContact O-CD 3.31Å; P25-A29 WeakPolarHBondContact O-CB 3.48Å; P25-A29 PolarHBondContact O-N 3.42Å
26	A	81.1	Confident	82.6	Confident	50 Å²	50	49 Å²	49	41%	0.413	29%	0.288	S	S	.	.	H	α-helix	trans	-76.2	-44.1	173.9	0	0	0	0	0	111.5	D24 L28 A29 N30	D24-A26 PolarHBondContact O-N 3.06Å; D24-A26 WeakPolarHBondContact OD1-CA 3Å; D24-A26 VanDerWaalsContact OD1-CB 3.31Å; D24-A26 WeakPolarHBondContact OD1-CB 3.13Å; D24-A26 PolarHBondContact OD1-N 3.14Å; A26-L28 VanDerWaalsContact C-N 3.34Å; A26-A29 PolarHBondContact O-N 3.08Å; A26-N30 PolarHBondContact O-N 3.01Å; A26-N30 VanDerWaalsContact O-N 3.1Å; A26-N30 PolarHBondContact O-ND2 2.86Å
27	A	85.5	Confident	82.5	Confident	54 Å²	54	52.2 Å²	52.2	45%	0.446	30%	0.301	S	S	.	.	H	α-helix	trans	-60.1	-45.4	171.8	0	0	0	0	0	111.4	D24 A29 N30 Y31	D24-A27 HydrophobicContact CB-CB 4Å; D24-A27 PolarHBondContact O-N 3.36Å; D24-A27 PolarHBondContact OD1-N 2.71Å; D24-A27 VanDerWaalsContact OD2-CB 3.23Å; D24-A27 WeakPolarHBondContact OD2-CB 3.43Å; D24-A27 PolarHBondContact OD2-N 2.95Å; A27-A29 PolarHBondContact O-N 2.86Å; A27-N30 WeakPolarHBondContact O-CB 3.28Å; A27-N30 PolarHBondContact O-N 3.29Å; A27-Y31 PolarHBondContact O-N 3.18Å; A27-Y31 VanDerWaalsContact O-N 3.08Å
28	L	85.2	Confident	82.4	Confident	8 Å²	8	56.7 Å²	56.7	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-65.4	-38.1	179	-136.4	173.4	0	0	0	111.8	L17 C21 D24 A26 N30 Y31 V32 L53 F56	L17-L28 HydrophobicContact CD1-CB 3.91Å; L17-L28 HydrophobicContact CD1-CD1 4.31Å; L17-L28 HydrophobicContact CD1-CD2 4.04Å; L17-L28 HydrophobicContact CD1-CG 4.3Å; C21-L28 HydrophobicContact CB-CD1 4.13Å; C21-L28 WeakPolarHBondContact SG-CD1 3.42Å; D24-L28 WeakPolarHBondContact O-CB 3.12Å; D24-L28 PolarHBondContact O-N 2.82Å; A26-L28 VanDerWaalsContact C-N 3.34Å; L28-N30 VanDerWaalsContact C-N 3.34Å; L28-N30 PolarHBondContact O-N 2.66Å; L28-Y31 WeakPolarHBondContact O-CA 3.38Å; L28-Y31 WeakPolarHBondContact O-CB 3.41Å; L28-Y31 PolarHBondContact O-N 2.72Å; L28-Y31 VanDerWaalsContact O-N 3.07Å; L28-V32 HydrophobicContact CD2-CG2 4.02Å; L28-V32 WeakPolarHBondContact O-CG2 3.17Å; L28-V32 PolarHBondContact O-N 3.32Å; L28-L53 HydrophobicContact CD2-CD2 3.71Å; L28-F56 HydrophobicContact CD1-CB 3.98Å; L28-F56 HydrophobicContact CD1-CD1 4.13Å; L28-F56 HydrophobicContact CD1-CG 4.16Å; L28-F56 HydrophobicContact CG-CD1 4.49Å
29	A	87.7	Confident	81.7	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-35.1	173.4	0	0	0	0	0	113.7	L13 P25 A26 A27 Y31 V33	L13-A29 HydrophobicContact CB-CB 4.26Å; L13-A29 VanDerWaalsContact CD2-CA 3.44Å; L13-A29 HydrophobicContact CD2-CB 3.63Å; P25-A29 WeakPolarHBondContact O-CB 3.48Å; P25-A29 PolarHBondContact O-N 3.42Å; A26-A29 PolarHBondContact O-N 3.08Å; A27-A29 PolarHBondContact O-N 2.86Å; A29-Y31 VanDerWaalsContact C-N 3.33Å; A29-V33 WeakPolarHBondContact O-CG2 3.37Å; A29-V33 PolarHBondContact O-N 3.41Å; A29-V33 VanDerWaalsContact O-N 3.14Å
30	N	87.3	Confident	81.8	Confident	78 Å²	78	57.4 Å²	57.4	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-38.4	170.4	-74.4	-71.2	0	0	0	111.7	K10 A26 A27 L28 A34	K10-N30 WeakPolarHBondContact CE-OD1 3.3Å; K10-N30 PolarHBondContact NZ-OD1 2.82Å; A26-N30 PolarHBondContact O-N 3.01Å; A26-N30 VanDerWaalsContact O-N 3.1Å; A26-N30 PolarHBondContact O-ND2 2.86Å; A27-N30 WeakPolarHBondContact O-CB 3.28Å; A27-N30 PolarHBondContact O-N 3.29Å; L28-N30 VanDerWaalsContact C-N 3.34Å; L28-N30 PolarHBondContact O-N 2.66Å; N30-A34 PolarHBondContact O-N 3.13Å; N30-A34 VanDerWaalsContact O-N 3.13Å
31	Y	87.3	Confident	82	Confident	78 Å²	78	58.9 Å²	58.9	31%	0.306	33%	0.33	S	S	.	.	H	α-helix	trans	-66.8	-46.7	177	-177.2	-105.5	0	0	0	112.7	A27 L28 A29 V33 A34 L35 Q52 L53	A27-Y31 PolarHBondContact O-N 3.18Å; A27-Y31 VanDerWaalsContact O-N 3.08Å; L28-Y31 WeakPolarHBondContact O-CA 3.38Å; L28-Y31 WeakPolarHBondContact O-CB 3.41Å; L28-Y31 PolarHBondContact O-N 2.72Å; L28-Y31 VanDerWaalsContact O-N 3.07Å; A29-Y31 VanDerWaalsContact C-N 3.33Å; Y31-V33 VanDerWaalsContact C-N 3.33Å; Y31-V33 PolarHBondContact O-N 2.85Å; Y31-A34 CarbonylContact O-C 3.53Å; Y31-A34 WeakPolarHBondContact O-CA 3.36Å; Y31-A34 WeakPolarHBondContact O-CB 3.23Å; Y31-A34 PolarHBondContact O-N 3.13Å; Y31-L35 HydrophobicContact CD1-CD1 4.21Å; Y31-L35 HydrophobicContact CD1-CG 4.31Å; Y31-L35 HydrophobicContact CE1-CD1 3.71Å; Y31-L35 HydrophobicContact CE1-CD2 4.15Å; Y31-L35 HydrophobicContact CE1-CG 3.98Å; Y31-L35 HydrophobicContact CE2-CD2 4.42Å; Y31-L35 PolarHBondContact O-N 3.31Å; Y31-Q52 HydrophobicContact CE1-CB 4.24Å; Y31-Q52 WeakPolarHBondContact OH-CB 3.19Å; Y31-Q52 PolarHBondContact OH-OE1 3.35Å; Y31-Q52 VanDerWaalsContact OH-OE1 3.12Å; Y31-L53 HydrophobicContact CD1-CD2 4.05Å; Y31-L53 HydrophobicContact CE1-CD2 4.16Å
32	V	87	Confident	82.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.8	-40.8	176.5	174.8	0	0	0	0	111.6	L13 L28 A34 L35 V36 L53 L68	L13-V32 HydrophobicContact CD1-CG1 3.91Å; L13-V32 HydrophobicContact CD2-CB 3.71Å; L13-V32 HydrophobicContact CD2-CG1 3.99Å; L13-V32 HydrophobicContact CD2-CG2 3.91Å; L28-V32 HydrophobicContact CD2-CG2 4.02Å; L28-V32 WeakPolarHBondContact O-CG2 3.17Å; L28-V32 PolarHBondContact O-N 3.32Å; V32-A34 VanDerWaalsContact C-N 3.27Å; V32-A34 PolarHBondContact O-N 3.17Å; V32-L35 WeakPolarHBondContact O-CB 3.34Å; V32-L35 PolarHBondContact O-N 3.04Å; V32-L35 VanDerWaalsContact O-N 3.08Å; V32-V36 HydrophobicContact CG1-CG2 4.31Å; V32-V36 WeakPolarHBondContact O-CG2 3.44Å; V32-V36 PolarHBondContact O-N 3.2Å; V32-L53 HydrophobicContact CG2-CD1 3.91Å; V32-L53 HydrophobicContact CG2-CD2 3.7Å; V32-L53 HydrophobicContact CG2-CG 4.46Å; V32-L68 HydrophobicContact CG1-CD1 4.08Å; V32-L68 HydrophobicContact CG1-CD2 3.66Å
33	V	86.3	Confident	82.7	Confident	9 Å²	9	62.8 Å²	62.8	6%	0.055	34%	0.338	C	S	.	.	H	α-helix	trans	-58.3	-39.2	171.5	166.3	0	0	0	0	111.8	V6 F9 K10 A29 Y31 L35 K37	V6-V33 HydrophobicContact CG1-CG1 4.06Å; F9-V33 HydrophobicContact CD1-CG2 3.62Å; F9-V33 HydrophobicContact CE1-CG2 3.77Å; K10-V33 HydrophobicContact CG-CG2 3.9Å; A29-V33 WeakPolarHBondContact O-CG2 3.37Å; A29-V33 PolarHBondContact O-N 3.41Å; A29-V33 VanDerWaalsContact O-N 3.14Å; Y31-V33 VanDerWaalsContact C-N 3.33Å; Y31-V33 PolarHBondContact O-N 2.85Å; V33-L35 VanDerWaalsContact C-N 3.35Å; V33-K37 HydrophobicContact CG1-CD 3.95Å; V33-K37 VanDerWaalsContact O-CB 3.3Å; V33-K37 WeakPolarHBondContact O-CB 3.33Å; V33-K37 VanDerWaalsContact O-CG 3.25Å; V33-K37 WeakPolarHBondContact O-CG 3.14Å; V33-K37 PolarHBondContact O-N 2.83Å; V33-K37 VanDerWaalsContact O-N 3.16Å
34	A	86.3	Confident	83	Confident	52 Å²	52	65.2 Å²	65.2	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-72.1	-24.2	176.1	0	0	0	0	0	113.4	N30 Y31 V32 K38	N30-A34 PolarHBondContact O-N 3.13Å; N30-A34 VanDerWaalsContact O-N 3.13Å; Y31-A34 CarbonylContact O-C 3.53Å; Y31-A34 WeakPolarHBondContact O-CA 3.36Å; Y31-A34 WeakPolarHBondContact O-CB 3.23Å; Y31-A34 PolarHBondContact O-N 3.13Å; V32-A34 VanDerWaalsContact C-N 3.27Å; V32-A34 PolarHBondContact O-N 3.17Å; A34-K38 WeakPolarHBondContact O-CG 3.45Å
35	L	84.5	Confident	83.1	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-73.7	-51.3	170.5	-63.4	-171.4	0	0	0	111.8	Y31 V32 V33 K37 K38 Q52 L53	Y31-L35 HydrophobicContact CD1-CD1 4.21Å; Y31-L35 HydrophobicContact CD1-CG 4.31Å; Y31-L35 HydrophobicContact CE1-CD1 3.71Å; Y31-L35 HydrophobicContact CE1-CD2 4.15Å; Y31-L35 HydrophobicContact CE1-CG 3.98Å; Y31-L35 HydrophobicContact CE2-CD2 4.42Å; Y31-L35 PolarHBondContact O-N 3.31Å; V32-L35 WeakPolarHBondContact O-CB 3.34Å; V32-L35 PolarHBondContact O-N 3.04Å; V32-L35 VanDerWaalsContact O-N 3.08Å; V33-L35 VanDerWaalsContact C-N 3.35Å; L35-K37 PolarHBondContact O-N 3.11Å; L35-K38 HydrophobicContact CD2-CD 4.4Å; L35-K38 WeakPolarHBondContact O-CB 3.31Å; L35-K38 PolarHBondContact O-N 3.47Å; L35-Q52 HydrophobicContact CD1-CB 3.95Å; L35-L53 HydrophobicContact CD1-CD2 4.37Å; L35-L53 HydrophobicContact CD1-CG 4.25Å
36	V	83.8	Confident	83.2	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.9	-25.8	-177.3	174.7	0	0	0	0	112.7	M1 I3 V32 K38 L68 L72	M1-V36 HydrophobicContact CB-CG1 3.98Å; M1-V36 PolarHBondContact N-O 3.26Å; I3-V36 HydrophobicContact CD1-CB 4.28Å; I3-V36 HydrophobicContact CD1-CG1 3.86Å; I3-V36 HydrophobicContact CG1-CG1 4.07Å; V32-V36 HydrophobicContact CG1-CG2 4.31Å; V32-V36 WeakPolarHBondContact O-CG2 3.44Å; V32-V36 PolarHBondContact O-N 3.2Å; V36-K38 VanDerWaalsContact C-N 3.34Å; V36-L68 HydrophobicContact CG2-CD2 4.44Å; V36-L72 HydrophobicContact CB-CD1 4.46Å; V36-L72 HydrophobicContact CG1-CD1 3.63Å; V36-L72 HydrophobicContact CG1-CD2 4.3Å; V36-L72 HydrophobicContact CG2-CD1 3.92Å
37	K	81.3	Confident	83.5	Confident	110 Å²	110	62.5 Å²	62.5	48%	0.478	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-1.2	173.2	-75.3	-178.7	175.8	-175	0	115	I3 V33 L35	I3-K37 HydrophobicContact CD1-CG 4.24Å; V33-K37 HydrophobicContact CG1-CD 3.95Å; V33-K37 VanDerWaalsContact O-CB 3.3Å; V33-K37 WeakPolarHBondContact O-CB 3.33Å; V33-K37 VanDerWaalsContact O-CG 3.25Å; V33-K37 WeakPolarHBondContact O-CG 3.14Å; V33-K37 PolarHBondContact O-N 2.83Å; V33-K37 VanDerWaalsContact O-N 3.16Å; L35-K37 PolarHBondContact O-N 3.11Å
38	K	81.1	Confident	83.5	Confident	94 Å²	94	62.6 Å²	62.6	41%	0.409	32%	0.317	S	S	.	.	S	Bend	trans	-73.9	131	171	-67.5	168.8	-175.4	176.7	0	109.2	A34 L35 V36 K40 L45	A34-K38 WeakPolarHBondContact O-CG 3.45Å; L35-K38 HydrophobicContact CD2-CD 4.4Å; L35-K38 WeakPolarHBondContact O-CB 3.31Å; L35-K38 PolarHBondContact O-N 3.47Å; V36-K38 VanDerWaalsContact C-N 3.34Å; K38-K40 PolarHBondContact O-N 3.31Å; K38-L45 HydrophobicContact CB-CD2 4.06Å; K38-L45 WeakPolarHBondContact O-CD2 3.49Å
39	D	69.5	Low	83.5	Confident	157 Å²	157	62.2 Å²	62.2	84%	0.84	32%	0.315	S	S	*	.			trans	-79.9	88.7	178.7	-73	-44.9	0	0	0	111.3
40	K	82.1	Confident	83.5	Confident	97 Å²	97	63.5 Å²	63.5	42%	0.422	33%	0.326	S	S	.	.	S	Bend	trans	-139.7	158.8	176.1	-74.6	-171.4	170.6	-149.6	0	110.2	K38 E44 L45 L48	K38-K40 PolarHBondContact O-N 3.31Å; K40-E44 HydrophobicContact CB-CB 4.38Å; K40-E44 HydrophobicContact CD-CB 4.48Å; K40-E44 IonicContact NZ-OE2 3.3Å; K40-L45 HydrophobicContact CB-CD2 3.79Å; K40-L45 HydrophobicContact CB-CG 3.82Å; K40-L45 VanDerWaalsContact O-CD1 3.3Å; K40-L45 WeakPolarHBondContact O-CD1 3.24Å; K40-L48 HydrophobicContact CD-CD1 3.4Å; K40-L48 VanDerWaalsContact CD-CD1 3.4Å
41	P	79.8	Confident	83.5	Confident	75 Å²	75	64.6 Å²	64.6	49%	0.487	33%	0.332	S	S	.	.			trans	-63.2	147.6	175.1	27	-34.5	0	0	0	111.1	K43 E44 L45	P41-K43 PolarHBondContact O-N 3.43Å; P41-K43 VanDerWaalsContact O-N 3.11Å; P41-E44 HydrophobicContact CG-CB 4.04Å; P41-E44 HydrophobicContact CG-CG 3.87Å; P41-E44 WeakPolarHBondContact CG-OE1 3.4Å; P41-E44 PolarHBondContact O-N 2.8Å; P41-L45 PolarHBondContact O-N 2.9Å
42	E	79.6	Confident	83.4	Confident	92 Å²	92	64.4 Å²	64.4	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-51.5	-40.9	-173.3	-168	-161.4	132	0	0	113.2	E44 L45 K46 F69	E42-E44 VanDerWaalsContact C-N 3.33Å; E42-E44 PolarHBondContact O-N 2.8Å; E42-L45 PolarHBondContact O-N 3.14Å; E42-L45 VanDerWaalsContact O-N 3.15Å; E42-K46 HydrophobicContact CG-CD 4.5Å; E42-K46 PolarHBondContact O-N 3.37Å; E42-K46 VanDerWaalsContact OE1-CE 3.32Å; E42-K46 WeakPolarHBondContact OE1-CE 3.33Å; E42-K46 IonicContact OE1-NZ 2.67Å; E42-K46 PolarHBondContact OE1-NZ 2.79Å; E42-F69 HydrophobicContact CG-CD1 3.76Å; E42-F69 HydrophobicContact CG-CE1 3.92Å
43	K	81.1	Confident	83.3	Confident	186 Å²	186	64.4 Å²	64.4	81%	0.809	33%	0.334	S	S	*	.	H	α-helix	trans	-63.8	-34.4	178.6	-171	171.9	-177.5	174.1	0	113.4	P41 A47	P41-K43 PolarHBondContact O-N 3.43Å; P41-K43 VanDerWaalsContact O-N 3.11Å; K43-A47 PolarHBondContact O-N 3.45Å
44	E	82.6	Confident	83.3	Confident	94 Å²	94	68.2 Å²	68.2	44%	0.439	35%	0.354	S	S	.	.	H	α-helix	trans	-76.8	-36.3	171.7	-74.2	-179.5	-141.7	0	0	111.6	K40 P41 E42 A47 L48	K40-E44 HydrophobicContact CB-CB 4.38Å; K40-E44 HydrophobicContact CD-CB 4.48Å; K40-E44 IonicContact NZ-OE2 3.3Å; P41-E44 HydrophobicContact CG-CB 4.04Å; P41-E44 HydrophobicContact CG-CG 3.87Å; P41-E44 WeakPolarHBondContact CG-OE1 3.4Å; P41-E44 PolarHBondContact O-N 2.8Å; E42-E44 VanDerWaalsContact C-N 3.33Å; E42-E44 PolarHBondContact O-N 2.8Å; E44-A47 PolarHBondContact O-N 2.85Å; E44-L48 WeakPolarHBondContact O-CB 3.31Å; E44-L48 WeakPolarHBondContact O-CD1 3.24Å; E44-L48 WeakPolarHBondContact O-CG 3.46Å; E44-L48 PolarHBondContact O-N 2.98Å
45	L	85.3	Confident	83.2	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-65.1	-40.8	176.6	-72	177.5	0	0	0	112.1	K38 K40 P41 E42 L48 C49 F69	K38-L45 HydrophobicContact CB-CD2 4.06Å; K38-L45 WeakPolarHBondContact O-CD2 3.49Å; K40-L45 HydrophobicContact CB-CD2 3.79Å; K40-L45 HydrophobicContact CB-CG 3.82Å; K40-L45 VanDerWaalsContact O-CD1 3.3Å; K40-L45 WeakPolarHBondContact O-CD1 3.24Å; P41-L45 PolarHBondContact O-N 2.9Å; E42-L45 PolarHBondContact O-N 3.14Å; E42-L45 VanDerWaalsContact O-N 3.15Å; L45-L48 PolarHBondContact O-N 3.46Å; L45-C49 WeakPolarHBondContact O-CB 3.44Å; L45-C49 PolarHBondContact O-N 2.85Å; L45-C49 PolarHBondContact O-SG 3.21Å; L45-F69 HydrophobicContact CB-CE1 3.96Å; L45-F69 HydrophobicContact CB-CZ 3.72Å
46	K	83.4	Confident	83.1	Confident	59 Å²	59	75 Å²	75	26%	0.257	38%	0.383	S	S	.	.	H	α-helix	trans	-58.5	-50	171.8	-80.2	175.8	165.8	165.8	0	111.4	E42 L48 C49 A50 V65 F69	E42-K46 HydrophobicContact CG-CD 4.5Å; E42-K46 PolarHBondContact O-N 3.37Å; E42-K46 VanDerWaalsContact OE1-CE 3.32Å; E42-K46 WeakPolarHBondContact OE1-CE 3.33Å; E42-K46 IonicContact OE1-NZ 2.67Å; E42-K46 PolarHBondContact OE1-NZ 2.79Å; K46-L48 VanDerWaalsContact C-N 3.33Å; K46-L48 PolarHBondContact O-N 3.34Å; K46-C49 PolarHBondContact O-N 3.27Å; K46-A50 PolarHBondContact O-N 3.4Å; K46-V65 HydrophobicContact CB-CG1 4.35Å; K46-V65 HydrophobicContact CG-CG1 4.33Å; K46-F69 HydrophobicContact CD-CB 4.45Å; K46-F69 HydrophobicContact CD-CD1 4.28Å; K46-F69 HydrophobicContact CD-CG 4.19Å; K46-F69 HydrophobicContact CG-CB 4.4Å; K46-F69 HydrophobicContact CG-CD1 3.76Å; K46-F69 HydrophobicContact CG-CD2 3.71Å; K46-F69 HydrophobicContact CG-CE1 3.87Å; K46-F69 HydrophobicContact CG-CE2 3.82Å; K46-F69 HydrophobicContact CG-CG 3.68Å; K46-F69 HydrophobicContact CG-CZ 3.9Å
47	A	87.1	Confident	82.9	Confident	60 Å²	60	75.5 Å²	75.5	50%	0.496	39%	0.385	S	S	.	.	H	α-helix	trans	-60.6	-39.5	177.5	0	0	0	0	0	113.1	K43 E44 A50 D51	K43-A47 PolarHBondContact O-N 3.45Å; E44-A47 PolarHBondContact O-N 2.85Å; A47-A50 PolarHBondContact O-N 3.1Å; A47-D51 WeakPolarHBondContact O-CB 3.2Å; A47-D51 PolarHBondContact O-N 2.75Å
48	L	85.5	Confident	83	Confident	56 Å²	56	76.4 Å²	76.4	29%	0.293	39%	0.391	S	S	.	.	H	α-helix	trans	-76.6	-27.7	178.1	-70.4	162.4	0	0	0	113.3	K40 E44 L45 K46 Q52	K40-L48 HydrophobicContact CD-CD1 3.4Å; K40-L48 VanDerWaalsContact CD-CD1 3.4Å; E44-L48 WeakPolarHBondContact O-CB 3.31Å; E44-L48 WeakPolarHBondContact O-CD1 3.24Å; E44-L48 WeakPolarHBondContact O-CG 3.46Å; E44-L48 PolarHBondContact O-N 2.98Å; L45-L48 PolarHBondContact O-N 3.46Å; K46-L48 VanDerWaalsContact C-N 3.33Å; K46-L48 PolarHBondContact O-N 3.34Å; L48-Q52 WeakPolarHBondContact O-CB 3.43Å; L48-Q52 WeakPolarHBondContact O-CG 3.32Å; L48-Q52 PolarHBondContact O-N 2.9Å
49	C	85.1	Confident	82.9	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-71.8	-40.3	169.6	-65.5	0	0	0	0	110	L45 K46 L53 V65 F69	L45-C49 WeakPolarHBondContact O-CB 3.44Å; L45-C49 PolarHBondContact O-N 2.85Å; L45-C49 PolarHBondContact O-SG 3.21Å; K46-C49 PolarHBondContact O-N 3.27Å; C49-L53 HydrophobicContact CB-CD1 4.22Å; C49-L53 WeakPolarHBondContact O-CB 3.35Å; C49-L53 WeakPolarHBondContact O-CD1 3.36Å; C49-L53 WeakPolarHBondContact O-CG 3.33Å; C49-L53 PolarHBondContact O-N 3.12Å; C49-V65 HydrophobicContact CB-CG1 4.1Å; C49-V65 HydrophobicContact CB-CG2 3.84Å; C49-F69 HydrophobicContact CB-CE2 4.19Å
50	A	87.8	Confident	83.3	Confident	29 Å²	29	79.7 Å²	79.7	24%	0.24	40%	0.4	C	S	.	.	H	α-helix	trans	-60.4	-58.8	173.6	0	0	0	0	0	111.5	K46 A47 Q52 L53 D54 T61	K46-A50 PolarHBondContact O-N 3.4Å; A47-A50 PolarHBondContact O-N 3.1Å; A50-Q52 VanDerWaalsContact C-N 3.3Å; A50-Q52 PolarHBondContact O-N 2.85Å; A50-L53 PolarHBondContact O-N 2.96Å; A50-D54 WeakPolarHBondContact O-CB 3.17Å; A50-D54 PolarHBondContact O-N 3.3Å; A50-T61 WeakPolarHBondContact O-CG2 3.42Å
51	D	88	Confident	83.4	Confident	101 Å²	101	75.1 Å²	75.1	54%	0.54	38%	0.38	S	S	.	.	H	α-helix	trans	-55	-39.6	-178.9	174.4	92.6	0	0	0	114	A47	A47-D51 WeakPolarHBondContact O-CB 3.2Å; A47-D51 PolarHBondContact O-N 2.75Å
52	Q	83.7	Confident	83.5	Confident	74 Å²	74	76 Å²	76	35%	0.346	38%	0.384	S	S	.	.	H	α-helix	trans	-88.5	-15.6	-177.2	-61.9	-70.1	-87.6	0	0	114.2	Y31 L35 L48 A50	Y31-Q52 HydrophobicContact CE1-CB 4.24Å; Y31-Q52 WeakPolarHBondContact OH-CB 3.19Å; Y31-Q52 PolarHBondContact OH-OE1 3.35Å; Y31-Q52 VanDerWaalsContact OH-OE1 3.12Å; L35-Q52 HydrophobicContact CD1-CB 3.95Å; L48-Q52 WeakPolarHBondContact O-CB 3.43Å; L48-Q52 WeakPolarHBondContact O-CG 3.32Å; L48-Q52 PolarHBondContact O-N 2.9Å; A50-Q52 VanDerWaalsContact C-N 3.3Å; A50-Q52 PolarHBondContact O-N 2.85Å
53	L	85.1	Confident	83.7	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-102.7	-13.7	177.2	-59.8	172.4	0	0	0	112.8	L28 Y31 V32 L35 C49 A50 V55 F56 L57 T61 F64 V65	L28-L53 HydrophobicContact CD2-CD2 3.71Å; Y31-L53 HydrophobicContact CD1-CD2 4.05Å; Y31-L53 HydrophobicContact CE1-CD2 4.16Å; V32-L53 HydrophobicContact CG2-CD1 3.91Å; V32-L53 HydrophobicContact CG2-CD2 3.7Å; V32-L53 HydrophobicContact CG2-CG 4.46Å; L35-L53 HydrophobicContact CD1-CD2 4.37Å; L35-L53 HydrophobicContact CD1-CG 4.25Å; C49-L53 HydrophobicContact CB-CD1 4.22Å; C49-L53 WeakPolarHBondContact O-CB 3.35Å; C49-L53 WeakPolarHBondContact O-CD1 3.36Å; C49-L53 WeakPolarHBondContact O-CG 3.33Å; C49-L53 PolarHBondContact O-N 3.12Å; A50-L53 PolarHBondContact O-N 2.96Å; L53-V55 PolarHBondContact O-N 3.12Å; L53-F56 CarbonylContact O-C 2.95Å; L53-F56 WeakPolarHBondContact O-CA 3.32Å; L53-F56 PolarHBondContact O-N 3.38Å; L53-L57 HydrophobicContact CB-CD1 4.18Å; L53-L57 PolarHBondContact O-N 2.85Å; L53-T61 HydrophobicContact CB-CG2 3.69Å; L53-F64 HydrophobicContact CD1-CD1 4.19Å; L53-F64 HydrophobicContact CD1-CE1 3.95Å; L53-V65 HydrophobicContact CD1-CG2 4.15Å
54	D	86.9	Confident	83.9	Confident	89 Å²	89	64.8 Å²	64.8	48%	0.476	35%	0.345	S	S	.	.	H	α-helix	trans	-58.3	-33.2	175.3	-167.7	51.9	0	0	0	112.2	A50 F56 Q58 T61	A50-D54 WeakPolarHBondContact O-CB 3.17Å; A50-D54 PolarHBondContact O-N 3.3Å; D54-F56 PolarHBondContact O-N 3.48Å; D54-Q58 WeakPolarHBondContact O-CA 3.46Å; D54-Q58 WeakPolarHBondContact O-CG 3.38Å; D54-Q58 PolarHBondContact O-N 3.2Å; D54-T61 WeakPolarHBondContact CA-OG1 3.5Å; D54-T61 HydrophobicContact CB-CG2 4.49Å
55	V	84.9	Confident	84.1	Confident	113 Å²	113	60.6 Å²	60.6	69%	0.685	33%	0.325	S	S	*	.	H	α-helix	trans	-61.3	-22.7	173.2	-173.3	0	0	0	0	113	L53	L53-V55 PolarHBondContact O-N 3.12Å
56	F	80.9	Confident	84.2	Confident	86 Å²	86	64.4 Å²	64.4	38%	0.377	35%	0.346	S	S	.	.	H	α-helix	trans	-115.4	-34.6	-173.6	-61.6	-84.1	0	0	0	114.5	C21 L28 L53 D54	C21-F56 PolarHBondContact SG-O 3.01Å; L28-F56 HydrophobicContact CD1-CB 3.98Å; L28-F56 HydrophobicContact CD1-CD1 4.13Å; L28-F56 HydrophobicContact CD1-CG 4.16Å; L28-F56 HydrophobicContact CG-CD1 4.49Å; L53-F56 CarbonylContact O-C 2.95Å; L53-F56 WeakPolarHBondContact O-CA 3.32Å; L53-F56 PolarHBondContact O-N 3.38Å; D54-F56 PolarHBondContact O-N 3.48Å
57	L	80.6	Confident	84.2	Confident	9 Å²	9	67 Å²	67	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-112.9	-8.7	-178.1	-75.7	94.9	0	0	0	113.4	L17 I20 L53 K59 E60 T61 F64	L17-L57 HydrophobicContact CD2-CD1 3.86Å; L17-L57 HydrophobicContact CD2-CD2 3.73Å; L17-L57 HydrophobicContact CD2-CG 4.19Å; I20-L57 HydrophobicContact CB-CD2 4.45Å; I20-L57 HydrophobicContact CG2-CD2 3.82Å; I20-L57 HydrophobicContact CG2-CG 4.26Å; L53-L57 HydrophobicContact CB-CD1 4.18Å; L53-L57 PolarHBondContact O-N 2.85Å; L57-K59 PolarHBondContact O-N 3.32Å; L57-K59 VanDerWaalsContact O-N 3.14Å; L57-E60 PolarHBondContact O-N 2.92Å; L57-T61 VanDerWaalsContact CB-OG1 3.27Å; L57-T61 WeakPolarHBondContact CB-OG1 3.45Å; L57-F64 HydrophobicContact CD2-CB 3.63Å; L57-F64 HydrophobicContact CD2-CD1 3.96Å; L57-F64 HydrophobicContact CD2-CD2 3.8Å; L57-F64 HydrophobicContact CD2-CE2 4.46Å; L57-F64 HydrophobicContact CD2-CG 3.51Å
58	Q	83.4	Confident	84.2	Confident	130 Å²	130	64.1 Å²	64.1	61%	0.607	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	43.7	-116.9	177.2	-55.3	-179.9	17.1	0	0	112.5	D54 E60 T61	D54-Q58 WeakPolarHBondContact O-CA 3.46Å; D54-Q58 WeakPolarHBondContact O-CG 3.38Å; D54-Q58 PolarHBondContact O-N 3.2Å; Q58-E60 PolarHBondContact O-N 3.49Å; Q58-E60 VanDerWaalsContact O-N 3.16Å; Q58-T61 PolarHBondContact N-OG1 3.5Å; Q58-T61 VanDerWaalsContact N-OG1 3.09Å; Q58-T61 VanDerWaalsContact O-CB 3.24Å; Q58-T61 WeakPolarHBondContact O-CB 3.36Å; Q58-T61 PolarHBondContact O-N 2.96Å; Q58-T61 VanDerWaalsContact O-N 3.1Å; Q58-T61 PolarHBondContact O-OG1 3.41Å
59	K	78.3	Confident	84.2	Confident	204 Å²	204	61.5 Å²	61.5	89%	0.887	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-60	-27.3	-176.3	-62.8	175.7	-175.7	170.1	0	114.1	L57	L57-K59 PolarHBondContact O-N 3.32Å; L57-K59 VanDerWaalsContact O-N 3.14Å
60	E	78.6	Confident	84.2	Confident	115 Å²	115	67.2 Å²	67.2	54%	0.537	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-87.5	-11.6	-178.7	-61.2	-150.7	-166.7	0	0	113.4	I20 L57 Q58 V62 G63 F64	I20-E60 HydrophobicContact CG2-CB 3.77Å; I20-E60 HydrophobicContact CG2-CG 4.19Å; L57-E60 PolarHBondContact O-N 2.92Å; Q58-E60 PolarHBondContact O-N 3.49Å; Q58-E60 VanDerWaalsContact O-N 3.16Å; E60-V62 VanDerWaalsContact C-N 3.32Å; E60-V62 PolarHBondContact O-N 2.88Å; E60-G63 PolarHBondContact O-N 3.44Å; E60-G63 VanDerWaalsContact O-N 3.14Å; E60-F64 PolarHBondContact O-N 3.18Å
61	T	83.6	Confident	83.9	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-53.6	-43.4	-173.5	-51.7	0	0	0	0	113.6	A50 L53 D54 L57 Q58 F64 V65	A50-T61 WeakPolarHBondContact O-CG2 3.42Å; L53-T61 HydrophobicContact CB-CG2 3.69Å; D54-T61 WeakPolarHBondContact CA-OG1 3.5Å; D54-T61 HydrophobicContact CB-CG2 4.49Å; L57-T61 VanDerWaalsContact CB-OG1 3.27Å; L57-T61 WeakPolarHBondContact CB-OG1 3.45Å; Q58-T61 PolarHBondContact N-OG1 3.5Å; Q58-T61 VanDerWaalsContact N-OG1 3.09Å; Q58-T61 VanDerWaalsContact O-CB 3.24Å; Q58-T61 WeakPolarHBondContact O-CB 3.36Å; Q58-T61 PolarHBondContact O-N 2.96Å; Q58-T61 VanDerWaalsContact O-N 3.1Å; Q58-T61 PolarHBondContact O-OG1 3.41Å; T61-F64 PolarHBondContact O-N 2.99Å; T61-V65 HydrophobicContact CG2-CG2 4.22Å; T61-V65 WeakPolarHBondContact O-CB 3.16Å; T61-V65 VanDerWaalsContact O-CG2 3.25Å; T61-V65 WeakPolarHBondContact O-CG2 3.44Å; T61-V65 PolarHBondContact O-N 3.01Å
62	V	82.1	Confident	83.6	Confident	93 Å²	93	62 Å²	62	56%	0.564	32%	0.315	S	S	*	.	H	α-helix	trans	-65.2	-47.2	-178	-175.1	0	0	0	0	110.4	E60 F64 V65 D66	E60-V62 VanDerWaalsContact C-N 3.32Å; E60-V62 PolarHBondContact O-N 2.88Å; V62-F64 VanDerWaalsContact C-N 3.34Å; V62-F64 PolarHBondContact O-N 2.94Å; V62-V65 PolarHBondContact O-N 2.97Å; V62-D66 PolarHBondContact O-N 3.07Å
63	G	83.7	Confident	83.5	Confident	38 Å²	38	62.4 Å²	62.4	39%	0.392	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-34.5	176.9	0	0	0	0	0	113.2	E60 K67	E60-G63 PolarHBondContact O-N 3.44Å; E60-G63 VanDerWaalsContact O-N 3.14Å; G63-K67 WeakPolarHBondContact O-CB 3.14Å; G63-K67 WeakPolarHBondContact O-CD 3.5Å; G63-K67 WeakPolarHBondContact O-CG 3.38Å; G63-K67 PolarHBondContact O-N 3.11Å
64	F	85.6	Confident	83.2	Confident	5 Å²	5	66.6 Å²	66.6	2%	0.022	35%	0.349	C	S	.	.	H	α-helix	trans	-66	-45.6	171.1	176.4	-93.7	0	0	0	111.8	L13 L16 L17 L53 L57 E60 T61 V62 K67 L68	L13-F64 HydrophobicContact CD1-CZ 3.84Å; L13-F64 HydrophobicContact CD2-CZ 4.27Å; L13-F64 HydrophobicContact CG-CZ 3.98Å; L16-F64 HydrophobicContact CB-CE2 4.41Å; L16-F64 HydrophobicContact CD2-CD2 3.97Å; L16-F64 HydrophobicContact CD2-CE2 3.72Å; L16-F64 HydrophobicContact CG-CD2 4.08Å; L16-F64 HydrophobicContact CG-CE2 3.86Å; L17-F64 HydrophobicContact CD1-CZ 4.39Å; L17-F64 HydrophobicContact CD2-CD2 4Å; L17-F64 HydrophobicContact CD2-CE1 4.25Å; L17-F64 HydrophobicContact CD2-CE2 3.38Å; L17-F64 HydrophobicContact CD2-CZ 3.53Å; L17-F64 HydrophobicContact CG-CE2 3.88Å; L17-F64 HydrophobicContact CG-CZ 3.97Å; L53-F64 HydrophobicContact CD1-CD1 4.19Å; L53-F64 HydrophobicContact CD1-CE1 3.95Å; L57-F64 HydrophobicContact CD2-CB 3.63Å; L57-F64 HydrophobicContact CD2-CD1 3.96Å; L57-F64 HydrophobicContact CD2-CD2 3.8Å; L57-F64 HydrophobicContact CD2-CE2 4.46Å; L57-F64 HydrophobicContact CD2-CG 3.51Å; E60-F64 PolarHBondContact O-N 3.18Å; T61-F64 PolarHBondContact O-N 2.99Å; V62-F64 VanDerWaalsContact C-N 3.34Å; V62-F64 PolarHBondContact O-N 2.94Å; F64-K67 PolarHBondContact O-N 2.94Å; F64-L68 HydrophobicContact CE1-CB 4.49Å; F64-L68 HydrophobicContact CE1-CD2 4.08Å; F64-L68 WeakPolarHBondContact O-CB 3.3Å; F64-L68 PolarHBondContact O-N 3.13Å
65	V	87.6	Confident	82.8	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.03	35%	0.345	C	S	.	.	H	α-helix	trans	-67	-38	-179	168.5	0	0	0	0	111.9	K46 C49 L53 T61 V62 L68 F69	K46-V65 HydrophobicContact CB-CG1 4.35Å; K46-V65 HydrophobicContact CG-CG1 4.33Å; C49-V65 HydrophobicContact CB-CG1 4.1Å; C49-V65 HydrophobicContact CB-CG2 3.84Å; L53-V65 HydrophobicContact CD1-CG2 4.15Å; T61-V65 HydrophobicContact CG2-CG2 4.22Å; T61-V65 WeakPolarHBondContact O-CB 3.16Å; T61-V65 VanDerWaalsContact O-CG2 3.25Å; T61-V65 WeakPolarHBondContact O-CG2 3.44Å; T61-V65 PolarHBondContact O-N 3.01Å; V62-V65 PolarHBondContact O-N 2.97Å; V65-L68 WeakPolarHBondContact O-CB 3.49Å; V65-L68 PolarHBondContact O-N 3.03Å; V65-F69 HydrophobicContact CG1-CD2 4.07Å; V65-F69 HydrophobicContact CG1-CE2 4.15Å; V65-F69 VanDerWaalsContact O-CD2 3.29Å; V65-F69 WeakPolarHBondContact O-CD2 3.46Å; V65-F69 PolarHBondContact O-N 3.07Å; V65-F69 VanDerWaalsContact O-N 3.08Å
66	D	86.9	Confident	82	Confident	85 Å²	85	64.1 Å²	64.1	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-67.5	-46.4	174.5	-76.5	-38	0	0	0	111.4	V62 L68 F69 E70	V62-D66 PolarHBondContact O-N 3.07Å; D66-L68 VanDerWaalsContact C-N 3.28Å; D66-L68 PolarHBondContact O-N 3.34Å; D66-F69 PolarHBondContact O-N 2.92Å; D66-E70 VanDerWaalsContact O-CB 3.3Å; D66-E70 WeakPolarHBondContact O-CB 3.34Å; D66-E70 PolarHBondContact O-N 3.41Å
67	K	83.8	Confident	81.6	Confident	113 Å²	113	60.4 Å²	60.4	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-58.5	-36.3	172.6	-73	171.4	-176.1	174.7	0	113.1	G63 F64 S71	G63-K67 WeakPolarHBondContact O-CB 3.14Å; G63-K67 WeakPolarHBondContact O-CD 3.5Å; G63-K67 WeakPolarHBondContact O-CG 3.38Å; G63-K67 PolarHBondContact O-N 3.11Å; F64-K67 PolarHBondContact O-N 2.94Å; K67-S71 WeakPolarHBondContact O-CB 3.13Å; K67-S71 PolarHBondContact O-N 3.43Å; K67-S71 PolarHBondContact O-OG 3.47Å
68	L	86.3	Confident	81.1	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-50.2	177.3	174.4	63.9	0	0	0	111.2	F9 W12 L13 V32 V36 F64 V65 D66 S71 L72	F9-L68 HydrophobicContact CE2-CD1 3.91Å; F9-L68 HydrophobicContact CZ-CD1 3.56Å; W12-L68 HydrophobicContact CZ3-CD1 4.17Å; L13-L68 HydrophobicContact CD1-CD1 3.31Å; V32-L68 HydrophobicContact CG1-CD1 4.08Å; V32-L68 HydrophobicContact CG1-CD2 3.66Å; V36-L68 HydrophobicContact CG2-CD2 4.44Å; F64-L68 HydrophobicContact CE1-CB 4.49Å; F64-L68 HydrophobicContact CE1-CD2 4.08Å; F64-L68 WeakPolarHBondContact O-CB 3.3Å; F64-L68 PolarHBondContact O-N 3.13Å; V65-L68 WeakPolarHBondContact O-CB 3.49Å; V65-L68 PolarHBondContact O-N 3.03Å; D66-L68 VanDerWaalsContact C-N 3.28Å; D66-L68 PolarHBondContact O-N 3.34Å; L68-S71 PolarHBondContact O-N 2.88Å; L68-L72 HydrophobicContact CD1-CD1 4.28Å; L68-L72 HydrophobicContact CG-CD1 4.21Å; L68-L72 WeakPolarHBondContact O-CD1 3.43Å; L68-L72 VanDerWaalsContact O-CG 3.32Å; L68-L72 WeakPolarHBondContact O-CG 3.31Å; L68-L72 PolarHBondContact O-N 3.32Å
69	F	85.8	Confident	79.8	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	33%	0.329	C	S	.	.	H	α-helix	trans	-74.3	-34.8	-179.5	-82.8	-103.1	0	0	0	112.3	M1 E42 L45 K46 C49 V65 D66 S71 L72 T73	M1-F69 HydrophobicContact SD-CD1 4.02Å; M1-F69 HydrophobicContact SD-CE1 4.11Å; E42-F69 HydrophobicContact CG-CD1 3.76Å; E42-F69 HydrophobicContact CG-CE1 3.92Å; L45-F69 HydrophobicContact CB-CE1 3.96Å; L45-F69 HydrophobicContact CB-CZ 3.72Å; K46-F69 HydrophobicContact CD-CB 4.45Å; K46-F69 HydrophobicContact CD-CD1 4.28Å; K46-F69 HydrophobicContact CD-CG 4.19Å; K46-F69 HydrophobicContact CG-CB 4.4Å; K46-F69 HydrophobicContact CG-CD1 3.76Å; K46-F69 HydrophobicContact CG-CD2 3.71Å; K46-F69 HydrophobicContact CG-CE1 3.87Å; K46-F69 HydrophobicContact CG-CE2 3.82Å; K46-F69 HydrophobicContact CG-CG 3.68Å; K46-F69 HydrophobicContact CG-CZ 3.9Å; C49-F69 HydrophobicContact CB-CE2 4.19Å; V65-F69 HydrophobicContact CG1-CD2 4.07Å; V65-F69 HydrophobicContact CG1-CE2 4.15Å; V65-F69 VanDerWaalsContact O-CD2 3.29Å; V65-F69 WeakPolarHBondContact O-CD2 3.46Å; V65-F69 PolarHBondContact O-N 3.07Å; V65-F69 VanDerWaalsContact O-N 3.08Å; D66-F69 PolarHBondContact O-N 2.92Å; F69-S71 VanDerWaalsContact C-N 3.31Å; F69-L72 PolarHBondContact O-N 2.88Å; F69-T73 WeakPolarHBondContact O-CG2 3.09Å; F69-T73 PolarHBondContact O-N 3.32Å; F69-T73 PolarHBondContact O-OG1 3.3Å
70	E	85.8	Confident	77.8	Confident	119 Å²	119	57.3 Å²	57.3	56%	0.556	33%	0.326	S	S	*	.	H	α-helix	trans	-60.8	-41	169.5	-178.5	171.6	-141.2	0	0	111.3	D66 L72 T73 T74	D66-E70 VanDerWaalsContact O-CB 3.3Å; D66-E70 WeakPolarHBondContact O-CB 3.34Å; D66-E70 PolarHBondContact O-N 3.41Å; E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 2.82Å; E70-T73 PolarHBondContact O-N 2.9Å; E70-T73 PolarHBondContact O-OG1 2.8Å; E70-T74 HydrophobicContact CG-CG2 4.24Å; E70-T74 WeakPolarHBondContact O-CB 3.47Å; E70-T74 VanDerWaalsContact O-CG2 3.3Å; E70-T74 WeakPolarHBondContact O-CG2 3.22Å; E70-T74 PolarHBondContact O-N 2.9Å; E70-T74 PolarHBondContact O-OG1 3.31Å
71	S	80.9	Confident	75.8	Confident	12 Å²	12	57.5 Å²	57.5	8%	0.084	34%	0.337	C	S	.	.	H	α-helix	trans	-70.4	-28.4	175.9	-63	0	0	0	0	112.6	W12 K67 L68 F69 K75 S76 Y77	W12-S71 VanDerWaalsContact CH2-OG 3.23Å; W12-S71 WeakPolarHBondContact CH2-OG 3.49Å; W12-S71 WeakPolarHBondContact CZ2-OG 3.27Å; K67-S71 WeakPolarHBondContact O-CB 3.13Å; K67-S71 PolarHBondContact O-N 3.43Å; K67-S71 PolarHBondContact O-OG 3.47Å; L68-S71 PolarHBondContact O-N 2.88Å; F69-S71 VanDerWaalsContact C-N 3.31Å; S71-K75 CarbonylContact O-C 3.3Å; S71-K75 WeakPolarHBondContact O-CA 3.23Å; S71-K75 PolarHBondContact O-N 2.87Å; S71-S76 WeakPolarHBondContact CA-OG 3.41Å; S71-S76 WeakPolarHBondContact CB-OG 3.25Å; S71-S76 PolarHBondContact O-N 2.84Å; S71-S76 PolarHBondContact OG-OG 2.85Å; S71-S76 VanDerWaalsContact OG-OG 3.05Å; S71-Y77 VanDerWaalsContact O-CD1 3.31Å; S71-Y77 WeakPolarHBondContact O-CD1 3.44Å
72	L	81.9	Confident	73.4	Confident	9 Å²	9	61.8 Å²	61.8	5%	0.047	37%	0.373	C	S	.	.	H	α-helix	trans	-76.2	-29.1	172.4	-75	162.4	0	0	0	113.6	M1 I3 F9 V36 L68 F69 E70 Y77	M1-L72 HydrophobicContact CE-CB 3.57Å; M1-L72 HydrophobicContact SD-CB 3.83Å; M1-L72 HydrophobicContact SD-CD1 3.99Å; M1-L72 HydrophobicContact SD-CG 4.44Å; I3-L72 HydrophobicContact CG1-CD2 4.07Å; F9-L72 HydrophobicContact CD2-CD2 4.14Å; F9-L72 HydrophobicContact CE1-CD2 4.39Å; F9-L72 HydrophobicContact CE2-CD1 4.32Å; F9-L72 HydrophobicContact CE2-CD2 3.56Å; F9-L72 HydrophobicContact CE2-CG 3.79Å; F9-L72 HydrophobicContact CZ-CD1 3.99Å; F9-L72 HydrophobicContact CZ-CD2 3.69Å; F9-L72 HydrophobicContact CZ-CG 3.95Å; V36-L72 HydrophobicContact CB-CD1 4.46Å; V36-L72 HydrophobicContact CG1-CD1 3.63Å; V36-L72 HydrophobicContact CG1-CD2 4.3Å; V36-L72 HydrophobicContact CG2-CD1 3.92Å; L68-L72 HydrophobicContact CD1-CD1 4.28Å; L68-L72 HydrophobicContact CG-CD1 4.21Å; L68-L72 WeakPolarHBondContact O-CD1 3.43Å; L68-L72 VanDerWaalsContact O-CG 3.32Å; L68-L72 WeakPolarHBondContact O-CG 3.31Å; L68-L72 PolarHBondContact O-N 3.32Å; F69-L72 PolarHBondContact O-N 2.88Å; E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 2.82Å; L72-Y77 HydrophobicContact CD2-CE1 4.1Å
73	T	81.3	Confident	70.9	Confident	82 Å²	82	61.9 Å²	61.9	50%	0.503	38%	0.383	S	S	.	.	H	α-helix	trans	-83.4	-42.8	174.3	54.4	0	0	0	0	112.6	M1 F69 E70 K75	M1-T73 HydrophobicContact CE-CG2 3.73Å; F69-T73 WeakPolarHBondContact O-CG2 3.09Å; F69-T73 PolarHBondContact O-N 3.32Å; F69-T73 PolarHBondContact O-OG1 3.3Å; E70-T73 PolarHBondContact O-N 2.9Å; E70-T73 PolarHBondContact O-OG1 2.8Å; T73-K75 VanDerWaalsContact C-N 3.31Å
74	T	78.6	Confident	68.7	Low	89 Å²	89	69.7 Å²	69.7	55%	0.546	41%	0.406	S	S	.	.	H	α-helix	trans	-76.5	-16.5	175.9	60.3	0	0	0	0	113.5	E70 S76	E70-T74 HydrophobicContact CG-CG2 4.24Å; E70-T74 WeakPolarHBondContact O-CB 3.47Å; E70-T74 VanDerWaalsContact O-CG2 3.3Å; E70-T74 WeakPolarHBondContact O-CG2 3.22Å; E70-T74 PolarHBondContact O-N 2.9Å; E70-T74 PolarHBondContact O-OG1 3.31Å; T74-S76 PolarHBondContact O-N 2.69Å; T74-S76 PolarHBondContact OG1-N 2.9Å
75	K	77.9	Confident	65.9	Low	90 Å²	90	78.8 Å²	78.8	39%	0.391	45%	0.449	S	S	.	.			trans	60.5	23.6	-173.9	-49.3	176.2	174.2	-167	0	114.5	E4 S71 T73 Y77 L78	E4-K75 WeakPolarHBondContact OE1-CE 3.16Å; E4-K75 IonicContact OE1-NZ 3.77Å; E4-K75 PolarHBondContact OE1-NZ 3.35Å; E4-K75 WeakPolarHBondContact OE2-CD 3.34Å; E4-K75 VanDerWaalsContact OE2-CE 3.25Å; E4-K75 WeakPolarHBondContact OE2-CE 3.16Å; E4-K75 IonicContact OE2-NZ 3.12Å; E4-K75 PolarHBondContact OE2-NZ 2.73Å; S71-K75 CarbonylContact O-C 3.3Å; S71-K75 WeakPolarHBondContact O-CA 3.23Å; S71-K75 PolarHBondContact O-N 2.87Å; T73-K75 VanDerWaalsContact C-N 3.31Å; K75-Y77 HydrophobicContact CB-CE1 4.4Å; K75-Y77 PolarHBondContact O-N 3.3Å; K75-L78 HydrophobicContact CB-CD1 4.2Å; K75-L78 HydrophobicContact CD-CD1 4.39Å; K75-L78 WeakPolarHBondContact O-CB 3.45Å; K75-L78 PolarHBondContact O-N 3.22Å
76	S	68.9	Low	63.1	Low	59 Å²	59	81.9 Å²	81.9	41%	0.413	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-51.3	-31.1	-177.9	62.1	0	0	0	0	114.1	S71 T74 L78 G79	S71-S76 WeakPolarHBondContact CA-OG 3.41Å; S71-S76 WeakPolarHBondContact CB-OG 3.25Å; S71-S76 PolarHBondContact O-N 2.84Å; S71-S76 PolarHBondContact OG-OG 2.85Å; S71-S76 VanDerWaalsContact OG-OG 3.05Å; T74-S76 PolarHBondContact O-N 2.69Å; T74-S76 PolarHBondContact OG1-N 2.9Å; S76-L78 PolarHBondContact O-N 2.98Å; S76-L78 VanDerWaalsContact O-N 3.13Å; S76-G79 PolarHBondContact O-N 3.48Å
77	Y	72.9	Confident	60.4	Low	9 Å²	9	83.9 Å²	83.9	4%	0.035	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-63	-12	176.4	70.8	-94.1	0	0	0	115.2	I3 E4 F9 S71 L72 K75 G79	I3-Y77 HydrophobicContact CG2-CE2 4.3Å; E4-Y77 PolarHBondContact N-OH 3.1Å; F9-Y77 HydrophobicContact CB-CD2 3.56Å; F9-Y77 HydrophobicContact CB-CE2 3.85Å; F9-Y77 HydrophobicContact CB-CG 4.11Å; F9-Y77 AromaticContact CD2-CD1 3.77Å; F9-Y77 HydrophobicContact CD2-CD1 3.77Å; F9-Y77 AromaticContact CD2-CD2 3.98Å; F9-Y77 HydrophobicContact CD2-CD2 3.98Å; F9-Y77 HydrophobicContact CD2-CE1 4.24Å; F9-Y77 HydrophobicContact CD2-CE2 4.41Å; F9-Y77 AromaticContact CD2-CG 3.63Å; F9-Y77 HydrophobicContact CD2-CG 3.63Å; F9-Y77 HydrophobicContact CE2-CD1 4.38Å; F9-Y77 HydrophobicContact CG-CD2 4.22Å; F9-Y77 HydrophobicContact CG-CE2 4.48Å; F9-Y77 HydrophobicContact CG-CG 4.33Å; S71-Y77 VanDerWaalsContact O-CD1 3.31Å; S71-Y77 WeakPolarHBondContact O-CD1 3.44Å; L72-Y77 HydrophobicContact CD2-CE1 4.1Å; K75-Y77 HydrophobicContact CB-CE1 4.4Å; K75-Y77 PolarHBondContact O-N 3.3Å; Y77-G79 VanDerWaalsContact C-N 3.33Å
78	L	69.8	Low	57.8	Low	68 Å²	68	88.5 Å²	88.5	36%	0.356	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-81.9	-4.3	177.8	-80.9	177	0	0	0	114.7	E4 N5 K75 S76	E4-L78 HydrophobicContact CB-CD1 4.37Å; N5-L78 HydrophobicContact CB-CD2 3.51Å; K75-L78 HydrophobicContact CB-CD1 4.2Å; K75-L78 HydrophobicContact CD-CD1 4.39Å; K75-L78 WeakPolarHBondContact O-CB 3.45Å; K75-L78 PolarHBondContact O-N 3.22Å; S76-L78 PolarHBondContact O-N 2.98Å; S76-L78 VanDerWaalsContact O-N 3.13Å
79	G	55.9	Low	55.3	Low	57 Å²	57	98 Å²	98	59%	0.588	56%	0.564	S	S	*	*			trans	39.2	88.3	162.1	0	0	0	0	0	116.5	S76 Y77	S76-G79 PolarHBondContact O-N 3.48Å; Y77-G79 VanDerWaalsContact C-N 3.33Å
80	N	35.8	Very low	52.6	Low	152 Å²	152	106.5 Å²	106.5	81%	0.813	60%	0.604	S	S	*	*			trans	-27.5	123.1	178.7	-171.1	36.6	0	0	0	114.2	A82	N80-A82 PolarHBondContact O-N 3.08Å
81	P	36.4	Very low	49.9	Very low	119 Å²	119	105.6 Å²	105.6	77%	0.773	61%	0.606	S	S	*	*	S	Bend	trans	-65.1	97.3	-165.1	24.2	-35.8	0	0	0	114.6
82	A	33.1	Very low	47.4	Very low	92 Å²	92	114 Å²	114	76%	0.76	64%	0.641	S	S	*	*			trans	52.5	69.4	155.9	0	0	0	0	0	117.3	N80	N80-A82 PolarHBondContact O-N 3.08Å
83	A	29.2	Very low	45.3	Very low	96 Å²	96	118.9 Å²	118.9	79%	0.793	67%	0.673	S	S	*	*			trans	-69.1	139	136.5	0	0	0	0	0	108.5
84	K	37.7	Very low	42.6	Very low	201 Å²	201	119.6 Å²	119.6	87%	0.874	69%	0.687	S	S	*	*			trans	-84.1	137.2	176.7	-60.1	173.7	-176.9	173.8	0	109.8
85	E	28.3	Very low	40	Very low	197 Å²	197	120.9 Å²	120.9	92%	0.921	70%	0.695	S	S	*	*			trans	-126.5	140.9	148.6	-68.5	-163	158.7	0	0	109.4
86	G	27.9	Very low	37.7	Very low	69 Å²	69	123.6 Å²	123.6	71%	0.711	71%	0.713	S	S	*	*			trans	-98.7	162.8	179.2	0	0	0	0	0	111.7
87	P	31	Very low	35.8	Very low	127 Å²	127	128.9 Å²	128.9	83%	0.825	73%	0.729	S	S	*	*			trans	-74.4	128.4	177.6	30.5	-33.4	0	0	0	111.8
88	K	27.8	Very low	33.7	Very low	211 Å²	211	134.2 Å²	134.2	92%	0.917	76%	0.762	S	S	*	*			trans	37.2	116.7	149.5	-59	-176.2	179.3	-174.7	0	118.6
89	E	34.8	Very low	31.7	Very low	200 Å²	200	137.3 Å²	137.3	94%	0.935	78%	0.779	S	S	*	*			trans	-127.1	149.1	150.5	-173.3	167.9	-160.5	0	0	108.9
90	E	28.3	Very low	30.3	Very low	179 Å²	179	140.2 Å²	140.2	84%	0.836	79%	0.785	S	S	*	*			trans	-139.6	156.2	-179.8	-157.6	-168.7	149.5	0	0	110.4
91	V	30	Very low	29.9	Very low	99 Å²	99	138.4 Å²	138.4	60%	0.6	78%	0.779	S	S	*	*			trans	91.1	81.7	165.5	-164.3	0	0	0	0	118.2
92	K	27.7	Very low	29.4	Very low	189 Å²	189	141.1 Å²	141.1	82%	0.822	78%	0.781	S	S	*	*			trans	78.4	156.3	134.2	-62.3	174.4	-172.5	167.7	0	120.4
93	P	38.2	Very low	29	Very low	112 Å²	112	141 Å²	141	73%	0.727	78%	0.781	S	S	*	*			cis	-144.5	156.1	-47.7	39.7	-23.1	0	0	0	115.8
94	A	24.6	Very low	28.8	Very low	96 Å²	96	144.3 Å²	144.3	79%	0.793	78%	0.78	S	S	*	*			trans	62.3	146.8	160	0	0	0	0	0	117.5
95	T	23.5	Very low	28.1	Very low	117 Å²	117	140.4 Å²	140.4	72%	0.718	77%	0.773	S	S	*	*			cis	-155.8	143.2	40.6	46.5	0	0	0	0	113.6
96	L	29.5	Very low	28.6	Very low	147 Å²	147	136 Å²	136	77%	0.77	76%	0.762	S	S	*	*			trans	53.5	143.2	141.5	-51	170.3	0	0	0	119.5
97	K	29.8	Very low	28.5	Very low	170 Å²	170	141.7 Å²	141.7	74%	0.739	77%	0.77	S	S	*	*			cis	-175.7	153.9	-2.2	-116.4	179.7	174.9	178.4	0	108.6
98	V	28.2	Very low	28.2	Very low	120 Å²	120	144.2 Å²	144.2	73%	0.727	77%	0.77	S	S	*	*			trans	61	133	141.7	173.7	0	0	0	0	118.4
99	D	27.2	Very low	28.2	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	76%	0.759	S	S	*	*			cis	-172.3	167.7	-13.7	-114.8	-50.7	0	0	0	111.9
100	V	28.1	Very low	27.9	Very low	119 Å²	119	140.5 Å²	140.5	72%	0.721	75%	0.748	S	S	*	*			trans	70.9	105.3	142.5	166.1	0	0	0	0	123
101	V	26.8	Very low	27.8	Very low	114 Å²	114	140.2 Å²	140.2	69%	0.691	75%	0.747	S	S	*	*				84.9	129	121.5	169.7	0	0	0	0	124.4
102	E	25.3	Very low	27.5	Very low	175 Å²	175	141.6 Å²	141.6	82%	0.818	75%	0.751	S	S	*	*			trans	50.1	123.8	149.4	-70.9	172.5	161	0	0	121.9
103	A	25.2	Very low	27.5	Very low	90 Å²	90	141.9 Å²	141.9	74%	0.744	75%	0.747	S	S	*	*				93.2	156.2	80.2	0	0	0	0	0	112.4
104	E	25	Very low	27.1	Very low	166 Å²	166	147.2 Å²	147.2	78%	0.776	75%	0.752	S	S	*	*			cis	-158.9	152.4	-5.2	-139.7	-174.5	-139.4	0	0	110.2
105	T	22.2	Very low	27.3	Very low	119 Å²	119	154.2 Å²	154.2	73%	0.73	76%	0.758	S	S	*	*			trans	62.9	177.4	160.8	71.7	0	0	0	0	119.5
106	P	39.6	Very low	27.5	Very low	105 Å²	105	159 Å²	159	68%	0.682	76%	0.763	S	S	*	*			cis	-133	-174.7	-42.5	29.2	-9	0	0	0	115.6
107	E	24.8	Very low	27.4	Very low	188 Å²	188	156.9 Å²	156.9	88%	0.879	76%	0.761	S	S	*	*			trans	91	164.8	141.1	-101.5	174.7	-170.4	0	0	123.3
108	E	26.6	Very low	27.9	Very low	180 Å²	180	153.6 Å²	153.6	84%	0.841	76%	0.757	S	S	*	*			trans	-86.2	156.1	-164.7	-53.2	-179.1	69.7	0	0	114
109	E	27.3	Very low	27.9	Very low	145 Å²	145	156 Å²	156	68%	0.678	77%	0.765	S	S	*	*				-171.3	153.2	107	-113.1	-154.6	51.3	0	0	117.5
110	R	27.1	Very low	28	Very low	187 Å²	187	160 Å²	160	71%	0.706	77%	0.77	S	S	*	*			trans	40.7	135	145.3	-92.4	-167.8	-174.9	74.9	5.7	125.9
111	E	26.4	Very low	27.9	Very low	174 Å²	174	160.6 Å²	160.6	81%	0.813	77%	0.769	S	S	*	*				91.2	164.6	126.6	-161.5	153	-147.6	0	0	119.7
112	N	24.8	Very low	27.9	Very low	128 Å²	128	165 Å²	165	68%	0.684	77%	0.773	S	S	*	*			trans	-162.1	119.7	-147.2	161.5	9.5	0	0	0	109
113	R	27.9	Very low	28	Very low	194 Å²	194	161 Å²	161	73%	0.732	77%	0.771	S	S	*	*			trans	160.5	142.3	143.8	-92.8	154.8	174.3	-180	-0.8	115.4
114	R	29.2	Very low	28	Very low	224 Å²	224	162.2 Å²	162.2	85%	0.845	76%	0.764	S	S	*	*			trans	68.3	155.9	158.8	-55.9	148.8	176.7	-175.6	-4.1	113.7
115	R	29.7	Very low	28.5	Very low	244 Å²	244	164.1 Å²	164.1	92%	0.921	77%	0.77	S	S	*	*			cis	-137.8	169.1	7.3	-57.3	172.5	-170.7	-113.1	7	107.3
116	R	26.4	Very low	28.9	Very low	216 Å²	216	164.4 Å²	164.4	82%	0.815	77%	0.767	S	S	*	*			cis	-166.3	152.5	-16.7	154.3	179.3	175.7	-161.5	-0.1	106.8
117	S	27.5	Very low	28.4	Very low	103 Å²	103	167.4 Å²	167.4	72%	0.72	77%	0.772	S	S	*	*			trans	-104.4	161.5	163.2	59.6	0	0	0	0	113.9
118	P	41.2	Very low	29	Very low	102 Å²	102	163.9 Å²	163.9	66%	0.662	77%	0.769	S	S	*	*			trans	-140.9	156.3	136.3	27.7	-8.2	0	0	0	116.1
119	L	28.5	Very low	29.6	Very low	170 Å²	170	165.5 Å²	165.5	89%	0.89	77%	0.767	S	S	*	*			trans	-64.5	169.9	179	-62.3	145.6	0	0	0	112.8
120	R	27.4	Very low	30.2	Very low	216 Å²	216	162.8 Å²	162.8	82%	0.815	76%	0.764	S	S	*	*				178.8	143	61.3	-172.3	175.9	-177.4	-169.9	0.8	114.1
121	N	26.2	Very low	30.8	Very low	133 Å²	133	164.2 Å²	164.2	71%	0.711	77%	0.769	S	S	*	*			trans	46.2	118.5	161	-60.6	4.1	0	0	0	119.7
122	R	27.9	Very low	31.3	Very low	206 Å²	206	161.8 Å²	161.8	78%	0.777	76%	0.758	S	S	*	*				65.8	121.3	65.2	-172	-179.8	175.4	-156.9	-7.4	111.7	D124	R122-D124 WeakPolarHBondContact CG-OD2 3.46Å; R122-D124 IonicContact CZ-OD1 3.55Å; R122-D124 IonicContact CZ-OD2 3.16Å; R122-D124 IonicContact NE-OD1 3.76Å; R122-D124 IonicContact NE-OD2 2.89Å; R122-D124 PolarHBondContact NE-OD2 2.7Å; R122-D124 IonicContact NH2-OD1 3.2Å; R122-D124 PolarHBondContact NH2-OD1 3.21Å; R122-D124 IonicContact NH2-OD2 2.67Å; R122-D124 PolarHBondContact NH2-OD2 3.21Å
123	A	26.6	Very low	32	Very low	92 Å²	92	160.8 Å²	160.8	76%	0.76	75%	0.753	S	S	*	*				-168.5	169.3	73.9	0	0	0	0	0	111.7
124	D	25.6	Very low	32.9	Very low	114 Å²	114	161.6 Å²	161.6	61%	0.61	76%	0.756	S	S	*	*			cis	-163.1	-152.4	-12.7	-118	-138.6	0	0	0	112.1	R122	R122-D124 WeakPolarHBondContact CG-OD2 3.46Å; R122-D124 IonicContact CZ-OD1 3.55Å; R122-D124 IonicContact CZ-OD2 3.16Å; R122-D124 IonicContact NE-OD1 3.76Å; R122-D124 IonicContact NE-OD2 2.89Å; R122-D124 PolarHBondContact NE-OD2 2.7Å; R122-D124 IonicContact NH2-OD1 3.2Å; R122-D124 PolarHBondContact NH2-OD1 3.21Å; R122-D124 IonicContact NH2-OD2 2.67Å; R122-D124 PolarHBondContact NH2-OD2 3.21Å
125	F	34.8	Very low	34	Very low	206 Å²	206	159.6 Å²	159.6	90%	0.904	75%	0.748	S	S	*	*			trans	-98.2	150.6	-173.4	-107.8	-119	0	0	0	115.1
126	N	30.8	Very low	35	Very low	125 Å²	125	156.6 Å²	156.6	67%	0.668	74%	0.737	S	S	*	*			trans	147.5	86.5	132.9	-179.7	57.1	0	0	0	115.1
127	E	30.2	Very low	35.6	Very low	168 Å²	168	151.4 Å²	151.4	79%	0.785	73%	0.725	S	S	*	*	S	Bend	trans	-153.2	54.5	169.6	-164.3	57.2	-108.4	0	0	112.4
128	S	37.6	Very low	36	Very low	115 Å²	115	151.5 Å²	151.5	80%	0.804	71%	0.714	S	S	*	*	S	Bend	trans	-149.2	-2.2	-178.3	-49.4	0	0	0	0	116.9
129	R	38.1	Very low	36.3	Very low	214 Å²	214	156.4 Å²	156.4	81%	0.808	72%	0.72	S	S	*	*	S	Bend	trans	-95	-11.4	-176.1	-74.8	-178.5	171.7	162.8	-1.9	115.3
130	S	40.3	Very low	36.9	Very low	87 Å²	87	155.7 Å²	155.7	61%	0.608	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-17.8	-170.5	-161.4	0	0	0	0	115.3
131	R	39.1	Very low	37.5	Very low	218 Å²	218	154.5 Å²	154.5	82%	0.823	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-14.2	-169.5	-132.5	174.9	-172.6	178.4	2.1	115.2
132	E	37.9	Very low	38.3	Very low	122 Å²	122	158 Å²	158	57%	0.57	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-44.3	-171.3	-162.7	59.3	-152.9	0	0	113.1	R134 R135	E132-R134 VanDerWaalsContact C-N 3.3Å; E132-R134 PolarHBondContact O-N 3.07Å; E132-R135 PolarHBondContact O-N 3.43Å
133	D	39.2	Very low	38.6	Very low	108 Å²	108	155 Å²	155	58%	0.578	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-59.1	-37.6	-175.3	-93.5	-41.8	0	0	0	113.3	R135 R136	D133-R135 PolarHBondContact O-N 3.13Å; D133-R136 WeakPolarHBondContact O-CB 3.48Å; D133-R136 PolarHBondContact O-N 2.89Å
134	R	46.8	Very low	39	Very low	210 Å²	210	160.3 Å²	160.3	79%	0.792	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-60.4	-18	178.4	-70.5	-176.5	177.7	163.1	1.4	114.1	E132	E132-R134 VanDerWaalsContact C-N 3.3Å; E132-R134 PolarHBondContact O-N 3.07Å
135	R	52.4	Low	39.4	Very low	182 Å²	182	163.1 Å²	163.1	69%	0.687	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-88.8	-12.8	174.4	-70	175.7	167.7	158.2	-7.5	113.4	E132 D133	E132-R135 PolarHBondContact O-N 3.43Å; D133-R135 PolarHBondContact O-N 3.13Å
136	R	50.4	Low	39.4	Very low	182 Å²	182	164.1 Å²	164.1	69%	0.687	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-42.5	-176	-173.6	166.8	-71.8	-133.3	-3.6	112.6	D133 R139	D133-R136 WeakPolarHBondContact O-CB 3.48Å; D133-R136 PolarHBondContact O-N 2.89Å; R136-R139 PolarHBondContact O-N 2.92Å
137	D	38.4	Very low	39.5	Very low	107 Å²	107	167.3 Å²	167.3	57%	0.572	73%	0.732	S	S	*	*	H	α-helix	trans	-69.3	-37.3	-176.7	-77.4	-45	0	0	0	113.6	R139 K140	D137-R139 PolarHBondContact O-N 3.14Å; D137-R139 VanDerWaalsContact O-N 3.15Å; D137-K140 WeakPolarHBondContact O-CB 3.37Å; D137-K140 PolarHBondContact O-N 2.86Å
138	E	35.9	Very low	39.4	Very low	104 Å²	104	164.7 Å²	164.7	49%	0.486	73%	0.732	S	S	.	*	H	α-helix	trans	-66.7	-19.7	-178	-149.2	60	-111.9	0	0	113.3	R141	E138-R141 IonicContact OE1-NH1 3Å; E138-R141 PolarHBondContact OE1-NH1 2.74Å; E138-R141 IonicContact OE2-NH1 3.44Å; E138-R141 PolarHBondContact OE2-NH1 3.05Å
139	R	48.8	Very low	39.1	Very low	206 Å²	206	169 Å²	169	78%	0.777	74%	0.736	S	S	*	*	H	α-helix	trans	-74.4	-29.9	173.2	-136.5	172.4	-165.8	158.1	5.2	112	R136 D137 R141	R136-R139 PolarHBondContact O-N 2.92Å; D137-R139 PolarHBondContact O-N 3.14Å; D137-R139 VanDerWaalsContact O-N 3.15Å; R139-R141 PolarHBondContact O-N 3.05Å
140	K	41.5	Very low	38.8	Very low	155 Å²	155	163.8 Å²	163.8	67%	0.674	74%	0.739	S	S	*	*	H	α-helix	trans	-78	-14.8	-171.1	-161.9	176.1	179.9	-176.7	0	114.2	D137	D137-K140 WeakPolarHBondContact O-CB 3.37Å; D137-K140 PolarHBondContact O-N 2.86Å
141	R	39.7	Very low	38.3	Very low	190 Å²	190	163.4 Å²	163.4	72%	0.717	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-20.4	177.4	-80.4	-172.4	172.8	122.8	-2.3	114.6	E138 R139	E138-R141 IonicContact OE1-NH1 3Å; E138-R141 PolarHBondContact OE1-NH1 2.74Å; E138-R141 IonicContact OE2-NH1 3.44Å; E138-R141 PolarHBondContact OE2-NH1 3.05Å; R139-R141 PolarHBondContact O-N 3.05Å
142	R	41.4	Very low	37.9	Very low	208 Å²	208	158.7 Å²	158.7	79%	0.785	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-88.1	-13.4	-170.8	-103.1	179.2	-81	-175.2	-7.7	115.8	F144	R142-F144 PolarHBondContact O-N 3.49Å
143	D	34.8	Very low	37.5	Very low	143 Å²	143	154.8 Å²	154.8	77%	0.765	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-81.7	-6	-174.8	-70.6	-48.2	0	0	0	114.9
144	F	34.9	Very low	37	Very low	203 Å²	203	156.6 Å²	156.6	89%	0.89	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-88.4	-6.3	-165.9	-129.9	-88.4	0	0	0	116.1	R142	R142-F144 PolarHBondContact O-N 3.49Å
145	E	33.5	Very low	36.4	Very low	173 Å²	173	157.2 Å²	157.2	81%	0.808	73%	0.732	S	S	*	*	S	Bend	trans	-108.9	1.9	-163.7	-160.6	168.1	-151.3	0	0	115.4
146	R	35.2	Very low	35.3	Very low	226 Å²	226	157 Å²	157	85%	0.853	74%	0.739	S	S	*	*			trans	-130.5	38.8	-166.4	-134.7	165.7	-72.6	-147	-0.7	117.7
147	H	32.9	Very low	34.3	Very low	193 Å²	193	159.2 Å²	159.2	89%	0.894	75%	0.747	S	S	*	*			trans	-126.4	124.1	165	-98.6	-67.5	0	0	0	112.9
148	S	27.9	Very low	33.8	Very low	113 Å²	113	163 Å²	163	79%	0.79	76%	0.761	S	S	*	*			trans	-162	126	165.2	-95.4	0	0	0	0	114.1
149	K	31.5	Very low	33.6	Very low	204 Å²	204	169.8 Å²	169.8	89%	0.887	78%	0.782	S	S	*	*			trans	66.4	130.3	168.7	-56.8	174.2	-177.3	174.6	0	115.4
150	A	32.5	Very low	32.9	Very low	106 Å²	106	169.5 Å²	169.5	88%	0.876	79%	0.789	S	S	*	*			cis	91.8	139.9	33.4	0	0	0	0	0	113.8
151	G	30.4	Very low	32.2	Very low	79 Å²	79	168.8 Å²	168.8	81%	0.814	79%	0.788	S	S	*	*			cis	-165.6	-155.7	5.6	0	0	0	0	0	114.6
152	E	29.7	Very low	31.6	Very low	118 Å²	118	167.9 Å²	167.9	55%	0.551	79%	0.785	S	S	*	*			trans	-102.7	-171.1	-172.6	-81.8	-169	114.6	0	0	114.8	F465 I466 P467	E152-F465 HydrophobicContact CG-CB 4.5Å; E152-I466 WeakPolarHBondContact OE1-CD1 3.36Å; E152-I466 VanDerWaalsContact OE1-CG1 3.27Å; E152-I466 WeakPolarHBondContact OE1-CG1 3.5Å; E152-P467 HydrophobicContact CB-CG 4.01Å; E152-P467 VanDerWaalsContact OE2-CB 3.27Å; E152-P467 WeakPolarHBondContact OE2-CB 3.22Å
153	A	30.7	Very low	31	Very low	41 Å²	41	167.9 Å²	167.9	34%	0.339	79%	0.785	S	S	.	*			trans	-118.4	-170.2	-162.8	0	0	0	0	0	116	F465 I466 P467	A153-F465 WeakPolarHBondContact CA-O 3.01Å; A153-F465 VanDerWaalsContact CB-N 3.29Å; A153-F465 WeakPolarHBondContact CB-O 3.36Å; A153-F465 PolarHBondContact N-O 3.31Å; A153-I466 CarbonylContact C-O 3.53Å; A153-I466 VanDerWaalsContact O-O 3.09Å; A153-P467 WeakPolarHBondContact O-CD 3.3Å
154	H	27.1	Very low	30.7	Very low	145 Å²	145	172.6 Å²	172.6	67%	0.671	79%	0.792	S	S	*	*			trans	-165.4	123.8	165.1	-177.8	-84.3	0	0	0	110.5
155	R	34.6	Very low	30.3	Very low	224 Å²	224	166.9 Å²	166.9	85%	0.845	79%	0.79	S	S	*	*			trans	163.5	55	154	-91.1	168.2	-160	88	-9.4	113.4
156	E	29.1	Very low	30	Very low	177 Å²	177	164.2 Å²	164.2	83%	0.827	79%	0.791	S	S	*	*			trans	-70.4	168.3	143.3	-162.9	-174.8	-171.9	0	0	108.4
157	R	29.6	Very low	30.9	Very low	229 Å²	229	158.4 Å²	158.4	86%	0.864	78%	0.782	S	S	*	*			trans	71.8	97.8	169.7	-171.7	-169.9	-55.2	-120.6	-5.1	116.1
158	E	28	Very low	30.7	Very low	185 Å²	185	161.1 Å²	161.1	86%	0.864	79%	0.785	S	S	*	*				168.8	92.3	121.3	-177.3	165.5	-123.2	0	0	111.6
159	R	32.5	Very low	30.7	Very low	248 Å²	248	159 Å²	159	94%	0.936	78%	0.781	S	S	*	*			trans	-171.9	17	155.3	-109.9	164.2	-154.4	-158.9	4.6	116.5	E161	R159-E161 PolarHBondContact O-N 3.34Å
160	H	33.3	Very low	30.5	Very low	199 Å²	199	161.6 Å²	161.6	92%	0.921	79%	0.785	S	S	*	*			trans	-71	93.7	160.2	-102.1	88.6	0	0	0	108.7
161	E	27.6	Very low	30.4	Very low	141 Å²	141	162.1 Å²	162.1	66%	0.659	78%	0.783	S	S	*	*			trans	-169.4	149.8	139.2	-112.6	-160.6	106.1	0	0	116.3	R159	R159-E161 PolarHBondContact O-N 3.34Å
162	R	26.2	Very low	30.2	Very low	170 Å²	170	167.5 Å²	167.5	64%	0.642	78%	0.78	S	S	*	*			trans	80.1	103	151.5	-68	159.3	-164.8	173.9	17.1	121.1
163	R	28.6	Very low	30.2	Very low	209 Å²	209	165.7 Å²	165.7	79%	0.789	78%	0.78	S	S	*	*			trans	82.1	150.1	135.7	-55.1	160.8	-173	-160.9	1.4	117.1
164	R	28.1	Very low	30.2	Very low	242 Å²	242	173.1 Å²	173.1	91%	0.913	80%	0.8	S	S	*	*			cis	-168.1	149.8	-19.4	-107.1	179.2	-177.3	-168.8	1	106.8
165	G	27.5	Very low	30.2	Very low	83 Å²	83	171 Å²	171	86%	0.856	80%	0.801	S	S	*	*			trans	146.8	141.8	157.9	0	0	0	0	0	119.2
166	S	27.9	Very low	30.1	Very low	116 Å²	116	171.2 Å²	171.2	81%	0.811	80%	0.802	S	S	*	*			trans	-142.3	178.7	166.2	-149.7	0	0	0	0	105.8
167	P	52.8	Low	30.1	Very low	105 Å²	105	166.6 Å²	166.6	68%	0.682	79%	0.789	S	S	*	*			cis	-147.5	-160.2	12.2	42.6	-19.4	0	0	0	116.5
168	R	30	Very low	30.2	Very low	249 Å²	249	164 Å²	164	94%	0.94	78%	0.779	S	S	*	*			trans	74.5	148	165.9	-70.2	173.3	171	171.8	-2.9	118.2
169	G	26.7	Very low	30.2	Very low	70 Å²	70	159.6 Å²	159.6	72%	0.722	77%	0.769	S	S	*	*			cis	163.7	150.3	-17.4	0	0	0	0	0	118.1
170	R	28.2	Very low	30.1	Very low	257 Å²	257	158.5 Å²	158.5	97%	0.97	77%	0.765	S	S	*	*			trans	71.6	169.4	160.9	-74.8	-174.1	174.2	176.4	-0.5	120.2
171	S	29	Very low	29.8	Very low	118 Å²	118	154.7 Å²	154.7	83%	0.825	76%	0.76	S	S	*	*			trans	-169.6	151.8	-165.8	52.8	0	0	0	0	111.6
172	Y	27.3	Very low	29.8	Very low	191 Å²	191	151.2 Å²	151.2	75%	0.749	76%	0.762	S	S	*	*			trans	-173.6	121.5	148.3	-166.4	-105.7	0	0	0	117.7
173	S	29.1	Very low	29.9	Very low	80 Å²	80	149 Å²	149	56%	0.559	77%	0.773	S	S	*	*			trans	-12.6	155.5	148.2	-15.8	0	0	0	0	126.2
174	R	31.1	Very low	30	Very low	198 Å²	198	151 Å²	151	75%	0.747	78%	0.781	S	S	*	*				104	91.5	118	-157.9	172.3	-151.1	137.9	7.8	125.2
175	S	27.9	Very low	30	Very low	100 Å²	100	143 Å²	143	70%	0.699	77%	0.773	S	S	*	*				73.3	150.7	120.9	-50.1	0	0	0	0	126.2
176	R	31.6	Very low	30.2	Very low	229 Å²	229	149.4 Å²	149.4	86%	0.864	78%	0.777	S	S	*	*			trans	85.8	151.2	138.9	-103.9	-177.9	-176.3	156.4	1.4	118.7
177	S	29	Very low	30.2	Very low	80 Å²	80	148.2 Å²	148.2	56%	0.559	77%	0.769	S	S	*	*			cis	-169	168.2	-0.4	2.9	0	0	0	0	115.1
178	R	32.6	Very low	29.2	Very low	173 Å²	173	154.1 Å²	154.1	65%	0.653	78%	0.777	S	S	*	*			trans	76.4	164.7	139.8	-80.6	177.7	177.2	145.8	-4	120.5
179	S	27.8	Very low	29.2	Very low	93 Å²	93	147.5 Å²	147.5	65%	0.65	76%	0.76	S	S	*	*			cis	-169.4	176.8	-5.8	-111.7	0	0	0	0	114.7
180	R	30	Very low	29.5	Very low	226 Å²	226	153.4 Å²	153.4	85%	0.853	76%	0.761	S	S	*	*			trans	89.3	155.2	161.8	-63.4	-176.1	168.7	160.2	-4.3	117.3
181	S	27.8	Very low	29.7	Very low	118 Å²	118	146.7 Å²	146.7	83%	0.825	74%	0.741	S	S	*	*			cis	-174.9	166.5	-24.8	-85.3	0	0	0	0	109.1
182	G	27.2	Very low	29.8	Very low	68 Å²	68	147.1 Å²	147.1	70%	0.701	73%	0.73	S	S	*	*			cis	155.7	138.3	-14.8	0	0	0	0	0	116.5
183	S	27.1	Very low	30	Very low	123 Å²	123	148.5 Å²	148.5	86%	0.86	73%	0.733	S	S	*	*			trans	94.6	166.6	156.5	85.7	0	0	0	0	123.5
184	R	31.2	Very low	30.1	Very low	253 Å²	253	148.1 Å²	148.1	96%	0.955	74%	0.742	S	S	*	*			trans	89.4	136.9	-174.9	-60.2	174.8	170.7	158.3	-3.1	116.4
185	G	29.2	Very low	29.9	Very low	72 Å²	72	142.5 Å²	142.5	74%	0.742	75%	0.746	S	S	*	*			cis	167.2	159.8	-14	0	0	0	0	0	115.7
186	K	30.9	Very low	30.3	Very low	219 Å²	219	148.2 Å²	148.2	95%	0.952	75%	0.752	S	S	*	*			trans	72.8	161.6	172.5	-67.7	-177.7	176.3	178.8	0	119.4
187	S	27.4	Very low	30.3	Very low	91 Å²	91	143.4 Å²	143.4	64%	0.636	74%	0.744	S	S	*	*			cis	168	136.9	-42.4	160.8	0	0	0	0	112
188	R	31.5	Very low	30.2	Very low	229 Å²	229	147.7 Å²	147.7	86%	0.864	75%	0.752	S	S	*	*			trans	153.3	133.2	147.4	-85.9	167.9	176.9	-176.7	-3.1	109.7
189	D	30.7	Very low	30	Very low	109 Å²	109	147.6 Å²	147.6	58%	0.583	76%	0.757	S	S	*	*			cis	74	141.9	37.5	-61.6	-90.8	0	0	0	113.1
190	R	34.1	Very low	29.9	Very low	194 Å²	194	148 Å²	148	73%	0.732	76%	0.76	S	S	*	*			cis	-174	169.8	-6.2	-111	-170.6	147.3	82.5	7.3	109
191	E	31.3	Very low	29.7	Very low	116 Å²	116	146.1 Å²	146.1	54%	0.542	76%	0.758	S	S	.	*			cis	-167.4	-164	-22.8	-143.4	-155.1	86.5	0	0	109.1
192	H	31.6	Very low	29.5	Very low	128 Å²	128	148 Å²	148	59%	0.593	75%	0.751	S	S	*	*			trans	70.6	156.1	158.9	-73.1	0.2	0	0	0	118.1
193	R	31.3	Very low	29.5	Very low	219 Å²	219	151.6 Å²	151.6	83%	0.826	75%	0.75	S	S	*	*			cis	-157.8	170.3	-6.8	-109	167.3	-158.7	-158.4	9.6	107.5
194	G	30.5	Very low	29.6	Very low	73 Å²	73	150.8 Å²	150.8	75%	0.753	74%	0.74	S	S	*	*			cis	139.7	94.6	-10.2	0	0	0	0	0	115.5
195	G	27.2	Very low	29.4	Very low	79 Å²	79	146.2 Å²	146.2	81%	0.814	73%	0.729	S	S	*	*			trans	81.3	173.9	167.7	0	0	0	0	0	116.9
196	R	36.4	Very low	29.4	Very low	220 Å²	220	154.9 Å²	154.9	83%	0.83	74%	0.739	S	S	*	*			cis	-168.9	-174.8	-17.6	-158.2	-172.8	-82.8	-168.5	-3.6	108.7
197	D	30.7	Very low	29.3	Very low	129 Å²	129	151.1 Å²	151.1	69%	0.69	72%	0.723	S	S	*	*			trans	79.9	153.9	157.9	-46.6	-42.2	0	0	0	116.6
198	F	28.7	Very low	29.3	Very low	169 Å²	169	152.6 Å²	152.6	74%	0.741	72%	0.724	S	S	*	*			cis	-160.7	166.9	-1.3	-146.5	-125.4	0	0	0	113.4
199	K	26.9	Very low	29.4	Very low	171 Å²	171	147.1 Å²	147.1	74%	0.743	71%	0.712	S	S	*	*			trans	62.2	120.4	161.1	-92.7	172.9	-178.2	174.6	0	119.8
200	S	27.1	Very low	29.3	Very low	103 Å²	103	148.3 Å²	148.3	72%	0.72	72%	0.718	S	S	*	*				84.6	143.3	78.6	79.1	0	0	0	0	114.6
201	K	25.8	Very low	29.1	Very low	186 Å²	186	141.8 Å²	141.8	81%	0.809	71%	0.711	S	S	*	*			cis	-159.6	175.7	16.5	-163.8	-170.3	173	-168.9	0	110.4
202	F	23.8	Very low	29	Very low	156 Å²	156	146.7 Å²	146.7	68%	0.684	73%	0.726	S	S	*	*			trans	82.2	120.6	169.4	-134.1	-109.8	0	0	0	114.7
203	E	25.9	Very low	28.8	Very low	144 Å²	144	146.5 Å²	146.5	67%	0.673	73%	0.73	S	S	*	*				70.5	134.1	66.3	-82.7	170.6	102.6	0	0	113.1
204	V	30.4	Very low	28.6	Very low	107 Å²	107	141.4 Å²	141.4	65%	0.648	72%	0.723	S	S	*	*			cis	-135	155.2	24.6	160.6	0	0	0	0	114
205	E	26	Very low	28.5	Very low	157 Å²	157	141.9 Å²	141.9	73%	0.734	72%	0.715	S	S	*	*			trans	19.2	139	163.6	-67.9	174.7	84.3	0	0	125.7
206	R	30.3	Very low	28.6	Very low	254 Å²	254	146.1 Å²	146.1	96%	0.958	71%	0.713	S	S	*	*				-128.6	149.2	128.7	-73.4	-173.4	-174.3	154	2.3	109.7
207	K	28.5	Very low	28.1	Very low	140 Å²	140	142 Å²	142	61%	0.609	71%	0.713	S	S	*	*			trans	-158	141	-174.6	-173.7	66.5	170.5	132.2	0	105.4
208	D	27.6	Very low	28	Very low	121 Å²	121	141.2 Å²	141.2	65%	0.647	72%	0.718	S	S	*	*			cis	-107.6	170.5	7.5	-80.7	-69.8	0	0	0	112.9
209	N	32.4	Very low	27.8	Very low	115 Å²	115	136.3 Å²	136.3	62%	0.615	72%	0.715	S	S	*	*			cis	68.6	135.8	48.2	-122	46.3	0	0	0	112.7
210	D	29.2	Very low	28.6	Very low	133 Å²	133	133.7 Å²	133.7	71%	0.711	72%	0.715	S	S	*	*			cis	-134.2	176.2	8.1	-84.4	-84.3	0	0	0	110.4
211	G	29.1	Very low	28.8	Very low	58 Å²	58	136.2 Å²	136.2	60%	0.598	72%	0.716	S	S	*	*			cis	159.2	158	-6.1	0	0	0	0	0	112.6
212	Y	29.9	Very low	29	Very low	218 Å²	218	134.1 Å²	134.1	86%	0.855	71%	0.709	S	S	*	*			trans	65	150.3	162.3	-73.3	-101.5	0	0	0	119.5
213	N	27.8	Very low	29.1	Very low	125 Å²	125	133 Å²	133	67%	0.668	71%	0.706	S	S	*	*			cis	-168.1	162.8	-19.9	-166.1	6.4	0	0	0	111.4
214	T	25.6	Very low	29.1	Very low	111 Å²	111	132.5 Å²	132.5	68%	0.681	70%	0.703	S	S	*	*			trans	43.8	148.1	140.8	-82.3	0	0	0	0	122.8
215	S	29.9	Very low	30.2	Very low	84 Å²	84	132.9 Å²	132.9	59%	0.587	71%	0.708	S	S	*	*			cis	-172.9	152.4	-18.7	-90.5	0	0	0	0	110.5
216	Q	27.9	Very low	31.4	Very low	167 Å²	167	129.5 Å²	129.5	78%	0.78	70%	0.7	S	S	*	*			trans	45.8	155	147	-58	-169.5	47.1	0	0	124.6
217	T	26.9	Very low	32.6	Very low	133 Å²	133	121.2 Å²	121.2	82%	0.816	68%	0.678	S	S	*	*			trans	67	174.1	166.7	80.5	0	0	0	0	115.3
218	S	28.2	Very low	32.7	Very low	113 Å²	113	120.1 Å²	120.1	79%	0.79	68%	0.679	S	S	*	*				-160.1	176.1	-57.6	50.2	0	0	0	0	106.4
219	G	24.5	Very low	33.3	Very low	66 Å²	66	119.9 Å²	119.9	68%	0.68	68%	0.677	S	S	*	*			trans	-82.4	-164.5	170.2	0	0	0	0	0	112.7
220	P	44.5	Very low	33.8	Very low	117 Å²	117	119.6 Å²	119.6	76%	0.76	68%	0.681	S	S	*	*			cis	-137.9	168.7	15	49.4	-31.3	0	0	0	113.7
221	Q	30.5	Very low	34.1	Very low	156 Å²	156	120.8 Å²	120.8	73%	0.729	69%	0.687	S	S	*	*				87.1	134.4	91	-180	174.2	-42.5	0	0	118.9
222	Q	30.7	Very low	34.6	Very low	141 Å²	141	123.6 Å²	123.6	66%	0.659	70%	0.695	S	S	*	*			trans	70.7	154.5	162.6	-75.3	170.8	-61.6	0	0	119.5
223	Q	26.3	Very low	34.8	Very low	132 Å²	132	119.4 Å²	119.4	62%	0.617	69%	0.692	S	S	*	*			cis	-167.1	138.4	-22.6	-116.5	175.4	-29.9	0	0	114.9
224	H	24.8	Very low	35.9	Very low	135 Å²	135	118.2 Å²	118.2	63%	0.625	69%	0.691	S	S	*	*			trans	58.7	172.6	138.5	-70.5	-20.7	0	0	0	123.4
225	P	53.3	Low	37.2	Very low	114 Å²	114	118.3 Å²	118.3	74%	0.74	69%	0.693	S	S	*	*			cis	-131.6	-146.8	-31	35.8	-13.2	0	0	0	111.4
226	P	52.1	Low	37.2	Very low	87 Å²	87	121.6 Å²	121.6	57%	0.565	70%	0.699	S	S	*	*			cis	-129.3	-110.1	-6.7	25.8	3.1	0	0	0	118.8	T522	P226-T522 VanDerWaalsContact O-CG2 3.32Å; P226-T522 WeakPolarHBondContact O-CG2 3.46Å
227	P	54.2	Low	38.4	Very low	79 Å²	79	119 Å²	119	51%	0.513	70%	0.697	S	S	.	*				-135.1	152	-119.4	42.5	-23.4	0	0	0	121.1	M523	P227-M523 WeakPolarHBondContact CA-O 3.48Å
228	L	31.5	Very low	38.5	Very low	117 Å²	117	120.5 Å²	120.5	61%	0.613	69%	0.694	S	S	*	*			trans	107.6	98.3	134.3	-12	162.2	0	0	0	121	R521 T522	L228-R521 CarbonylContact O-C 3.57Å; L228-T522 VanDerWaalsContact C-N 3.31Å; L228-T522 CarbonylContact C-O 3.54Å; L228-T522 VanDerWaalsContact C-O 3.3Å; L228-T522 PolarHBondContact N-O 2.79Å; L228-T522 PolarHBondContact O-N 3.41Å
229	L	39.5	Very low	39.5	Very low	116 Å²	116	119.8 Å²	119.8	61%	0.607	69%	0.687	S	S	*	*			trans	-58.6	161.4	175.8	-74.8	-177.3	0	0	0	116.5	T522	L229-T522 WeakPolarHBondContact CG-O 3.16Å; L229-T522 PolarHBondContact N-O 3.46Å
230	P	43.9	Very low	39.6	Very low	110 Å²	110	125.9 Å²	125.9	71%	0.714	70%	0.695	S	S	*	*				-142.9	-145	50.9	37.6	-12.3	0	0	0	118.5
231	L	34.5	Very low	38.7	Very low	157 Å²	157	124.9 Å²	124.9	82%	0.822	69%	0.691	S	S	*	*			trans	-93.5	-175.7	-155.8	-101.7	65.6	0	0	0	116.8
232	P	40.4	Very low	38.5	Very low	118 Å²	118	123 Å²	123	77%	0.766	70%	0.695	S	S	*	*			cis	-146.5	-132.1	30.7	45.5	-20.8	0	0	0	118.8
233	T	33.5	Very low	38.3	Very low	130 Å²	130	120.5 Å²	120.5	80%	0.798	70%	0.699	S	S	*	*			trans	-150.6	-171.7	-169.8	58.8	0	0	0	0	111
234	P	50.9	Low	38.3	Very low	100 Å²	100	120.1 Å²	120.1	65%	0.649	71%	0.706	S	S	*	*			cis	-108	-133.8	4	45.2	-31.5	0	0	0	113.9
235	P	52.2	Low	38.4	Very low	112 Å²	112	118.9 Å²	118.9	73%	0.727	71%	0.712	S	S	*	*			cis	-111.4	-167.2	16.1	21	5.3	0	0	0	114.6
236	H	31.6	Very low	37.2	Very low	153 Å²	153	119 Å²	119	71%	0.708	72%	0.715	S	S	*	*			cis	87.4	148.1	15.6	-50	-48.9	0	0	0	116.9
237	P	52.2	Low	35.9	Very low	114 Å²	114	119.7 Å²	119.7	74%	0.74	73%	0.729	S	S	*	*			cis	-130	-155.2	29.1	39.7	-17.9	0	0	0	119.2
238	H	28.3	Very low	34.7	Very low	164 Å²	164	119.3 Å²	119.3	76%	0.759	74%	0.739	S	S	*	*			trans	-104.2	-157.2	-146.7	-18.1	-82.9	0	0	0	116.3
239	P	50.5	Low	34.6	Very low	98 Å²	98	121.1 Å²	121.1	64%	0.636	75%	0.754	S	S	*	*			cis	-139.1	-176.4	-35.1	33.2	-10.8	0	0	0	117
240	F	27.3	Very low	34	Very low	193 Å²	193	119.1 Å²	119.1	85%	0.846	76%	0.762	S	S	*	*			trans	62.5	177	163.9	-64.5	-66.1	0	0	0	119.8
241	S	25.3	Very low	33.2	Very low	96 Å²	96	117.6 Å²	117.6	67%	0.671	77%	0.766	S	S	*	*				-170.1	151.7	-61.1	-92.2	0	0	0	0	111.2
242	S	25.7	Very low	33.1	Very low	117 Å²	117	116.9 Å²	116.9	82%	0.818	77%	0.768	S	S	*	*			trans	61.8	138.3	165.1	-59.7	0	0	0	0	118
243	A	27.2	Very low	33.4	Very low	89 Å²	89	116.6 Å²	116.6	74%	0.736	77%	0.766	S	S	*	*			cis	70.1	127.5	49.4	0	0	0	0	0	113.1
244	T	26.2	Very low	33.1	Very low	124 Å²	124	116.1 Å²	116.1	76%	0.761	76%	0.763	S	S	*	*			cis	-165.6	173.9	1.1	-80.1	0	0	0	0	109.5
245	S	26.8	Very low	32.1	Very low	108 Å²	108	117.6 Å²	117.6	76%	0.755	77%	0.77	S	S	*	*			trans	77.1	157.2	163.8	10.5	0	0	0	0	118
246	S	27.7	Very low	30.8	Very low	116 Å²	116	118.2 Å²	118.2	81%	0.811	77%	0.772	S	S	*	*			cis	-156.2	173.6	0.4	34	0	0	0	0	113.5
247	A	25.6	Very low	31.4	Very low	103 Å²	103	116.8 Å²	116.8	85%	0.851	78%	0.776	S	S	*	*			trans	-48.1	171.3	170.1	0	0	0	0	0	114.8
248	G	27.4	Very low	30.2	Very low	70 Å²	70	115.8 Å²	115.8	72%	0.722	78%	0.777	S	S	*	*			cis	-170.3	-156.9	20.1	0	0	0	0	0	107.2
249	V	29	Very low	30.2	Very low	155 Å²	155	116.3 Å²	116.3	94%	0.939	78%	0.78	S	S	*	*			cis	-156	155.1	20.5	177.5	0	0	0	0	105.8
250	G	28.4	Very low	29.5	Very low	75 Å²	75	118.1 Å²	118.1	77%	0.773	78%	0.783	S	S	*	*			cis	167	168.3	-4.2	0	0	0	0	0	110.8
251	G	27.1	Very low	30.4	Very low	78 Å²	78	114.8 Å²	114.8	80%	0.804	78%	0.781	S	S	*	*			trans	179.8	149.8	-180	0	0	0	0	0	112.2
252	V	32.6	Very low	30.4	Very low	142 Å²	142	117.3 Å²	117.3	86%	0.861	79%	0.787	S	S	*	*			trans	-145.5	171.8	-169.2	-111.3	0	0	0	0	109.2
253	P	45.2	Very low	30.5	Very low	111 Å²	111	115.5 Å²	115.5	72%	0.721	78%	0.775	S	S	*	*			cis	-137.7	-158.2	-1.9	23.3	4.5	0	0	0	114.4
254	V	29	Very low	30.6	Very low	121 Å²	121	117 Å²	117	73%	0.733	77%	0.774	S	S	*	*			trans	103.3	103.3	148	-177.4	0	0	0	0	121.4
255	V	29.1	Very low	30.9	Very low	131 Å²	131	117.6 Å²	117.6	79%	0.794	78%	0.778	S	S	*	*			trans	68.2	155.3	132.5	-178.4	0	0	0	0	122.7
256	T	25.1	Very low	30.9	Very low	124 Å²	124	119.6 Å²	119.6	76%	0.761	78%	0.78	S	S	*	*			trans	-93.5	-165.3	-174.8	59.1	0	0	0	0	112.7
257	P	43.8	Very low	30.9	Very low	124 Å²	124	118.4 Å²	118.4	81%	0.805	77%	0.772	S	S	*	*			cis	-131.2	-160.5	-10.6	38.6	-17.1	0	0	0	114.6
258	A	27.8	Very low	30.9	Very low	93 Å²	93	122.8 Å²	122.8	77%	0.769	77%	0.767	S	S	*	*			trans	-90.8	173	-174.1	0	0	0	0	0	116.4
259	H	27.9	Very low	31.1	Very low	175 Å²	175	123.6 Å²	123.6	81%	0.81	76%	0.762	S	S	*	*			trans	-157.8	164.6	137.4	-146.7	-105.9	0	0	0	115.9
260	L	36.1	Very low	31	Very low	135 Å²	135	120.6 Å²	120.6	71%	0.707	75%	0.748	S	S	*	*			trans	-71.6	164.3	-173.5	-63.5	160.5	0	0	0	115
261	P	45	Very low	30.9	Very low	123 Å²	123	124.9 Å²	124.9	80%	0.799	74%	0.742	S	S	*	*				-144.3	179.7	84.3	37.9	-21	0	0	0	114.9
262	D	25.1	Very low	31.1	Very low	149 Å²	149	132.2 Å²	132.2	80%	0.797	75%	0.747	S	S	*	*			cis	-176.9	166.5	-36.1	-175.5	25.6	0	0	0	108.6
263	S	27.8	Very low	30.9	Very low	80 Å²	80	133.3 Å²	133.3	56%	0.559	75%	0.746	S	S	*	*			trans	80.6	99.9	149.3	-157	0	0	0	0	122.9
264	T	30.3	Very low	30.4	Very low	119 Å²	119	132 Å²	132	73%	0.73	74%	0.744	S	S	*	*				76.9	148.1	124.5	67.7	0	0	0	0	125.7
265	T	31.9	Very low	30.6	Very low	138 Å²	138	129 Å²	129	85%	0.847	72%	0.722	S	S	*	*			trans	73.6	112.7	164.1	66.7	0	0	0	0	119
266	D	27.8	Very low	30.8	Very low	149 Å²	149	129.9 Å²	129.9	80%	0.797	71%	0.712	S	S	*	*			trans	-138	157.4	153.9	-147.2	-35.8	0	0	0	109
267	S	27.2	Very low	31.4	Very low	92 Å²	92	131 Å²	131	64%	0.643	71%	0.708	S	S	*	*			trans	-132	132	-162	-172	0	0	0	0	113.5	S269	S267-S269 PolarHBondContact O-N 2.68Å
268	W	26.3	Very low	30.9	Very low	194 Å²	194	131.1 Å²	131.1	74%	0.735	70%	0.702	S	S	*	*			trans	-62.9	126	166.5	-85.6	8.2	0	0	0	111.1	I618	W268-I618 HydrophobicContact CE3-CB 3.96Å; W268-I618 HydrophobicContact CE3-CD1 4.1Å; W268-I618 HydrophobicContact CE3-CG1 3.53Å; W268-I618 HydrophobicContact CE3-CG2 3.65Å; W268-I618 HydrophobicContact CH2-CD1 4.46Å; W268-I618 HydrophobicContact CZ3-CB 3.89Å; W268-I618 HydrophobicContact CZ3-CD1 3.73Å; W268-I618 HydrophobicContact CZ3-CG1 3.59Å; W268-I618 HydrophobicContact CZ3-CG2 3.95Å
269	S	30.7	Very low	31.1	Very low	88 Å²	88	130.3 Å²	130.3	62%	0.615	70%	0.703	S	S	*	*			trans	-177.6	88.7	147.6	-86.8	0	0	0	0	112	S267	S267-S269 PolarHBondContact O-N 2.68Å
270	S	26.7	Very low	31.4	Very low	92 Å²	92	129 Å²	129	64%	0.643	71%	0.706	S	S	*	*			trans	-168.5	60.8	155.9	-84.3	0	0	0	0	112.5
271	Y	27	Very low	31.2	Very low	165 Å²	165	125.3 Å²	125.3	65%	0.647	70%	0.702	S	S	*	*			trans	-123.4	94.2	167.2	-117.5	-105.6	0	0	0	110.8	H921	Y271-H921 AromaticContact CE2-CD2 3.64Å; Y271-H921 AromaticContact CE2-NE2 3.27Å; Y271-H921 VanDerWaalsContact CE2-NE2 3.27Å; Y271-H921 WeakPolarHBondContact CE2-NE2 3.41Å; Y271-H921 AromaticContact CZ-CD2 3.87Å; Y271-H921 AromaticContact CZ-NE2 3.74Å; Y271-H921 PolarHBondContact OH-CD2 2.85Å
272	Y	31.4	Very low	30.7	Very low	232 Å²	232	129.1 Å²	129.1	91%	0.91	71%	0.705	S	S	*	*			trans	166	111.1	163.7	-93.9	-64.9	0	0	0	103.3
273	I	28.1	Very low	31.6	Very low	164 Å²	164	127.4 Å²	127.4	84%	0.841	70%	0.702	S	S	*	*			cis	-126	151.7	24.7	-74	163.6	0	0	0	110.6
274	A	34.7	Very low	31.7	Very low	83 Å²	83	134 Å²	134	69%	0.686	72%	0.721	S	S	*	*			trans	-85.3	-170.8	179.7	0	0	0	0	0	113.4
275	Q	32.4	Very low	31.6	Very low	59 Å²	59	132.3 Å²	132.3	28%	0.276	73%	0.728	S	S	.	*			trans	95.2	90.8	161	-152.8	-176.7	-46.5	0	0	118.6	D313	Q275-D313 PolarHBondContact NE2-OD2 2.87Å
276	R	34.1	Very low	31.7	Very low	150 Å²	150	129.4 Å²	129.4	57%	0.566	73%	0.726	S	S	*	*			trans	67.6	158.2	143.2	-64.7	-168.4	-169.5	-82.5	20.5	120.1	G315 S316	R276-G315 PolarHBondContact NE-O 3.35Å; R276-G315 VanDerWaalsContact NE-O 3.08Å; R276-G315 PolarHBondContact NH2-O 2.97Å; R276-S316 VanDerWaalsContact NH2-C 3.29Å; R276-S316 VanDerWaalsContact NH2-CA 3.27Å; R276-S316 PolarHBondContact NH2-O 2.95Å
277	Q	36.6	Very low	31.9	Very low	146 Å²	146	132.1 Å²	132.1	68%	0.682	73%	0.731	S	S	*	*			cis	-160.5	172.6	-35.7	-164	151.5	-7.8	0	0	108.8
278	D	33.2	Very low	32.3	Very low	127 Å²	127	135.7 Å²	135.7	68%	0.679	74%	0.742	S	S	*	*			trans	-65.8	158.4	-170.3	-48.9	-105.6	0	0	0	116.1	R922	D278-R922 IonicContact OD1-NH2 2.8Å; D278-R922 PolarHBondContact OD1-NH2 2.59Å
279	G	32.5	Very low	32.8	Very low	76 Å²	76	132.7 Å²	132.7	78%	0.784	75%	0.746	S	S	*	*			trans	178.1	113.3	170.5	0	0	0	0	0	114.5
280	V	34.4	Very low	33.4	Very low	147 Å²	147	134.3 Å²	134.3	89%	0.891	75%	0.754	S	S	*	*			trans	-130.5	134.5	-177.8	-179.3	0	0	0	0	110.2
281	G	32.8	Very low	34.4	Very low	59 Å²	59	138 Å²	138	61%	0.608	77%	0.766	S	S	*	*			cis	163.6	156.6	-13.9	0	0	0	0	0	115.3
282	K	34.5	Very low	36	Very low	202 Å²	202	137.5 Å²	137.5	88%	0.878	77%	0.767	S	S	*	*			trans	77.4	148.7	166	-52.1	160	-175.7	167.9	0	117.2
283	P	42.5	Very low	38.1	Very low	113 Å²	113	133.6 Å²	133.6	73%	0.734	76%	0.757	S	S	*	*			cis	-125.3	133.8	-10.6	34.6	-16.9	0	0	0	116.1
284	F	30.7	Very low	40.7	Very low	218 Å²	218	131.3 Å²	131.3	96%	0.956	74%	0.738	S	S	*	*			trans	47.5	118.5	152.7	-69.3	-76.2	0	0	0	122.9
285	G	28.8	Very low	43.1	Very low	84 Å²	84	127.4 Å²	127.4	87%	0.866	71%	0.706	S	S	*	*			trans	168.4	43.4	161.9	0	0	0	0	0	116.7
286	G	34	Very low	45.6	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	72%	0.724	S	S	*	*			trans	-80	159.7	-163.6	0	0	0	0	0	118.2
287	K	31.2	Very low	47.7	Very low	206 Å²	206	129.2 Å²	129.2	90%	0.896	72%	0.715	S	S	*	*			trans	-133.3	143.9	156.9	-68.7	-178.5	-178.5	176.3	0	107.8
288	N	36.3	Very low	49.9	Very low	167 Å²	167	124.1 Å²	124.1	89%	0.893	69%	0.69	S	S	*	*			trans	-83.7	133.1	-170.7	-52.7	-39.4	0	0	0	112.1
289	T	37.3	Very low	52.4	Low	131 Å²	131	121.6 Å²	121.6	80%	0.804	68%	0.677	S	S	*	*			trans	-105.8	142	154	41.7	0	0	0	0	108.8
290	P	42	Very low	54.5	Low	122 Å²	122	123.9 Å²	123.9	79%	0.792	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-72.8	143.6	-179.3	30	-34.1	0	0	0	111.1	K292	P290-K292 PolarHBondContact O-N 2.88Å
291	L	48.9	Very low	56.3	Low	170 Å²	170	122.9 Å²	122.9	89%	0.89	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-62.2	127.6	168.8	-62.7	170.8	0	0	0	108.8
292	K	59.8	Low	58.4	Low	153 Å²	153	122.4 Å²	122.4	67%	0.665	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-61.3	148	170.4	-80.8	-179.7	159.4	-158.2	0	109.7	P290 P311	P290-K292 PolarHBondContact O-N 2.88Å; K292-P311 VanDerWaalsContact CD-O 3.28Å; K292-P311 WeakPolarHBondContact CD-O 3.29Å; K292-P311 WeakPolarHBondContact CE-O 3.5Å; K292-P311 PolarHBondContact NZ-O 2.91Å
293	Q	75.8	Confident	60.4	Low	151 Å²	151	118.3 Å²	118.3	71%	0.706	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-69.1	152.1	171.1	-64.1	-96.6	-41.1	0	0	109.7	F312 D313	Q293-F312 HydrophobicContact CB-CD1 3.94Å; Q293-F312 HydrophobicContact CB-CE1 4.28Å; Q293-F312 WeakPolarHBondContact O-CA 3.32Å; Q293-F312 WeakPolarHBondContact O-CB 3.21Å; Q293-D313 PolarHBondContact O-N 2.83Å
294	R	82.1	Confident	62.4	Low	115 Å²	115	113.9 Å²	113.9	43%	0.434	60%	0.599	S	S	.	*	B	Isolated β-bridge	trans	-72.6	144.5	170.6	-146.7	162.4	-175.8	-102.1	-8.7	108.9	R296 D299 D313	R294-R296 PolarHBondContact O-N 2.7Å; R294-D299 WeakPolarHBondContact CD-OD2 3.5Å; R294-D299 WeakPolarHBondContact CG-OD2 3.41Å; R294-D299 IonicContact CZ-OD1 3.67Å; R294-D299 VanDerWaalsContact CZ-OD1 3.27Å; R294-D299 IonicContact CZ-OD2 2.69Å; R294-D299 IonicContact NE-OD1 3.64Å; R294-D299 IonicContact NE-OD2 3.21Å; R294-D299 IonicContact NH1-OD1 2.61Å; R294-D299 PolarHBondContact NH1-OD1 2.74Å; R294-D299 IonicContact NH1-OD2 2.67Å; R294-D299 PolarHBondContact NH1-OD2 3.34Å; R294-D299 IonicContact NH2-OD1 2.76Å; R294-D313 WeakPolarHBondContact CG-O 3.39Å
295	C	84.5	Confident	64.8	Low	2 Å²	2	110 Å²	110	1%	0.014	59%	0.593	C	S	.	*	P	Polyproline II helix	trans	-70.8	125.5	-176.6	-172.9	0	0	0	0	110.7	D299 F312 D313 H314	C295-D299 WeakPolarHBondContact O-CB 3.39Å; C295-D299 PolarHBondContact O-N 2.67Å; C295-F312 HydrophobicContact CB-CB 3.7Å; C295-D313 PolarHBondContact N-O 3.18Å; C295-H314 WeakPolarHBondContact CB-CD2 3.35Å; C295-H314 VanDerWaalsContact CB-NE2 3.28Å; C295-H314 WeakPolarHBondContact CB-NE2 3.33Å; C295-H314 PolarHBondContact SG-NE2 3.04Å; C295-H314 VanDerWaalsContact SG-NE2 3.37Å
296	R	85.1	Confident	66.9	Low	174 Å²	174	110.8 Å²	110.8	66%	0.657	58%	0.577	S	S	*	*	H	α-helix	trans	-69.1	-41.2	-179.6	-174.3	172.7	-178	153.6	11.4	112.2	R294 Y298 D299 E300	R294-R296 PolarHBondContact O-N 2.7Å; R296-Y298 PolarHBondContact O-N 3.47Å; R296-D299 PolarHBondContact O-N 3.38Å; R296-E300 HydrophobicContact CG-CG 4.18Å; R296-E300 VanDerWaalsContact CG-OE2 3.31Å; R296-E300 WeakPolarHBondContact CG-OE2 3.5Å; R296-E300 IonicContact CZ-OE1 3.13Å; R296-E300 VanDerWaalsContact CZ-OE1 3.25Å; R296-E300 IonicContact CZ-OE2 3.79Å; R296-E300 IonicContact NE-OE1 3.73Å; R296-E300 PolarHBondContact NE-OE1 2.94Å; R296-E300 IonicContact NE-OE2 3.64Å; R296-E300 PolarHBondContact NE-OE2 3.5Å; R296-E300 IonicContact NH2-OE1 3.57Å; R296-E300 PolarHBondContact NH2-OE1 2.69Å; R296-E300 IonicContact NH2-OE2 2.7Å; R296-E300 WeakPolarHBondContact O-CB 3.36Å; R296-E300 PolarHBondContact O-N 3.47Å
297	D	78.3	Confident	68.9	Low	72 Å²	72	108 Å²	108	39%	0.385	55%	0.548	S	S	.	.	H	α-helix	trans	-60.6	-45.5	177	-70.2	-85.4	0	0	0	111.5	E300 K301 F303 C304	D297-E300 PolarHBondContact O-N 2.84Å; D297-K301 HydrophobicContact CB-CD 4.4Å; D297-K301 WeakPolarHBondContact O-CA 3.47Å; D297-K301 WeakPolarHBondContact O-CB 3.39Å; D297-K301 WeakPolarHBondContact O-CG 3.37Å; D297-K301 PolarHBondContact O-N 2.77Å; D297-K301 WeakPolarHBondContact OD1-CE 3.43Å; D297-K301 IonicContact OD1-NZ 3.18Å; D297-K301 PolarHBondContact OD1-NZ 2.84Å; D297-F303 CarbonylContact C-O 3.5Å; D297-C304 HydrophobicContact CB-CB 4.47Å
298	Y	84.3	Confident	70.8	Confident	39 Å²	39	104 Å²	104	15%	0.153	54%	0.537	C	S	.	.	H	α-helix	trans	-63.3	-44	176.1	-167.8	-83.2	0	0	0	112.1	R296 E300 G302 H314 D317 P318	R296-Y298 PolarHBondContact O-N 3.47Å; Y298-E300 VanDerWaalsContact C-N 3.35Å; Y298-E300 PolarHBondContact O-N 3.27Å; Y298-G302 WeakPolarHBondContact CE2-O 3.4Å; Y298-G302 VanDerWaalsContact O-CA 3.25Å; Y298-G302 WeakPolarHBondContact O-CA 3.25Å; Y298-G302 PolarHBondContact O-N 3.24Å; Y298-H314 VanDerWaalsContact CB-CD2 3.46Å; Y298-H314 WeakPolarHBondContact CB-CD2 3.47Å; Y298-H314 HydrophobicContact CD1-CB 4.48Å; Y298-H314 HydrophobicContact CD2-CB 3.98Å; Y298-H314 AromaticContact CD2-CD2 3.85Å; Y298-H314 AromaticContact CD2-CG 3.8Å; Y298-H314 WeakPolarHBondContact CE1-O 3.3Å; Y298-H314 HydrophobicContact CE2-CB 4.2Å; Y298-H314 HydrophobicContact CG-CB 4.15Å; Y298-H314 AromaticContact CG-CD2 3.71Å; Y298-D317 PolarHBondContact OH-O 3.39Å; Y298-P318 HydrophobicContact CE2-CB 4.02Å; Y298-P318 WeakPolarHBondContact OH-CA 3.34Å
299	D	84	Confident	72.3	Confident	75 Å²	75	104.2 Å²	104.2	40%	0.401	53%	0.534	S	S	.	.	H	α-helix	trans	-71.6	-23.6	-179.5	-84.7	1.5	0	0	0	114.2	R294 C295 R296	R294-D299 WeakPolarHBondContact CD-OD2 3.5Å; R294-D299 WeakPolarHBondContact CG-OD2 3.41Å; R294-D299 IonicContact CZ-OD1 3.67Å; R294-D299 VanDerWaalsContact CZ-OD1 3.27Å; R294-D299 IonicContact CZ-OD2 2.69Å; R294-D299 IonicContact NE-OD1 3.64Å; R294-D299 IonicContact NE-OD2 3.21Å; R294-D299 IonicContact NH1-OD1 2.61Å; R294-D299 PolarHBondContact NH1-OD1 2.74Å; R294-D299 IonicContact NH1-OD2 2.67Å; R294-D299 PolarHBondContact NH1-OD2 3.34Å; R294-D299 IonicContact NH2-OD1 2.76Å; C295-D299 WeakPolarHBondContact O-CB 3.39Å; C295-D299 PolarHBondContact O-N 2.67Å; R296-D299 PolarHBondContact O-N 3.38Å
300	E	78.3	Confident	74.4	Confident	124 Å²	124	98.7 Å²	98.7	58%	0.579	50%	0.501	S	S	*	.	H	α-helix	trans	-100.1	-23.3	178.8	-68.6	-176.6	153.8	0	0	113.9	R296 D297 Y298	R296-E300 HydrophobicContact CG-CG 4.18Å; R296-E300 VanDerWaalsContact CG-OE2 3.31Å; R296-E300 WeakPolarHBondContact CG-OE2 3.5Å; R296-E300 IonicContact CZ-OE1 3.13Å; R296-E300 VanDerWaalsContact CZ-OE1 3.25Å; R296-E300 IonicContact CZ-OE2 3.79Å; R296-E300 IonicContact NE-OE1 3.73Å; R296-E300 PolarHBondContact NE-OE1 2.94Å; R296-E300 IonicContact NE-OE2 3.64Å; R296-E300 PolarHBondContact NE-OE2 3.5Å; R296-E300 IonicContact NH2-OE1 3.57Å; R296-E300 PolarHBondContact NH2-OE1 2.69Å; R296-E300 IonicContact NH2-OE2 2.7Å; R296-E300 WeakPolarHBondContact O-CB 3.36Å; R296-E300 PolarHBondContact O-N 3.47Å; D297-E300 PolarHBondContact O-N 2.84Å; Y298-E300 VanDerWaalsContact C-N 3.35Å; Y298-E300 PolarHBondContact O-N 3.27Å
301	K	72.2	Confident	76	Confident	126 Å²	126	96.2 Å²	96.2	55%	0.548	49%	0.485	S	S	.	.	H	α-helix	trans	-117.4	-13.6	-176.2	-56.6	168.1	178.6	167.8	0	114.5	D297 F303	D297-K301 HydrophobicContact CB-CD 4.4Å; D297-K301 WeakPolarHBondContact O-CA 3.47Å; D297-K301 WeakPolarHBondContact O-CB 3.39Å; D297-K301 WeakPolarHBondContact O-CG 3.37Å; D297-K301 PolarHBondContact O-N 2.77Å; D297-K301 WeakPolarHBondContact OD1-CE 3.43Å; D297-K301 IonicContact OD1-NZ 3.18Å; D297-K301 PolarHBondContact OD1-NZ 2.84Å; K301-F303 HydrophobicContact CB-CD1 4.13Å; K301-F303 HydrophobicContact CB-CE1 4.1Å; K301-F303 WeakPolarHBondContact O-CD1 3.3Å; K301-F303 PolarHBondContact O-N 3.02Å
302	G	76.2	Confident	77.6	Confident	48 Å²	48	93 Å²	93	50%	0.495	46%	0.464	S	S	.	.	S	Bend	trans	80.2	-9.8	-173.4	0	0	0	0	0	115	Y298	Y298-G302 WeakPolarHBondContact CE2-O 3.4Å; Y298-G302 VanDerWaalsContact O-CA 3.25Å; Y298-G302 WeakPolarHBondContact O-CA 3.25Å; Y298-G302 PolarHBondContact O-N 3.24Å
303	F	77.1	Confident	78.7	Confident	117 Å²	117	88.7 Å²	88.7	51%	0.513	45%	0.448	S	S	.	.			trans	-143.6	165	175.9	71.8	-81.9	0	0	0	110.8	D297 K301 V305	D297-F303 CarbonylContact C-O 3.5Å; K301-F303 HydrophobicContact CB-CD1 4.13Å; K301-F303 HydrophobicContact CB-CE1 4.1Å; K301-F303 WeakPolarHBondContact O-CD1 3.3Å; K301-F303 PolarHBondContact O-N 3.02Å; F303-V305 HydrophobicContact CE2-CG2 4.22Å
304	C	84	Confident	78.9	Confident	19 Å²	19	82.2 Å²	82.2	13%	0.128	42%	0.418	C	S	.	.			trans	-137.4	130.2	173.9	-176.9	0	0	0	0	109.7	D297 L306 G307 H314	D297-C304 HydrophobicContact CB-CB 4.47Å; C304-L306 PolarHBondContact O-N 3.38Å; C304-L306 VanDerWaalsContact O-N 3.11Å; C304-G307 PolarHBondContact O-N 2.89Å; C304-H314 VanDerWaalsContact CB-CE1 3.44Å; C304-H314 WeakPolarHBondContact CB-CE1 3.48Å; C304-H314 WeakPolarHBondContact CB-NE2 3.5Å
305	V	79.9	Confident	78.6	Confident	137 Å²	137	77.2 Å²	77.2	83%	0.83	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-17.3	-178.1	-172.4	0	0	0	0	112.7	F303	F303-V305 HydrophobicContact CE2-CG2 4.22Å
306	L	73.4	Confident	77.4	Confident	101 Å²	101	80.5 Å²	80.5	53%	0.529	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.1	173.1	-63.9	176.8	0	0	0	113.9	C304 D308 M309 C310	C304-L306 PolarHBondContact O-N 3.38Å; C304-L306 VanDerWaalsContact O-N 3.11Å; L306-D308 PolarHBondContact O-N 3.03Å; L306-M309 WeakPolarHBondContact O-CA 3.39Å; L306-M309 WeakPolarHBondContact O-CB 3.15Å; L306-M309 PolarHBondContact O-N 2.92Å; L306-C310 HydrophobicContact CB-CB 3.98Å; L306-C310 PolarHBondContact O-N 3.13Å
307	G	75.4	Confident	75.8	Confident	20 Å²	20	79 Å²	79	21%	0.206	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	47.4	-132.2	-178.9	0	0	0	0	0	113	C304 M309 C310 H314	C304-G307 PolarHBondContact O-N 2.89Å; G307-M309 PolarHBondContact O-N 2.85Å; G307-C310 WeakPolarHBondContact O-CB 3.27Å; G307-C310 PolarHBondContact O-N 2.92Å; G307-H314 PolarHBondContact O-CE1 3.08Å; G307-H314 PolarHBondContact O-ND1 3.35Å
308	D	71.8	Confident	74.8	Confident	122 Å²	122	77.4 Å²	77.4	65%	0.652	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-71.8	-10.8	175.5	-89.1	7.5	0	0	0	114.5	L306 C310 I320	L306-D308 PolarHBondContact O-N 3.03Å; D308-C310 PolarHBondContact O-N 3.47Å; D308-I320 WeakPolarHBondContact OD1-CD1 3.09Å
309	M	67.5	Low	73.2	Confident	170 Å²	170	83.1 Å²	83.1	84%	0.837	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-81.1	-2.8	172.6	-60.8	-161.1	70.4	0	0	113.3	L306 G307	L306-M309 WeakPolarHBondContact O-CA 3.39Å; L306-M309 WeakPolarHBondContact O-CB 3.15Å; L306-M309 PolarHBondContact O-N 2.92Å; G307-M309 PolarHBondContact O-N 2.85Å
310	C	81.4	Confident	71.8	Confident	16 Å²	16	83.1 Å²	83.1	11%	0.108	46%	0.455	C	S	.	.			trans	-61.9	131.7	178.2	-171.8	0	0	0	0	112.4	L306 G307 D308 F312 H314	L306-C310 HydrophobicContact CB-CB 3.98Å; L306-C310 PolarHBondContact O-N 3.13Å; G307-C310 WeakPolarHBondContact O-CB 3.27Å; G307-C310 PolarHBondContact O-N 2.92Å; D308-C310 PolarHBondContact O-N 3.47Å; C310-F312 PolarHBondContact O-N 3.12Å; C310-F312 VanDerWaalsContact O-N 3.11Å; C310-F312 PolarHBondContact SG-N 3.29Å; C310-H314 WeakPolarHBondContact CB-CE1 3.3Å; C310-H314 WeakPolarHBondContact CB-NE2 3.43Å; C310-H314 PolarHBondContact SG-NE2 2.81Å; C310-H314 VanDerWaalsContact SG-NE2 3.36Å
311	P	75.8	Confident	70.3	Confident	69 Å²	69	83.3 Å²	83.3	45%	0.448	47%	0.465	S	S	.	.	S	Bend	trans	-65.3	-11.4	174.8	-24.1	35.1	0	0	0	114.9	K292	K292-P311 VanDerWaalsContact CD-O 3.28Å; K292-P311 WeakPolarHBondContact CD-O 3.29Å; K292-P311 WeakPolarHBondContact CE-O 3.5Å; K292-P311 PolarHBondContact NZ-O 2.91Å
312	F	82.3	Confident	69	Low	102 Å²	102	84 Å²	84	45%	0.447	47%	0.474	S	S	.	.	S	Bend	trans	-116	159.2	-170.7	-56.5	-74.2	0	0	0	111.7	Q293 C295 C310	Q293-F312 HydrophobicContact CB-CD1 3.94Å; Q293-F312 HydrophobicContact CB-CE1 4.28Å; Q293-F312 WeakPolarHBondContact O-CA 3.32Å; Q293-F312 WeakPolarHBondContact O-CB 3.21Å; C295-F312 HydrophobicContact CB-CB 3.7Å; C310-F312 PolarHBondContact O-N 3.12Å; C310-F312 VanDerWaalsContact O-N 3.11Å; C310-F312 PolarHBondContact SG-N 3.29Å
313	D	82.4	Confident	67.5	Low	64 Å²	64	89 Å²	89	34%	0.342	49%	0.49	S	S	.	.	B	Isolated β-bridge	trans	-78.1	133.5	-173	173.7	32.3	0	0	0	113.3	Q275 Q293 R294 C295 G315	Q275-D313 PolarHBondContact NE2-OD2 2.87Å; Q293-D313 PolarHBondContact O-N 2.83Å; R294-D313 WeakPolarHBondContact CG-O 3.39Å; C295-D313 PolarHBondContact N-O 3.18Å; D313-G315 PolarHBondContact OD1-N 2.94Å
314	H	81.3	Confident	65.5	Low	15 Å²	15	89.2 Å²	89.2	7%	0.069	50%	0.5	C	S	.	.			trans	-105	-0.5	-179.1	-69.2	168	0	0	0	114.5	C295 Y298 C304 G307 C310 P318	C295-H314 WeakPolarHBondContact CB-CD2 3.35Å; C295-H314 VanDerWaalsContact CB-NE2 3.28Å; C295-H314 WeakPolarHBondContact CB-NE2 3.33Å; C295-H314 PolarHBondContact SG-NE2 3.04Å; C295-H314 VanDerWaalsContact SG-NE2 3.37Å; Y298-H314 VanDerWaalsContact CB-CD2 3.46Å; Y298-H314 WeakPolarHBondContact CB-CD2 3.47Å; Y298-H314 HydrophobicContact CD1-CB 4.48Å; Y298-H314 HydrophobicContact CD2-CB 3.98Å; Y298-H314 AromaticContact CD2-CD2 3.85Å; Y298-H314 AromaticContact CD2-CG 3.8Å; Y298-H314 WeakPolarHBondContact CE1-O 3.3Å; Y298-H314 HydrophobicContact CE2-CB 4.2Å; Y298-H314 HydrophobicContact CG-CB 4.15Å; Y298-H314 AromaticContact CG-CD2 3.71Å; C304-H314 VanDerWaalsContact CB-CE1 3.44Å; C304-H314 WeakPolarHBondContact CB-CE1 3.48Å; C304-H314 WeakPolarHBondContact CB-NE2 3.5Å; G307-H314 PolarHBondContact O-CE1 3.08Å; G307-H314 PolarHBondContact O-ND1 3.35Å; C310-H314 WeakPolarHBondContact CB-CE1 3.3Å; C310-H314 WeakPolarHBondContact CB-NE2 3.43Å; C310-H314 PolarHBondContact SG-NE2 2.81Å; C310-H314 VanDerWaalsContact SG-NE2 3.36Å; H314-P318 HydrophobicContact CB-CB 4.24Å
315	G	75.7	Confident	63.1	Low	10 Å²	10	94.5 Å²	94.5	10%	0.103	53%	0.532	C	S	.	.			trans	99.3	-126.2	164.1	0	0	0	0	0	117	R276 D313	R276-G315 PolarHBondContact NE-O 3.35Å; R276-G315 VanDerWaalsContact NE-O 3.08Å; R276-G315 PolarHBondContact NH2-O 2.97Å; D313-G315 PolarHBondContact OD1-N 2.94Å
316	S	60	Low	61	Low	71 Å²	71	95.7 Å²	95.7	50%	0.497	53%	0.533	S	S	.	.	S	Bend	trans	-99.5	-33.5	-164.5	-71.3	0	0	0	0	114.7	R276	R276-S316 VanDerWaalsContact NH2-C 3.29Å; R276-S316 VanDerWaalsContact NH2-CA 3.27Å; R276-S316 PolarHBondContact NH2-O 2.95Å
317	D	50.5	Low	59.2	Low	141 Å²	141	96.9 Å²	96.9	75%	0.754	55%	0.547	S	S	*	.			trans	-165.5	91.1	-175.7	-155.1	14.7	0	0	0	107.6	Y298	Y298-D317 PolarHBondContact OH-O 3.39Å
318	P	56.6	Low	57.2	Low	40 Å²	40	105.6 Å²	105.6	26%	0.26	58%	0.579	S	S	.	*			trans	-79.1	125.7	179	30.6	-31.1	0	0	0	110.6	Y298 H314 I320	Y298-P318 HydrophobicContact CE2-CB 4.02Å; Y298-P318 WeakPolarHBondContact OH-CA 3.34Å; H314-P318 HydrophobicContact CB-CB 4.24Å; P318-I320 VanDerWaalsContact C-N 3.28Å; P318-I320 HydrophobicContact CB-CG1 4.33Å; P318-I320 HydrophobicContact CG-CD1 4.39Å; P318-I320 HydrophobicContact CG-CG1 4.25Å; P318-I320 PolarHBondContact O-N 2.97Å
319	L	51.2	Low	55.5	Low	158 Å²	158	107.7 Å²	107.7	83%	0.827	59%	0.587	S	S	*	*			trans	-71.6	90.5	163.4	-74.6	172.7	0	0	0	108.4	V321	L319-V321 PolarHBondContact O-N 3.16Å
320	I	54.8	Low	54	Low	76 Å²	76	107.1 Å²	107.1	39%	0.39	59%	0.585	S	S	.	*			trans	-75.3	117.5	170.7	-56.9	160.3	0	0	0	106.7	D308 P318 D322	D308-I320 WeakPolarHBondContact OD1-CD1 3.09Å; P318-I320 VanDerWaalsContact C-N 3.28Å; P318-I320 HydrophobicContact CB-CG1 4.33Å; P318-I320 HydrophobicContact CG-CD1 4.39Å; P318-I320 HydrophobicContact CG-CG1 4.25Å; P318-I320 PolarHBondContact O-N 2.97Å; I320-D322 PolarHBondContact O-N 3.1Å
321	V	47.7	Very low	52	Low	127 Å²	127	111.1 Å²	111.1	77%	0.77	61%	0.612	S	S	*	*			trans	-84.2	101.4	165.1	-178	0	0	0	0	106.1	L319	L319-V321 PolarHBondContact O-N 3.16Å
322	D	45	Very low	49.8	Very low	141 Å²	141	117.1 Å²	117.1	75%	0.754	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-65	148.2	167.9	-88.3	-40.6	0	0	0	109.8	I320	I320-D322 PolarHBondContact O-N 3.1Å
323	D	43.4	Very low	47.7	Very low	154 Å²	154	117.2 Å²	117.2	82%	0.824	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-57.6	133.3	-160.9	-67.8	-59.8	0	0	0	115.2	T325	D323-T325 PolarHBondContact O-N 3Å
324	V	35.5	Very low	45.6	Very low	121 Å²	121	119.9 Å²	119.9	73%	0.733	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-65.4	126	155.6	176.8	0	0	0	0	108.1	L326	V324-L326 PolarHBondContact O-N 3.14Å
325	T	33.7	Very low	43.7	Very low	130 Å²	130	124.5 Å²	124.5	80%	0.798	69%	0.694	S	S	*	*			trans	-67.3	98	-172.9	50.4	0	0	0	0	113	D323	D323-T325 PolarHBondContact O-N 3Å
326	L	35	Very low	42	Very low	162 Å²	162	130.3 Å²	130.3	85%	0.848	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-77.1	128	168.5	-70.3	176.3	0	0	0	111.2	V324	V324-L326 PolarHBondContact O-N 3.14Å
327	P	36.6	Very low	41.1	Very low	125 Å²	125	133.3 Å²	133.3	81%	0.812	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-63.9	163.8	179.8	-27.2	37.3	0	0	0	116.4
328	K	32.9	Very low	40.2	Very low	203 Å²	203	134.7 Å²	134.7	88%	0.883	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-67	128.6	-165.2	-65	165.7	180	166.4	0	115.6
329	M	35.4	Very low	39.3	Very low	166 Å²	166	137.8 Å²	137.8	82%	0.818	77%	0.769	S	S	*	*			trans	34.9	128.8	131	-65	-123.3	-61.9	0	0	121.4
330	I	36	Very low	38.8	Very low	158 Å²	158	136.6 Å²	136.6	81%	0.81	77%	0.77	S	S	*	*			trans	-127.2	133.2	142.2	-63.4	179.1	0	0	0	108.2
331	P	40.1	Very low	38	Very low	101 Å²	101	138.2 Å²	138.2	66%	0.656	80%	0.796	S	S	*	*			trans	-98.9	150.5	-170.5	37.1	-34.9	0	0	0	114.6
332	F	30.2	Very low	37.5	Very low	194 Å²	194	135.5 Å²	135.5	85%	0.851	79%	0.793	S	S	*	*			trans	-134	159.4	167.2	-94.6	-93.2	0	0	0	111.4
333	P	37.8	Very low	37.2	Very low	105 Å²	105	138 Å²	138	68%	0.682	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-88.6	162.7	-148.9	34	-37.4	0	0	0	115.9
334	P	37.8	Very low	37.1	Very low	119 Å²	119	136 Å²	136	77%	0.773	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71.6	145.2	175.2	30.5	-35.8	0	0	0	112.7
335	P	41.7	Very low	37.5	Very low	113 Å²	113	138.6 Å²	138.6	73%	0.734	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74	155.1	175.8	30.9	-35.2	0	0	0	112.8
336	P	39.3	Very low	38.1	Very low	131 Å²	131	137.2 Å²	137.2	85%	0.851	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75.5	167.6	-176.7	31.4	-36.4	0	0	0	114.2
337	V	42.1	Very low	38.5	Very low	134 Å²	134	134.8 Å²	134.8	81%	0.812	79%	0.791	S	S	*	*			trans	-115.4	162.3	-175.5	178.6	0	0	0	0	110.4
338	M	32.1	Very low	38.9	Very low	170 Å²	170	136.8 Å²	136.8	84%	0.837	79%	0.794	S	S	*	*			trans	101.4	160.1	172.5	-60.8	178.6	61.6	0	0	115.3
339	P	36.8	Very low	39	Very low	106 Å²	106	133.1 Å²	133.1	69%	0.688	79%	0.788	S	S	*	*			cis	-126	-173.7	-42.4	36.2	-18.8	0	0	0	111.1
340	P	41.5	Very low	39	Very low	132 Å²	132	134 Å²	134	86%	0.857	79%	0.79	S	S	*	*			trans	-83	174.8	-171.5	33.6	-35.2	0	0	0	115.7
341	A	37.2	Very low	39.4	Very low	111 Å²	111	131.7 Å²	131.7	92%	0.917	79%	0.786	S	S	*	*			trans	-81.5	154.1	-156.6	0	0	0	0	0	117.8
342	G	36.6	Very low	39.4	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	79%	0.792	S	S	*	*			trans	173.3	137.7	161.9	0	0	0	0	0	113.7
343	M	39.6	Very low	40.1	Very low	192 Å²	192	129.4 Å²	129.4	95%	0.946	79%	0.791	S	S	*	*	S	Bend	trans	70.8	159.6	171.6	-66.1	-63.4	167.8	0	0	117.6
344	P	41.7	Very low	39.9	Very low	112 Å²	112	130 Å²	130	73%	0.727	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-99.3	167.8	-154.8	38.5	-36.7	0	0	0	116.3
345	M	43.2	Very low	39.8	Very low	176 Å²	176	132.9 Å²	132.9	87%	0.867	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72	131	-179.2	-70.1	-71.4	-68.1	0	0	114.1
346	P	46.3	Very low	39.6	Very low	102 Å²	102	138.8 Å²	138.8	66%	0.662	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.9	167.3	157	34.1	-32.3	0	0	0	111.6
347	P	44.8	Very low	39.4	Very low	110 Å²	110	140.8 Å²	140.8	71%	0.714	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-83.4	159.4	-162.8	32.8	-37	0	0	0	115.4
348	I	43	Very low	39.3	Very low	168 Å²	168	140 Å²	140	86%	0.862	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.5	130.5	167.2	-60.8	169.5	0	0	0	109.2
349	T	35.7	Very low	39.4	Very low	125 Å²	125	136.5 Å²	136.5	77%	0.767	81%	0.809	S	S	*	*			trans	-124.7	97.6	170.7	43.6	0	0	0	0	111.1
350	E	35.2	Very low	39.2	Very low	185 Å²	185	140 Å²	140	86%	0.864	82%	0.818	S	S	*	*			trans	66.3	158.5	163.3	-65.2	-162.7	108	0	0	120.1
351	P	45.7	Very low	39.3	Very low	109 Å²	109	138.5 Å²	138.5	71%	0.708	81%	0.808	S	S	*	*			trans	-116.5	155.8	-160.3	40.4	-29.1	0	0	0	115.5
352	P	40	Very low	39.4	Very low	121 Å²	121	139 Å²	139	79%	0.786	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-80.6	151.7	160.3	33.5	-32.3	0	0	0	111.7
353	P	43.8	Very low	39.1	Very low	127 Å²	127	147 Å²	147	83%	0.825	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-89.3	170.2	-164.8	35.7	-38	0	0	0	115.4
354	S	34.3	Very low	38.8	Very low	117 Å²	117	142.5 Å²	142.5	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-76.6	139.5	178.9	43.6	0	0	0	0	113.7
355	L	36.2	Very low	38.4	Very low	179 Å²	179	145.9 Å²	145.9	94%	0.937	81%	0.812	S	S	*	*			trans	-110.3	144.6	163.3	-70.7	177.9	0	0	0	110.5
356	R	36.8	Very low	38.1	Very low	237 Å²	237	143.1 Å²	143.1	89%	0.894	81%	0.807	S	S	*	*			trans	-118.4	117	-162.7	174.4	-176.3	179.7	178.2	0.1	109.6
357	M	33.9	Very low	37.9	Very low	174 Å²	174	143.9 Å²	143.9	86%	0.857	81%	0.812	S	S	*	*			trans	-73.2	138.7	172.4	-65.6	-63.4	-75.3	0	0	110.6
358	P	41.4	Very low	37.7	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	81%	0.814	S	S	*	*			trans	-76.9	160.1	170.3	33	-34.2	0	0	0	111.4
359	A	34.3	Very low	37.6	Very low	97 Å²	97	142.5 Å²	142.5	80%	0.802	81%	0.814	S	S	*	*			trans	-104	155.9	175.8	0	0	0	0	0	111.3
360	M	32.8	Very low	37.5	Very low	179 Å²	179	140.1 Å²	140.1	88%	0.882	81%	0.814	S	S	*	*			trans	-107.3	157.3	172.7	-76.8	-67.9	-74.2	0	0	111.8
361	P	42.5	Very low	37.4	Very low	101 Å²	101	137 Å²	137	66%	0.656	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-86.3	172.5	-165.8	-9.6	30	0	0	0	114.6
362	P	38.8	Very low	36.6	Very low	121 Å²	121	141 Å²	141	79%	0.786	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-89.6	154.8	-172.2	36	-35.5	0	0	0	114.3
363	Y	31.8	Very low	36.7	Very low	237 Å²	237	141.2 Å²	141.2	93%	0.929	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-100.2	162.3	162.1	-80.6	-90.4	0	0	0	111.6
364	A	31.8	Very low	36.3	Very low	99 Å²	99	143.6 Å²	143.6	82%	0.818	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-90.6	166.8	-150.4	0	0	0	0	0	116.4
365	Q	33.7	Very low	36.2	Very low	183 Å²	183	145.1 Å²	145.1	86%	0.855	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-81.5	145.6	172.8	-63.9	-179.7	-25	0	0	112.4
366	P	36.9	Very low	36	Very low	118 Å²	118	139.9 Å²	139.9	77%	0.766	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-80	142.7	151.7	33	-31.2	0	0	0	110.9
367	P	41.6	Very low	36.7	Very low	117 Å²	117	134.4 Å²	134.4	76%	0.76	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-85.9	159.3	-176.2	34.3	-36.3	0	0	0	114.1
368	P	41.3	Very low	37.4	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.3	154.5	173.4	34.4	-35.3	0	0	0	112.8
369	P	40.3	Very low	36.9	Very low	134 Å²	134	133 Å²	133	87%	0.87	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-74.7	128.5	178.1	29.6	-34.2	0	0	0	112.7
370	G	34.8	Very low	36.6	Very low	75 Å²	75	135.7 Å²	135.7	77%	0.773	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-94.2	172.7	170.9	0	0	0	0	0	113.4
371	V	32.8	Very low	36.5	Very low	119 Å²	119	130.9 Å²	130.9	72%	0.721	79%	0.79	S	S	*	*			trans	-125.2	175.2	-177.3	-73.8	0	0	0	0	112.2
372	F	29.4	Very low	35.9	Very low	193 Å²	193	132.6 Å²	132.6	85%	0.846	80%	0.799	S	S	*	*			trans	88	152.8	175.4	-50.4	-61	0	0	0	116.7
373	P	41.8	Very low	35.5	Very low	125 Å²	125	132.3 Å²	132.3	81%	0.812	80%	0.799	S	S	*	*			cis	-133	-165.3	-24.9	32.5	-10.8	0	0	0	114.4
374	M	34.4	Very low	35.3	Very low	177 Å²	177	124 Å²	124	87%	0.872	79%	0.785	S	S	*	*			trans	-62.3	151.9	-170.9	-56.3	174	62.9	0	0	118.9
375	T	32.7	Very low	35.2	Very low	150 Å²	150	126.8 Å²	126.8	92%	0.92	79%	0.785	S	S	*	*			trans	-147.2	168.7	137	42.8	0	0	0	0	111.4
376	G	32.5	Very low	35	Very low	69 Å²	69	125 Å²	125	71%	0.711	78%	0.781	S	S	*	*			trans	-104	-167.5	-168.4	0	0	0	0	0	118.1
377	P	50.3	Low	34.9	Very low	122 Å²	122	125.4 Å²	125.4	79%	0.792	78%	0.782	S	S	*	*			trans	-95.2	165.7	-165.9	39.3	-38.5	0	0	0	115.5
378	P	49.9	Very low	34.9	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	78%	0.781	S	S	*	*				-144	140.1	102.2	30.9	-11.5	0	0	0	115.1
379	L	29.9	Very low	34.6	Very low	146 Å²	146	125.5 Å²	125.5	76%	0.764	78%	0.776	S	S	*	*				83.2	122.3	89.9	-59.5	-171	0	0	0	118.8
380	I	29.6	Very low	34.4	Very low	153 Å²	153	125.7 Å²	125.7	79%	0.785	77%	0.765	S	S	*	*			trans	49.3	131	133.3	-39.6	162.1	0	0	0	117.8
381	A	30	Very low	34.3	Very low	78 Å²	78	130 Å²	130	65%	0.645	77%	0.765	S	S	*	*				-172.2	157.7	63.6	0	0	0	0	0	116.9
382	T	30.8	Very low	34.3	Very low	138 Å²	138	129.3 Å²	129.3	85%	0.847	77%	0.766	S	S	*	*			trans	22.8	154.9	141.2	59.7	0	0	0	0	122.6
383	S	28.7	Very low	34.6	Very low	114 Å²	114	124.6 Å²	124.6	80%	0.797	76%	0.762	S	S	*	*			cis	-142.8	174.4	19.5	57.9	0	0	0	0	110.7
384	G	28.2	Very low	34.2	Very low	62 Å²	62	126.3 Å²	126.3	64%	0.639	76%	0.763	S	S	*	*			cis	88	135.9	38.6	0	0	0	0	0	110.6
385	I	30	Very low	34	Very low	159 Å²	159	123.6 Å²	123.6	82%	0.815	76%	0.756	S	S	*	*			cis	-163.4	-169.2	7.2	-141	162.5	0	0	0	111.7
386	D	29.4	Very low	33.8	Very low	144 Å²	144	121.3 Å²	121.3	77%	0.77	75%	0.747	S	S	*	*			trans	91.3	134	162	-80.7	-43	0	0	0	123.8
387	T	35.3	Very low	33.7	Very low	127 Å²	127	123.5 Å²	123.5	78%	0.779	75%	0.751	S	S	*	*			trans	-150.9	145.2	162.5	59.1	0	0	0	0	107.5
388	P	42.1	Very low	34.4	Very low	115 Å²	115	123.2 Å²	123.2	75%	0.747	75%	0.749	S	S	*	*				-149.1	130.4	123.2	32.1	-13.9	0	0	0	116.8
389	N	33	Very low	35	Very low	121 Å²	121	123.4 Å²	123.4	65%	0.647	75%	0.75	S	S	*	*				51.7	129.1	123.1	-158.1	22.4	0	0	0	121.1
390	H	37.4	Very low	35.1	Very low	138 Å²	138	125 Å²	125	64%	0.639	76%	0.758	S	S	*	*				171.2	113.2	110.5	-95.3	-84	0	0	0	114.6
391	Q	32.7	Very low	35.1	Very low	166 Å²	166	120.6 Å²	120.6	78%	0.776	75%	0.75	S	S	*	*			trans	65.6	157.3	140.2	-63.5	173.7	8.7	0	0	120.3
392	S	32.7	Very low	36.2	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	76%	0.758	S	S	*	*			cis	-139.3	136.1	3.2	16.3	0	0	0	0	110.4
393	A	35	Very low	37.1	Very low	94 Å²	94	122.4 Å²	122.4	78%	0.777	76%	0.757	S	S	*	*				67.6	138.2	91.8	0	0	0	0	0	113.8
394	I	32.9	Very low	37.2	Very low	161 Å²	161	120.1 Å²	120.1	83%	0.826	75%	0.752	S	S	*	*			cis	-149.2	173.1	30.4	49.9	166.8	0	0	0	109
395	T	30.8	Very low	37.4	Very low	119 Å²	119	124.8 Å²	124.8	73%	0.73	77%	0.768	S	S	*	*			cis	-172.5	168.2	-19.3	-172.5	0	0	0	0	105.3
396	S	29	Very low	37.4	Very low	103 Å²	103	120.7 Å²	120.7	72%	0.72	76%	0.764	S	S	*	*			cis	-143.8	-175.4	14.3	-59.7	0	0	0	0	110.7
397	S	30	Very low	37.5	Very low	115 Å²	115	122 Å²	122	80%	0.804	77%	0.771	S	S	*	*			trans	-124.1	153.1	-154.5	-51.6	0	0	0	0	118.5
398	P	64.9	Low	38.1	Very low	116 Å²	116	121.1 Å²	121.1	75%	0.753	77%	0.767	S	S	*	*			trans	-90	-155.1	154.6	43.5	-37.2	0	0	0	109.3
399	P	62.2	Low	37.4	Very low	119 Å²	119	120.8 Å²	120.8	77%	0.773	77%	0.767	S	S	*	*			cis	-138.6	-176.3	-2.8	44.1	-25.7	0	0	0	116.9
400	I	32.4	Very low	37.3	Very low	180 Å²	180	121.6 Å²	121.6	92%	0.923	78%	0.777	S	S	*	*			trans	-155	152.1	159.2	-117.1	170.1	0	0	0	108
401	G	30.5	Very low	37.1	Very low	59 Å²	59	122.5 Å²	122.5	61%	0.608	79%	0.786	S	S	*	*			cis	-174	164.4	-5.1	0	0	0	0	0	111.9
402	P	52.8	Low	37.9	Very low	126 Å²	126	120.1 Å²	120.1	82%	0.818	78%	0.784	S	S	*	*			trans	-84.6	179.8	177.5	37	-37.2	0	0	0	112.5
403	P	49.9	Very low	38.9	Very low	129 Å²	129	120.4 Å²	120.4	84%	0.838	78%	0.784	S	S	*	*			cis	-118.6	-171.4	0.4	42.4	-29.2	0	0	0	112.9
404	G	29.5	Very low	39.7	Very low	66 Å²	66	121.6 Å²	121.6	68%	0.68	78%	0.784	S	S	*	*			cis	141.8	-178.3	-7.7	0	0	0	0	0	113.8
405	V	32.4	Very low	40.5	Very low	160 Å²	160	119.7 Å²	119.7	97%	0.97	78%	0.782	S	S	*	*			trans	72	122	174.2	-165.1	0	0	0	0	118.4
406	G	29.9	Very low	41.7	Very low	72 Å²	72	119.6 Å²	119.6	74%	0.742	78%	0.783	S	S	*	*			trans	131.9	110.3	146.1	0	0	0	0	0	119.8
407	L	33.1	Very low	42.6	Very low	173 Å²	173	120.9 Å²	120.9	91%	0.906	79%	0.789	S	S	*	*			trans	-140.5	163.1	156.7	-84.9	178	0	0	0	106.6
408	P	46.1	Very low	42.9	Very low	107 Å²	107	120 Å²	120	70%	0.695	79%	0.788	S	S	*	*			cis	-151.5	-168.4	36.5	43.9	-22.1	0	0	0	118.2
409	S	27.6	Very low	42	Very low	109 Å²	109	120.4 Å²	120.4	76%	0.762	79%	0.791	S	S	*	*			trans	73.1	150.8	157.2	-57.4	0	0	0	0	118.5
410	T	31	Very low	42.1	Very low	137 Å²	137	120.1 Å²	120.1	84%	0.84	79%	0.789	S	S	*	*			cis	-138.3	171.2	20	51.2	0	0	0	0	115.4
411	L	34	Very low	42.1	Very low	158 Å²	158	120 Å²	120	83%	0.827	79%	0.785	S	S	*	*			trans	-77.7	-173.6	173.8	-64.7	166	0	0	0	113.2
412	P	49.4	Very low	42.8	Very low	116 Å²	116	122 Å²	122	75%	0.753	79%	0.787	S	S	*	*			cis	-134.6	178.4	-1.8	30.1	-6.3	0	0	0	117
413	P	53.4	Low	42.8	Very low	109 Å²	109	121.1 Å²	121.1	71%	0.708	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-91.7	169.3	172.6	37.3	-36.6	0	0	0	115.1
414	P	51.9	Low	41.8	Very low	120 Å²	120	120.8 Å²	120.8	78%	0.779	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-79.5	160.1	177.1	32.4	-36.1	0	0	0	115
415	P	49.9	Very low	41.8	Very low	121 Å²	121	123 Å²	123	79%	0.786	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-93.3	165.1	-164	36.4	-38.2	0	0	0	117.3
416	P	54.7	Low	41.6	Very low	117 Å²	117	121.4 Å²	121.4	76%	0.76	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-85.5	171	179	36.1	-37.8	0	0	0	114.8
417	P	48.2	Very low	41.5	Very low	130 Å²	130	123 Å²	123	84%	0.844	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-78.6	162.2	177.5	33.2	-37.3	0	0	0	114.1
418	A	36.7	Very low	41.3	Very low	95 Å²	95	119.7 Å²	119.7	79%	0.785	77%	0.774	S	S	*	*			trans	-124.9	157.1	176.9	0	0	0	0	0	112.4
419	P	46.3	Very low	40.4	Very low	126 Å²	126	120.7 Å²	120.7	82%	0.818	78%	0.778	S	S	*	*			trans	-117.3	-136.7	-161.8	33.4	-10.6	0	0	0	113.5
420	P	64.4	Low	40.5	Very low	112 Å²	112	120.3 Å²	120.3	73%	0.727	78%	0.775	S	S	*	*				-115	-173.6	-119.4	38.6	-20.6	0	0	0	114.2
421	Q	32.7	Very low	40.2	Very low	179 Å²	179	122.1 Å²	122.1	84%	0.836	78%	0.779	S	S	*	*			trans	-178.8	161.7	138.1	-89.9	-89	-21.8	0	0	111.1
422	P	44	Very low	39.9	Very low	101 Å²	101	122.5 Å²	122.5	66%	0.656	77%	0.769	S	S	*	*			trans	-122.6	-144.6	-171.8	45.9	-29.7	0	0	0	110.6
423	P	53.3	Low	39.9	Very low	107 Å²	107	120.8 Å²	120.8	70%	0.695	76%	0.758	S	S	*	*			cis	-124.5	176.8	-31.1	40.1	-26.8	0	0	0	113
424	S	28.6	Very low	38.9	Very low	121 Å²	121	121.9 Å²	121.9	85%	0.846	75%	0.754	S	S	*	*			trans	172.6	157.2	132.8	-81.6	0	0	0	0	113.2
425	S	29.7	Very low	38.1	Very low	114 Å²	114	123 Å²	123	80%	0.797	74%	0.744	S	S	*	*			trans	-116.5	150.4	-173.7	-47.6	0	0	0	0	112.2
426	S	28.7	Very low	37.3	Very low	125 Å²	125	123 Å²	123	87%	0.874	74%	0.741	S	S	*	*				175.3	156.7	128.8	-81.5	0	0	0	0	114.3
427	S	28.3	Very low	36.1	Very low	107 Å²	107	123.2 Å²	123.2	75%	0.748	73%	0.732	S	S	*	*			trans	-76.8	156	-176.6	52.4	0	0	0	0	115.7
428	S	28	Very low	35.5	Very low	103 Å²	103	121.6 Å²	121.6	72%	0.72	72%	0.723	S	S	*	*				142.3	118.1	120.3	-73.5	0	0	0	0	116.2
429	V	26.7	Very low	35.4	Very low	128 Å²	128	121.5 Å²	121.5	78%	0.776	71%	0.707	S	S	*	*			trans	40.7	113.3	133	-173.5	0	0	0	0	119.8
430	S	29.7	Very low	34.9	Very low	101 Å²	101	124.5 Å²	124.5	71%	0.706	70%	0.703	S	S	*	*			trans	31.2	121.6	139.5	-49.9	0	0	0	0	120.5
431	L	25.6	Very low	33.5	Very low	174 Å²	174	125.1 Å²	125.1	91%	0.911	70%	0.701	S	S	*	*				-168.4	155.3	93	-99.5	171.4	0	0	0	114.4
432	R	28.3	Very low	33.3	Very low	166 Å²	166	126.7 Å²	126.7	63%	0.626	70%	0.7	S	S	*	*			trans	-79.7	-174	168	-130.2	-173.7	158.7	-155.5	-1.8	108.6	I651	R432-I651 HydrophobicContact CG-CD1 4.09Å
433	P	49.8	Very low	33	Very low	80 Å²	80	128.2 Å²	128.2	52%	0.519	70%	0.703	S	S	.	*			cis	-146.5	-165.2	-5	27.4	0.7	0	0	0	116.6
434	Q	32.2	Very low	32.8	Very low	133 Å²	133	127.9 Å²	127.9	62%	0.621	70%	0.701	S	S	*	*			trans	84.4	151.2	153.5	-42.2	-51.4	30.4	0	0	119.7
435	Y	34.3	Very low	33.3	Very low	144 Å²	144	131 Å²	131	57%	0.565	70%	0.702	S	S	*	*			cis	-138.4	160	-13.4	-141.8	-143.3	0	0	0	109.2	Q437	Y435-Q437 HydrophobicContact CE1-CB 4.42Å; Y435-Q437 HydrophobicContact CE1-CG 3.8Å; Y435-Q437 WeakPolarHBondContact CE2-O 3.33Å; Y435-Q437 PolarHBondContact OH-O 3.14Å
436	V	33.8	Very low	33.5	Very low	120 Å²	120	129.1 Å²	129.1	73%	0.727	70%	0.7	S	S	*	*				-165.4	146.4	66.6	163.6	0	0	0	0	107.8
437	Q	30	Very low	33.6	Very low	121 Å²	121	134.3 Å²	134.3	57%	0.565	70%	0.703	S	S	*	*			cis	-126.1	-120.2	-4.9	-143.9	164.4	-78.9	0	0	108.9	Y435 E439	Y435-Q437 HydrophobicContact CE1-CB 4.42Å; Y435-Q437 HydrophobicContact CE1-CG 3.8Å; Y435-Q437 WeakPolarHBondContact CE2-O 3.33Å; Y435-Q437 PolarHBondContact OH-O 3.14Å; Q437-E439 PolarHBondContact NE2-OE2 3.19Å
438	S	34.8	Very low	34.4	Very low	96 Å²	96	135.3 Å²	135.3	67%	0.671	70%	0.699	S	S	*	*			cis	-149.3	167	-9.1	78	0	0	0	0	111.6
439	E	35.3	Very low	35.7	Very low	94 Å²	94	134.8 Å²	134.8	44%	0.439	69%	0.694	S	S	.	*			trans	-93.7	-177.8	175.1	-31.3	86.2	88.2	0	0	111	Q437	Q437-E439 PolarHBondContact NE2-OE2 3.19Å
440	Y	34.1	Very low	35.9	Very low	188 Å²	188	137.4 Å²	137.4	74%	0.737	70%	0.697	S	S	*	*			cis	-128.4	140.6	-2.6	-75.9	-80.5	0	0	0	107.4
441	N	36	Very low	36	Very low	126 Å²	126	137.8 Å²	137.8	67%	0.674	70%	0.7	S	S	*	*			cis	90.4	98.9	46.5	-171.3	25.3	0	0	0	114.4
442	Y	28.2	Very low	37.3	Very low	212 Å²	212	136 Å²	136	83%	0.831	70%	0.699	S	S	*	*				-168.4	161.8	115.5	-138.8	-103.1	0	0	0	113
443	D	38.3	Very low	37.4	Very low	132 Å²	132	131 Å²	131	71%	0.706	70%	0.7	S	S	*	*			trans	-100.8	-160.4	179.6	-143.1	6.8	0	0	0	110.5
444	P	49.2	Very low	36.6	Very low	100 Å²	100	135.5 Å²	135.5	65%	0.649	72%	0.718	S	S	*	*			cis	-136.1	170.3	19.7	42.1	-21.9	0	0	0	118.8
445	E	37.8	Very low	36.6	Very low	187 Å²	187	135.3 Å²	135.3	87%	0.874	73%	0.726	S	S	*	*			trans	18.8	153	141.9	-54	-176.5	136.1	0	0	122.4
446	G	34.3	Very low	36.2	Very low	74 Å²	74	133 Å²	133	76%	0.763	74%	0.737	S	S	*	*			cis	160.6	168.2	-3	0	0	0	0	0	114.6
447	Y	31.3	Very low	36	Very low	235 Å²	235	132.6 Å²	132.6	92%	0.922	75%	0.746	S	S	*	*			trans	74.8	166.8	159.2	-136.5	-105.8	0	0	0	123.2
448	N	43.7	Very low	36	Very low	127 Å²	127	130.1 Å²	130.1	68%	0.679	75%	0.754	S	S	*	*			trans	-160.5	145	-167.3	156	81.4	0	0	0	112.8
449	P	55.7	Low	35.6	Very low	93 Å²	93	137.7 Å²	137.7	60%	0.604	77%	0.767	S	S	*	*			trans	-148.9	154.1	145.5	36.4	-18.6	0	0	0	118.6
450	E	30.8	Very low	35.2	Very low	182 Å²	182	140.5 Å²	140.5	85%	0.85	79%	0.785	S	S	*	*			trans	64.3	151.7	147.3	-68.6	172.7	153.2	0	0	121.5
451	S	32.3	Very low	35	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	79%	0.788	S	S	*	*			cis	-163.3	173.3	-12.9	52.8	0	0	0	0	111.2
452	P	53.6	Low	34.5	Very low	136 Å²	136	140.4 Å²	140.4	88%	0.883	79%	0.79	S	S	*	*			trans	-123.4	177	-161.5	43.6	-33.1	0	0	0	119.5
453	G	30.6	Very low	34.6	Very low	63 Å²	63	139.3 Å²	139.3	65%	0.649	78%	0.784	S	S	*	*			trans	-176.1	139.8	165.1	0	0	0	0	0	111.4
454	L	32.2	Very low	34.3	Very low	174 Å²	174	139.4 Å²	139.4	91%	0.911	78%	0.781	S	S	*	*			cis	72.2	134.2	45.4	-57.6	178.9	0	0	0	112.6
455	T	31.5	Very low	33.5	Very low	128 Å²	128	140 Å²	140	79%	0.785	77%	0.774	S	S	*	*			cis	-148.6	143.7	15.3	51.2	0	0	0	0	111.3
456	A	27.4	Very low	33.5	Very low	95 Å²	95	137.3 Å²	137.3	79%	0.785	76%	0.763	S	S	*	*				83.1	137.9	82.1	0	0	0	0	0	119.7
457	A	29.3	Very low	34.7	Very low	112 Å²	112	137.1 Å²	137.1	93%	0.926	75%	0.749	S	S	*	*			trans	60.9	152.7	164.5	0	0	0	0	0	121.2
458	G	29.3	Very low	34.7	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	75%	0.749	S	S	*	*			cis	170.2	155.7	-12.5	0	0	0	0	0	116.3
459	R	27	Very low	34.3	Very low	254 Å²	254	138 Å²	138	96%	0.958	76%	0.756	S	S	*	*			trans	63.2	147.9	159.3	-62.9	-169.9	178.6	-156.6	-0.4	123.8
460	N	27.5	Very low	33.2	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	77%	0.766	S	S	*	*			trans	-52.3	169.6	-179.5	-52.2	-11.1	0	0	0	116.5
461	T	28.3	Very low	33.2	Very low	131 Å²	131	138.7 Å²	138.7	80%	0.804	76%	0.759	S	S	*	*				-179.6	129.4	64.9	-52.5	0	0	0	0	116.1
462	Y	26.6	Very low	33	Very low	182 Å²	182	142.1 Å²	142.1	71%	0.714	76%	0.763	S	S	*	*			trans	38.4	138.1	136.7	-140.4	-137.2	0	0	0	127.6
463	R	29.3	Very low	31.8	Very low	188 Å²	188	146.6 Å²	146.6	71%	0.709	76%	0.762	S	S	*	*			trans	58.3	139.8	160.5	-70.1	-176	-175.9	-117.2	1.9	120.3
464	Q	32.6	Very low	31.9	Very low	134 Å²	134	148 Å²	148	63%	0.626	76%	0.762	S	S	*	*			cis	95.2	144.3	30.2	-69.1	-76.5	55.3	0	0	115.1
465	F	32.3	Very low	32.4	Very low	114 Å²	114	146.8 Å²	146.8	50%	0.5	76%	0.756	S	S	.	*			cis	-156.7	144.6	11.9	-112.1	-55.6	0	0	0	113.5	E152 A153	E152-F465 HydrophobicContact CG-CB 4.5Å; A153-F465 WeakPolarHBondContact CA-O 3.01Å; A153-F465 VanDerWaalsContact CB-N 3.29Å; A153-F465 WeakPolarHBondContact CB-O 3.36Å; A153-F465 PolarHBondContact N-O 3.31Å
466	I	38.9	Very low	32.8	Very low	129 Å²	129	148.2 Å²	148.2	66%	0.662	76%	0.759	S	S	*	*			trans	41.5	-146.6	164.4	-11.6	177.4	0	0	0	118.8	E152 A153	E152-I466 WeakPolarHBondContact OE1-CD1 3.36Å; E152-I466 VanDerWaalsContact OE1-CG1 3.27Å; E152-I466 WeakPolarHBondContact OE1-CG1 3.5Å; A153-I466 CarbonylContact C-O 3.53Å; A153-I466 VanDerWaalsContact O-O 3.09Å
467	P	58.2	Low	33.1	Very low	71 Å²	71	151.1 Å²	151.1	46%	0.461	76%	0.759	S	S	.	*			cis	-138.1	-179.4	-12.7	45.1	-28	0	0	0	120.1	E152 A153	E152-P467 HydrophobicContact CB-CG 4.01Å; E152-P467 VanDerWaalsContact OE2-CB 3.27Å; E152-P467 WeakPolarHBondContact OE2-CB 3.22Å; A153-P467 WeakPolarHBondContact O-CD 3.3Å
468	R	31.1	Very low	33.2	Very low	245 Å²	245	148.5 Å²	148.5	93%	0.925	74%	0.744	S	S	*	*			trans	79.6	167.2	158.9	-134.9	166.4	-177.5	118.3	1	122.9
469	V	36.2	Very low	33.5	Very low	136 Å²	136	153.1 Å²	153.1	82%	0.824	75%	0.751	S	S	*	*			trans	-147.7	159.9	-147.8	-150.7	0	0	0	0	113.9
470	Q	31.7	Very low	33.7	Very low	172 Å²	172	147 Å²	147	80%	0.804	74%	0.741	S	S	*	*				161.8	160.5	128.5	-161.4	173.6	-3.8	0	0	115.4
471	T	31.1	Very low	34.1	Very low	116 Å²	116	144.5 Å²	144.5	71%	0.712	74%	0.736	S	S	*	*			trans	77	162.7	164.7	83.3	0	0	0	0	118
472	Q	28.2	Very low	34.4	Very low	181 Å²	181	142.8 Å²	142.8	85%	0.846	73%	0.73	S	S	*	*			cis	-150.9	-139.9	-13.3	-138.8	170.9	-42.6	0	0	113.5
473	R	27.9	Very low	34.7	Very low	231 Å²	231	142.4 Å²	142.4	87%	0.872	73%	0.734	S	S	*	*			trans	-143	-171.9	-172	-57.9	-178.3	-178.8	172.1	-0.7	110.8
474	S	33.6	Very low	35	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	73%	0.73	S	S	*	*			cis	-169.1	159	12.8	-6.8	0	0	0	0	114.5
475	N	41.9	Very low	35	Very low	149 Å²	149	139.6 Å²	139.6	80%	0.797	75%	0.746	S	S	*	*			trans	77.7	167.3	141.8	-62.2	0.9	0	0	0	123.8
476	L	40.1	Very low	34.8	Very low	159 Å²	159	137.3 Å²	137.3	83%	0.832	75%	0.754	S	S	*	*			trans	78.9	150.8	177.3	-90.8	61.5	0	0	0	116.5
477	I	34.5	Very low	34.6	Very low	155 Å²	155	136.6 Å²	136.6	80%	0.795	76%	0.76	S	S	*	*			cis	-163.3	166	-10.9	-158	164.3	0	0	0	108.1
478	G	30.7	Very low	33.3	Very low	58 Å²	58	144.9 Å²	144.9	60%	0.598	78%	0.782	S	S	*	*			cis	150.3	131.5	-18.2	0	0	0	0	0	114.8
479	L	35.4	Very low	33.3	Very low	167 Å²	167	137.9 Å²	137.9	87%	0.874	78%	0.777	S	S	*	*			trans	75.4	155.4	165.6	-48.9	-178.3	0	0	0	117.8
480	T	32.1	Very low	33.1	Very low	124 Å²	124	135.8 Å²	135.8	76%	0.761	77%	0.774	S	S	*	*			cis	-131.9	136.6	25.8	53.9	0	0	0	0	113.8
481	S	34.5	Very low	33.1	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	77%	0.773	S	S	*	*				65.4	143.8	90.5	-52.8	0	0	0	0	117.4
482	S	35.8	Very low	33.2	Very low	95 Å²	95	135.6 Å²	135.6	66%	0.664	77%	0.773	S	S	*	*			cis	-166.8	-162.5	-22	51	0	0	0	0	107.8
483	E	33.5	Very low	33.3	Very low	173 Å²	173	132.9 Å²	132.9	81%	0.808	77%	0.768	S	S	*	*			cis	-163.9	161	12.2	-164.2	47.9	-93	0	0	113
484	G	35.2	Very low	33.6	Very low	61 Å²	61	128.5 Å²	128.5	63%	0.629	76%	0.761	S	S	*	*			trans	90.5	147.5	152.8	0	0	0	0	0	119.5
485	Q	32.2	Very low	33.4	Very low	203 Å²	203	131.8 Å²	131.8	95%	0.949	77%	0.766	S	S	*	*			cis	-166.1	137.9	-6.1	179.5	177.1	-9.8	0	0	111.4
486	G	28.6	Very low	33	Very low	65 Å²	65	131 Å²	131	67%	0.67	77%	0.767	S	S	*	*			trans	122.4	92.1	149.8	0	0	0	0	0	123
487	S	34.7	Very low	32.4	Very low	114 Å²	114	132 Å²	132	80%	0.797	77%	0.767	S	S	*	*				62.4	131	124.4	-57.7	0	0	0	0	126.4
488	R	31.2	Very low	33.3	Very low	245 Å²	245	130 Å²	130	93%	0.925	77%	0.765	S	S	*	*			trans	68.3	134.5	156.8	-61.4	174.1	177.1	177.1	-2	117.3
489	A	30.2	Very low	33.2	Very low	99 Å²	99	132.1 Å²	132.1	82%	0.818	78%	0.776	S	S	*	*			cis	86.1	133.1	21.4	0	0	0	0	0	115.4
490	A	32.3	Very low	32.9	Very low	92 Å²	92	130.1 Å²	130.1	76%	0.76	78%	0.776	S	S	*	*			cis	-167	-162.7	-4.3	0	0	0	0	0	112
491	N	31.8	Very low	32.7	Very low	144 Å²	144	129 Å²	129	77%	0.77	78%	0.78	S	S	*	*			trans	89.8	126.1	163.7	-75	-13.4	0	0	0	123.1
492	I	32.3	Very low	32.3	Very low	139 Å²	139	128.8 Å²	128.8	71%	0.713	78%	0.778	S	S	*	*				73.9	103.7	124.5	-61.8	173.4	0	0	0	123.3
493	V	31.9	Very low	31.8	Very low	124 Å²	124	131.8 Å²	131.8	75%	0.752	79%	0.787	S	S	*	*				68.5	142.2	121.6	179.6	0	0	0	0	124.6
494	I	33.8	Very low	31.4	Very low	139 Å²	139	129 Å²	129	71%	0.713	79%	0.786	S	S	*	*			trans	99	110.4	152.1	-94	162.6	0	0	0	123.2
495	Q	29.6	Very low	31.7	Very low	161 Å²	161	132.3 Å²	132.3	75%	0.752	80%	0.797	S	S	*	*			trans	51.1	154.3	135.5	-60.5	178.3	9.5	0	0	127.3
496	T	32.3	Very low	31.4	Very low	132 Å²	132	126.6 Å²	126.6	81%	0.81	79%	0.792	S	S	*	*			trans	96.9	155.3	142.5	23	0	0	0	0	122.2
497	E	28.9	Very low	31.4	Very low	179 Å²	179	130.8 Å²	130.8	84%	0.836	80%	0.799	S	S	*	*			trans	-108.7	-153.7	-161.8	-59.9	-173.4	110.7	0	0	112.5
498	P	53.2	Low	31.3	Very low	115 Å²	115	131.6 Å²	131.6	75%	0.747	80%	0.795	S	S	*	*				-131.4	-160.7	-89.3	42.9	-25.9	0	0	0	114.3
499	A	28.7	Very low	31.3	Very low	102 Å²	102	125.7 Å²	125.7	84%	0.843	79%	0.785	S	S	*	*			trans	99.3	137.3	160.8	0	0	0	0	0	118.1
500	S	28.8	Very low	31.3	Very low	125 Å²	125	126 Å²	126	87%	0.874	78%	0.782	S	S	*	*			trans	-159	155.1	176.6	58.6	0	0	0	0	110
501	A	27.1	Very low	31.2	Very low	100 Å²	100	132.7 Å²	132.7	83%	0.826	79%	0.787	S	S	*	*			trans	-145.6	172.8	-176.1	0	0	0	0	0	112.8
502	S	26.3	Very low	31.1	Very low	98 Å²	98	134.9 Å²	134.9	69%	0.685	79%	0.79	S	S	*	*			trans	74.1	105.1	158.2	179.3	0	0	0	0	120.3
503	N	25.8	Very low	30.9	Very low	158 Å²	158	133.5 Å²	133.5	85%	0.845	78%	0.784	S	S	*	*			trans	68.3	143.2	131.2	-60.4	-14.2	0	0	0	123.7
504	S	24.5	Very low	30.7	Very low	113 Å²	113	132.7 Å²	132.7	79%	0.79	78%	0.78	S	S	*	*			trans	-75.7	-171.4	165.9	-29.8	0	0	0	0	112.2
505	P	42.2	Very low	30.5	Very low	132 Å²	132	132 Å²	132	86%	0.857	77%	0.774	S	S	*	*			cis	-133.5	-175.5	-5.7	42.1	-25.1	0	0	0	114.4
506	G	26.3	Very low	30.6	Very low	82 Å²	82	131.1 Å²	131.1	85%	0.845	77%	0.769	S	S	*	*			trans	171.2	139.5	165.6	0	0	0	0	0	115.3
507	N	26.9	Very low	30.5	Very low	153 Å²	153	128.9 Å²	128.9	82%	0.818	75%	0.752	S	S	*	*			trans	-121.6	164.1	-168.2	-146.4	7.3	0	0	0	112.6
508	N	32.3	Very low	30.4	Very low	132 Å²	132	125 Å²	125	71%	0.706	75%	0.745	S	S	*	*			trans	98.2	117.9	148.8	-66.4	-22	0	0	0	125.3
509	V	31.7	Very low	29.7	Very low	121 Å²	121	126.4 Å²	126.4	73%	0.733	74%	0.736	S	S	*	*				85.9	101.9	121.5	179.9	0	0	0	0	123.3
510	S	30.3	Very low	30	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	73%	0.732	S	S	*	*			trans	11.4	144.5	131.4	-41.6	0	0	0	0	125.3
511	R	31	Very low	30.3	Very low	231 Å²	231	131.9 Å²	131.9	87%	0.872	72%	0.72	S	S	*	*				-171.9	128.1	127.1	-106.1	164.4	-174.8	179.8	2.2	113
512	F	29.5	Very low	30.3	Very low	190 Å²	190	129.1 Å²	129.1	83%	0.833	69%	0.693	S	S	*	*				76	148.2	104.5	-100.7	-122.3	0	0	0	116.5
513	N	27.1	Very low	30.5	Very low	111 Å²	111	130.6 Å²	130.6	59%	0.594	69%	0.691	S	S	*	*			cis	-172.6	-177.3	-23	-176	43.1	0	0	0	109.6
514	T	28.8	Very low	30.7	Very low	106 Å²	106	126.6 Å²	126.6	65%	0.65	69%	0.687	S	S	*	*			trans	84.8	133	156.7	-64.6	0	0	0	0	117.5
515	E	29.8	Very low	31.1	Very low	126 Å²	126	125.8 Å²	125.8	59%	0.589	69%	0.687	S	S	*	*			cis	-172.8	153.3	-28.9	-116.7	168.7	106.7	0	0	113
516	Q	31.5	Very low	30.4	Very low	142 Å²	142	124.7 Å²	124.7	66%	0.664	68%	0.683	S	S	*	*			trans	46.7	157.1	142.7	-72.6	-169.2	77.1	0	0	123.6
517	D	30.3	Very low	30.5	Very low	84 Å²	84	129.1 Å²	129.1	45%	0.449	69%	0.686	S	S	.	*			cis	-177.9	143.9	-20.5	-177.5	-42.4	0	0	0	111.2	R519	D517-R519 WeakPolarHBondContact OD1-CD 3.35Å; D517-R519 WeakPolarHBondContact OD1-CG 3.44Å; D517-R519 IonicContact OD1-CZ 2.77Å; D517-R519 IonicContact OD1-NE 2.59Å; D517-R519 PolarHBondContact OD1-NE 2.88Å; D517-R519 IonicContact OD1-NH2 2.65Å; D517-R519 IonicContact OD2-CZ 2.68Å; D517-R519 IonicContact OD2-NE 2.71Å; D517-R519 PolarHBondContact OD2-NE 3.24Å; D517-R519 IonicContact OD2-NH2 2.7Å; D517-R519 PolarHBondContact OD2-NH2 2.83Å
518	S	25.6	Very low	30.5	Very low	99 Å²	99	125.5 Å²	125.5	69%	0.692	68%	0.678	S	S	*	*			trans	-167.8	125	145.5	-85.5	0	0	0	0	111.2
519	R	39.4	Very low	30.1	Very low	144 Å²	144	127.2 Å²	127.2	54%	0.543	69%	0.687	S	S	.	*			cis	80.7	147.1	40.2	-69.8	167.2	-160.7	-167.8	14.6	113.8	D517	D517-R519 WeakPolarHBondContact OD1-CD 3.35Å; D517-R519 WeakPolarHBondContact OD1-CG 3.44Å; D517-R519 IonicContact OD1-CZ 2.77Å; D517-R519 IonicContact OD1-NE 2.59Å; D517-R519 PolarHBondContact OD1-NE 2.88Å; D517-R519 IonicContact OD1-NH2 2.65Å; D517-R519 IonicContact OD2-CZ 2.68Å; D517-R519 IonicContact OD2-NE 2.71Å; D517-R519 PolarHBondContact OD2-NE 3.24Å; D517-R519 IonicContact OD2-NH2 2.7Å; D517-R519 PolarHBondContact OD2-NH2 2.83Å
520	K	35.7	Very low	29.8	Very low	174 Å²	174	124.8 Å²	124.8	76%	0.757	69%	0.686	S	S	*	*			cis	-121	-150.5	28.4	-70.7	83.6	-169.2	166.3	0	114.7
521	R	33.9	Very low	30.4	Very low	167 Å²	167	125.8 Å²	125.8	63%	0.63	69%	0.69	S	S	*	*			trans	-173.3	158.7	-147.8	-167.1	-165.5	-63.4	152.1	-3.7	116.4	L228	L228-R521 CarbonylContact O-C 3.57Å
522	T	27.8	Very low	30.4	Very low	43 Å²	43	119.6 Å²	119.6	26%	0.264	69%	0.689	S	S	.	*			trans	133.4	-153.1	140	-9.7	0	0	0	0	122.2	P226 L228 L229	P226-T522 VanDerWaalsContact O-CG2 3.32Å; P226-T522 WeakPolarHBondContact O-CG2 3.46Å; L228-T522 VanDerWaalsContact C-N 3.31Å; L228-T522 CarbonylContact C-O 3.54Å; L228-T522 VanDerWaalsContact C-O 3.3Å; L228-T522 PolarHBondContact N-O 2.79Å; L228-T522 PolarHBondContact O-N 3.41Å; L229-T522 WeakPolarHBondContact CG-O 3.16Å; L229-T522 PolarHBondContact N-O 3.46Å
523	M	30.5	Very low	30.5	Very low	128 Å²	128	114.9 Å²	114.9	63%	0.631	69%	0.685	S	S	*	*			trans	-142.7	179.6	-142.1	-55.4	-65.9	-169.4	0	0	117.7	P227	P227-M523 WeakPolarHBondContact CA-O 3.48Å
524	G	30	Very low	30.6	Very low	74 Å²	74	119.1 Å²	119.1	76%	0.763	70%	0.698	S	S	*	*			trans	154	154.2	146.3	0	0	0	0	0	122.4
525	A	33.6	Very low	30.8	Very low	97 Å²	97	123.4 Å²	123.4	80%	0.802	71%	0.708	S	S	*	*			trans	96.8	162.1	151.5	0	0	0	0	0	123.7
526	S	27.5	Very low	31.5	Very low	109 Å²	109	123 Å²	123	76%	0.762	72%	0.716	S	S	*	*			trans	-152.2	164.8	-167	-61.6	0	0	0	0	114.2
527	L	26.8	Very low	31.2	Very low	174 Å²	174	126.2 Å²	126.2	91%	0.911	72%	0.722	S	S	*	*			trans	85.7	138.7	147	-159.3	67.4	0	0	0	122.2
528	A	27.2	Very low	31.2	Very low	78 Å²	78	128.8 Å²	128.8	65%	0.645	73%	0.733	S	S	*	*			trans	63.9	122.7	152.7	0	0	0	0	0	126
529	D	24.6	Very low	31.2	Very low	167 Å²	167	131.8 Å²	131.8	89%	0.893	74%	0.736	S	S	*	*				48.7	123.8	129.9	-66.2	-74.1	0	0	0	127.6
530	G	25.4	Very low	30.7	Very low	71 Å²	71	132.2 Å²	132.2	73%	0.732	74%	0.742	S	S	*	*			trans	103.8	160	132.5	0	0	0	0	0	119
531	P	43	Very low	30.9	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	74%	0.743	S	S	*	*			cis	-137	174.5	-22.4	41.6	-26.1	0	0	0	115.2
532	A	29.9	Very low	30.6	Very low	102 Å²	102	126.7 Å²	126.7	84%	0.843	74%	0.74	S	S	*	*			trans	52.9	147.3	151.6	0	0	0	0	0	121.6
533	A	32.5	Very low	30.6	Very low	91 Å²	91	135.1 Å²	135.1	75%	0.752	77%	0.773	S	S	*	*			cis	-161.5	-159.8	-11.5	0	0	0	0	0	106.5
534	K	29.5	Very low	30.6	Very low	200 Å²	200	133.5 Å²	133.5	87%	0.87	78%	0.78	S	S	*	*			cis	-139.5	-156.7	4.6	-62.5	-179.2	177.9	-178.8	0	108.9
535	K	33.1	Very low	30.5	Very low	196 Å²	196	133.3 Å²	133.3	85%	0.852	78%	0.778	S	S	*	*			trans	-145.6	171.8	167.3	-62.5	-177.5	-173.4	165.1	0	110.1
536	P	43.9	Very low	30.5	Very low	118 Å²	118	138.5 Å²	138.5	77%	0.766	79%	0.786	S	S	*	*				-131.1	-156.2	86	43.5	-33.2	0	0	0	111.4
537	W	25.2	Very low	30.7	Very low	208 Å²	208	136.6 Å²	136.6	79%	0.788	78%	0.783	S	S	*	*			cis	-145.6	-140.7	-4.5	-169.7	-124.3	0	0	0	111.5
538	M	29.6	Very low	31.1	Very low	139 Å²	139	137.3 Å²	137.3	69%	0.685	78%	0.779	S	S	*	*			trans	-138	-175.8	-172.4	-80.6	169.1	149.9	0	0	109
539	E	25.3	Very low	31.3	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.752	79%	0.791	S	S	*	*			cis	-152.8	-155.1	19.2	-146.7	148.8	160.1	0	0	114.1
540	K	30.1	Very low	31.7	Very low	153 Å²	153	140.2 Å²	140.2	67%	0.665	78%	0.782	S	S	*	*			trans	-134.4	-172.9	-168.9	-122.3	172.2	157	-94.1	0	110.7	D542	K540-D542 IonicContact NZ-OD1 2.65Å; K540-D542 PolarHBondContact NZ-OD1 3.38Å; K540-D542 IonicContact NZ-OD2 2.62Å; K540-D542 PolarHBondContact NZ-OD2 3.08Å
541	P	40.1	Very low	32	Very low	119 Å²	119	146 Å²	146	77%	0.773	79%	0.788	S	S	*	*			cis	-133.4	-131.2	26.5	41.1	-18.3	0	0	0	117.1
542	D	26.8	Very low	32	Very low	107 Å²	107	145.8 Å²	145.8	57%	0.572	79%	0.786	S	S	*	*			trans	-144.4	172.1	-141.6	-55.7	-102.8	0	0	0	115.2	K540	K540-D542 IonicContact NZ-OD1 2.65Å; K540-D542 PolarHBondContact NZ-OD1 3.38Å; K540-D542 IonicContact NZ-OD2 2.62Å; K540-D542 PolarHBondContact NZ-OD2 3.08Å
543	F	28.4	Very low	32.2	Very low	219 Å²	219	150 Å²	150	96%	0.961	79%	0.785	S	S	*	*				-169.2	-170.3	128.5	-117.6	-89.1	0	0	0	114.4
544	A	30.2	Very low	32.4	Very low	95 Å²	95	157 Å²	157	79%	0.785	79%	0.792	S	S	*	*			trans	-116.4	-179.4	-158.5	0	0	0	0	0	114.8
545	G	28.6	Very low	32.6	Very low	69 Å²	69	154 Å²	154	71%	0.711	79%	0.786	S	S	*	*			cis	170.8	-164	0.5	0	0	0	0	0	114.4
546	Q	33.4	Very low	33.1	Very low	207 Å²	207	153.2 Å²	153.2	97%	0.967	79%	0.785	S	S	*	*			trans	73.8	158.8	171.4	-66.2	-67.9	3.9	0	0	120.9
547	G	31.2	Very low	33.4	Very low	68 Å²	68	156.3 Å²	156.3	70%	0.701	78%	0.782	S	S	*	*			trans	116.2	116.1	168.6	0	0	0	0	0	116.8
548	K	35.4	Very low	35.7	Very low	190 Å²	190	152 Å²	152	83%	0.826	78%	0.779	S	S	*	*			trans	-145.2	142.6	166.7	-69.3	179.1	-174.5	167.3	0	110.2	I550	K548-I550 HydrophobicContact CB-CD1 4.4Å
549	N	31.4	Very low	38.2	Very low	167 Å²	167	146.7 Å²	146.7	89%	0.893	75%	0.753	S	S	*	*			trans	-138.6	142.9	155.5	-96.5	-36	0	0	0	110
550	I	33.2	Very low	41.3	Very low	138 Å²	138	140.5 Å²	140.5	71%	0.708	73%	0.726	S	S	*	*			trans	-108.4	119.8	-175	-75	69.4	0	0	0	108.3	K548	K548-I550 HydrophobicContact CB-CD1 4.4Å
551	F	32.1	Very low	44.3	Very low	194 Å²	194	135.1 Å²	135.1	85%	0.851	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-67.8	132.6	164.5	-71.9	-85.1	0	0	0	109.9
552	P	42.1	Very low	46.8	Very low	120 Å²	120	129.5 Å²	129.5	78%	0.779	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-66	135.8	179.5	26.9	-33.8	0	0	0	111
553	K	34.1	Very low	49.9	Very low	192 Å²	192	125.5 Å²	125.5	84%	0.835	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-70.6	143.1	177.1	-64.8	178.2	-179.7	176.9	0	110.1	N555	K553-N555 PolarHBondContact O-N 3.42Å
554	R	35.9	Very low	53	Low	237 Å²	237	115 Å²	115	89%	0.894	60%	0.598	S	S	*	*			trans	-59.8	107.3	170.2	-75	-174.4	178.3	179.8	-0	110.3	H556	R554-H556 PolarHBondContact O-N 3.26Å
555	N	34.7	Very low	55.9	Low	138 Å²	138	114.9 Å²	114.9	74%	0.738	58%	0.577	S	S	*	*			trans	-61.8	120.2	168.9	-76.1	-16.5	0	0	0	109.7	K553 Y557	K553-N555 PolarHBondContact O-N 3.42Å; N555-Y557 PolarHBondContact O-N 3.31Å; N555-Y557 VanDerWaalsContact O-N 3.11Å
556	H	42.6	Very low	58.7	Low	179 Å²	179	117.6 Å²	117.6	83%	0.829	57%	0.57	S	S	*	*			trans	-77.4	90.6	166.6	-82.5	53.3	0	0	0	108.4	R554	R554-H556 PolarHBondContact O-N 3.26Å
557	Y	51.4	Low	61.3	Low	183 Å²	183	107.8 Å²	107.8	72%	0.718	52%	0.524	S	S	*	.			trans	-80	128.4	175.7	-126.4	-104.4	0	0	0	110.1	N555 N559	N555-Y557 PolarHBondContact O-N 3.31Å; N555-Y557 VanDerWaalsContact O-N 3.11Å; Y557-N559 HydrophobicContact CD1-CB 4.22Å; Y557-N559 PolarHBondContact O-N 2.98Å
558	V	72.2	Confident	64	Low	118 Å²	118	106.6 Å²	106.6	72%	0.715	50%	0.504	S	S	*	.			trans	-78.5	38.5	175	-67.3	0	0	0	0	112
559	N	83.3	Confident	66.2	Low	27 Å²	27	106.3 Å²	106.3	14%	0.144	50%	0.497	C	S	.	.			trans	-62.9	137.9	-171.2	-170.4	9.3	0	0	0	111.6	Y557 K561 N608 W631 H632	Y557-N559 HydrophobicContact CD1-CB 4.22Å; Y557-N559 PolarHBondContact O-N 2.98Å; N559-K561 PolarHBondContact ND2-O 2.87Å; N559-K561 VanDerWaalsContact ND2-O 3.15Å; N559-K561 WeakPolarHBondContact OD1-CB 3.37Å; N559-K561 PolarHBondContact OD1-N 3.02Å; N559-N608 PolarHBondContact N-ND2 3.39Å; N559-N608 PolarHBondContact O-ND2 3.18Å; N559-W631 HydrophobicContact CB-CE3 3.85Å; N559-W631 HydrophobicContact CB-CZ3 4.06Å; N559-W631 WeakPolarHBondContact O-CZ3 3.33Å; N559-H632 PolarHBondContact ND2-O 2.93Å
560	T	89.8	Confident	68.6	Low	30 Å²	30	106.9 Å²	106.9	18%	0.184	50%	0.495	C	S	.	.			trans	-113.3	0.2	173.1	78.3	0	0	0	0	113	Q604 Y605 N608	T560-Q604 WeakPolarHBondContact O-CA 3.41Å; T560-Y605 WeakPolarHBondContact CB-O 3.22Å; T560-Y605 PolarHBondContact O-N 2.71Å; T560-Y605 PolarHBondContact OG1-O 3.17Å; T560-N608 HydrophobicContact CG2-CB 4.41Å
561	K	92.5	Very high	70.9	Confident	41 Å²	41	103 Å²	103	18%	0.178	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.9	-179.9	-65.9	-178.3	171.3	-175.3	0	111.8	N559 L602 I603 Q604 H632 E634	N559-K561 PolarHBondContact ND2-O 2.87Å; N559-K561 VanDerWaalsContact ND2-O 3.15Å; N559-K561 WeakPolarHBondContact OD1-CB 3.37Å; N559-K561 PolarHBondContact OD1-N 3.02Å; K561-L602 HydrophobicContact CB-CD1 4.13Å; K561-L602 HydrophobicContact CD-CD2 4.39Å; K561-I603 CarbonylContact C-O 3.58Å; K561-I603 WeakPolarHBondContact CA-O 3.41Å; K561-Q604 HydrophobicContact CG-CB 4.03Å; K561-Q604 HydrophobicContact CG-CG 3.85Å; K561-H632 HydrophobicContact CB-CB 3.86Å; K561-H632 PolarHBondContact O-N 3.29Å; K561-H632 VanDerWaalsContact O-N 3.14Å; K561-E634 IonicContact NZ-OE1 2.88Å; K561-E634 PolarHBondContact NZ-OE1 3.38Å
562	L	93.3	Very high	73.4	Confident	0 Å²	0	94.2 Å²	94.2	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139	172.1	-58.2	-177.5	0	0	0	110.1	L602 I603 Y605 A611 A614 I615 V629 Y630 W631	L562-L602 WeakPolarHBondContact O-CA 3.13Å; L562-I603 PolarHBondContact N-O 3.24Å; L562-I603 PolarHBondContact O-N 3.33Å; L562-Y605 HydrophobicContact CD1-CD2 4.49Å; L562-Y605 HydrophobicContact CD1-CE2 3.92Å; L562-A611 HydrophobicContact CD1-CB 4.45Å; L562-A611 WeakPolarHBondContact CD1-O 3.49Å; L562-A611 HydrophobicContact CD2-CB 4.27Å; L562-A611 HydrophobicContact CG-CB 4.19Å; L562-A614 HydrophobicContact CD1-CB 3.73Å; L562-I615 HydrophobicContact CD1-CB 4.18Å; L562-I615 HydrophobicContact CD2-CB 4.02Å; L562-I615 HydrophobicContact CD2-CD1 4.17Å; L562-I615 HydrophobicContact CD2-CG2 4.26Å; L562-V629 HydrophobicContact CB-CG1 4.02Å; L562-V629 HydrophobicContact CD1-CG1 3.89Å; L562-V629 HydrophobicContact CG-CG1 4.39Å; L562-Y630 CarbonylContact C-O 3.59Å; L562-Y630 VanDerWaalsContact CA-O 3.28Å; L562-Y630 WeakPolarHBondContact CA-O 3.41Å; L562-W631 HydrophobicContact CD2-CD2 3.98Å; L562-W631 HydrophobicContact CD2-CE3 3.53Å; L562-W631 HydrophobicContact CD2-CH2 3.94Å; L562-W631 HydrophobicContact CD2-CZ2 4.34Å; L562-W631 HydrophobicContact CD2-CZ3 3.51Å
563	E	92.5	Very high	75.7	Confident	23 Å²	23	92.5 Å²	92.5	11%	0.107	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	113.5	175.6	-171.4	178	134.2	0	0	108.2	R565 F594 Y630 H632	E563-R565 IonicContact OE1-CZ 2.63Å; E563-R565 IonicContact OE1-NE 2.66Å; E563-R565 PolarHBondContact OE1-NE 3.22Å; E563-R565 IonicContact OE1-NH2 3.89Å; E563-R565 PolarHBondContact OE1-NH2 3.31Å; E563-F594 HydrophobicContact CG-CD1 4.1Å; E563-F594 HydrophobicContact CG-CE1 4.43Å; E563-Y630 PolarHBondContact N-O 2.86Å; E563-Y630 PolarHBondContact O-N 3.38Å; E563-H632 HydrophobicContact CB-CB 3.95Å; E563-H632 IonicContact OE2-CE1 3.92Å; E563-H632 IonicContact OE2-CG 2.62Å; E563-H632 IonicContact OE2-ND1 2.75Å; E563-H632 PolarHBondContact OE2-ND1 2.93Å
564	V	93.8	Very high	78.3	Confident	0 Å²	0	87.7 Å²	87.7	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131	179.8	-171.3	0	0	0	0	107.4	I567 F581 A600 A601 I603 I627 R628 V629	V564-I567 HydrophobicContact CB-CD1 4.03Å; V564-I567 HydrophobicContact CB-CG1 4.44Å; V564-I567 HydrophobicContact CG1-CD1 3.78Å; V564-I567 HydrophobicContact CG1-CG1 3.69Å; V564-F581 HydrophobicContact CG1-CZ 4.34Å; V564-F581 HydrophobicContact CG2-CE1 4.31Å; V564-F581 HydrophobicContact CG2-CE2 4.18Å; V564-F581 HydrophobicContact CG2-CZ 3.7Å; V564-A600 CarbonylContact O-C 3.55Å; V564-A600 WeakPolarHBondContact O-CA 3.19Å; V564-A601 PolarHBondContact N-O 2.92Å; V564-A601 PolarHBondContact O-N 3.46Å; V564-I603 HydrophobicContact CG2-CD1 3.84Å; V564-I603 HydrophobicContact CG2-CG1 4.31Å; V564-I627 HydrophobicContact CG1-CG2 3.33Å; V564-R628 WeakPolarHBondContact CA-O 3.31Å; V564-V629 HydrophobicContact CG1-CG2 4.33Å; V564-V629 HydrophobicContact CG2-CG1 4.35Å; V564-V629 HydrophobicContact CG2-CG2 4.26Å
565	R	91	Very high	80.9	Confident	91 Å²	91	81 Å²	81	34%	0.343	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	164.3	179	-66.5	-177.9	172.3	-103.7	-5.7	111.4	E563 I567 D597 E599 A600 R628 Y630	E563-R565 IonicContact OE1-CZ 2.63Å; E563-R565 IonicContact OE1-NE 2.66Å; E563-R565 PolarHBondContact OE1-NE 3.22Å; E563-R565 IonicContact OE1-NH2 3.89Å; E563-R565 PolarHBondContact OE1-NH2 3.31Å; R565-I567 VanDerWaalsContact C-N 3.29Å; R565-D597 IonicContact CZ-OD2 2.68Å; R565-D597 IonicContact NH1-OD2 3.62Å; R565-D597 PolarHBondContact NH1-OD2 2.8Å; R565-D597 IonicContact NH2-OD2 3.27Å; R565-E599 CarbonylContact C-O 3.58Å; R565-E599 WeakPolarHBondContact CA-O 3.28Å; R565-A600 HydrophobicContact CG-CB 4.22Å; R565-R628 PolarHBondContact N-O 2.96Å; R565-R628 PolarHBondContact O-N 3.26Å; R565-Y630 HydrophobicContact CB-CE2 4.19Å; R565-Y630 HydrophobicContact CG-CD2 4.45Å; R565-Y630 HydrophobicContact CG-CE2 4.33Å
566	K	87	Confident	83.5	Confident	127 Å²	127	78.5 Å²	78.5	55%	0.552	37%	0.372	S	S	*	.			trans	63.2	28.8	-173	-66.1	-161.8	164.1	-145.4	0	113.8	P568 E599 I627	K566-P568 WeakPolarHBondContact O-CD 3.41Å; K566-E599 PolarHBondContact N-O 3.38Å; K566-E599 VanDerWaalsContact N-O 3.13Å; K566-I627 WeakPolarHBondContact O-CG1 3.3Å
567	I	88.5	Confident	85.7	Confident	0 Å²	0	70 Å²	70	0%	0	33%	0.332	C	S	.	.			trans	-74.8	124.1	171.3	-47	161	0	0	0	107.5	V564 R565 L571 N572 L577 E599 A601 I627	V564-I567 HydrophobicContact CB-CD1 4.03Å; V564-I567 HydrophobicContact CB-CG1 4.44Å; V564-I567 HydrophobicContact CG1-CD1 3.78Å; V564-I567 HydrophobicContact CG1-CG1 3.69Å; R565-I567 VanDerWaalsContact C-N 3.29Å; I567-L571 HydrophobicContact CG2-CB 4.06Å; I567-N572 HydrophobicContact CB-CB 4.13Å; I567-N572 HydrophobicContact CG2-CB 3.79Å; I567-L577 HydrophobicContact CD1-CD1 4.4Å; I567-L577 HydrophobicContact CD1-CD2 4.17Å; I567-E599 WeakPolarHBondContact CG1-O 3.28Å; I567-E599 PolarHBondContact N-O 3.47Å; I567-E599 VanDerWaalsContact O-CA 3.25Å; I567-E599 WeakPolarHBondContact O-CA 3.5Å; I567-E599 WeakPolarHBondContact O-CB 3.28Å; I567-A601 HydrophobicContact CD1-CB 3.64Å; I567-I627 HydrophobicContact CB-CD1 4.42Å; I567-I627 HydrophobicContact CG1-CD1 4.47Å; I567-I627 HydrophobicContact CG1-CG2 4.01Å; I567-I627 HydrophobicContact CG2-CD1 4.15Å
568	P	87.6	Confident	87.7	Confident	44 Å²	44	65 Å²	65	29%	0.286	32%	0.318	S	S	.	.			trans	-54.9	141.4	171.1	-26.3	36.3	0	0	0	110.8	K566 E570 L571 N572	K566-P568 WeakPolarHBondContact O-CD 3.41Å; P568-E570 PolarHBondContact O-N 2.87Å; P568-E570 VanDerWaalsContact O-N 3.16Å; P568-L571 HydrophobicContact CB-CB 4.37Å; P568-L571 HydrophobicContact CB-CD1 4.31Å; P568-L571 HydrophobicContact CB-CG 4.32Å; P568-L571 HydrophobicContact CG-CD1 4.07Å; P568-L571 CarbonylContact O-C 3.53Å; P568-L571 WeakPolarHBondContact O-CA 3.36Å; P568-L571 PolarHBondContact O-N 3.11Å; P568-N572 PolarHBondContact O-N 3.35Å
569	R	80.3	Confident	88.6	Confident	183 Å²	183	64.1 Å²	64.1	69%	0.691	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-36	-168.7	-57.5	179.6	81.1	-178	7.5	112.8	L571 N572 P598	R569-L571 VanDerWaalsContact C-N 3.32Å; R569-L571 PolarHBondContact O-N 3.05Å; R569-N572 PolarHBondContact O-N 2.91Å; R569-P598 HydrophobicContact CG-CB 4.48Å
570	E	83.2	Confident	88.9	Confident	179 Å²	179	63.2 Å²	63.2	84%	0.836	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-33.6	173.6	-66.3	156	-155.5	0	0	113.5	P568	P568-E570 PolarHBondContact O-N 2.87Å; P568-E570 VanDerWaalsContact O-N 3.16Å
571	L	80.4	Confident	89	Confident	56 Å²	56	61.8 Å²	61.8	29%	0.293	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-12	-178.3	-63	-175.9	0	0	0	113	I567 P568 R569 N573 L622	I567-L571 HydrophobicContact CG2-CB 4.06Å; P568-L571 HydrophobicContact CB-CB 4.37Å; P568-L571 HydrophobicContact CB-CD1 4.31Å; P568-L571 HydrophobicContact CB-CG 4.32Å; P568-L571 HydrophobicContact CG-CD1 4.07Å; P568-L571 CarbonylContact O-C 3.53Å; P568-L571 WeakPolarHBondContact O-CA 3.36Å; P568-L571 PolarHBondContact O-N 3.11Å; R569-L571 VanDerWaalsContact C-N 3.32Å; R569-L571 PolarHBondContact O-N 3.05Å; L571-N573 PolarHBondContact O-N 3.24Å; L571-L622 HydrophobicContact CB-CD1 3.95Å
572	N	86.2	Confident	89	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.059	30%	0.302	C	S	.	.			trans	-78.7	55.3	175.5	-161.4	5.7	0	0	0	111.5	I567 P568 R569 V592 P598 A600	I567-N572 HydrophobicContact CB-CB 4.13Å; I567-N572 HydrophobicContact CG2-CB 3.79Å; P568-N572 PolarHBondContact O-N 3.35Å; R569-N572 PolarHBondContact O-N 2.91Å; N572-V592 WeakPolarHBondContact O-CG1 3.47Å; N572-P598 PolarHBondContact ND2-O 2.89Å; N572-A600 PolarHBondContact ND2-O 3.18Å
573	N	88.9	Confident	88.8	Confident	83 Å²	83	68.4 Å²	68.4	44%	0.444	33%	0.328	S	S	.	.			trans	-114.2	138.4	179	-172.4	-33.3	0	0	0	109.7	L571 T575 K576 L577	L571-N573 PolarHBondContact O-N 3.24Å; N573-T575 PolarHBondContact O-N 3.08Å; N573-T575 PolarHBondContact OD1-N 2.74Å; N573-T575 VanDerWaalsContact OD1-N 3.08Å; N573-K576 PolarHBondContact O-N 3.35Å; N573-K576 VanDerWaalsContact O-N 3.16Å; N573-L577 WeakPolarHBondContact O-CG 3.13Å; N573-L577 PolarHBondContact O-N 2.94Å
574	I	89	Confident	88.7	Confident	91 Å²	91	68.4 Å²	68.4	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-52	-40.7	178.8	-60.1	176.6	0	0	0	110.8	N578 I590 V592	I574-N578 WeakPolarHBondContact O-CB 3.36Å; I574-N578 PolarHBondContact O-N 3.17Å; I574-I590 HydrophobicContact CG1-CG2 4.46Å; I574-I590 HydrophobicContact CG2-CB 4.32Å; I574-I590 HydrophobicContact CG2-CD1 4.25Å; I574-I590 HydrophobicContact CG2-CG2 4.49Å; I574-V592 HydrophobicContact CG1-CB 4.27Å; I574-V592 HydrophobicContact CG1-CG2 3.64Å
575	T	90.9	Very high	88.5	Confident	96 Å²	96	69.1 Å²	69.1	59%	0.589	34%	0.335	S	S	*	.	H	α-helix	trans	-62.1	-49.9	-179.6	-53.2	0	0	0	0	111.9	N573 N578 E579	N573-T575 PolarHBondContact O-N 3.08Å; N573-T575 PolarHBondContact OD1-N 2.74Å; N573-T575 VanDerWaalsContact OD1-N 3.08Å; T575-N578 PolarHBondContact O-N 3.44Å; T575-E579 WeakPolarHBondContact O-CB 3.49Å; T575-E579 PolarHBondContact O-N 3.43Å
576	K	89.1	Confident	88.5	Confident	86 Å²	86	68.4 Å²	68.4	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-69	-42.7	-179.4	-77.4	-74.6	159.6	-158.1	0	111.7	N573 N578 E579 H580 L622	N573-K576 PolarHBondContact O-N 3.35Å; N573-K576 VanDerWaalsContact O-N 3.16Å; K576-N578 VanDerWaalsContact C-N 3.32Å; K576-N578 PolarHBondContact O-N 3.42Å; K576-E579 WeakPolarHBondContact CD-OE2 3.19Å; K576-E579 VanDerWaalsContact CE-OE2 3.3Å; K576-E579 WeakPolarHBondContact CE-OE2 3.35Å; K576-E579 IonicContact NZ-OE1 3.18Å; K576-E579 PolarHBondContact NZ-OE1 3.25Å; K576-E579 IonicContact NZ-OE2 2.65Å; K576-E579 PolarHBondContact NZ-OE2 2.83Å; K576-E579 WeakPolarHBondContact O-CB 3.45Å; K576-E579 PolarHBondContact O-N 3.21Å; K576-H580 PolarHBondContact O-N 2.66Å; K576-L622 HydrophobicContact CB-CD1 4.27Å; K576-L622 HydrophobicContact CB-CD2 3.99Å; K576-L622 HydrophobicContact CD-CD2 4.45Å; K576-L622 WeakPolarHBondContact O-CD2 3.25Å
577	L	89.9	Confident	88.8	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-40.1	174	-67.5	174.4	0	0	0	111.7	I567 N573 F581 I590 V592 A601 L622	I567-L577 HydrophobicContact CD1-CD1 4.4Å; I567-L577 HydrophobicContact CD1-CD2 4.17Å; N573-L577 WeakPolarHBondContact O-CG 3.13Å; N573-L577 PolarHBondContact O-N 2.94Å; L577-F581 HydrophobicContact CB-CD2 4.47Å; L577-F581 HydrophobicContact CD2-CD2 4.16Å; L577-F581 HydrophobicContact CD2-CE2 3.87Å; L577-F581 VanDerWaalsContact O-CB 3.26Å; L577-F581 WeakPolarHBondContact O-CB 3.21Å; L577-F581 WeakPolarHBondContact O-CD2 3.49Å; L577-F581 PolarHBondContact O-N 3.47Å; L577-I590 HydrophobicContact CB-CD1 4.47Å; L577-I590 HydrophobicContact CB-CG2 4.29Å; L577-I590 HydrophobicContact CD1-CG2 4.09Å; L577-V592 HydrophobicContact CD1-CG2 3.82Å; L577-A601 HydrophobicContact CD1-CB 3.51Å; L577-L622 HydrophobicContact CD2-CD1 4.22Å
578	N	91.9	Very high	89	Confident	79 Å²	79	68 Å²	68	42%	0.422	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-44.8	174.9	-175.1	57.4	0	0	0	112.1	I574 T575 K576 H580 S582 I590	I574-N578 WeakPolarHBondContact O-CB 3.36Å; I574-N578 PolarHBondContact O-N 3.17Å; T575-N578 PolarHBondContact O-N 3.44Å; K576-N578 VanDerWaalsContact C-N 3.32Å; K576-N578 PolarHBondContact O-N 3.42Å; N578-H580 VanDerWaalsContact C-N 3.34Å; N578-H580 PolarHBondContact O-N 3.13Å; N578-S582 WeakPolarHBondContact O-CB 3.38Å; N578-S582 PolarHBondContact O-N 3.24Å; N578-S582 PolarHBondContact O-OG 2.95Å; N578-I590 HydrophobicContact CB-CD1 3.75Å
579	E	91.6	Very high	89.1	Confident	99 Å²	99	70.1 Å²	70.1	46%	0.463	36%	0.356	S	S	.	.	H	α-helix	trans	-55.8	-44	177	-175.5	-174.8	163.1	0	0	112.4	T575 K576	T575-E579 WeakPolarHBondContact O-CB 3.49Å; T575-E579 PolarHBondContact O-N 3.43Å; K576-E579 WeakPolarHBondContact CD-OE2 3.19Å; K576-E579 VanDerWaalsContact CE-OE2 3.3Å; K576-E579 WeakPolarHBondContact CE-OE2 3.35Å; K576-E579 IonicContact NZ-OE1 3.18Å; K576-E579 PolarHBondContact NZ-OE1 3.25Å; K576-E579 IonicContact NZ-OE2 2.65Å; K576-E579 PolarHBondContact NZ-OE2 2.83Å; K576-E579 WeakPolarHBondContact O-CB 3.45Å; K576-E579 PolarHBondContact O-N 3.21Å
580	H	89.6	Confident	89.7	Confident	8 Å²	8	62.4 Å²	62.4	4%	0.037	33%	0.328	C	S	.	.	H	α-helix	trans	-76.3	-53.9	175.7	-178.5	-96.6	0	0	0	112.8	K576 N578 S582 K583 F584 E619 V621 L622	K576-H580 PolarHBondContact O-N 2.66Å; N578-H580 VanDerWaalsContact C-N 3.34Å; N578-H580 PolarHBondContact O-N 3.13Å; H580-S582 PolarHBondContact O-N 2.68Å; H580-K583 WeakPolarHBondContact O-CB 3.24Å; H580-K583 VanDerWaalsContact O-CG 3.32Å; H580-K583 WeakPolarHBondContact O-CG 3.46Å; H580-K583 PolarHBondContact O-N 2.7Å; H580-F584 AromaticContact ND1-CE2 3.99Å; H580-F584 AromaticContact NE2-CE2 3.48Å; H580-F584 WeakPolarHBondContact NE2-CE2 3.25Å; H580-F584 AromaticContact NE2-CZ 3.94Å; H580-F584 WeakPolarHBondContact O-CE2 3.3Å; H580-E619 IonicContact CD2-OE1 2.65Å; H580-V621 VanDerWaalsContact NE2-CG2 3.33Å; H580-V621 WeakPolarHBondContact NE2-CG2 3.32Å; H580-L622 HydrophobicContact CB-CD2 3.8Å; H580-L622 HydrophobicContact CB-CG 4.44Å
581	F	91.6	Very high	89.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-78.5	-18.4	-167.3	-76.3	-83.3	0	0	0	114.1	V564 L577 K583 F584 I587 I603 Y605 A614 V621 V629	V564-F581 HydrophobicContact CG1-CZ 4.34Å; V564-F581 HydrophobicContact CG2-CE1 4.31Å; V564-F581 HydrophobicContact CG2-CE2 4.18Å; V564-F581 HydrophobicContact CG2-CZ 3.7Å; L577-F581 HydrophobicContact CB-CD2 4.47Å; L577-F581 HydrophobicContact CD2-CD2 4.16Å; L577-F581 HydrophobicContact CD2-CE2 3.87Å; L577-F581 VanDerWaalsContact O-CB 3.26Å; L577-F581 WeakPolarHBondContact O-CB 3.21Å; L577-F581 WeakPolarHBondContact O-CD2 3.49Å; L577-F581 PolarHBondContact O-N 3.47Å; F581-K583 VanDerWaalsContact C-N 3.26Å; F581-K583 PolarHBondContact O-N 2.89Å; F581-F584 PolarHBondContact O-N 3.12Å; F581-I587 HydrophobicContact CB-CD1 3.77Å; F581-I603 HydrophobicContact CB-CD1 4.02Å; F581-I603 HydrophobicContact CB-CG2 4.4Å; F581-I603 HydrophobicContact CD1-CD1 3.9Å; F581-I603 HydrophobicContact CD2-CD1 3.24Å; F581-I603 HydrophobicContact CE1-CD1 4.15Å; F581-I603 HydrophobicContact CE2-CD1 3.53Å; F581-I603 HydrophobicContact CG-CD1 3.44Å; F581-I603 VanDerWaalsContact CG-CD1 3.44Å; F581-I603 HydrophobicContact CZ-CD1 3.98Å; F581-Y605 WeakPolarHBondContact CB-OH 3.5Å; F581-Y605 WeakPolarHBondContact CD1-OH 3.38Å; F581-Y605 PolarHBondContact O-OH 3.2Å; F581-A614 HydrophobicContact CD1-CB 4.32Å; F581-V621 HydrophobicContact CE1-CG2 4.44Å; F581-V621 HydrophobicContact CE2-CG1 3.47Å; F581-V621 VanDerWaalsContact CE2-CG1 3.47Å; F581-V621 HydrophobicContact CE2-CG2 4.43Å; F581-V621 HydrophobicContact CZ-CB 4.36Å; F581-V621 HydrophobicContact CZ-CG1 3.62Å; F581-V621 HydrophobicContact CZ-CG2 3.74Å; F581-V629 HydrophobicContact CE1-CG2 4.26Å; F581-V629 HydrophobicContact CZ-CG2 4.08Å
582	S	92.6	Very high	90.4	Very high	54 Å²	54	57.5 Å²	57.5	38%	0.378	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-68.1	-24.5	175.1	62.4	0	0	0	0	113.2	N578 H580 F584 G585	N578-S582 WeakPolarHBondContact O-CB 3.38Å; N578-S582 PolarHBondContact O-N 3.24Å; N578-S582 PolarHBondContact O-OG 2.95Å; H580-S582 PolarHBondContact O-N 2.68Å; S582-F584 PolarHBondContact O-N 3.19Å; S582-F584 VanDerWaalsContact O-N 3.13Å; S582-G585 WeakPolarHBondContact CA-O 3.09Å; S582-G585 PolarHBondContact O-N 3.19Å; S582-G585 VanDerWaalsContact O-N 3.09Å; S582-G585 VanDerWaalsContact O-O 3.11Å
583	K	89.6	Confident	90.3	Very high	126 Å²	126	60.2 Å²	60.2	55%	0.548	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-52.7	-34.4	173.8	-60.9	-178.8	-175	-172.9	0	112.6	H580 F581 E619	H580-K583 WeakPolarHBondContact O-CB 3.24Å; H580-K583 VanDerWaalsContact O-CG 3.32Å; H580-K583 WeakPolarHBondContact O-CG 3.46Å; H580-K583 PolarHBondContact O-N 2.7Å; F581-K583 VanDerWaalsContact C-N 3.26Å; F581-K583 PolarHBondContact O-N 2.89Å; K583-E619 IonicContact NZ-OE1 3.81Å; K583-E619 PolarHBondContact NZ-OE1 2.88Å
584	F	89.8	Confident	89.9	Confident	23 Å²	23	58 Å²	58	10%	0.101	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-92	-11.8	-175.8	-48.7	-69.9	0	0	0	113.8	H580 F581 S582 R613 A614 S617 E619	H580-F584 AromaticContact ND1-CE2 3.99Å; H580-F584 AromaticContact NE2-CE2 3.48Å; H580-F584 WeakPolarHBondContact NE2-CE2 3.25Å; H580-F584 AromaticContact NE2-CZ 3.94Å; H580-F584 WeakPolarHBondContact O-CE2 3.3Å; F581-F584 PolarHBondContact O-N 3.12Å; S582-F584 PolarHBondContact O-N 3.19Å; S582-F584 VanDerWaalsContact O-N 3.13Å; F584-R613 PolarHBondContact O-NE 3.01Å; F584-R613 PolarHBondContact O-NH2 3.22Å; F584-A614 HydrophobicContact CB-CB 3.71Å; F584-A614 HydrophobicContact CD2-CB 3.96Å; F584-A614 HydrophobicContact CG-CB 3.9Å; F584-S617 WeakPolarHBondContact CE1-OG 3.16Å; F584-S617 WeakPolarHBondContact CZ-OG 3.48Å; F584-E619 HydrophobicContact CZ-CB 4.3Å; F584-E619 WeakPolarHBondContact CZ-OE2 3.31Å
585	G	89.4	Confident	89.2	Confident	15 Å²	15	57 Å²	57	16%	0.155	32%	0.322	C	S	.	.	S	Bend	trans	158.2	-176.4	176.8	0	0	0	0	0	115.4	S582 I587	S582-G585 WeakPolarHBondContact CA-O 3.09Å; S582-G585 PolarHBondContact O-N 3.19Å; S582-G585 VanDerWaalsContact O-N 3.09Å; S582-G585 VanDerWaalsContact O-O 3.11Å; G585-I587 PolarHBondContact O-N 3.26Å
586	T	91.2	Very high	88.5	Confident	76 Å²	76	55.1 Å²	55.1	47%	0.466	32%	0.322	S	S	.	.			trans	-77.2	113.5	-179.7	49.2	0	0	0	0	111.4	Y605 T606 E610	T586-Y605 WeakPolarHBondContact O-CA 3.47Å; T586-T606 PolarHBondContact O-N 3.46Å; T586-T606 VanDerWaalsContact OG1-CG2 3.24Å; T586-T606 WeakPolarHBondContact OG1-CG2 3.46Å; T586-T606 PolarHBondContact OG1-OG1 3.22Å; T586-E610 PolarHBondContact N-OE2 3.36Å; T586-E610 PolarHBondContact OG1-OE2 3.49Å
587	I	93.1	Very high	88.1	Confident	39 Å²	39	54.3 Å²	54.3	20%	0.2	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	133.5	176.4	-52.4	176.1	0	0	0	109.4	F581 G585 N589 I590 I603 Q604 Y605	F581-I587 HydrophobicContact CB-CD1 3.77Å; G585-I587 PolarHBondContact O-N 3.26Å; I587-N589 WeakPolarHBondContact CG2-O 3.36Å; I587-I590 HydrophobicContact CD1-CD1 3.97Å; I587-I590 HydrophobicContact CD1-CG1 4.39Å; I587-I590 HydrophobicContact CG2-CD1 4.23Å; I587-I590 HydrophobicContact CG2-CG1 3.61Å; I587-I603 HydrophobicContact CD1-CG2 4.21Å; I587-I603 HydrophobicContact CG1-CG2 4.36Å; I587-I603 HydrophobicContact CG2-CG2 4.02Å; I587-Q604 CarbonylContact C-O 3.51Å; I587-Q604 WeakPolarHBondContact CG2-O 3.32Å; I587-Y605 HydrophobicContact CG1-CD1 4.25Å; I587-Y605 HydrophobicContact CG1-CE1 3.86Å
588	V	92.7	Very high	87.6	Confident	81 Å²	81	56.5 Å²	56.5	49%	0.491	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-37.6	175.1	174.8	0	0	0	0	111.2	Q604 T606	V588-Q604 HydrophobicContact CB-CG 4.26Å; V588-Q604 PolarHBondContact N-O 3.33Å; V588-T606 HydrophobicContact CG2-CG2 3.43Å; V588-T606 VanDerWaalsContact CG2-CG2 3.43Å
589	N	90.4	Very high	87.3	Confident	87 Å²	87	57.2 Å²	57.2	47%	0.465	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	144.1	-177.3	-165.5	4.6	0	0	0	111	I587 Q604	I587-N589 WeakPolarHBondContact CG2-O 3.36Å; N589-Q604 HydrophobicContact CB-CB 4.17Å; N589-Q604 PolarHBondContact N-O 3.02Å; N589-Q604 PolarHBondContact O-N 2.95Å
590	I	92.6	Very high	87.2	Confident	21 Å²	21	52.6 Å²	52.6	11%	0.108	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.9	169.2	-56.3	179	0	0	0	107.1	I574 L577 N578 I587 V592 L602	I574-I590 HydrophobicContact CG1-CG2 4.46Å; I574-I590 HydrophobicContact CG2-CB 4.32Å; I574-I590 HydrophobicContact CG2-CD1 4.25Å; I574-I590 HydrophobicContact CG2-CG2 4.49Å; L577-I590 HydrophobicContact CB-CD1 4.47Å; L577-I590 HydrophobicContact CB-CG2 4.29Å; L577-I590 HydrophobicContact CD1-CG2 4.09Å; N578-I590 HydrophobicContact CB-CD1 3.75Å; I587-I590 HydrophobicContact CD1-CD1 3.97Å; I587-I590 HydrophobicContact CD1-CG1 4.39Å; I587-I590 HydrophobicContact CG2-CD1 4.23Å; I587-I590 HydrophobicContact CG2-CG1 3.61Å; I590-V592 HydrophobicContact CG2-CG2 4.33Å; I590-L602 WeakPolarHBondContact CA-O 3.4Å
591	Q	88.6	Confident	87.4	Confident	91 Å²	91	52.2 Å²	52.2	43%	0.425	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	101.5	173.4	-178.2	178.5	5.5	0	0	109	F594 A601 L602	Q591-F594 HydrophobicContact CG-CD2 4.37Å; Q591-A601 CarbonylContact O-C 3.59Å; Q591-A601 VanDerWaalsContact O-CA 3.25Å; Q591-A601 WeakPolarHBondContact O-CA 3.28Å; Q591-L602 HydrophobicContact CB-CB 4.26Å; Q591-L602 PolarHBondContact N-O 3.05Å; Q591-L602 PolarHBondContact O-N 3.01Å
592	V	89.5	Confident	87.5	Confident	42 Å²	42	52.8 Å²	52.8	26%	0.255	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	152.1	169.7	159	0	0	0	0	110.1	N572 I574 L577 I590	N572-V592 WeakPolarHBondContact O-CG1 3.47Å; I574-V592 HydrophobicContact CG1-CB 4.27Å; I574-V592 HydrophobicContact CG1-CG2 3.64Å; L577-V592 HydrophobicContact CD1-CG2 3.82Å; I590-V592 HydrophobicContact CG2-CG2 4.33Å
593	V	84.3	Confident	87.5	Confident	67 Å²	67	50.2 Å²	50.2	41%	0.406	30%	0.298	S	S	.	.	S	Bend	trans	53.1	54.5	-169.7	-168.1	0	0	0	0	111.8	G595 G596 D597 A600	V593-G595 PolarHBondContact O-N 3.09Å; V593-G596 PolarHBondContact O-N 3.16Å; V593-D597 WeakPolarHBondContact CA-O 3.15Å; V593-A600 WeakPolarHBondContact CA-O 3.48Å; V593-A600 PolarHBondContact N-O 2.81Å; V593-A600 VanDerWaalsContact N-O 3.08Å
594	F	81.7	Confident	87.7	Confident	37 Å²	37	46.6 Å²	46.6	16%	0.162	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-70.2	129.4	-178.6	-176.4	-107.9	0	0	0	112	E563 Q591 G596 D597 A600 L602 H632	E563-F594 HydrophobicContact CG-CD1 4.1Å; E563-F594 HydrophobicContact CG-CE1 4.43Å; Q591-F594 HydrophobicContact CG-CD2 4.37Å; F594-G596 PolarHBondContact O-N 2.67Å; F594-D597 PolarHBondContact O-N 3.46Å; F594-A600 HydrophobicContact CB-CB 4.3Å; F594-A600 PolarHBondContact N-O 3.36Å; F594-L602 HydrophobicContact CB-CB 4.04Å; F594-L602 HydrophobicContact CD1-CB 4.27Å; F594-L602 HydrophobicContact CD2-CB 3.52Å; F594-L602 HydrophobicContact CD2-CD2 3.94Å; F594-L602 HydrophobicContact CD2-CG 4.26Å; F594-L602 HydrophobicContact CE2-CB 4.07Å; F594-L602 HydrophobicContact CE2-CD2 3.65Å; F594-L602 HydrophobicContact CE2-CG 4.32Å; F594-L602 HydrophobicContact CG-CB 3.65Å; F594-L602 HydrophobicContact CZ-CD1 4.49Å; F594-L602 HydrophobicContact CZ-CD2 4.2Å; F594-H632 AromaticContact CE1-CE1 3.53Å; F594-H632 AromaticContact CE1-ND1 3.7Å; F594-H632 AromaticContact CZ-CE1 3.38Å; F594-H632 WeakPolarHBondContact CZ-CE1 3.49Å; F594-H632 AromaticContact CZ-ND1 3.93Å; F594-H632 AromaticContact CZ-NE2 4Å
595	G	73.6	Confident	87.9	Confident	70 Å²	70	45.6 Å²	45.6	72%	0.722	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	72.7	3.5	-179.7	0	0	0	0	0	115.2	V593	V593-G595 PolarHBondContact O-N 3.09Å
596	G	75.9	Confident	88.1	Confident	56 Å²	56	48.2 Å²	48.2	58%	0.577	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	95.6	-15.4	-171.9	0	0	0	0	0	113.9	V593 F594 P598	V593-G596 PolarHBondContact O-N 3.16Å; F594-G596 PolarHBondContact O-N 2.67Å; G596-P598 VanDerWaalsContact O-CD 3.31Å; G596-P598 WeakPolarHBondContact O-CD 3.17Å
597	D	79.9	Confident	88.1	Confident	69 Å²	69	49.5 Å²	49.5	37%	0.369	29%	0.291	S	S	.	.			trans	-70.9	113.9	176	-72.3	-21.4	0	0	0	109.7	R565 V593 F594 E599 A600	R565-D597 IonicContact CZ-OD2 2.68Å; R565-D597 IonicContact NH1-OD2 3.62Å; R565-D597 PolarHBondContact NH1-OD2 2.8Å; R565-D597 IonicContact NH2-OD2 3.27Å; V593-D597 WeakPolarHBondContact CA-O 3.15Å; F594-D597 PolarHBondContact O-N 3.46Å; D597-E599 PolarHBondContact O-N 3.1Å; D597-E599 VanDerWaalsContact O-N 3.13Å; D597-A600 HydrophobicContact CB-CB 3.62Å; D597-A600 PolarHBondContact O-N 3.26Å
598	P	79.4	Confident	88	Confident	46 Å²	46	49.6 Å²	49.6	30%	0.299	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-6.8	-178.9	31.6	-36.7	0	0	0	113.5	R569 N572 G596	R569-P598 HydrophobicContact CG-CB 4.48Å; N572-P598 PolarHBondContact ND2-O 2.89Å; G596-P598 VanDerWaalsContact O-CD 3.31Å; G596-P598 WeakPolarHBondContact O-CD 3.17Å
599	E	86.8	Confident	87.9	Confident	95 Å²	95	52 Å²	52	44%	0.444	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	5.6	172.6	-56.3	-172	173.7	0	0	113.4	R565 K566 I567 D597	R565-E599 CarbonylContact C-O 3.58Å; R565-E599 WeakPolarHBondContact CA-O 3.28Å; K566-E599 PolarHBondContact N-O 3.38Å; K566-E599 VanDerWaalsContact N-O 3.13Å; I567-E599 WeakPolarHBondContact CG1-O 3.28Å; I567-E599 PolarHBondContact N-O 3.47Å; I567-E599 VanDerWaalsContact O-CA 3.25Å; I567-E599 WeakPolarHBondContact O-CA 3.5Å; I567-E599 WeakPolarHBondContact O-CB 3.28Å; D597-E599 PolarHBondContact O-N 3.1Å; D597-E599 VanDerWaalsContact O-N 3.13Å
600	A	89.7	Confident	88	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.008	28%	0.28	C	S	.	.			trans	-114.2	149.6	-178.3	0	0	0	0	0	112.9	V564 R565 N572 V593 F594 D597	V564-A600 CarbonylContact O-C 3.55Å; V564-A600 WeakPolarHBondContact O-CA 3.19Å; R565-A600 HydrophobicContact CG-CB 4.22Å; N572-A600 PolarHBondContact ND2-O 3.18Å; V593-A600 WeakPolarHBondContact CA-O 3.48Å; V593-A600 PolarHBondContact N-O 2.81Å; V593-A600 VanDerWaalsContact N-O 3.08Å; F594-A600 HydrophobicContact CB-CB 4.3Å; F594-A600 PolarHBondContact N-O 3.36Å; D597-A600 HydrophobicContact CB-CB 3.62Å; D597-A600 PolarHBondContact O-N 3.26Å
601	A	93.1	Very high	87.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	147.8	170.7	0	0	0	0	0	111.6	V564 I567 L577 Q591	V564-A601 PolarHBondContact N-O 2.92Å; V564-A601 PolarHBondContact O-N 3.46Å; I567-A601 HydrophobicContact CD1-CB 3.64Å; L577-A601 HydrophobicContact CD1-CB 3.51Å; Q591-A601 CarbonylContact O-C 3.59Å; Q591-A601 VanDerWaalsContact O-CA 3.25Å; Q591-A601 WeakPolarHBondContact O-CA 3.28Å
602	L	92.9	Very high	88.1	Confident	12 Å²	12	50.1 Å²	50.1	6%	0.063	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124	173.9	-179.1	77.1	0	0	0	109.6	K561 L562 I590 Q591 F594 H632	K561-L602 HydrophobicContact CB-CD1 4.13Å; K561-L602 HydrophobicContact CD-CD2 4.39Å; L562-L602 WeakPolarHBondContact O-CA 3.13Å; I590-L602 WeakPolarHBondContact CA-O 3.4Å; Q591-L602 HydrophobicContact CB-CB 4.26Å; Q591-L602 PolarHBondContact N-O 3.05Å; Q591-L602 PolarHBondContact O-N 3.01Å; F594-L602 HydrophobicContact CB-CB 4.04Å; F594-L602 HydrophobicContact CD1-CB 4.27Å; F594-L602 HydrophobicContact CD2-CB 3.52Å; F594-L602 HydrophobicContact CD2-CD2 3.94Å; F594-L602 HydrophobicContact CD2-CG 4.26Å; F594-L602 HydrophobicContact CE2-CB 4.07Å; F594-L602 HydrophobicContact CE2-CD2 3.65Å; F594-L602 HydrophobicContact CE2-CG 4.32Å; F594-L602 HydrophobicContact CG-CB 3.65Å; F594-L602 HydrophobicContact CZ-CD1 4.49Å; F594-L602 HydrophobicContact CZ-CD2 4.2Å; L602-H632 HydrophobicContact CD1-CB 3.46Å; L602-H632 VanDerWaalsContact CD1-CB 3.46Å
603	I	94.2	Very high	88.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.4	-177	-56.4	-177.6	0	0	0	108.8	K561 L562 V564 F581 I587 Y605	K561-I603 CarbonylContact C-O 3.58Å; K561-I603 WeakPolarHBondContact CA-O 3.41Å; L562-I603 PolarHBondContact N-O 3.24Å; L562-I603 PolarHBondContact O-N 3.33Å; V564-I603 HydrophobicContact CG2-CD1 3.84Å; V564-I603 HydrophobicContact CG2-CG1 4.31Å; F581-I603 HydrophobicContact CB-CD1 4.02Å; F581-I603 HydrophobicContact CB-CG2 4.4Å; F581-I603 HydrophobicContact CD1-CD1 3.9Å; F581-I603 HydrophobicContact CD2-CD1 3.24Å; F581-I603 HydrophobicContact CE1-CD1 4.15Å; F581-I603 HydrophobicContact CE2-CD1 3.53Å; F581-I603 HydrophobicContact CG-CD1 3.44Å; F581-I603 VanDerWaalsContact CG-CD1 3.44Å; F581-I603 HydrophobicContact CZ-CD1 3.98Å; I587-I603 HydrophobicContact CD1-CG2 4.21Å; I587-I603 HydrophobicContact CG1-CG2 4.36Å; I587-I603 HydrophobicContact CG2-CG2 4.02Å; I603-Y605 HydrophobicContact CG2-CD2 4.39Å; I603-Y605 HydrophobicContact CG2-CE2 3.89Å
604	Q	92.8	Very high	88.5	Confident	51 Å²	51	51.3 Å²	51.3	24%	0.238	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.8	179.8	-175.6	177.2	-28	0	0	110.6	T560 K561 I587 V588 N589	T560-Q604 WeakPolarHBondContact O-CA 3.41Å; K561-Q604 HydrophobicContact CG-CB 4.03Å; K561-Q604 HydrophobicContact CG-CG 3.85Å; I587-Q604 CarbonylContact C-O 3.51Å; I587-Q604 WeakPolarHBondContact CG2-O 3.32Å; V588-Q604 HydrophobicContact CB-CG 4.26Å; V588-Q604 PolarHBondContact N-O 3.33Å; N589-Q604 HydrophobicContact CB-CB 4.17Å; N589-Q604 PolarHBondContact N-O 3.02Å; N589-Q604 PolarHBondContact O-N 2.95Å
605	Y	95.1	Very high	88.9	Confident	1 Å²	1	51.9 Å²	51.9	0%	0.004	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	163	174	-72.6	-87.6	0	0	0	113	T560 L562 F581 T586 I587 I603 K607 E610 A611 A614	T560-Y605 WeakPolarHBondContact CB-O 3.22Å; T560-Y605 PolarHBondContact O-N 2.71Å; T560-Y605 PolarHBondContact OG1-O 3.17Å; L562-Y605 HydrophobicContact CD1-CD2 4.49Å; L562-Y605 HydrophobicContact CD1-CE2 3.92Å; F581-Y605 WeakPolarHBondContact CB-OH 3.5Å; F581-Y605 WeakPolarHBondContact CD1-OH 3.38Å; F581-Y605 PolarHBondContact O-OH 3.2Å; T586-Y605 WeakPolarHBondContact O-CA 3.47Å; I587-Y605 HydrophobicContact CG1-CD1 4.25Å; I587-Y605 HydrophobicContact CG1-CE1 3.86Å; I603-Y605 HydrophobicContact CG2-CD2 4.39Å; I603-Y605 HydrophobicContact CG2-CE2 3.89Å; Y605-K607 VanDerWaalsContact C-N 3.34Å; Y605-E610 HydrophobicContact CD1-CB 3.71Å; Y605-E610 HydrophobicContact CE1-CB 4.43Å; Y605-E610 HydrophobicContact CG-CB 4.04Å; Y605-A611 VanDerWaalsContact CD2-CA 3.5Å; Y605-A611 HydrophobicContact CD2-CB 3.66Å; Y605-A611 HydrophobicContact CE2-CB 4.43Å; Y605-A611 HydrophobicContact CG-CB 4.21Å; Y605-A614 HydrophobicContact CE2-CB 3.85Å; Y605-A614 VanDerWaalsContact OH-CB 3.3Å; Y605-A614 WeakPolarHBondContact OH-CB 3.34Å
606	T	92.4	Very high	89.6	Confident	71 Å²	71	51.2 Å²	51.2	44%	0.436	26%	0.262	S	S	.	.	S	Bend	trans	-70.7	-29.6	172.2	68.9	0	0	0	0	112.6	T586 V588 E610	T586-T606 PolarHBondContact O-N 3.46Å; T586-T606 VanDerWaalsContact OG1-CG2 3.24Å; T586-T606 WeakPolarHBondContact OG1-CG2 3.46Å; T586-T606 PolarHBondContact OG1-OG1 3.22Å; V588-T606 HydrophobicContact CG2-CG2 3.43Å; V588-T606 VanDerWaalsContact CG2-CG2 3.43Å; T606-E610 PolarHBondContact OG1-OE2 3.37Å
607	K	90.7	Very high	90.2	Very high	103 Å²	103	50.4 Å²	50.4	45%	0.448	25%	0.247	S	C	.	.	S	Bend	trans	-126.9	146.2	-177.3	-54.9	-173.5	-164.4	68.6	0	112.1	Y605 E609 E610 A611	Y605-K607 VanDerWaalsContact C-N 3.34Å; K607-E609 PolarHBondContact O-N 2.85Å; K607-E610 HydrophobicContact CB-CB 4.35Å; K607-E610 HydrophobicContact CB-CG 4.18Å; K607-E610 WeakPolarHBondContact CD-OE1 3.48Å; K607-E610 WeakPolarHBondContact CE-OE1 3.2Å; K607-E610 IonicContact NZ-OE1 2.68Å; K607-E610 PolarHBondContact NZ-OE1 3.11Å; K607-E610 PolarHBondContact O-N 2.76Å; K607-A611 PolarHBondContact O-N 3.06Å
608	N	91	Very high	90.3	Very high	40 Å²	40	53 Å²	53	21%	0.214	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-35.1	170.6	171.8	-111	0	0	0	111.6	N559 T560 R612	N559-N608 PolarHBondContact N-ND2 3.39Å; N559-N608 PolarHBondContact O-ND2 3.18Å; T560-N608 HydrophobicContact CG2-CB 4.41Å; N608-R612 WeakPolarHBondContact O-CB 3.44Å; N608-R612 WeakPolarHBondContact O-CG 3.25Å; N608-R612 PolarHBondContact O-N 2.68Å; N608-R612 VanDerWaalsContact OD1-CD 3.24Å; N608-R612 WeakPolarHBondContact OD1-CD 3.34Å
609	E	91.6	Very high	90.5	Very high	133 Å²	133	53.9 Å²	53.9	62%	0.621	26%	0.26	S	S	*	.	H	α-helix	trans	-66	-37	177.7	-173.3	166.6	-146.5	0	0	113	K607 R612 R613	K607-E609 PolarHBondContact O-N 2.85Å; E609-R612 PolarHBondContact O-N 3.48Å; E609-R613 WeakPolarHBondContact O-CG 3.27Å; E609-R613 PolarHBondContact O-N 2.84Å
610	E	92.5	Very high	90.3	Very high	16 Å²	16	50.6 Å²	50.6	8%	0.075	25%	0.249	C	C	.	.	H	α-helix	trans	-68.3	-46.8	176.5	-73.1	167.5	-151	0	0	110.9	T586 Y605 T606 K607 R612 R613 A614	T586-E610 PolarHBondContact N-OE2 3.36Å; T586-E610 PolarHBondContact OG1-OE2 3.49Å; Y605-E610 HydrophobicContact CD1-CB 3.71Å; Y605-E610 HydrophobicContact CE1-CB 4.43Å; Y605-E610 HydrophobicContact CG-CB 4.04Å; T606-E610 PolarHBondContact OG1-OE2 3.37Å; K607-E610 HydrophobicContact CB-CB 4.35Å; K607-E610 HydrophobicContact CB-CG 4.18Å; K607-E610 WeakPolarHBondContact CD-OE1 3.48Å; K607-E610 WeakPolarHBondContact CE-OE1 3.2Å; K607-E610 IonicContact NZ-OE1 2.68Å; K607-E610 PolarHBondContact NZ-OE1 3.11Å; K607-E610 PolarHBondContact O-N 2.76Å; E610-R612 VanDerWaalsContact C-N 3.27Å; E610-R612 PolarHBondContact O-N 3.42Å; E610-R613 PolarHBondContact O-N 2.86Å; E610-A614 PolarHBondContact O-N 2.99Å; E610-A614 VanDerWaalsContact O-N 3.09Å
611	A	91.2	Very high	89.9	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-36.3	171.1	0	0	0	0	0	112.7	L562 Y605 K607 A614 I615 W631	L562-A611 HydrophobicContact CD1-CB 4.45Å; L562-A611 WeakPolarHBondContact CD1-O 3.49Å; L562-A611 HydrophobicContact CD2-CB 4.27Å; L562-A611 HydrophobicContact CG-CB 4.19Å; Y605-A611 VanDerWaalsContact CD2-CA 3.5Å; Y605-A611 HydrophobicContact CD2-CB 3.66Å; Y605-A611 HydrophobicContact CE2-CB 4.43Å; Y605-A611 HydrophobicContact CG-CB 4.21Å; K607-A611 PolarHBondContact O-N 3.06Å; A611-A614 PolarHBondContact O-N 2.69Å; A611-I615 WeakPolarHBondContact O-CG2 3.34Å; A611-I615 PolarHBondContact O-N 3.45Å; A611-I615 VanDerWaalsContact O-N 3.12Å; A611-W631 HydrophobicContact CB-CH2 3.73Å; A611-W631 HydrophobicContact CB-CZ3 3.77Å
612	R	91.3	Very high	89.3	Confident	143 Å²	143	52.4 Å²	52.4	54%	0.54	26%	0.259	S	S	.	.	H	α-helix	trans	-65.7	-45.2	176.7	-78.7	171.6	73.2	138.9	6.3	112	N608 E609 E610 A614 I615 S616 W631	N608-R612 WeakPolarHBondContact O-CB 3.44Å; N608-R612 WeakPolarHBondContact O-CG 3.25Å; N608-R612 PolarHBondContact O-N 2.68Å; N608-R612 VanDerWaalsContact OD1-CD 3.24Å; N608-R612 WeakPolarHBondContact OD1-CD 3.34Å; E609-R612 PolarHBondContact O-N 3.48Å; E610-R612 VanDerWaalsContact C-N 3.27Å; E610-R612 PolarHBondContact O-N 3.42Å; R612-A614 VanDerWaalsContact C-N 3.29Å; R612-A614 PolarHBondContact O-N 2.88Å; R612-I615 PolarHBondContact O-N 2.63Å; R612-S616 WeakPolarHBondContact O-CB 3.36Å; R612-S616 PolarHBondContact O-N 3.33Å; R612-S616 PolarHBondContact O-OG 3.4Å; R612-W631 HydrophobicContact CB-CH2 4.49Å; R612-W631 HydrophobicContact CB-CZ2 4.44Å; R612-W631 HydrophobicContact CG-CH2 3.69Å; R612-W631 HydrophobicContact CG-CZ2 3.6Å
613	R	91.6	Very high	88.8	Confident	131 Å²	131	58.9 Å²	58.9	49%	0.494	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-34.7	176.9	-69.1	-175.2	-52.2	-179	8	112.3	F584 E609 E610 S617	F584-R613 PolarHBondContact O-NE 3.01Å; F584-R613 PolarHBondContact O-NH2 3.22Å; E609-R613 WeakPolarHBondContact O-CG 3.27Å; E609-R613 PolarHBondContact O-N 2.84Å; E610-R613 PolarHBondContact O-N 2.86Å; R613-S617 PolarHBondContact O-N 3.39Å; R613-S617 VanDerWaalsContact O-N 3.11Å
614	A	92.1	Very high	88.4	Confident	3 Å²	3	60.8 Å²	60.8	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-67.1	-49.8	175.9	0	0	0	0	0	112.8	L562 F581 F584 Y605 E610 A611 R612 S617	L562-A614 HydrophobicContact CD1-CB 3.73Å; F581-A614 HydrophobicContact CD1-CB 4.32Å; F584-A614 HydrophobicContact CB-CB 3.71Å; F584-A614 HydrophobicContact CD2-CB 3.96Å; F584-A614 HydrophobicContact CG-CB 3.9Å; Y605-A614 HydrophobicContact CE2-CB 3.85Å; Y605-A614 VanDerWaalsContact OH-CB 3.3Å; Y605-A614 WeakPolarHBondContact OH-CB 3.34Å; E610-A614 PolarHBondContact O-N 2.99Å; E610-A614 VanDerWaalsContact O-N 3.09Å; A611-A614 PolarHBondContact O-N 2.69Å; R612-A614 VanDerWaalsContact C-N 3.29Å; R612-A614 PolarHBondContact O-N 2.88Å; A614-S617 VanDerWaalsContact O-CB 3.23Å; A614-S617 WeakPolarHBondContact O-CB 3.21Å; A614-S617 PolarHBondContact O-N 2.66Å
615	I	90.1	Very high	87.9	Confident	48 Å²	48	69.1 Å²	69.1	25%	0.246	33%	0.333	C	S	.	.	H	α-helix	trans	-75.5	-21.4	179	-165.6	169.7	0	0	0	113.6	L562 A611 R612 S617 V629 W631	L562-I615 HydrophobicContact CD1-CB 4.18Å; L562-I615 HydrophobicContact CD2-CB 4.02Å; L562-I615 HydrophobicContact CD2-CD1 4.17Å; L562-I615 HydrophobicContact CD2-CG2 4.26Å; A611-I615 WeakPolarHBondContact O-CG2 3.34Å; A611-I615 PolarHBondContact O-N 3.45Å; A611-I615 VanDerWaalsContact O-N 3.12Å; R612-I615 PolarHBondContact O-N 2.63Å; I615-S617 VanDerWaalsContact C-N 3.29Å; I615-V629 HydrophobicContact CB-CG1 4.07Å; I615-V629 HydrophobicContact CD1-CG1 4.16Å; I615-V629 WeakPolarHBondContact CD1-O 3.38Å; I615-V629 HydrophobicContact CG1-CB 4.16Å; I615-V629 HydrophobicContact CG1-CG1 3.86Å; I615-W631 HydrophobicContact CD1-CD2 4.48Å; I615-W631 HydrophobicContact CD1-CG 4.23Å; I615-W631 HydrophobicContact CG2-CH2 4.31Å; I615-W631 HydrophobicContact CG2-CZ2 3.54Å
616	S	86.5	Confident	87.5	Confident	57 Å²	57	77 Å²	77	40%	0.399	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	7.8	168.8	77	0	0	0	0	113.1	R612	R612-S616 WeakPolarHBondContact O-CB 3.36Å; R612-S616 PolarHBondContact O-N 3.33Å; R612-S616 PolarHBondContact O-OG 3.4Å
617	S	88.6	Confident	87.4	Confident	38 Å²	38	74.2 Å²	74.2	27%	0.266	35%	0.349	S	S	.	.			trans	-72.1	143.6	175.9	-168.1	0	0	0	0	110.6	F584 R613 A614 I615 E619	F584-S617 WeakPolarHBondContact CE1-OG 3.16Å; F584-S617 WeakPolarHBondContact CZ-OG 3.48Å; R613-S617 PolarHBondContact O-N 3.39Å; R613-S617 VanDerWaalsContact O-N 3.11Å; A614-S617 VanDerWaalsContact O-CB 3.23Å; A614-S617 WeakPolarHBondContact O-CB 3.21Å; A614-S617 PolarHBondContact O-N 2.66Å; I615-S617 VanDerWaalsContact C-N 3.29Å; S617-E619 WeakPolarHBondContact OG-CB 3.46Å; S617-E619 PolarHBondContact OG-N 3.38Å; S617-E619 VanDerWaalsContact OG-N 3.16Å
618	I	81.9	Confident	87.3	Confident	124 Å²	124	76.1 Å²	76.1	64%	0.636	35%	0.354	S	S	*	.			trans	-97.1	-7.9	172	57	87	0	0	0	112.4	W268 A620	W268-I618 HydrophobicContact CE3-CB 3.96Å; W268-I618 HydrophobicContact CE3-CD1 4.1Å; W268-I618 HydrophobicContact CE3-CG1 3.53Å; W268-I618 HydrophobicContact CE3-CG2 3.65Å; W268-I618 HydrophobicContact CH2-CD1 4.46Å; W268-I618 HydrophobicContact CZ3-CB 3.89Å; W268-I618 HydrophobicContact CZ3-CD1 3.73Å; W268-I618 HydrophobicContact CZ3-CG1 3.59Å; W268-I618 HydrophobicContact CZ3-CG2 3.95Å; I618-A620 PolarHBondContact O-N 2.95Å
619	E	83.8	Confident	87.4	Confident	65 Å²	65	75.7 Å²	75.7	30%	0.304	35%	0.353	S	S	.	.	S	Bend	trans	-67.4	124.2	171.4	-167.4	179.7	163.7	0	0	108.4	H580 K583 F584 S617 V621	H580-E619 IonicContact CD2-OE1 2.65Å; K583-E619 IonicContact NZ-OE1 3.81Å; K583-E619 PolarHBondContact NZ-OE1 2.88Å; F584-E619 HydrophobicContact CZ-CB 4.3Å; F584-E619 WeakPolarHBondContact CZ-OE2 3.31Å; S617-E619 WeakPolarHBondContact OG-CB 3.46Å; S617-E619 PolarHBondContact OG-N 3.38Å; S617-E619 VanDerWaalsContact OG-N 3.16Å; E619-V621 PolarHBondContact O-N 2.98Å
620	A	82.9	Confident	87.5	Confident	25 Å²	25	73.5 Å²	73.5	21%	0.207	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-66.8	125.9	179.6	0	0	0	0	0	109.5	I618 L622 N623 R625	I618-A620 PolarHBondContact O-N 2.95Å; A620-L622 PolarHBondContact O-N 3.15Å; A620-N623 PolarHBondContact O-N 3.38Å; A620-R625 HydrophobicContact CB-CG 3.79Å
621	V	81.4	Confident	87.5	Confident	9 Å²	9	77.1 Å²	77.1	6%	0.055	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-58.9	118	-177.8	179.9	0	0	0	0	109.1	H580 F581 E619 N623 N624 I627 V629	H580-V621 VanDerWaalsContact NE2-CG2 3.33Å; H580-V621 WeakPolarHBondContact NE2-CG2 3.32Å; F581-V621 HydrophobicContact CE1-CG2 4.44Å; F581-V621 HydrophobicContact CE2-CG1 3.47Å; F581-V621 VanDerWaalsContact CE2-CG1 3.47Å; F581-V621 HydrophobicContact CE2-CG2 4.43Å; F581-V621 HydrophobicContact CZ-CB 4.36Å; F581-V621 HydrophobicContact CZ-CG1 3.62Å; F581-V621 HydrophobicContact CZ-CG2 3.74Å; E619-V621 PolarHBondContact O-N 2.98Å; V621-N623 PolarHBondContact O-N 3.37Å; V621-N624 PolarHBondContact O-N 2.83Å; V621-I627 HydrophobicContact CB-CB 4.01Å; V621-I627 HydrophobicContact CB-CD1 4.31Å; V621-I627 HydrophobicContact CB-CG2 3.88Å; V621-I627 HydrophobicContact CG1-CB 4.4Å; V621-I627 HydrophobicContact CG1-CD1 4.09Å; V621-I627 HydrophobicContact CG1-CG2 3.85Å; V621-I627 HydrophobicContact CG2-CG2 4.34Å; V621-I627 WeakPolarHBondContact O-CD1 3.13Å; V621-V629 HydrophobicContact CG2-CG2 3.75Å
622	L	80.6	Confident	87.4	Confident	31 Å²	31	77.7 Å²	77.7	16%	0.162	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	53	39.7	-176.4	-55.9	173.8	0	0	0	112.8	L571 K576 L577 H580 A620 N624	L571-L622 HydrophobicContact CB-CD1 3.95Å; K576-L622 HydrophobicContact CB-CD1 4.27Å; K576-L622 HydrophobicContact CB-CD2 3.99Å; K576-L622 HydrophobicContact CD-CD2 4.45Å; K576-L622 WeakPolarHBondContact O-CD2 3.25Å; L577-L622 HydrophobicContact CD2-CD1 4.22Å; H580-L622 HydrophobicContact CB-CD2 3.8Å; H580-L622 HydrophobicContact CB-CG 4.44Å; A620-L622 PolarHBondContact O-N 3.15Å; L622-N624 PolarHBondContact O-N 3.41Å
623	N	83.1	Confident	87.1	Confident	148 Å²	148	81.2 Å²	81.2	79%	0.791	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	60.4	3.4	-172.5	-66.4	-14.8	0	0	0	115.5	A620 V621	A620-N623 PolarHBondContact O-N 3.38Å; V621-N623 PolarHBondContact O-N 3.37Å
624	N	84.6	Confident	86.3	Confident	39 Å²	39	80.8 Å²	80.8	21%	0.209	37%	0.372	C	S	.	.			trans	-103.4	112.4	-176.8	-175.4	-23.6	0	0	0	111.4	V621 L622 F626 I627	V621-N624 PolarHBondContact O-N 2.83Å; L622-N624 PolarHBondContact O-N 3.41Å; N624-F626 VanDerWaalsContact C-N 3.26Å; N624-F626 PolarHBondContact O-N 2.92Å; N624-F626 WeakPolarHBondContact OD1-CB 3.38Å; N624-F626 WeakPolarHBondContact OD1-CD2 3.47Å; N624-F626 PolarHBondContact OD1-N 3.11Å; N624-I627 HydrophobicContact CB-CD1 3.94Å; N624-I627 HydrophobicContact CB-CG1 3.94Å
625	R	84	Confident	84.5	Confident	227 Å²	227	85.8 Å²	85.8	86%	0.857	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.9	-179.2	-66.3	-177.7	-178.2	176.8	2.8	114.4	A620	A620-R625 HydrophobicContact CB-CG 3.79Å
626	F	85.7	Confident	82	Confident	165 Å²	165	88.6 Å²	88.6	72%	0.724	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-13.1	-179.9	-55.9	-70.6	0	0	0	113.4	N624	N624-F626 VanDerWaalsContact C-N 3.26Å; N624-F626 PolarHBondContact O-N 2.92Å; N624-F626 WeakPolarHBondContact OD1-CB 3.38Å; N624-F626 WeakPolarHBondContact OD1-CD2 3.47Å; N624-F626 PolarHBondContact OD1-N 3.11Å
627	I	90.8	Very high	79.9	Confident	13 Å²	13	92.7 Å²	92.7	7%	0.067	45%	0.451	C	S	.	.			trans	-70.3	126.5	171.8	-57.3	-172.8	0	0	0	108.9	V564 K566 I567 V621 N624	V564-I627 HydrophobicContact CG1-CG2 3.33Å; K566-I627 WeakPolarHBondContact O-CG1 3.3Å; I567-I627 HydrophobicContact CB-CD1 4.42Å; I567-I627 HydrophobicContact CG1-CD1 4.47Å; I567-I627 HydrophobicContact CG1-CG2 4.01Å; I567-I627 HydrophobicContact CG2-CD1 4.15Å; V621-I627 HydrophobicContact CB-CB 4.01Å; V621-I627 HydrophobicContact CB-CD1 4.31Å; V621-I627 HydrophobicContact CB-CG2 3.88Å; V621-I627 HydrophobicContact CG1-CB 4.4Å; V621-I627 HydrophobicContact CG1-CD1 4.09Å; V621-I627 HydrophobicContact CG1-CG2 3.85Å; V621-I627 HydrophobicContact CG2-CG2 4.34Å; V621-I627 WeakPolarHBondContact O-CD1 3.13Å; N624-I627 HydrophobicContact CB-CD1 3.94Å; N624-I627 HydrophobicContact CB-CG1 3.94Å
628	R	89.1	Confident	77.3	Confident	143 Å²	143	97.2 Å²	97.2	54%	0.54	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.2	-173.9	-63.8	178.3	71.8	-176.4	-0	110.9	V564 R565 Y630	V564-R628 WeakPolarHBondContact CA-O 3.31Å; R565-R628 PolarHBondContact N-O 2.96Å; R565-R628 PolarHBondContact O-N 3.26Å; R628-Y630 HydrophobicContact CB-CE2 3.68Å; R628-Y630 PolarHBondContact NE-OH 3.23Å; R628-Y630 VanDerWaalsContact NE-OH 3.07Å
629	V	92.6	Very high	75	Confident	31 Å²	31	98.3 Å²	98.3	19%	0.188	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.5	178.3	-172.3	0	0	0	0	109.9	L562 V564 F581 I615 V621	L562-V629 HydrophobicContact CB-CG1 4.02Å; L562-V629 HydrophobicContact CD1-CG1 3.89Å; L562-V629 HydrophobicContact CG-CG1 4.39Å; V564-V629 HydrophobicContact CG1-CG2 4.33Å; V564-V629 HydrophobicContact CG2-CG1 4.35Å; V564-V629 HydrophobicContact CG2-CG2 4.26Å; F581-V629 HydrophobicContact CE1-CG2 4.26Å; F581-V629 HydrophobicContact CZ-CG2 4.08Å; I615-V629 HydrophobicContact CB-CG1 4.07Å; I615-V629 HydrophobicContact CD1-CG1 4.16Å; I615-V629 WeakPolarHBondContact CD1-O 3.38Å; I615-V629 HydrophobicContact CG1-CB 4.16Å; I615-V629 HydrophobicContact CG1-CG1 3.86Å; V621-V629 HydrophobicContact CG2-CG2 3.75Å
630	Y	92.3	Very high	72.6	Confident	87 Å²	87	100.2 Å²	100.2	34%	0.341	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	160.5	-179.4	-56.7	-81	0	0	0	111.3	L562 E563 R565 R628 H632	L562-Y630 CarbonylContact C-O 3.59Å; L562-Y630 VanDerWaalsContact CA-O 3.28Å; L562-Y630 WeakPolarHBondContact CA-O 3.41Å; E563-Y630 PolarHBondContact N-O 2.86Å; E563-Y630 PolarHBondContact O-N 3.38Å; R565-Y630 HydrophobicContact CB-CE2 4.19Å; R565-Y630 HydrophobicContact CG-CD2 4.45Å; R565-Y630 HydrophobicContact CG-CE2 4.33Å; R628-Y630 HydrophobicContact CB-CE2 3.68Å; R628-Y630 PolarHBondContact NE-OH 3.23Å; R628-Y630 VanDerWaalsContact NE-OH 3.07Å; Y630-H632 PolarHBondContact O-N 2.94Å
631	W	93.4	Very high	70.2	Confident	92 Å²	92	102.5 Å²	102.5	35%	0.348	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	113.2	164.8	-75.1	105.6	0	0	0	109.5	N559 L562 A611 R612 I615 R633	N559-W631 HydrophobicContact CB-CE3 3.85Å; N559-W631 HydrophobicContact CB-CZ3 4.06Å; N559-W631 WeakPolarHBondContact O-CZ3 3.33Å; L562-W631 HydrophobicContact CD2-CD2 3.98Å; L562-W631 HydrophobicContact CD2-CE3 3.53Å; L562-W631 HydrophobicContact CD2-CH2 3.94Å; L562-W631 HydrophobicContact CD2-CZ2 4.34Å; L562-W631 HydrophobicContact CD2-CZ3 3.51Å; A611-W631 HydrophobicContact CB-CH2 3.73Å; A611-W631 HydrophobicContact CB-CZ3 3.77Å; R612-W631 HydrophobicContact CB-CH2 4.49Å; R612-W631 HydrophobicContact CB-CZ2 4.44Å; R612-W631 HydrophobicContact CG-CH2 3.69Å; R612-W631 HydrophobicContact CG-CZ2 3.6Å; I615-W631 HydrophobicContact CD1-CD2 4.48Å; I615-W631 HydrophobicContact CD1-CG 4.23Å; I615-W631 HydrophobicContact CG2-CH2 4.31Å; I615-W631 HydrophobicContact CG2-CZ2 3.54Å; W631-R633 PolarHBondContact O-N 2.84Å
632	H	89.1	Confident	67.9	Low	13 Å²	13	111.3 Å²	111.3	6%	0.06	58%	0.578	C	S	.	*			trans	-60.3	127.8	177.1	178.5	57	0	0	0	110	N559 K561 E563 F594 L602 Y630 E634	N559-H632 PolarHBondContact ND2-O 2.93Å; K561-H632 HydrophobicContact CB-CB 3.86Å; K561-H632 PolarHBondContact O-N 3.29Å; K561-H632 VanDerWaalsContact O-N 3.14Å; E563-H632 HydrophobicContact CB-CB 3.95Å; E563-H632 IonicContact OE2-CE1 3.92Å; E563-H632 IonicContact OE2-CG 2.62Å; E563-H632 IonicContact OE2-ND1 2.75Å; E563-H632 PolarHBondContact OE2-ND1 2.93Å; F594-H632 AromaticContact CE1-CE1 3.53Å; F594-H632 AromaticContact CE1-ND1 3.7Å; F594-H632 AromaticContact CZ-CE1 3.38Å; F594-H632 WeakPolarHBondContact CZ-CE1 3.49Å; F594-H632 AromaticContact CZ-ND1 3.93Å; F594-H632 AromaticContact CZ-NE2 4Å; L602-H632 HydrophobicContact CD1-CB 3.46Å; L602-H632 VanDerWaalsContact CD1-CB 3.46Å; Y630-H632 PolarHBondContact O-N 2.94Å; H632-E634 PolarHBondContact NE2-N 3.15Å
633	R	85.4	Confident	65.4	Low	217 Å²	217	117 Å²	117	82%	0.819	60%	0.604	S	S	*	*			trans	-108.3	106.7	173.2	-62.8	-177	-172.8	179	5	107.5	W631 P635	W631-R633 PolarHBondContact O-N 2.84Å; R633-P635 WeakPolarHBondContact O-CD 3.43Å
634	E	74	Confident	63	Low	122 Å²	122	116.1 Å²	116.1	57%	0.57	61%	0.606	S	S	*	*			trans	-56.2	122.9	168.9	-70.1	-179	166.9	0	0	108	K561 H632 S636	K561-E634 IonicContact NZ-OE1 2.88Å; K561-E634 PolarHBondContact NZ-OE1 3.38Å; H632-E634 PolarHBondContact NE2-N 3.15Å; E634-S636 PolarHBondContact O-N 3.04Å; E634-S636 VanDerWaalsContact O-N 3.1Å
635	P	55.7	Low	60.3	Low	108 Å²	108	119.5 Å²	119.5	70%	0.701	63%	0.629	S	S	*	*			trans	-67	113.8	176.8	26.5	-32.2	0	0	0	108.2	R633 T637	R633-P635 WeakPolarHBondContact O-CD 3.43Å; P635-T637 PolarHBondContact O-N 2.81Å
636	S	37.6	Very low	57.8	Low	107 Å²	107	114.7 Å²	114.7	75%	0.748	63%	0.63	S	S	*	*			trans	-56	108.9	175.7	-58.3	0	0	0	0	109.8	E634 N638	E634-S636 PolarHBondContact O-N 3.04Å; E634-S636 VanDerWaalsContact O-N 3.1Å; S636-N638 PolarHBondContact O-N 3.38Å
637	T	40.4	Very low	55.2	Low	142 Å²	142	110.4 Å²	110.4	87%	0.871	63%	0.633	S	S	*	*			trans	-73.7	70.8	178.6	44.9	0	0	0	0	111.4	P635	P635-T637 PolarHBondContact O-N 2.81Å
638	N	34.8	Very low	52.2	Low	134 Å²	134	114.8 Å²	114.8	72%	0.717	66%	0.664	S	S	*	*			trans	-128.1	113.3	172.8	-101.1	-27.4	0	0	0	109.5	S636	S636-N638 PolarHBondContact O-N 3.38Å
639	T	33.7	Very low	49.4	Very low	146 Å²	146	116.7 Å²	116.7	90%	0.896	68%	0.679	S	S	*	*			trans	62.7	139.4	168.9	51.3	0	0	0	0	117.5
640	A	33.9	Very low	46.5	Very low	105 Å²	105	118.3 Å²	118.3	87%	0.868	70%	0.702	S	S	*	*			trans	-93.8	158.6	-179.4	0	0	0	0	0	112.1
641	G	32.1	Very low	43.4	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	72%	0.715	S	S	*	*			trans	85.1	153.5	177.8	0	0	0	0	0	113.9
642	Q	34	Very low	40.3	Very low	194 Å²	194	118.7 Å²	118.7	91%	0.907	73%	0.731	S	S	*	*			cis	-157.4	170.9	-7.9	-159.8	166.5	5.8	0	0	109
643	E	27.7	Very low	37.6	Very low	149 Å²	149	123 Å²	123	70%	0.696	76%	0.763	S	S	*	*			trans	-58.4	146.7	174.9	-71.1	-135.2	116.4	0	0	113.8	T645	E643-T645 HydrophobicContact CB-CG2 4.35Å; E643-T645 PolarHBondContact O-N 2.9Å
644	P	31.3	Very low	35	Very low	130 Å²	130	119.4 Å²	119.4	84%	0.844	77%	0.765	S	S	*	*			trans	-86.3	73.3	163.3	36.1	-32.2	0	0	0	110.7
645	T	28.3	Very low	33.6	Very low	110 Å²	110	119.6 Å²	119.6	68%	0.675	78%	0.777	S	S	*	*			trans	-70.7	150	166.7	44.9	0	0	0	0	111	E643	E643-T645 HydrophobicContact CB-CG2 4.35Å; E643-T645 PolarHBondContact O-N 2.9Å
646	S	32.6	Very low	32.2	Very low	126 Å²	126	117.7 Å²	117.7	88%	0.881	78%	0.777	S	S	*	*			trans	-68	145.9	-178.8	-52.3	0	0	0	0	111.8
647	G	29.7	Very low	31.7	Very low	76 Å²	76	122.4 Å²	122.4	78%	0.784	79%	0.787	S	S	*	*			trans	-100.2	-172.9	-170.8	0	0	0	0	0	116.3
648	S	29.6	Very low	31.1	Very low	105 Å²	105	119.6 Å²	119.6	73%	0.734	79%	0.786	S	S	*	*			trans	102.6	85.5	161.9	-160.9	0	0	0	0	119.8
649	Q	30	Very low	30.8	Very low	182 Å²	182	121.4 Å²	121.4	85%	0.85	80%	0.795	S	S	*	*			trans	61.4	136.5	130.8	-58.2	-178.5	3.1	0	0	121.4
650	G	30.2	Very low	31.1	Very low	65 Å²	65	119.5 Å²	119.5	67%	0.67	79%	0.785	S	S	*	*			trans	-149.1	-53.4	-179.2	0	0	0	0	0	118
651	I	27.2	Very low	30.7	Very low	121 Å²	121	123 Å²	123	62%	0.621	78%	0.783	S	S	*	*			trans	75	126.7	173.4	-56.6	173.4	0	0	0	118.6	R432	R432-I651 HydrophobicContact CG-CD1 4.09Å
652	G	29.4	Very low	30.4	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	79%	0.789	S	S	*	*			trans	109.1	148.8	147.8	0	0	0	0	0	117.7
653	S	31.2	Very low	30.1	Very low	105 Å²	105	122.3 Å²	122.3	73%	0.734	78%	0.778	S	S	*	*			cis	-167.9	117.2	-12.8	-94.4	0	0	0	0	113.3
654	V	31.6	Very low	30.1	Very low	140 Å²	140	123.6 Å²	123.6	85%	0.848	79%	0.786	S	S	*	*			trans	48	172.7	151.3	-92.5	0	0	0	0	121.7
655	P	44.1	Very low	30.1	Very low	127 Å²	127	124.4 Å²	124.4	83%	0.825	78%	0.778	S	S	*	*			cis	-129.9	178.1	-34.1	36	-19.4	0	0	0	114.2
656	G	27.3	Very low	30.2	Very low	68 Å²	68	129.2 Å²	129.2	70%	0.701	79%	0.79	S	S	*	*			trans	151.6	79.7	164.8	0	0	0	0	0	114.4
657	Q	27.3	Very low	30	Very low	206 Å²	206	126.5 Å²	126.5	96%	0.963	78%	0.782	S	S	*	*				56.2	115.9	98.1	-69.7	-169	-14.1	0	0	116
658	G	27.6	Very low	30.1	Very low	83 Å²	83	131 Å²	131	86%	0.856	79%	0.786	S	S	*	*			trans	168.1	66.7	176.1	0	0	0	0	0	117.7
659	L	28.7	Very low	30	Very low	172 Å²	172	134.9 Å²	134.9	90%	0.901	79%	0.79	S	S	*	*			trans	-111.9	159.6	155.5	-78.9	165	0	0	0	107.1
660	P	38.6	Very low	30	Very low	105 Å²	105	133.2 Å²	133.2	68%	0.682	78%	0.782	S	S	*	*			cis	-138.9	178.6	15.1	40.3	-20.9	0	0	0	116.9
661	H	26	Very low	29.9	Very low	180 Å²	180	137.9 Å²	137.9	83%	0.833	79%	0.786	S	S	*	*			trans	44.6	127.7	144.6	-75.8	-140.6	0	0	0	122.4
662	S	25.9	Very low	30.4	Very low	125 Å²	125	137.3 Å²	137.3	87%	0.874	79%	0.793	S	S	*	*				179.7	173.1	105.3	50.4	0	0	0	0	113.8
663	N	27.2	Very low	30.7	Very low	128 Å²	128	138.8 Å²	138.8	68%	0.684	79%	0.791	S	S	*	*			trans	-109.1	152.2	-167.7	-92.1	-17	0	0	0	114.1
664	M	29.1	Very low	30.8	Very low	175 Å²	175	136.4 Å²	136.4	86%	0.862	78%	0.782	S	S	*	*			trans	-165.4	107.3	134.8	-133.1	67	75.1	0	0	108.5
665	H	31.6	Very low	30.6	Very low	147 Å²	147	134.3 Å²	134.3	68%	0.681	78%	0.779	S	S	*	*				46.9	128.8	88	-73.5	-111.3	0	0	0	114.2
666	K	28.6	Very low	29.8	Very low	211 Å²	211	138.3 Å²	138.3	92%	0.917	78%	0.78	S	S	*	*			cis	-146.8	162.3	28.8	-55.9	164.4	-173.6	168.2	0	110.3
667	G	29.6	Very low	29.9	Very low	70 Å²	70	141.5 Å²	141.5	72%	0.722	79%	0.785	S	S	*	*			cis	167.6	-170.8	-4.7	0	0	0	0	0	114
668	I	30.5	Very low	29.8	Very low	170 Å²	170	138.4 Å²	138.4	87%	0.872	78%	0.775	S	S	*	*			trans	78	87	165.4	-47.6	-178.7	0	0	0	118.8
669	K	29.4	Very low	29.8	Very low	187 Å²	187	140.8 Å²	140.8	81%	0.813	77%	0.768	S	S	*	*			trans	-12.3	163.5	140.4	-64.2	175.3	-178.8	179.2	0	120.2
670	Q	28.9	Very low	29.6	Very low	147 Å²	147	141.3 Å²	141.3	69%	0.687	76%	0.763	S	S	*	*			cis	179.8	161.6	-27.8	-152.7	176.7	1.5	0	0	109.8
671	H	28.8	Very low	29	Very low	163 Å²	163	142.7 Å²	142.7	76%	0.755	77%	0.77	S	S	*	*			trans	70.1	132.4	161.2	-76	-71.8	0	0	0	121.7
672	S	36.4	Very low	29.2	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	77%	0.769	S	S	*	*			trans	-80.3	153.9	157.6	-33.8	0	0	0	0	110.9
673	P	36.7	Very low	29.6	Very low	98 Å²	98	140.5 Å²	140.5	64%	0.636	77%	0.766	S	S	*	*				-148.8	152.1	86.1	38.7	-22	0	0	0	115.5
674	G	32.1	Very low	29.5	Very low	54 Å²	54	143 Å²	143	56%	0.557	77%	0.77	S	S	*	*			trans	-94.6	160.6	-179.6	0	0	0	0	0	116.3	K730	G674-K730 PolarHBondContact O-NZ 3.31Å
675	A	28.3	Very low	29.4	Very low	96 Å²	96	143 Å²	143	79%	0.793	77%	0.767	S	S	*	*			trans	-152.9	164.3	165.1	0	0	0	0	0	111.8
676	Y	28.1	Very low	29.2	Very low	212 Å²	212	142.5 Å²	142.5	83%	0.831	77%	0.765	S	S	*	*			trans	-70.4	161.4	-171.7	-53.6	-98.7	0	0	0	115.2
677	V	28	Very low	29.1	Very low	135 Å²	135	138.6 Å²	138.6	82%	0.818	75%	0.754	S	S	*	*				165.9	112.4	113.9	160.7	0	0	0	0	113.9
678	L	26.8	Very low	29	Very low	141 Å²	141	142.4 Å²	142.4	74%	0.738	76%	0.758	S	S	*	*			trans	51.1	120.3	133	-158.6	66.7	0	0	0	124.7
679	N	26.1	Very low	28.9	Very low	133 Å²	133	139.1 Å²	139.1	71%	0.711	76%	0.756	S	S	*	*			trans	68.1	157.1	152.8	-67.4	-9	0	0	0	118.3
680	K	24.4	Very low	29	Very low	182 Å²	182	134.7 Å²	134.7	79%	0.791	75%	0.754	S	S	*	*			cis	-164.7	-175.3	34	-146	161.9	-174.3	177.8	0	113.5
681	T	27.4	Very low	29.5	Very low	135 Å²	135	133.8 Å²	133.8	83%	0.828	76%	0.761	S	S	*	*			trans	78.4	140.2	156	41.3	0	0	0	0	123
682	V	28.8	Very low	29.5	Very low	135 Å²	135	129.4 Å²	129.4	82%	0.818	76%	0.76	S	S	*	*			trans	-119.2	148.6	172.7	169.8	0	0	0	0	108.9
683	P	35.2	Very low	29.1	Very low	124 Å²	124	130.7 Å²	130.7	81%	0.805	76%	0.763	S	S	*	*			trans	-97	103.3	178.6	5.4	15.9	0	0	0	115.1
684	K	24.3	Very low	28.9	Very low	181 Å²	181	131.9 Å²	131.9	79%	0.787	77%	0.769	S	S	*	*				40.6	108.7	123.2	-169.2	-175.5	-178.1	-175.8	0	121.8
685	H	28.2	Very low	28.7	Very low	173 Å²	173	136.7 Å²	136.7	80%	0.801	78%	0.78	S	S	*	*				-168.9	125.5	127.4	-120.8	-99.9	0	0	0	107.4
686	H	26.4	Very low	28.9	Very low	137 Å²	137	135.8 Å²	135.8	63%	0.634	77%	0.773	S	S	*	*			cis	94.2	98.6	31.8	-166.6	-80	0	0	0	114.7
687	L	27.7	Very low	28.9	Very low	130 Å²	130	131.2 Å²	131.2	68%	0.681	77%	0.767	S	S	*	*				179.8	141.6	128.9	-95.8	168.8	0	0	0	112.6
688	N	25.9	Very low	29	Very low	150 Å²	150	133.2 Å²	133.2	80%	0.802	77%	0.765	S	S	*	*			trans	49.5	145.6	157.1	-57.8	-4	0	0	0	120.4
689	A	28.2	Very low	29	Very low	101 Å²	101	132.2 Å²	132.2	84%	0.835	77%	0.765	S	S	*	*			cis	-141.8	-174.2	18.5	0	0	0	0	0	113
690	A	32.4	Very low	29.1	Very low	94 Å²	94	133.1 Å²	133.1	78%	0.777	77%	0.77	S	S	*	*			trans	-127	-160.1	-170.1	0	0	0	0	0	113.9
691	P	40.5	Very low	29.2	Very low	128 Å²	128	127 Å²	127	83%	0.831	76%	0.758	S	S	*	*				-91.6	177.7	-126.5	40.8	-29.7	0	0	0	114.9
692	G	28.1	Very low	29.3	Very low	71 Å²	71	129 Å²	129	73%	0.732	76%	0.76	S	S	*	*			cis	133.3	125.9	-2	0	0	0	0	0	112.7
693	T	27	Very low	29.3	Very low	134 Å²	134	129.9 Å²	129.9	82%	0.822	76%	0.76	S	S	*	*			trans	-140.2	130	-170.2	-56.5	0	0	0	0	113.5
694	T	32.9	Very low	30.4	Very low	124 Å²	124	128.6 Å²	128.6	76%	0.761	75%	0.752	S	S	*	*			trans	-10.1	159.7	161.3	66.6	0	0	0	0	120.6
695	I	29.1	Very low	30.7	Very low	154 Å²	154	127.8 Å²	127.8	79%	0.79	76%	0.756	S	S	*	*			cis	-149.1	155.7	32.8	-68.7	174.8	0	0	0	111.9
696	A	31.3	Very low	30.9	Very low	77 Å²	77	125.2 Å²	125.2	64%	0.636	76%	0.758	S	S	*	*			trans	5	165.1	157.1	0	0	0	0	0	123.3
697	T	28.3	Very low	31.1	Very low	116 Å²	116	126.3 Å²	126.3	71%	0.712	77%	0.768	S	S	*	*			cis	-164.7	156.2	33.5	-19.9	0	0	0	0	114.7
698	K	29.5	Very low	31.2	Very low	177 Å²	177	124.3 Å²	124.3	77%	0.77	77%	0.771	S	S	*	*			trans	70.7	113.7	144.1	-90.1	172.9	-176.1	-179.4	0	123.2
699	T	28.3	Very low	31.3	Very low	120 Å²	120	124.6 Å²	124.6	74%	0.736	77%	0.771	S	S	*	*				58.1	137.3	127.1	54.9	0	0	0	0	121.2
700	N	26.5	Very low	31.3	Very low	152 Å²	152	125.4 Å²	125.4	81%	0.813	77%	0.766	S	S	*	*			cis	-145.8	152	19.4	-99.5	-20.5	0	0	0	113.2
701	G	27.2	Very low	31.2	Very low	53 Å²	53	127.7 Å²	127.7	55%	0.546	77%	0.77	S	S	.	*			trans	-103.5	-153	150.5	0	0	0	0	0	109.8
702	M	29.8	Very low	30.8	Very low	177 Å²	177	125.4 Å²	125.4	87%	0.872	76%	0.762	S	S	*	*			cis	-153.3	139.8	4.1	-84.1	90.1	170.2	0	0	107.3
703	N	28.9	Very low	31.7	Very low	154 Å²	154	128 Å²	128	82%	0.824	77%	0.766	S	S	*	*				80.9	-174.2	92.7	-138	24	0	0	0	114
704	P	57.7	Low	31.9	Very low	98 Å²	98	127.1 Å²	127.1	64%	0.636	76%	0.756	S	S	*	*				-134.6	-171.7	-112	45.5	-27.4	0	0	0	117.7
705	N	31.8	Very low	31.9	Very low	163 Å²	163	126.7 Å²	126.7	87%	0.872	75%	0.754	S	S	*	*			trans	0.2	138.3	159.6	-69.4	8.7	0	0	0	121.7
706	S	32	Very low	32.1	Very low	119 Å²	119	126.2 Å²	126.2	83%	0.832	75%	0.748	S	S	*	*				-160.1	166.9	128.5	54.2	0	0	0	0	112
707	D	31.1	Very low	32.1	Very low	160 Å²	160	131.3 Å²	131.3	86%	0.856	76%	0.756	S	S	*	*			trans	-85.2	161.1	-167.9	-52.4	-100.1	0	0	0	116
708	A	29.3	Very low	32.1	Very low	88 Å²	88	129 Å²	129	73%	0.727	76%	0.755	S	S	*	*				155.7	155.7	109.6	0	0	0	0	0	117.5
709	L	28.7	Very low	32.8	Very low	157 Å²	157	126 Å²	126	82%	0.822	75%	0.754	S	S	*	*			trans	76.5	125.8	148.9	-102.8	82.7	0	0	0	125.1
710	T	27.4	Very low	32.8	Very low	117 Å²	117	130.2 Å²	130.2	72%	0.718	76%	0.757	S	S	*	*			trans	83.8	126.1	136.5	40.6	0	0	0	0	126.5
711	V	29.6	Very low	33.1	Very low	142 Å²	142	128.5 Å²	128.5	86%	0.861	75%	0.753	S	S	*	*			trans	79	143	141.7	175.9	0	0	0	0	120.5
712	A	32.5	Very low	34	Very low	81 Å²	81	131.2 Å²	131.2	67%	0.669	76%	0.761	S	S	*	*			trans	-129.3	170.9	-179.9	0	0	0	0	0	111.5
713	P	47.7	Very low	34.1	Very low	124 Å²	124	129.1 Å²	129.1	81%	0.805	76%	0.758	S	S	*	*				-132.8	136.6	104.1	7.5	14.9	0	0	0	113.7
714	N	30.3	Very low	34.2	Very low	116 Å²	116	125.8 Å²	125.8	62%	0.62	75%	0.752	S	S	*	*				65.6	106.2	94.3	-162.8	27.7	0	0	0	114.4
715	T	32.3	Very low	33.1	Very low	116 Å²	116	125.4 Å²	125.4	71%	0.712	76%	0.757	S	S	*	*				-165	128.5	84.8	25.3	0	0	0	0	110.9
716	Q	33.9	Very low	33.3	Very low	143 Å²	143	127.1 Å²	127.1	67%	0.668	76%	0.757	S	S	*	*				64.3	128.8	91.7	-74.5	-162.3	21.3	0	0	114.9
717	K	30.8	Very low	33.3	Very low	185 Å²	185	125.9 Å²	125.9	80%	0.804	75%	0.748	S	S	*	*			cis	-146	167.1	12.6	-57.8	-177	177.9	174.1	0	112.7
718	G	29.4	Very low	33.5	Very low	67 Å²	67	123.6 Å²	123.6	69%	0.691	74%	0.744	S	S	*	*			trans	-81.2	-161.5	163.4	0	0	0	0	0	113.4
719	P	42.9	Very low	34	Very low	115 Å²	115	123.1 Å²	123.1	75%	0.747	74%	0.736	S	S	*	*			cis	-145.2	151.8	47.5	34.5	-12.6	0	0	0	119.9
720	Y	28.9	Very low	34.7	Very low	207 Å²	207	122.4 Å²	122.4	81%	0.812	73%	0.726	S	S	*	*			trans	44	114.2	133.1	-58.2	-53.9	0	0	0	121.9
721	T	33	Very low	35.2	Very low	117 Å²	117	122.4 Å²	122.4	72%	0.718	73%	0.731	S	S	*	*				73.4	164.3	75.4	61	0	0	0	0	114.8
722	P	46.7	Very low	35.5	Very low	110 Å²	110	124.4 Å²	124.4	71%	0.714	74%	0.736	S	S	*	*			cis	-115	160.3	5.7	5.8	21.9	0	0	0	115.5
723	T	32.1	Very low	35.9	Very low	133 Å²	133	124 Å²	124	82%	0.816	74%	0.74	S	S	*	*				72.4	133.3	76.7	-41.4	0	0	0	0	112.6
724	A	31	Very low	35.9	Very low	84 Å²	84	127 Å²	127	69%	0.694	74%	0.74	S	S	*	*			cis	-152.5	173.2	20.3	0	0	0	0	0	114.8
725	A	33.5	Very low	36.9	Very low	90 Å²	90	127.1 Å²	127.1	74%	0.744	75%	0.745	S	S	*	*			trans	43.1	153.1	140.2	0	0	0	0	0	122.1
726	K	36.3	Very low	37.9	Very low	199 Å²	199	124 Å²	124	87%	0.865	74%	0.735	S	S	*	*			cis	-175.3	169.9	-7.5	-104.4	178.2	179	178.8	0	106.3
727	S	32.6	Very low	38.9	Very low	93 Å²	93	125 Å²	125	65%	0.65	74%	0.738	S	S	*	*			cis	-179.9	140.1	-37.8	54.4	0	0	0	0	110.1
728	S	35.4	Very low	40.1	Very low	111 Å²	111	120.7 Å²	120.7	78%	0.776	73%	0.726	S	S	*	*			trans	73.2	148.4	168.9	-161.1	0	0	0	0	117.4
729	S	38.8	Very low	41.5	Very low	78 Å²	78	122.7 Å²	122.7	55%	0.545	72%	0.721	S	S	.	*			cis	-166.3	168.8	-28.4	58	0	0	0	0	113
730	K	44.3	Very low	42.8	Very low	142 Å²	142	123.6 Å²	123.6	62%	0.617	72%	0.715	S	S	*	*			trans	56.7	118.5	155.7	-75.8	-172.9	169.8	-172	0	123.4	G674	G674-K730 PolarHBondContact O-NZ 3.31Å
731	S	36.5	Very low	45	Very low	117 Å²	117	117.9 Å²	117.9	82%	0.818	70%	0.702	S	S	*	*				-174.9	123.3	114	31.8	0	0	0	0	109.5
732	L	37.4	Very low	47	Very low	184 Å²	184	118.1 Å²	118.1	96%	0.963	70%	0.695	S	S	*	*				71.2	110.2	87.6	-161.3	74.9	0	0	0	114.5
733	G	39	Very low	48.6	Very low	73 Å²	73	117.8 Å²	117.8	75%	0.753	68%	0.683	S	S	*	*			trans	161.5	54.1	177.6	0	0	0	0	0	115
734	K	48.9	Very low	50.9	Low	188 Å²	188	114.2 Å²	114.2	82%	0.817	67%	0.667	S	S	*	*			trans	-156.1	46.9	-172.8	-141.5	157.6	-173.3	172.8	0	117.2
735	T	51.3	Low	53.5	Low	118 Å²	118	114.5 Å²	114.5	72%	0.724	66%	0.657	S	S	*	*	S	Bend	trans	-100.1	-43.4	177.6	44.5	0	0	0	0	114.2	K737 V738	T735-K737 PolarHBondContact O-N 2.75Å; T735-V738 PolarHBondContact O-N 2.9Å
736	G	52.4	Low	56.1	Low	49 Å²	49	116 Å²	116	51%	0.505	65%	0.646	S	S	.	*	H	α-helix	trans	-57.3	-44	-172.5	0	0	0	0	0	115.5	V738 L739 E740	G736-V738 PolarHBondContact O-N 3.02Å; G736-L739 PolarHBondContact O-N 2.88Å; G736-E740 PolarHBondContact O-N 3.05Å
737	K	55	Low	58.4	Low	166 Å²	166	112.1 Å²	112.1	72%	0.722	63%	0.629	S	S	*	*	H	α-helix	trans	-70.3	-11.9	-176.1	-63.6	-166.3	176.9	-168.4	0	115	T735 V741	T735-K737 PolarHBondContact O-N 2.75Å; K737-V741 WeakPolarHBondContact O-CG2 3.43Å
738	V	56.3	Low	61	Low	93 Å²	93	115.3 Å²	115.3	56%	0.564	63%	0.632	S	S	*	*	H	α-helix	trans	-84	-41.9	175.4	-179.8	0	0	0	0	110.1	T735 G736 V741 Q742	T735-V738 PolarHBondContact O-N 2.9Å; G736-V738 PolarHBondContact O-N 3.02Å; V738-V741 PolarHBondContact O-N 2.91Å; V738-Q742 WeakPolarHBondContact O-CB 3.36Å; V738-Q742 PolarHBondContact O-N 3.26Å
739	L	59.6	Low	63.5	Low	109 Å²	109	115.8 Å²	115.8	57%	0.571	62%	0.622	S	S	*	*	H	α-helix	trans	-64.3	-43.3	178.5	-63.1	173.6	0	0	0	111.6	G736 V741 Q742 E743	G736-L739 PolarHBondContact O-N 2.88Å; L739-V741 VanDerWaalsContact C-N 3.31Å; L739-V741 PolarHBondContact O-N 3.34Å; L739-Q742 PolarHBondContact O-N 3.16Å; L739-Q742 VanDerWaalsContact O-N 3.15Å; L739-E743 WeakPolarHBondContact O-CB 3.47Å; L739-E743 PolarHBondContact O-N 3.41Å
740	E	68.9	Low	66	Low	134 Å²	134	116.4 Å²	116.4	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-59.5	-39.4	176.9	-171.8	179.2	-168.8	0	0	112.4	G736 A744	G736-E740 PolarHBondContact O-N 3.05Å; E740-A744 WeakPolarHBondContact O-CB 3.4Å; E740-A744 PolarHBondContact O-N 2.89Å
741	V	76.6	Confident	67.9	Low	88 Å²	88	112.4 Å²	112.4	53%	0.533	61%	0.609	S	S	.	*	H	α-helix	trans	-71.4	-39	175.3	172.3	0	0	0	0	111.5	K737 V738 L739 A744 I745	K737-V741 WeakPolarHBondContact O-CG2 3.43Å; V738-V741 PolarHBondContact O-N 2.91Å; L739-V741 VanDerWaalsContact C-N 3.31Å; L739-V741 PolarHBondContact O-N 3.34Å; V741-A744 PolarHBondContact O-N 3.29Å; V741-I745 HydrophobicContact CG1-CD1 4.09Å; V741-I745 VanDerWaalsContact O-CG1 3.31Å; V741-I745 WeakPolarHBondContact O-CG1 3.45Å; V741-I745 PolarHBondContact O-N 2.94Å
742	Q	75	Confident	70.5	Confident	122 Å²	122	111.8 Å²	111.8	57%	0.57	60%	0.595	S	S	*	*	H	α-helix	trans	-65.3	-39.4	176.2	-167	174.7	15.6	0	0	111.6	V738 L739 I745 K746	V738-Q742 WeakPolarHBondContact O-CB 3.36Å; V738-Q742 PolarHBondContact O-N 3.26Å; L739-Q742 PolarHBondContact O-N 3.16Å; L739-Q742 VanDerWaalsContact O-N 3.15Å; Q742-I745 PolarHBondContact O-N 3.07Å; Q742-K746 PolarHBondContact O-N 3Å
743	E	80.6	Confident	73.1	Confident	102 Å²	102	109.2 Å²	109.2	48%	0.477	58%	0.576	S	S	.	*	H	α-helix	trans	-67.8	-39.2	174.4	-161.9	-168.6	147	0	0	111.7	L739 I745 K746 K747	L739-E743 WeakPolarHBondContact O-CB 3.47Å; L739-E743 PolarHBondContact O-N 3.41Å; E743-I745 VanDerWaalsContact C-N 3.33Å; E743-I745 PolarHBondContact O-N 2.62Å; E743-K746 PolarHBondContact O-N 3.45Å; E743-K747 HydrophobicContact CG-CD 4.34Å; E743-K747 WeakPolarHBondContact O-CB 3.37Å; E743-K747 WeakPolarHBondContact O-CG 3.38Å; E743-K747 PolarHBondContact O-N 3.01Å; E743-K747 WeakPolarHBondContact OE1-CE 3.41Å; E743-K747 IonicContact OE1-NZ 2.82Å; E743-K747 PolarHBondContact OE1-NZ 3.02Å
744	A	80.3	Confident	75.6	Confident	58 Å²	58	111.1 Å²	111.1	48%	0.479	57%	0.568	S	S	.	*	H	α-helix	trans	-63.3	-37.4	172.7	0	0	0	0	0	112.5	E740 V741 K748	E740-A744 WeakPolarHBondContact O-CB 3.4Å; E740-A744 PolarHBondContact O-N 2.89Å; V741-A744 PolarHBondContact O-N 3.29Å; A744-K748 WeakPolarHBondContact O-CB 3.38Å; A744-K748 PolarHBondContact O-N 3.26Å
745	I	84.6	Confident	77.5	Confident	91 Å²	91	107.3 Å²	107.3	47%	0.467	55%	0.553	S	S	.	*	H	α-helix	trans	-65.5	-45.4	172.5	-69.5	163.9	0	0	0	110.5	V741 Q742 E743 K748 Q749	V741-I745 HydrophobicContact CG1-CD1 4.09Å; V741-I745 VanDerWaalsContact O-CG1 3.31Å; V741-I745 WeakPolarHBondContact O-CG1 3.45Å; V741-I745 PolarHBondContact O-N 2.94Å; Q742-I745 PolarHBondContact O-N 3.07Å; E743-I745 VanDerWaalsContact C-N 3.33Å; E743-I745 PolarHBondContact O-N 2.62Å; I745-K748 WeakPolarHBondContact O-CB 3.43Å; I745-K748 PolarHBondContact O-N 3.37Å; I745-Q749 WeakPolarHBondContact O-CG 3.38Å; I745-Q749 PolarHBondContact O-N 3.37Å
746	K	87.4	Confident	79.4	Confident	121 Å²	121	106 Å²	106	53%	0.526	54%	0.539	S	S	.	.	H	α-helix	trans	-61.3	-47.7	177.3	-170.2	175.1	-175.6	-86.8	0	111.7	Q742 E743 K748 Q749 E750	Q742-K746 PolarHBondContact O-N 3Å; E743-K746 PolarHBondContact O-N 3.45Å; K746-K748 VanDerWaalsContact C-N 3.28Å; K746-K748 PolarHBondContact O-N 2.89Å; K746-Q749 WeakPolarHBondContact O-CB 3.35Å; K746-Q749 PolarHBondContact O-N 2.94Å; K746-E750 WeakPolarHBondContact CE-OE1 3.43Å; K746-E750 IonicContact NZ-OE1 2.68Å; K746-E750 PolarHBondContact NZ-OE1 3.27Å; K746-E750 WeakPolarHBondContact O-CG 3.43Å; K746-E750 PolarHBondContact O-N 3.39Å
747	K	85.5	Confident	81.2	Confident	118 Å²	118	106.5 Å²	106.5	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-59.8	-34.7	174.1	-77.3	170.5	168.4	168.9	0	112.6	E743 A751	E743-K747 HydrophobicContact CG-CD 4.34Å; E743-K747 WeakPolarHBondContact O-CB 3.37Å; E743-K747 WeakPolarHBondContact O-CG 3.38Å; E743-K747 PolarHBondContact O-N 3.01Å; E743-K747 WeakPolarHBondContact OE1-CE 3.41Å; E743-K747 IonicContact OE1-NZ 2.82Å; E743-K747 PolarHBondContact OE1-NZ 3.02Å; K747-A751 VanDerWaalsContact O-CB 3.25Å; K747-A751 WeakPolarHBondContact O-CB 3.43Å; K747-A751 PolarHBondContact O-N 3.06Å
748	K	87.8	Confident	82.9	Confident	160 Å²	160	103.8 Å²	103.8	70%	0.696	52%	0.521	S	S	*	.	H	α-helix	trans	-70.2	-36.4	173.3	-172	178.3	179.5	-177.4	0	112.7	A744 I745 K746 M752	A744-K748 WeakPolarHBondContact O-CB 3.38Å; A744-K748 PolarHBondContact O-N 3.26Å; I745-K748 WeakPolarHBondContact O-CB 3.43Å; I745-K748 PolarHBondContact O-N 3.37Å; K746-K748 VanDerWaalsContact C-N 3.28Å; K746-K748 PolarHBondContact O-N 2.89Å; K748-M752 WeakPolarHBondContact O-CB 3.43Å; K748-M752 PolarHBondContact O-N 3.2Å
749	Q	88.3	Confident	84.3	Confident	121 Å²	121	105.9 Å²	105.9	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-68.1	-44.1	172.9	-71.7	173.1	-19.8	0	0	111.5	I745 K746 M752 K753	I745-Q749 WeakPolarHBondContact O-CG 3.38Å; I745-Q749 PolarHBondContact O-N 3.37Å; K746-Q749 WeakPolarHBondContact O-CB 3.35Å; K746-Q749 PolarHBondContact O-N 2.94Å; Q749-M752 PolarHBondContact O-N 2.9Å; Q749-K753 WeakPolarHBondContact O-CB 3.12Å; Q749-K753 PolarHBondContact O-N 3.03Å
750	E	89.8	Confident	85.9	Confident	90 Å²	90	105.7 Å²	105.7	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-62.3	-43.1	175.7	-71.8	166.4	173.2	0	0	111.5	K746 K753 L754	K746-E750 WeakPolarHBondContact CE-OE1 3.43Å; K746-E750 IonicContact NZ-OE1 2.68Å; K746-E750 PolarHBondContact NZ-OE1 3.27Å; K746-E750 WeakPolarHBondContact O-CG 3.43Å; K746-E750 PolarHBondContact O-N 3.39Å; E750-K753 PolarHBondContact O-N 2.82Å; E750-L754 WeakPolarHBondContact O-CB 3.49Å; E750-L754 PolarHBondContact O-N 3.05Å
751	A	85.5	Confident	86.9	Confident	59 Å²	59	105.8 Å²	105.8	49%	0.488	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-38	173.2	0	0	0	0	0	112.9	K747 Q755	K747-A751 VanDerWaalsContact O-CB 3.25Å; K747-A751 WeakPolarHBondContact O-CB 3.43Å; K747-A751 PolarHBondContact O-N 3.06Å; A751-Q755 WeakPolarHBondContact O-CB 3.39Å; A751-Q755 PolarHBondContact O-N 3.07Å
752	M	89.4	Confident	87.4	Confident	104 Å²	104	105.1 Å²	105.1	51%	0.512	50%	0.502	S	S	.	.	H	α-helix	trans	-65.5	-43.3	173.8	-167.4	-155.4	-58.8	0	0	111.2	K748 Q749 Q755 Q756	K748-M752 WeakPolarHBondContact O-CB 3.43Å; K748-M752 PolarHBondContact O-N 3.2Å; Q749-M752 PolarHBondContact O-N 2.9Å; M752-Q755 PolarHBondContact O-N 3.37Å; M752-Q756 WeakPolarHBondContact O-CG 3.13Å; M752-Q756 PolarHBondContact O-N 3.03Å
753	K	93.9	Very high	88.1	Confident	129 Å²	129	104 Å²	104	56%	0.561	50%	0.497	S	S	*	.	H	α-helix	trans	-60.7	-47.9	175.8	-175.8	-176.2	174.4	-172.4	0	110.8	Q749 E750 Q755 Q756 D757	Q749-K753 WeakPolarHBondContact O-CB 3.12Å; Q749-K753 PolarHBondContact O-N 3.03Å; E750-K753 PolarHBondContact O-N 2.82Å; K753-Q755 VanDerWaalsContact C-N 3.27Å; K753-Q755 PolarHBondContact O-N 2.89Å; K753-Q756 CarbonylContact O-C 3.59Å; K753-Q756 WeakPolarHBondContact O-CA 3.5Å; K753-Q756 WeakPolarHBondContact O-CB 3.45Å; K753-Q756 PolarHBondContact O-N 2.7Å; K753-D757 WeakPolarHBondContact CE-OD2 3.19Å; K753-D757 WeakPolarHBondContact CG-OD2 3.39Å; K753-D757 PolarHBondContact O-N 2.99Å
754	L	91	Very high	88.7	Confident	114 Å²	114	105 Å²	105	60%	0.597	50%	0.501	S	S	*	.	H	α-helix	trans	-58.2	-39.2	175.2	-175.4	63.9	0	0	0	111.9	E750 D757 M758	E750-L754 WeakPolarHBondContact O-CB 3.49Å; E750-L754 PolarHBondContact O-N 3.05Å; L754-D757 PolarHBondContact O-N 3.21Å; L754-M758 WeakPolarHBondContact O-CB 3.23Å; L754-M758 VanDerWaalsContact O-CG 3.32Å; L754-M758 WeakPolarHBondContact O-CG 3.37Å; L754-M758 PolarHBondContact O-N 3.15Å
755	Q	87.9	Confident	89.2	Confident	107 Å²	107	106.5 Å²	106.5	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-68.7	-32.2	174.8	-156.7	-167.2	51	0	0	112.8	A751 M752 K753 R759	A751-Q755 WeakPolarHBondContact O-CB 3.39Å; A751-Q755 PolarHBondContact O-N 3.07Å; M752-Q755 PolarHBondContact O-N 3.37Å; K753-Q755 VanDerWaalsContact C-N 3.27Å; K753-Q755 PolarHBondContact O-N 2.89Å; Q755-R759 VanDerWaalsContact CD-NH1 3.27Å; Q755-R759 WeakPolarHBondContact O-CG 3.37Å; Q755-R759 PolarHBondContact O-N 3.17Å
756	Q	90.8	Very high	89.6	Confident	92 Å²	92	102.8 Å²	102.8	43%	0.43	48%	0.48	S	S	.	.	H	α-helix	trans	-69.8	-45	171.1	-70.5	-177.9	8	0	0	111.5	M752 K753 M758 R759 K760	M752-Q756 WeakPolarHBondContact O-CG 3.13Å; M752-Q756 PolarHBondContact O-N 3.03Å; K753-Q756 CarbonylContact O-C 3.59Å; K753-Q756 WeakPolarHBondContact O-CA 3.5Å; K753-Q756 WeakPolarHBondContact O-CB 3.45Å; K753-Q756 PolarHBondContact O-N 2.7Å; Q756-M758 VanDerWaalsContact C-N 3.35Å; Q756-M758 PolarHBondContact O-N 2.94Å; Q756-R759 CarbonylContact O-C 3.47Å; Q756-R759 WeakPolarHBondContact O-CA 3.25Å; Q756-R759 WeakPolarHBondContact O-CB 3.48Å; Q756-R759 PolarHBondContact O-N 3.35Å; Q756-K760 WeakPolarHBondContact O-CG 3.33Å; Q756-K760 PolarHBondContact O-N 3.16Å
757	D	90.9	Very high	89.8	Confident	58 Å²	58	104.1 Å²	104.1	31%	0.31	49%	0.486	S	S	.	.	H	α-helix	trans	-69.1	-34	-177.3	-65.4	-22	0	0	0	111.4	K753 L754 K760 K761	K753-D757 WeakPolarHBondContact CE-OD2 3.19Å; K753-D757 WeakPolarHBondContact CG-OD2 3.39Å; K753-D757 PolarHBondContact O-N 2.99Å; L754-D757 PolarHBondContact O-N 3.21Å; D757-K760 PolarHBondContact O-N 2.85Å; D757-K760 WeakPolarHBondContact OD1-CE 3.48Å; D757-K760 IonicContact OD1-NZ 2.85Å; D757-K760 PolarHBondContact OD1-NZ 3.11Å; D757-K761 WeakPolarHBondContact O-CB 3.4Å; D757-K761 PolarHBondContact O-N 3.48Å
758	M	90.4	Very high	90.2	Very high	110 Å²	110	101.8 Å²	101.8	54%	0.542	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-38.5	166.9	-75.2	-64.4	-68.7	0	0	113	L754 Q756 K762	L754-M758 WeakPolarHBondContact O-CB 3.23Å; L754-M758 VanDerWaalsContact O-CG 3.32Å; L754-M758 WeakPolarHBondContact O-CG 3.37Å; L754-M758 PolarHBondContact O-N 3.15Å; Q756-M758 VanDerWaalsContact C-N 3.35Å; Q756-M758 PolarHBondContact O-N 2.94Å; M758-K762 PolarHBondContact O-N 2.89Å; M758-K762 VanDerWaalsContact O-N 3.07Å
759	R	86.2	Confident	90.3	Very high	136 Å²	136	95.9 Å²	95.9	51%	0.513	46%	0.457	S	S	.	.	H	α-helix	trans	-66.8	-41.7	173.6	-76.5	179.6	-178.5	110.9	-1.8	111.8	Q755 Q756 K762 Q763	Q755-R759 VanDerWaalsContact CD-NH1 3.27Å; Q755-R759 WeakPolarHBondContact O-CG 3.37Å; Q755-R759 PolarHBondContact O-N 3.17Å; Q756-R759 CarbonylContact O-C 3.47Å; Q756-R759 WeakPolarHBondContact O-CA 3.25Å; Q756-R759 WeakPolarHBondContact O-CB 3.48Å; Q756-R759 PolarHBondContact O-N 3.35Å; R759-K762 PolarHBondContact O-N 3.06Å; R759-Q763 WeakPolarHBondContact O-CG 3.48Å; R759-Q763 PolarHBondContact O-N 2.7Å
760	K	93.3	Very high	90.6	Very high	106 Å²	106	92.3 Å²	92.3	46%	0.461	44%	0.441	S	S	.	.	H	α-helix	trans	-59.8	-48.4	174.2	-67.6	170.9	-163.6	161.6	0	110.8	Q756 D757 K762 Q763 E764	Q756-K760 WeakPolarHBondContact O-CG 3.33Å; Q756-K760 PolarHBondContact O-N 3.16Å; D757-K760 PolarHBondContact O-N 2.85Å; D757-K760 WeakPolarHBondContact OD1-CE 3.48Å; D757-K760 IonicContact OD1-NZ 2.85Å; D757-K760 PolarHBondContact OD1-NZ 3.11Å; K760-K762 VanDerWaalsContact C-N 3.32Å; K760-K762 PolarHBondContact O-N 3.39Å; K760-Q763 CarbonylContact O-C 3.59Å; K760-Q763 WeakPolarHBondContact O-CA 3.32Å; K760-Q763 WeakPolarHBondContact O-CB 3.42Å; K760-Q763 PolarHBondContact O-N 3.22Å; K760-E764 WeakPolarHBondContact O-CB 3.34Å; K760-E764 PolarHBondContact O-N 3.03Å
761	K	90.4	Very high	90.7	Very high	135 Å²	135	94.4 Å²	94.4	59%	0.587	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-36.2	178.7	-168.9	170.4	-176.2	174.2	0	112.7	D757 M765	D757-K761 WeakPolarHBondContact O-CB 3.4Å; D757-K761 PolarHBondContact O-N 3.48Å; K761-M765 WeakPolarHBondContact O-CB 3.29Å; K761-M765 PolarHBondContact O-N 3.01Å
762	K	86	Confident	90.8	Very high	75 Å²	75	94.9 Å²	94.9	33%	0.326	45%	0.45	S	S	.	.	H	α-helix	trans	-67.3	-42	170.5	-74.1	-159.2	179.5	-161.6	0	112.8	M758 R759 K760 E764 M765 L766 E811	M758-K762 PolarHBondContact O-N 2.89Å; M758-K762 VanDerWaalsContact O-N 3.07Å; R759-K762 PolarHBondContact O-N 3.06Å; K760-K762 VanDerWaalsContact C-N 3.32Å; K760-K762 PolarHBondContact O-N 3.39Å; K762-E764 VanDerWaalsContact C-N 3.33Å; K762-E764 PolarHBondContact O-N 3.43Å; K762-M765 PolarHBondContact O-N 3.29Å; K762-L766 WeakPolarHBondContact O-CB 3.47Å; K762-L766 PolarHBondContact O-N 3.44Å; K762-E811 IonicContact NZ-OE2 3.86Å; K762-E811 PolarHBondContact NZ-OE2 3.42Å
763	Q	89.4	Confident	90.9	Very high	98 Å²	98	91.7 Å²	91.7	46%	0.458	43%	0.434	S	S	.	.	H	α-helix	trans	-64	-37.3	175.3	-75.7	175.6	-13.3	0	0	112.6	R759 K760 K767 M812	R759-Q763 WeakPolarHBondContact O-CG 3.48Å; R759-Q763 PolarHBondContact O-N 2.7Å; K760-Q763 CarbonylContact O-C 3.59Å; K760-Q763 WeakPolarHBondContact O-CA 3.32Å; K760-Q763 WeakPolarHBondContact O-CB 3.42Å; K760-Q763 PolarHBondContact O-N 3.22Å; Q763-K767 WeakPolarHBondContact O-CB 3.42Å; Q763-K767 VanDerWaalsContact O-CG 3.3Å; Q763-K767 WeakPolarHBondContact O-CG 3.3Å; Q763-K767 PolarHBondContact O-N 3.34Å; Q763-M812 HydrophobicContact CG-SD 3.63Å
764	E	94	Very high	90.7	Very high	124 Å²	124	92 Å²	92	58%	0.579	44%	0.435	S	S	*	.	H	α-helix	trans	-67	-47.8	175.9	-174.5	176	-164.8	0	0	111.5	K760 K762 L766 K767 T768	K760-E764 WeakPolarHBondContact O-CB 3.34Å; K760-E764 PolarHBondContact O-N 3.03Å; K762-E764 VanDerWaalsContact C-N 3.33Å; K762-E764 PolarHBondContact O-N 3.43Å; E764-L766 VanDerWaalsContact C-N 3.29Å; E764-L766 PolarHBondContact O-N 2.84Å; E764-K767 WeakPolarHBondContact O-CB 3.39Å; E764-K767 PolarHBondContact O-N 3.45Å; E764-K767 VanDerWaalsContact O-N 3.12Å; E764-T768 PolarHBondContact O-N 2.86Å; E764-T768 PolarHBondContact O-OG1 3.39Å
765	M	91.3	Very high	90.8	Very high	89 Å²	89	89.5 Å²	89.5	44%	0.438	43%	0.431	S	S	.	.	H	α-helix	trans	-59.4	-37.9	173.6	-172.7	-173.6	-69.6	0	0	112.6	K761 K762 T768 Q769 L808	K761-M765 WeakPolarHBondContact O-CB 3.29Å; K761-M765 PolarHBondContact O-N 3.01Å; K762-M765 PolarHBondContact O-N 3.29Å; M765-T768 PolarHBondContact O-OG1 3.1Å; M765-T768 VanDerWaalsContact O-OG1 3.11Å; M765-Q769 WeakPolarHBondContact O-CG 3.22Å; M765-Q769 PolarHBondContact O-N 2.94Å; M765-L808 HydrophobicContact CB-CD1 4.29Å; M765-L808 HydrophobicContact CG-CD1 3.69Å; M765-L808 HydrophobicContact SD-CD1 3.8Å; M765-L808 HydrophobicContact SD-CD2 4.11Å
766	L	92.2	Very high	90.8	Very high	12 Å²	12	86.3 Å²	86.3	6%	0.063	42%	0.417	C	S	.	.	H	α-helix	trans	-68.8	-40.1	174.3	177.5	60.9	0	0	0	111.9	K762 E764 Q769 I770 I805 L808 Q809 M812	K762-L766 WeakPolarHBondContact O-CB 3.47Å; K762-L766 PolarHBondContact O-N 3.44Å; E764-L766 VanDerWaalsContact C-N 3.29Å; E764-L766 PolarHBondContact O-N 2.84Å; L766-Q769 PolarHBondContact O-N 2.92Å; L766-I770 HydrophobicContact CD1-CD1 3.91Å; L766-I770 HydrophobicContact CD1-CG1 4.28Å; L766-I770 HydrophobicContact CG-CD1 3.9Å; L766-I770 VanDerWaalsContact O-CG1 3.29Å; L766-I770 WeakPolarHBondContact O-CG1 3.36Å; L766-I770 PolarHBondContact O-N 3.27Å; L766-I805 HydrophobicContact CD1-CB 4.42Å; L766-I805 HydrophobicContact CD1-CG1 4.44Å; L766-I805 HydrophobicContact CD1-CG2 4.03Å; L766-L808 HydrophobicContact CB-CD1 4.49Å; L766-L808 HydrophobicContact CD1-CB 4.09Å; L766-Q809 HydrophobicContact CD1-CG 3.88Å; L766-Q809 HydrophobicContact CD2-CG 3.79Å; L766-Q809 HydrophobicContact CG-CG 4.5Å; L766-M812 HydrophobicContact CD2-CE 3.41Å; L766-M812 VanDerWaalsContact CD2-CE 3.41Å; L766-M812 HydrophobicContact CD2-SD 3.84Å
767	K	91.8	Very high	90.7	Very high	149 Å²	149	84.9 Å²	84.9	65%	0.648	41%	0.412	S	S	*	.	H	α-helix	trans	-61.2	-47.8	175.8	-79.2	173.3	178.8	-176	0	111.7	Q763 E764 Q769 I770 E771	Q763-K767 WeakPolarHBondContact O-CB 3.42Å; Q763-K767 VanDerWaalsContact O-CG 3.3Å; Q763-K767 WeakPolarHBondContact O-CG 3.3Å; Q763-K767 PolarHBondContact O-N 3.34Å; E764-K767 WeakPolarHBondContact O-CB 3.39Å; E764-K767 PolarHBondContact O-N 3.45Å; E764-K767 VanDerWaalsContact O-N 3.12Å; K767-Q769 PolarHBondContact O-N 2.63Å; K767-I770 PolarHBondContact O-N 3.36Å; K767-E771 WeakPolarHBondContact O-CB 3.35Å; K767-E771 PolarHBondContact O-N 3.04Å
768	T	92.9	Very high	90.7	Very high	69 Å²	69	85.2 Å²	85.2	42%	0.423	41%	0.413	S	S	.	.	H	α-helix	trans	-65.4	-37.6	-179.9	54.1	0	0	0	0	112	E764 M765 E771 C772	E764-T768 PolarHBondContact O-N 2.86Å; E764-T768 PolarHBondContact O-OG1 3.39Å; M765-T768 PolarHBondContact O-OG1 3.1Å; M765-T768 VanDerWaalsContact O-OG1 3.11Å; T768-E771 PolarHBondContact O-N 2.9Å; T768-C772 PolarHBondContact O-N 2.93Å; T768-C772 PolarHBondContact O-SG 3.46Å
769	Q	91.1	Very high	90.5	Very high	36 Å²	36	86.6 Å²	86.6	17%	0.168	41%	0.413	C	S	.	.	H	α-helix	trans	-62.7	-43.8	172	-73.3	-174.8	7.3	0	0	112.8	M765 L766 K767 E771 C772 Q773 K804 I805	M765-Q769 WeakPolarHBondContact O-CG 3.22Å; M765-Q769 PolarHBondContact O-N 2.94Å; L766-Q769 PolarHBondContact O-N 2.92Å; K767-Q769 PolarHBondContact O-N 2.63Å; Q769-E771 VanDerWaalsContact C-N 3.28Å; Q769-E771 PolarHBondContact O-N 2.9Å; Q769-C772 PolarHBondContact O-N 3.43Å; Q769-Q773 WeakPolarHBondContact O-CB 3.14Å; Q769-Q773 PolarHBondContact O-N 3.47Å; Q769-K804 VanDerWaalsContact OE1-C 3.24Å; Q769-K804 PolarHBondContact OE1-O 2.91Å; Q769-I805 HydrophobicContact CB-CD1 4.25Å; Q769-I805 HydrophobicContact CB-CG1 3.72Å
770	I	93.3	Very high	90.4	Very high	47 Å²	47	81.6 Å²	81.6	24%	0.241	40%	0.396	C	S	.	.	H	α-helix	trans	-63.3	-35.9	175.5	-69.7	166.9	0	0	0	111.1	L766 K767 Q773 K774 I805	L766-I770 HydrophobicContact CD1-CD1 3.91Å; L766-I770 HydrophobicContact CD1-CG1 4.28Å; L766-I770 HydrophobicContact CG-CD1 3.9Å; L766-I770 VanDerWaalsContact O-CG1 3.29Å; L766-I770 WeakPolarHBondContact O-CG1 3.36Å; L766-I770 PolarHBondContact O-N 3.27Å; K767-I770 PolarHBondContact O-N 3.36Å; I770-Q773 PolarHBondContact O-N 2.87Å; I770-K774 HydrophobicContact CG2-CD 4.24Å; I770-K774 WeakPolarHBondContact O-CB 3.29Å; I770-K774 VanDerWaalsContact O-CG 3.3Å; I770-K774 WeakPolarHBondContact O-CG 3.45Å; I770-K774 PolarHBondContact O-N 2.67Å; I770-I805 HydrophobicContact CG1-CD1 3.9Å; I770-I805 HydrophobicContact CG1-CG1 4.12Å; I770-I805 HydrophobicContact CG1-CG2 4.14Å
771	E	93.1	Very high	90.1	Very high	133 Å²	133	82.2 Å²	82.2	62%	0.621	40%	0.4	S	S	*	.	H	α-helix	trans	-67.5	-45.5	175.7	-173.4	166.3	-160.9	0	0	111.9	K767 T768 Q769 Q773 K774 A775	K767-E771 WeakPolarHBondContact O-CB 3.35Å; K767-E771 PolarHBondContact O-N 3.04Å; T768-E771 PolarHBondContact O-N 2.9Å; Q769-E771 VanDerWaalsContact C-N 3.28Å; Q769-E771 PolarHBondContact O-N 2.9Å; E771-Q773 VanDerWaalsContact C-N 3.34Å; E771-Q773 PolarHBondContact O-N 3.38Å; E771-K774 PolarHBondContact O-N 2.86Å; E771-A775 WeakPolarHBondContact O-CB 3.45Å; E771-A775 PolarHBondContact O-N 3.25Å
772	C	87.8	Confident	89.9	Confident	69 Å²	69	83.1 Å²	83.1	47%	0.466	40%	0.404	S	S	.	.	H	α-helix	trans	-59.4	-42.3	171.8	-66	0	0	0	0	112.2	T768 Q769 A775 L776 L801	T768-C772 PolarHBondContact O-N 2.93Å; T768-C772 PolarHBondContact O-SG 3.46Å; Q769-C772 PolarHBondContact O-N 3.43Å; C772-A775 PolarHBondContact O-N 2.96Å; C772-L776 WeakPolarHBondContact O-CG 3.34Å; C772-L776 PolarHBondContact O-N 3.36Å; C772-L801 HydrophobicContact CB-CD1 4.12Å
773	Q	90.1	Very high	89.5	Confident	38 Å²	38	83.2 Å²	83.2	18%	0.178	41%	0.408	C	S	.	.	H	α-helix	trans	-60.8	-46.6	175.6	-169.3	-163.4	33.8	0	0	110.9	Q769 I770 E771 L776 I777 L798 T802 I805	Q769-Q773 WeakPolarHBondContact O-CB 3.14Å; Q769-Q773 PolarHBondContact O-N 3.47Å; I770-Q773 PolarHBondContact O-N 2.87Å; E771-Q773 VanDerWaalsContact C-N 3.34Å; E771-Q773 PolarHBondContact O-N 3.38Å; Q773-L776 PolarHBondContact O-N 3.47Å; Q773-I777 HydrophobicContact CG-CD1 4.2Å; Q773-I777 WeakPolarHBondContact O-CG1 3.37Å; Q773-I777 PolarHBondContact O-N 2.75Å; Q773-L798 HydrophobicContact CB-CD2 4.5Å; Q773-L798 HydrophobicContact CG-CD2 3.8Å; Q773-L798 WeakPolarHBondContact O-CD2 3.44Å; Q773-T802 PolarHBondContact NE2-OG1 3.11Å; Q773-I805 HydrophobicContact CB-CD1 3.84Å; Q773-I805 HydrophobicContact CG-CD1 4.16Å
774	K	91.5	Very high	88.9	Confident	136 Å²	136	89.1 Å²	89.1	59%	0.591	43%	0.426	S	S	*	.	H	α-helix	trans	-62.3	-41.9	175.8	-75.9	174.5	178.2	-176	0	112.7	I770 E771 L776 I777 N778	I770-K774 HydrophobicContact CG2-CD 4.24Å; I770-K774 WeakPolarHBondContact O-CB 3.29Å; I770-K774 VanDerWaalsContact O-CG 3.3Å; I770-K774 WeakPolarHBondContact O-CG 3.45Å; I770-K774 PolarHBondContact O-N 2.67Å; E771-K774 PolarHBondContact O-N 2.86Å; K774-L776 VanDerWaalsContact C-N 3.34Å; K774-L776 PolarHBondContact O-N 2.89Å; K774-I777 PolarHBondContact O-N 3.13Å; K774-N778 WeakPolarHBondContact O-CB 3.33Å; K774-N778 PolarHBondContact O-N 2.89Å
775	A	91.6	Very high	88.1	Confident	60 Å²	60	88.1 Å²	88.1	50%	0.496	44%	0.439	S	S	.	.	H	α-helix	trans	-62.5	-40.5	177.7	0	0	0	0	0	112	E771 C772 N778 R779	E771-A775 WeakPolarHBondContact O-CB 3.45Å; E771-A775 PolarHBondContact O-N 3.25Å; C772-A775 PolarHBondContact O-N 2.96Å; A775-N778 PolarHBondContact O-N 2.88Å; A775-R779 WeakPolarHBondContact O-CB 3.49Å; A775-R779 PolarHBondContact O-N 2.92Å
776	L	87.9	Confident	87.4	Confident	40 Å²	40	85.7 Å²	85.7	21%	0.209	43%	0.427	C	S	.	.	H	α-helix	trans	-71.3	-38.3	176.4	-71	175.8	0	0	0	113	C772 Q773 K774 R779 L780 I794 L798 L801	C772-L776 WeakPolarHBondContact O-CG 3.34Å; C772-L776 PolarHBondContact O-N 3.36Å; Q773-L776 PolarHBondContact O-N 3.47Å; K774-L776 VanDerWaalsContact C-N 3.34Å; K774-L776 PolarHBondContact O-N 2.89Å; L776-R779 PolarHBondContact O-N 3.12Å; L776-L780 PolarHBondContact O-N 3.06Å; L776-I794 HydrophobicContact CB-CG2 4.06Å; L776-I794 HydrophobicContact CD2-CG2 4.14Å; L776-L798 HydrophobicContact CB-CD1 4.48Å; L776-L798 HydrophobicContact CB-CD2 3.63Å; L776-L798 HydrophobicContact CB-CG 3.99Å; L776-L798 HydrophobicContact CD1-CD2 4.42Å; L776-L801 HydrophobicContact CD1-CD1 3.67Å
777	I	89.1	Confident	87.2	Confident	63 Å²	63	91.1 Å²	91.1	32%	0.323	45%	0.45	S	S	.	.	H	α-helix	trans	-58.6	-50.6	169.9	-70.7	164.6	0	0	0	109.6	Q773 K774 R779 L780 E781 L798	Q773-I777 HydrophobicContact CG-CD1 4.2Å; Q773-I777 WeakPolarHBondContact O-CG1 3.37Å; Q773-I777 PolarHBondContact O-N 2.75Å; K774-I777 PolarHBondContact O-N 3.13Å; I777-R779 VanDerWaalsContact C-N 3.26Å; I777-R779 PolarHBondContact O-N 3.47Å; I777-L780 WeakPolarHBondContact O-CB 3.15Å; I777-L780 PolarHBondContact O-N 3.09Å; I777-E781 HydrophobicContact CG2-CG 4.21Å; I777-E781 WeakPolarHBondContact CG2-OE1 3.32Å; I777-E781 WeakPolarHBondContact O-CG 3.49Å; I777-E781 PolarHBondContact O-N 3.45Å; I777-L798 HydrophobicContact CD1-CD2 4.47Å; I777-L798 HydrophobicContact CG1-CD1 4.02Å; I777-L798 HydrophobicContact CG1-CD2 3.83Å
778	N	91.3	Very high	86.9	Confident	65 Å²	65	89.1 Å²	89.1	35%	0.348	45%	0.453	S	S	.	.	H	α-helix	trans	-63.9	-31.7	-178.6	-159.1	-112.8	0	0	0	112.6	K774 A775 K782	K774-N778 WeakPolarHBondContact O-CB 3.33Å; K774-N778 PolarHBondContact O-N 2.89Å; A775-N778 PolarHBondContact O-N 2.88Å; N778-K782 WeakPolarHBondContact O-CB 3.5Å; N778-K782 WeakPolarHBondContact O-CG 3.44Å; N778-K782 PolarHBondContact O-N 2.79Å; N778-K782 WeakPolarHBondContact OD1-CD 3.2Å; N778-K782 WeakPolarHBondContact OD1-CE 3.42Å; N778-K782 PolarHBondContact OD1-NZ 2.96Å
779	R	86.1	Confident	86.5	Confident	139 Å²	139	92.7 Å²	92.7	53%	0.525	47%	0.465	S	S	.	.	H	α-helix	trans	-67.4	-38.8	172.1	-172.6	173.1	179.7	163.6	-0.3	112.3	A775 L776 I777 N783	A775-R779 WeakPolarHBondContact O-CB 3.49Å; A775-R779 PolarHBondContact O-N 2.92Å; L776-R779 PolarHBondContact O-N 3.12Å; I777-R779 VanDerWaalsContact C-N 3.26Å; I777-R779 PolarHBondContact O-N 3.47Å; R779-N783 WeakPolarHBondContact O-CB 3.38Å; R779-N783 PolarHBondContact O-N 3.02Å; R779-N783 PolarHBondContact O-ND2 3.44Å
780	L	84.4	Confident	86.2	Confident	30 Å²	30	94.1 Å²	94.1	16%	0.157	47%	0.471	C	S	.	.	H	α-helix	trans	-68.3	-40.6	172.9	-74.5	-177.2	0	0	0	112.7	L776 I777 R791 I794 M795 L798	L776-L780 PolarHBondContact O-N 3.06Å; I777-L780 WeakPolarHBondContact O-CB 3.15Å; I777-L780 PolarHBondContact O-N 3.09Å; L780-R791 HydrophobicContact CD2-CG 4.03Å; L780-I794 HydrophobicContact CD1-CG2 3.9Å; L780-I794 HydrophobicContact CD2-CB 3.91Å; L780-I794 HydrophobicContact CD2-CD1 4.14Å; L780-I794 HydrophobicContact CD2-CG2 3.82Å; L780-I794 HydrophobicContact CG-CB 4.27Å; L780-I794 HydrophobicContact CG-CG2 3.61Å; L780-M795 HydrophobicContact CD1-CG 4.08Å; L780-M795 HydrophobicContact CD1-SD 3.59Å; L780-M795 VanDerWaalsContact CD1-SD 3.59Å; L780-L798 HydrophobicContact CD1-CD1 3.56Å
781	E	86	Confident	85.9	Confident	119 Å²	119	98.7 Å²	98.7	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-67.2	-46.9	-178.4	-71.7	171.2	155.4	0	0	111.9	I777	I777-E781 HydrophobicContact CG2-CG 4.21Å; I777-E781 WeakPolarHBondContact CG2-OE1 3.32Å; I777-E781 WeakPolarHBondContact O-CG 3.49Å; I777-E781 PolarHBondContact O-N 3.45Å
782	K	86	Confident	85.7	Confident	154 Å²	154	95 Å²	95	67%	0.67	48%	0.478	S	S	*	.	H	α-helix	trans	-70.4	-36.6	179.5	-74	173.6	172.5	163.8	0	113	N778	N778-K782 WeakPolarHBondContact O-CB 3.5Å; N778-K782 WeakPolarHBondContact O-CG 3.44Å; N778-K782 PolarHBondContact O-N 2.79Å; N778-K782 WeakPolarHBondContact OD1-CD 3.2Å; N778-K782 WeakPolarHBondContact OD1-CE 3.42Å; N778-K782 PolarHBondContact OD1-NZ 2.96Å
783	N	77.8	Confident	85.9	Confident	78 Å²	78	96.7 Å²	96.7	42%	0.417	48%	0.482	S	S	.	.			trans	-106.6	63.3	-175.1	-52.8	-82.4	0	0	0	111.3	R779 A785 M786	R779-N783 WeakPolarHBondContact O-CB 3.38Å; R779-N783 PolarHBondContact O-N 3.02Å; R779-N783 PolarHBondContact O-ND2 3.44Å; N783-A785 PolarHBondContact O-N 3.28Å; N783-M786 HydrophobicContact CB-CG 3.44Å; N783-M786 VanDerWaalsContact CB-CG 3.44Å; N783-M786 HydrophobicContact CB-SD 3.9Å; N783-M786 WeakPolarHBondContact O-CG 3.41Å; N783-M786 PolarHBondContact O-N 3.13Å; N783-M786 VanDerWaalsContact O-N 3.15Å
784	R	76.5	Confident	85.8	Confident	222 Å²	222	95.7 Å²	95.7	84%	0.838	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-19.1	176.9	-91.5	-177.3	168.9	-178.4	-3	114.6
785	A	77.8	Confident	85.7	Confident	103 Å²	103	93.5 Å²	93.5	85%	0.851	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	13	-180	0	0	0	0	0	114.9	N783	N783-A785 PolarHBondContact O-N 3.28Å
786	M	78.1	Confident	85.8	Confident	38 Å²	38	96.7 Å²	96.7	19%	0.187	47%	0.474	C	S	.	.	S	Bend	trans	-58.1	149	172.7	-68.1	-81	-68.2	0	0	111.7	N783 E790 I794	N783-M786 HydrophobicContact CB-CG 3.44Å; N783-M786 VanDerWaalsContact CB-CG 3.44Å; N783-M786 HydrophobicContact CB-SD 3.9Å; N783-M786 WeakPolarHBondContact O-CG 3.41Å; N783-M786 PolarHBondContact O-N 3.13Å; N783-M786 VanDerWaalsContact O-N 3.15Å; M786-E790 HydrophobicContact CE-CB 3.81Å; M786-E790 WeakPolarHBondContact CE-OE2 3.48Å; M786-I794 HydrophobicContact CE-CD1 3.86Å
787	K	87.2	Confident	85.9	Confident	125 Å²	125	97.4 Å²	97.4	54%	0.543	48%	0.48	S	S	.	.			trans	-55.1	145.6	174.1	-60.4	-168.2	-159.4	115.7	0	111	E789 E790 R791	K787-E789 PolarHBondContact O-N 2.96Å; K787-E790 HydrophobicContact CB-CB 4.42Å; K787-E790 HydrophobicContact CB-CG 4.12Å; K787-E790 WeakPolarHBondContact CD-OE1 3.48Å; K787-E790 WeakPolarHBondContact CE-OE1 3.34Å; K787-E790 IonicContact NZ-OE1 3.53Å; K787-E790 PolarHBondContact NZ-OE1 2.8Å; K787-E790 PolarHBondContact O-N 3.45Å; K787-R791 WeakPolarHBondContact O-CB 3.3Å; K787-R791 PolarHBondContact O-N 3.43Å
788	P	84.6	Confident	86.1	Confident	108 Å²	108	95.2 Å²	95.2	70%	0.701	47%	0.469	S	S	*	.	H	α-helix	trans	-60.1	-34.5	-176	23.2	-33.7	0	0	0	112.9	A792	P788-A792 VanDerWaalsContact O-CB 3.31Å; P788-A792 WeakPolarHBondContact O-CB 3.48Å; P788-A792 PolarHBondContact O-N 3.03Å
789	E	85.4	Confident	86.2	Confident	144 Å²	144	99.3 Å²	99.3	67%	0.673	48%	0.483	S	S	*	.	H	α-helix	trans	-66.8	-47	176.3	-61.7	173.1	170.3	0	0	112.2	K787 R791 A792 N793	K787-E789 PolarHBondContact O-N 2.96Å; E789-R791 VanDerWaalsContact C-N 3.32Å; E789-R791 PolarHBondContact O-N 2.68Å; E789-A792 PolarHBondContact O-N 2.78Å; E789-N793 WeakPolarHBondContact O-CB 3.26Å; E789-N793 VanDerWaalsContact O-CG 3.32Å; E789-N793 PolarHBondContact O-N 2.94Å; E789-N793 PolarHBondContact O-ND2 3.13Å
790	E	84.8	Confident	86.6	Confident	65 Å²	65	95.7 Å²	95.7	30%	0.304	47%	0.473	S	S	.	.	H	α-helix	trans	-63.6	-40.3	176.7	-62	172.1	-151.6	0	0	110.7	M786 K787 N793 I794	M786-E790 HydrophobicContact CE-CB 3.81Å; M786-E790 WeakPolarHBondContact CE-OE2 3.48Å; K787-E790 HydrophobicContact CB-CB 4.42Å; K787-E790 HydrophobicContact CB-CG 4.12Å; K787-E790 WeakPolarHBondContact CD-OE1 3.48Å; K787-E790 WeakPolarHBondContact CE-OE1 3.34Å; K787-E790 IonicContact NZ-OE1 3.53Å; K787-E790 PolarHBondContact NZ-OE1 2.8Å; K787-E790 PolarHBondContact O-N 3.45Å; E790-N793 PolarHBondContact O-N 3.4Å; E790-I794 VanDerWaalsContact O-CG1 3.32Å; E790-I794 WeakPolarHBondContact O-CG1 3.15Å; E790-I794 PolarHBondContact O-N 3.16Å
791	R	86.4	Confident	86.9	Confident	143 Å²	143	95.7 Å²	95.7	54%	0.54	47%	0.473	S	S	.	.	H	α-helix	trans	-63.6	-40.6	173	-178.3	172	177.4	-176.1	-3.7	112.1	L780 K787 E789 M795	L780-R791 HydrophobicContact CD2-CG 4.03Å; K787-R791 WeakPolarHBondContact O-CB 3.3Å; K787-R791 PolarHBondContact O-N 3.43Å; E789-R791 VanDerWaalsContact C-N 3.32Å; E789-R791 PolarHBondContact O-N 2.68Å; R791-M795 WeakPolarHBondContact O-CB 3.37Å; R791-M795 VanDerWaalsContact O-CG 3.25Å; R791-M795 WeakPolarHBondContact O-CG 3.11Å; R791-M795 PolarHBondContact O-N 3.35Å
792	A	89.4	Confident	87.2	Confident	57 Å²	57	92.9 Å²	92.9	47%	0.471	46%	0.463	S	S	.	.	H	α-helix	trans	-65.6	-41.8	175.2	0	0	0	0	0	111.8	P788 E789 M795 K796	P788-A792 VanDerWaalsContact O-CB 3.31Å; P788-A792 WeakPolarHBondContact O-CB 3.48Å; P788-A792 PolarHBondContact O-N 3.03Å; E789-A792 PolarHBondContact O-N 2.78Å; A792-M795 CarbonylContact O-C 3.52Å; A792-M795 PolarHBondContact O-N 2.84Å; A792-K796 PolarHBondContact O-N 2.85Å
793	N	91.6	Very high	87.5	Confident	103 Å²	103	92 Å²	92	55%	0.551	46%	0.461	S	S	*	.	H	α-helix	trans	-63.8	-43.2	175.9	-73.7	-27.7	0	0	0	112	E789 E790 K796 T797	E789-N793 WeakPolarHBondContact O-CB 3.26Å; E789-N793 VanDerWaalsContact O-CG 3.32Å; E789-N793 PolarHBondContact O-N 2.94Å; E789-N793 PolarHBondContact O-ND2 3.13Å; E790-N793 PolarHBondContact O-N 3.4Å; N793-K796 WeakPolarHBondContact O-CB 3.46Å; N793-K796 PolarHBondContact O-N 2.95Å; N793-T797 PolarHBondContact O-N 3.36Å; N793-T797 PolarHBondContact O-OG1 3.09Å
794	I	89.1	Confident	88.1	Confident	17 Å²	17	92.5 Å²	92.5	9%	0.087	46%	0.46	C	S	.	.	H	α-helix	trans	-66.2	-40.2	174.5	-62.2	163.2	0	0	0	110.8	L776 L780 M786 E790 K796 T797 L798	L776-I794 HydrophobicContact CB-CG2 4.06Å; L776-I794 HydrophobicContact CD2-CG2 4.14Å; L780-I794 HydrophobicContact CD1-CG2 3.9Å; L780-I794 HydrophobicContact CD2-CB 3.91Å; L780-I794 HydrophobicContact CD2-CD1 4.14Å; L780-I794 HydrophobicContact CD2-CG2 3.82Å; L780-I794 HydrophobicContact CG-CB 4.27Å; L780-I794 HydrophobicContact CG-CG2 3.61Å; M786-I794 HydrophobicContact CE-CD1 3.86Å; E790-I794 VanDerWaalsContact O-CG1 3.32Å; E790-I794 WeakPolarHBondContact O-CG1 3.15Å; E790-I794 PolarHBondContact O-N 3.16Å; I794-K796 VanDerWaalsContact C-N 3.29Å; I794-K796 PolarHBondContact O-N 3.08Å; I794-T797 WeakPolarHBondContact CA-OG1 3.49Å; I794-T797 PolarHBondContact O-N 3.18Å; I794-T797 PolarHBondContact O-OG1 2.93Å; I794-L798 HydrophobicContact CG2-CD1 4.2Å; I794-L798 HydrophobicContact CG2-CG 4.4Å; I794-L798 WeakPolarHBondContact O-CB 3.46Å; I794-L798 WeakPolarHBondContact O-CG 3.4Å; I794-L798 PolarHBondContact O-N 2.68Å
795	M	88.1	Confident	88.8	Confident	90 Å²	90	82.3 Å²	82.3	44%	0.443	42%	0.422	S	S	.	.	H	α-helix	trans	-63.4	-31.2	173.1	-75	-65.4	-63.9	0	0	113.2	L780 R791 A792 L798 K799	L780-M795 HydrophobicContact CD1-CG 4.08Å; L780-M795 HydrophobicContact CD1-SD 3.59Å; L780-M795 VanDerWaalsContact CD1-SD 3.59Å; R791-M795 WeakPolarHBondContact O-CB 3.37Å; R791-M795 VanDerWaalsContact O-CG 3.25Å; R791-M795 WeakPolarHBondContact O-CG 3.11Å; R791-M795 PolarHBondContact O-N 3.35Å; A792-M795 CarbonylContact O-C 3.52Å; A792-M795 PolarHBondContact O-N 2.84Å; M795-L798 HydrophobicContact SD-CD1 4.45Å; M795-K799 WeakPolarHBondContact O-CG 3.3Å; M795-K799 PolarHBondContact O-N 3.41Å
796	K	94.1	Very high	89.4	Confident	128 Å²	128	80.4 Å²	80.4	56%	0.557	40%	0.4	S	S	*	.	H	α-helix	trans	-69.1	-52.9	173.2	-170.2	-167.3	177.9	-159.8	0	111	A792 N793 I794 L798 K799 E800	A792-K796 PolarHBondContact O-N 2.85Å; N793-K796 WeakPolarHBondContact O-CB 3.46Å; N793-K796 PolarHBondContact O-N 2.95Å; I794-K796 VanDerWaalsContact C-N 3.29Å; I794-K796 PolarHBondContact O-N 3.08Å; K796-L798 VanDerWaalsContact C-N 3.26Å; K796-L798 PolarHBondContact O-N 2.93Å; K796-K799 WeakPolarHBondContact O-CB 3.29Å; K796-K799 PolarHBondContact O-N 2.9Å; K796-E800 WeakPolarHBondContact CE-OE1 3.07Å; K796-E800 IonicContact NZ-OE1 2.8Å; K796-E800 PolarHBondContact O-N 3.36Å
797	T	90.1	Very high	90	Very high	55 Å²	55	84.1 Å²	84.1	34%	0.337	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-32.1	178.3	56.6	0	0	0	0	112.7	N793 I794 E800 L801	N793-T797 PolarHBondContact O-N 3.36Å; N793-T797 PolarHBondContact O-OG1 3.09Å; I794-T797 WeakPolarHBondContact CA-OG1 3.49Å; I794-T797 PolarHBondContact O-N 3.18Å; I794-T797 PolarHBondContact O-OG1 2.93Å; T797-E800 PolarHBondContact O-N 3.35Å; T797-L801 WeakPolarHBondContact O-CB 3.35Å; T797-L801 WeakPolarHBondContact O-CG 3.37Å; T797-L801 PolarHBondContact O-N 2.95Å
798	L	93.4	Very high	89.9	Confident	16 Å²	16	79.1 Å²	79.1	8%	0.084	40%	0.396	C	S	.	.	H	α-helix	trans	-64.4	-39.9	170.8	-80.1	175.1	0	0	0	113.1	Q773 L776 I777 L780 I794 M795 K796 T802	Q773-L798 HydrophobicContact CB-CD2 4.5Å; Q773-L798 HydrophobicContact CG-CD2 3.8Å; Q773-L798 WeakPolarHBondContact O-CD2 3.44Å; L776-L798 HydrophobicContact CB-CD1 4.48Å; L776-L798 HydrophobicContact CB-CD2 3.63Å; L776-L798 HydrophobicContact CB-CG 3.99Å; L776-L798 HydrophobicContact CD1-CD2 4.42Å; I777-L798 HydrophobicContact CD1-CD2 4.47Å; I777-L798 HydrophobicContact CG1-CD1 4.02Å; I777-L798 HydrophobicContact CG1-CD2 3.83Å; L780-L798 HydrophobicContact CD1-CD1 3.56Å; I794-L798 HydrophobicContact CG2-CD1 4.2Å; I794-L798 HydrophobicContact CG2-CG 4.4Å; I794-L798 WeakPolarHBondContact O-CB 3.46Å; I794-L798 WeakPolarHBondContact O-CG 3.4Å; I794-L798 PolarHBondContact O-N 2.68Å; M795-L798 HydrophobicContact SD-CD1 4.45Å; K796-L798 VanDerWaalsContact C-N 3.26Å; K796-L798 PolarHBondContact O-N 2.93Å; L798-T802 WeakPolarHBondContact O-CB 3.16Å; L798-T802 PolarHBondContact O-N 3.05Å; L798-T802 PolarHBondContact O-OG1 3.31Å
799	K	93.6	Very high	89.9	Confident	151 Å²	151	77.4 Å²	77.4	66%	0.657	38%	0.379	S	S	*	.	H	α-helix	trans	-63.8	-48.9	173.4	-72.6	174.7	179	-176	0	111	M795 K796 L801 T802 E803	M795-K799 WeakPolarHBondContact O-CG 3.3Å; M795-K799 PolarHBondContact O-N 3.41Å; K796-K799 WeakPolarHBondContact O-CB 3.29Å; K796-K799 PolarHBondContact O-N 2.9Å; K799-L801 VanDerWaalsContact C-N 3.34Å; K799-L801 PolarHBondContact O-N 3.43Å; K799-T802 WeakPolarHBondContact O-CB 3.43Å; K799-T802 PolarHBondContact O-N 3.47Å; K799-T802 VanDerWaalsContact O-N 3.1Å; K799-E803 PolarHBondContact O-N 2.95Å
800	E	94	Very high	89.9	Confident	64 Å²	64	74.7 Å²	74.7	30%	0.299	37%	0.369	S	S	.	.	H	α-helix	trans	-60.6	-39.3	178.2	-66.8	177.3	-153.4	0	0	112.9	K796 T797 K804	K796-E800 WeakPolarHBondContact CE-OE1 3.07Å; K796-E800 IonicContact NZ-OE1 2.8Å; K796-E800 PolarHBondContact O-N 3.36Å; T797-E800 PolarHBondContact O-N 3.35Å; E800-K804 VanDerWaalsContact O-CD 3.29Å; E800-K804 WeakPolarHBondContact O-CD 3.22Å; E800-K804 VanDerWaalsContact O-CG 3.22Å; E800-K804 WeakPolarHBondContact O-CG 3.44Å; E800-K804 PolarHBondContact O-N 3.22Å; E800-K804 IonicContact OE2-NZ 2.66Å
801	L	90.6	Very high	89.7	Confident	30 Å²	30	76.3 Å²	76.3	16%	0.157	38%	0.376	C	S	.	.	H	α-helix	trans	-69.3	-37.7	173.3	-76.2	173.1	0	0	0	111.9	C772 L776 T797 K799 E803 K804 I805	C772-L801 HydrophobicContact CB-CD1 4.12Å; L776-L801 HydrophobicContact CD1-CD1 3.67Å; T797-L801 WeakPolarHBondContact O-CB 3.35Å; T797-L801 WeakPolarHBondContact O-CG 3.37Å; T797-L801 PolarHBondContact O-N 2.95Å; K799-L801 VanDerWaalsContact C-N 3.34Å; K799-L801 PolarHBondContact O-N 3.43Å; L801-E803 VanDerWaalsContact C-N 3.3Å; L801-E803 PolarHBondContact O-N 3.17Å; L801-K804 PolarHBondContact O-N 3.44Å; L801-I805 VanDerWaalsContact O-CB 3.29Å; L801-I805 WeakPolarHBondContact O-CB 3.46Å; L801-I805 WeakPolarHBondContact O-CD1 3.24Å; L801-I805 WeakPolarHBondContact O-CG1 3.35Å; L801-I805 PolarHBondContact O-N 3.43Å
802	T	92.1	Very high	89.4	Confident	59 Å²	59	73 Å²	73	36%	0.362	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-39.9	176	-54.7	0	0	0	0	111	Q773 L798 K799 I805 T806	Q773-T802 PolarHBondContact NE2-OG1 3.11Å; L798-T802 WeakPolarHBondContact O-CB 3.16Å; L798-T802 PolarHBondContact O-N 3.05Å; L798-T802 PolarHBondContact O-OG1 3.31Å; K799-T802 WeakPolarHBondContact O-CB 3.43Å; K799-T802 PolarHBondContact O-N 3.47Å; K799-T802 VanDerWaalsContact O-N 3.1Å; T802-I805 PolarHBondContact O-N 3.36Å; T802-T806 WeakPolarHBondContact O-CG2 3.28Å; T802-T806 PolarHBondContact O-N 3.47Å; T802-T806 PolarHBondContact O-OG1 3.3Å
803	E	93.3	Very high	88.8	Confident	135 Å²	135	74.3 Å²	74.3	63%	0.631	37%	0.367	S	S	*	.	H	α-helix	trans	-67	-43.4	175.1	-173.4	170.7	-158.2	0	0	112.4	K799 L801 I805 T806 Q807	K799-E803 PolarHBondContact O-N 2.95Å; L801-E803 VanDerWaalsContact C-N 3.3Å; L801-E803 PolarHBondContact O-N 3.17Å; E803-I805 VanDerWaalsContact C-N 3.31Å; E803-I805 PolarHBondContact O-N 3.48Å; E803-T806 PolarHBondContact O-N 3.28Å; E803-T806 PolarHBondContact O-OG1 3.04Å; E803-T806 VanDerWaalsContact O-OG1 3.05Å; E803-Q807 WeakPolarHBondContact O-CB 3.48Å; E803-Q807 PolarHBondContact O-N 3.01Å
804	K	89.6	Confident	87.2	Confident	90 Å²	90	75.3 Å²	75.3	39%	0.391	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-37.4	174	-69.6	159.5	-171	163.2	0	111.8	Q769 E800 L801 Q807 L808	Q769-K804 VanDerWaalsContact OE1-C 3.24Å; Q769-K804 PolarHBondContact OE1-O 2.91Å; E800-K804 VanDerWaalsContact O-CD 3.29Å; E800-K804 WeakPolarHBondContact O-CD 3.22Å; E800-K804 VanDerWaalsContact O-CG 3.22Å; E800-K804 WeakPolarHBondContact O-CG 3.44Å; E800-K804 PolarHBondContact O-N 3.22Å; E800-K804 IonicContact OE2-NZ 2.66Å; L801-K804 PolarHBondContact O-N 3.44Å; K804-Q807 PolarHBondContact O-N 3.3Å; K804-L808 WeakPolarHBondContact O-CG 3.31Å; K804-L808 PolarHBondContact O-N 2.76Å
805	I	91.3	Very high	85.1	Confident	8 Å²	8	80 Å²	80	4%	0.041	41%	0.408	C	S	.	.	H	α-helix	trans	-65.7	-46.6	175.1	-74.8	164.4	0	0	0	111.3	L766 Q769 I770 Q773 L801 T802 E803 Q807 L808 Q809	L766-I805 HydrophobicContact CD1-CB 4.42Å; L766-I805 HydrophobicContact CD1-CG1 4.44Å; L766-I805 HydrophobicContact CD1-CG2 4.03Å; Q769-I805 HydrophobicContact CB-CD1 4.25Å; Q769-I805 HydrophobicContact CB-CG1 3.72Å; I770-I805 HydrophobicContact CG1-CD1 3.9Å; I770-I805 HydrophobicContact CG1-CG1 4.12Å; I770-I805 HydrophobicContact CG1-CG2 4.14Å; Q773-I805 HydrophobicContact CB-CD1 3.84Å; Q773-I805 HydrophobicContact CG-CD1 4.16Å; L801-I805 VanDerWaalsContact O-CB 3.29Å; L801-I805 WeakPolarHBondContact O-CB 3.46Å; L801-I805 WeakPolarHBondContact O-CD1 3.24Å; L801-I805 WeakPolarHBondContact O-CG1 3.35Å; L801-I805 PolarHBondContact O-N 3.43Å; T802-I805 PolarHBondContact O-N 3.36Å; E803-I805 VanDerWaalsContact C-N 3.31Å; E803-I805 PolarHBondContact O-N 3.48Å; I805-Q807 VanDerWaalsContact C-N 3.34Å; I805-L808 PolarHBondContact O-N 2.75Å; I805-Q809 HydrophobicContact CG2-CG 4.47Å; I805-Q809 WeakPolarHBondContact O-CB 3.41Å; I805-Q809 WeakPolarHBondContact O-CG 3.46Å; I805-Q809 PolarHBondContact O-N 2.79Å
806	T	90.3	Very high	83	Confident	63 Å²	63	78.1 Å²	78.1	39%	0.387	40%	0.404	S	S	.	.	H	α-helix	trans	-68.6	-34.1	177.5	56.2	0	0	0	0	111.8	T802 E803 Q809 N810	T802-T806 WeakPolarHBondContact O-CG2 3.28Å; T802-T806 PolarHBondContact O-N 3.47Å; T802-T806 PolarHBondContact O-OG1 3.3Å; E803-T806 PolarHBondContact O-N 3.28Å; E803-T806 PolarHBondContact O-OG1 3.04Å; E803-T806 VanDerWaalsContact O-OG1 3.05Å; T806-Q809 PolarHBondContact O-N 2.87Å; T806-N810 WeakPolarHBondContact O-CB 3.46Å; T806-N810 PolarHBondContact O-N 3.29Å; T806-N810 PolarHBondContact O-ND2 2.81Å
807	Q	90.1	Very high	80.6	Confident	115 Å²	115	81 Å²	81	54%	0.537	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-51	171.3	-172.3	176.3	9.6	0	0	111.6	E803 K804 I805 Q809 N810 E811	E803-Q807 WeakPolarHBondContact O-CB 3.48Å; E803-Q807 PolarHBondContact O-N 3.01Å; K804-Q807 PolarHBondContact O-N 3.3Å; I805-Q807 VanDerWaalsContact C-N 3.34Å; Q807-Q809 PolarHBondContact O-N 2.99Å; Q807-N810 PolarHBondContact O-N 2.65Å; Q807-E811 PolarHBondContact O-N 2.84Å
808	L	85.9	Confident	78.1	Confident	20 Å²	20	81.9 Å²	81.9	11%	0.105	43%	0.425	C	S	.	.	H	α-helix	trans	-66.1	-33.5	177	-73.2	-171.3	0	0	0	113.3	M765 L766 K804 I805 E811 M812	M765-L808 HydrophobicContact CB-CD1 4.29Å; M765-L808 HydrophobicContact CG-CD1 3.69Å; M765-L808 HydrophobicContact SD-CD1 3.8Å; M765-L808 HydrophobicContact SD-CD2 4.11Å; L766-L808 HydrophobicContact CB-CD1 4.49Å; L766-L808 HydrophobicContact CD1-CB 4.09Å; K804-L808 WeakPolarHBondContact O-CG 3.31Å; K804-L808 PolarHBondContact O-N 2.76Å; I805-L808 PolarHBondContact O-N 2.75Å; L808-E811 PolarHBondContact O-N 2.81Å; L808-M812 VanDerWaalsContact O-CB 3.3Å; L808-M812 WeakPolarHBondContact O-CB 3.35Å; L808-M812 PolarHBondContact O-N 3.29Å
809	Q	84.6	Confident	75.3	Confident	73 Å²	73	86.3 Å²	86.3	34%	0.341	46%	0.457	S	S	.	.	H	α-helix	trans	-64.9	-40.5	172.3	-76	171	0.2	0	0	111.6	L766 I805 T806 Q807 M812 N813	L766-Q809 HydrophobicContact CD1-CG 3.88Å; L766-Q809 HydrophobicContact CD2-CG 3.79Å; L766-Q809 HydrophobicContact CG-CG 4.5Å; I805-Q809 HydrophobicContact CG2-CG 4.47Å; I805-Q809 WeakPolarHBondContact O-CB 3.41Å; I805-Q809 WeakPolarHBondContact O-CG 3.46Å; I805-Q809 PolarHBondContact O-N 2.79Å; T806-Q809 PolarHBondContact O-N 2.87Å; Q807-Q809 PolarHBondContact O-N 2.99Å; Q809-M812 PolarHBondContact O-N 2.87Å; Q809-N813 WeakPolarHBondContact O-CB 3.42Å; Q809-N813 PolarHBondContact O-N 3.34Å
810	N	85.4	Confident	72.2	Confident	86 Å²	86	85.6 Å²	85.6	46%	0.46	47%	0.471	S	S	.	.	H	α-helix	trans	-68	-32.7	174.4	-77.1	-40.7	0	0	0	112.8	T806 Q807 M812 S816	T806-N810 WeakPolarHBondContact O-CB 3.46Å; T806-N810 PolarHBondContact O-N 3.29Å; T806-N810 PolarHBondContact O-ND2 2.81Å; Q807-N810 PolarHBondContact O-N 2.65Å; N810-M812 VanDerWaalsContact C-N 3.32Å; N810-S816 PolarHBondContact OD1-OG 2.84Å; N810-S816 VanDerWaalsContact OD1-OG 3.14Å
811	E	81.1	Confident	69.2	Low	100 Å²	100	85.8 Å²	85.8	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-73.4	-21	170.3	-75.8	-169.6	-148.6	0	0	114.3	K762 Q807 L808	K762-E811 IonicContact NZ-OE2 3.86Å; K762-E811 PolarHBondContact NZ-OE2 3.42Å; Q807-E811 PolarHBondContact O-N 2.84Å; L808-E811 PolarHBondContact O-N 2.81Å
812	M	79.1	Confident	66.6	Low	74 Å²	74	93.1 Å²	93.1	37%	0.365	52%	0.521	S	S	.	.	H	α-helix	trans	-88.6	-31.8	178.2	-173.3	176.4	66.5	0	0	112.2	Q763 L766 L808 Q809 N810 P814	Q763-M812 HydrophobicContact CG-SD 3.63Å; L766-M812 HydrophobicContact CD2-CE 3.41Å; L766-M812 VanDerWaalsContact CD2-CE 3.41Å; L766-M812 HydrophobicContact CD2-SD 3.84Å; L808-M812 VanDerWaalsContact O-CB 3.3Å; L808-M812 WeakPolarHBondContact O-CB 3.35Å; L808-M812 PolarHBondContact O-N 3.29Å; Q809-M812 PolarHBondContact O-N 2.87Å; N810-M812 VanDerWaalsContact C-N 3.32Å; M812-P814 VanDerWaalsContact O-CD 3.31Å; M812-P814 WeakPolarHBondContact O-CD 3.25Å
813	N	76.8	Confident	63.7	Low	83 Å²	83	95.9 Å²	95.9	44%	0.444	54%	0.538	S	S	.	.			trans	-79.8	110.6	176.2	-83.5	-24.1	0	0	0	111.2	Q809 T815 S816	Q809-N813 WeakPolarHBondContact O-CB 3.42Å; Q809-N813 PolarHBondContact O-N 3.34Å; N813-T815 PolarHBondContact O-N 3.35Å; N813-S816 PolarHBondContact O-N 3.35Å
814	P	57.8	Low	60.9	Low	124 Å²	124	95.8 Å²	95.8	81%	0.805	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-6.3	178.3	30.3	-36.7	0	0	0	113.6	M812	M812-P814 VanDerWaalsContact O-CD 3.31Å; M812-P814 WeakPolarHBondContact O-CD 3.25Å
815	T	46.5	Very low	58.3	Low	115 Å²	115	98.9 Å²	98.9	71%	0.706	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-22.1	-179.7	-41.8	0	0	0	0	113	N813 Q817	N813-T815 PolarHBondContact O-N 3.35Å; T815-Q817 VanDerWaalsContact C-N 3.34Å; T815-Q817 PolarHBondContact O-N 3.03Å
816	S	43.4	Very low	55.7	Low	51 Å²	51	103.6 Å²	103.6	36%	0.357	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.6	-3.8	-168.7	-65.7	0	0	0	0	115.6	N810 N813	N810-S816 PolarHBondContact OD1-OG 2.84Å; N810-S816 VanDerWaalsContact OD1-OG 3.14Å; N813-S816 PolarHBondContact O-N 3.35Å
817	Q	44	Very low	53.3	Low	190 Å²	190	107.3 Å²	107.3	89%	0.888	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	28	174.5	-76.3	-161.1	-26.5	0	0	114.2	T815	T815-Q817 VanDerWaalsContact C-N 3.34Å; T815-Q817 PolarHBondContact O-N 3.03Å
818	V	37	Very low	51	Low	73 Å²	73	107.1 Å²	107.1	44%	0.442	61%	0.613	S	S	.	*			trans	-136.4	54.3	176.2	-159.4	0	0	0	0	114.3
819	S	33.8	Very low	49.4	Very low	109 Å²	109	110 Å²	110	76%	0.762	62%	0.624	S	S	*	*			trans	-160.6	109.8	158	51	0	0	0	0	108.7
820	S	29.8	Very low	48.5	Very low	135 Å²	135	110.5 Å²	110.5	94%	0.944	63%	0.633	S	S	*	*	S	Bend	cis	-102.7	134.5	33.1	-57	0	0	0	0	116.5
821	G	31.1	Very low	48	Very low	69 Å²	69	112 Å²	112	71%	0.711	64%	0.635	S	S	*	*	S	Bend	trans	96.6	60	150	0	0	0	0	0	119.7
822	K	34.9	Very low	48	Very low	183 Å²	183	112.1 Å²	112.1	80%	0.796	64%	0.643	S	S	*	*			trans	25.4	121.4	141.3	-66.8	-179.6	-179.2	178.6	0	117.9
823	T	32.8	Very low	48.1	Very low	118 Å²	118	112.4 Å²	112.4	72%	0.724	65%	0.646	S	S	*	*			cis	-152	164.3	17.3	52.3	0	0	0	0	112.7
824	N	34	Very low	48.3	Very low	133 Å²	133	108.6 Å²	108.6	71%	0.711	63%	0.626	S	S	*	*			trans	-94.8	131.2	164.3	-93.7	-56.1	0	0	0	111
825	H	34.2	Very low	49.3	Very low	155 Å²	155	107.3 Å²	107.3	72%	0.718	61%	0.609	S	S	*	*			trans	-149.8	118.6	138.6	-156.2	-35.5	0	0	0	111	Q827	H825-Q827 VanDerWaalsContact C-N 3.26Å; H825-Q827 PolarHBondContact O-N 3.08Å
826	S	37.3	Very low	51.3	Low	107 Å²	107	107.7 Å²	107.7	75%	0.748	60%	0.601	S	S	*	*			trans	-80.3	69.4	173.9	44.7	0	0	0	0	111.7
827	Q	39.3	Very low	53.4	Low	141 Å²	141	107.6 Å²	107.6	66%	0.659	60%	0.595	S	S	*	*	S	Bend	trans	-133	152.2	156.2	-74.2	-61	-69	0	0	107.7	H825 K829	H825-Q827 VanDerWaalsContact C-N 3.26Å; H825-Q827 PolarHBondContact O-N 3.08Å; Q827-K829 PolarHBondContact O-N 3.27Å
828	P	42.4	Very low	55.6	Low	110 Å²	110	99.3 Å²	99.3	71%	0.714	56%	0.557	S	S	*	*			trans	-64.4	103.5	171.1	27.1	-32.5	0	0	0	108.6	T830	P828-T830 PolarHBondContact O-N 2.86Å
829	K	52	Low	57.9	Low	81 Å²	81	100 Å²	100	35%	0.352	56%	0.557	S	S	.	*			trans	-42.5	115.3	178.8	-77.6	-169.5	-175.7	177.4	0	109	Q827 E837 E868	Q827-K829 PolarHBondContact O-N 3.27Å; K829-E837 IonicContact NZ-OE1 3.22Å; K829-E837 IonicContact NZ-OE2 2.7Å; K829-E837 PolarHBondContact NZ-OE2 2.85Å; K829-E868 IonicContact NZ-OE2 3.97Å; K829-E868 PolarHBondContact NZ-OE2 2.86Å
830	T	64.9	Low	60.6	Low	84 Å²	84	98.2 Å²	98.2	52%	0.515	54%	0.54	S	S	.	.			trans	-64.1	152.4	-178	63.6	0	0	0	0	109.2	P828 T832 D833 A834	P828-T830 PolarHBondContact O-N 2.86Å; T830-T832 PolarHBondContact O-N 3.23Å; T830-T832 VanDerWaalsContact O-N 3.09Å; T830-T832 PolarHBondContact OG1-OG1 2.74Å; T830-D833 WeakPolarHBondContact O-CB 3.34Å; T830-D833 PolarHBondContact O-N 3.23Å; T830-D833 WeakPolarHBondContact OG1-CB 3.39Å; T830-D833 PolarHBondContact OG1-N 3.29Å; T830-A834 PolarHBondContact O-N 2.69Å
831	K	75.5	Confident	63.4	Low	116 Å²	116	92.4 Å²	92.4	50%	0.504	50%	0.5	S	S	.	.	H	α-helix	trans	-56.4	-32.1	-177.2	-174.9	157.2	-178.6	155.6	0	112.2	L872 G873 L874	K831-L872 PolarHBondContact NZ-O 3.39Å; K831-L872 VanDerWaalsContact NZ-O 3.15Å; K831-G873 VanDerWaalsContact NZ-C 3.31Å; K831-G873 PolarHBondContact NZ-O 3.07Å; K831-L874 HydrophobicContact CD-CD2 4.18Å; K831-L874 HydrophobicContact CD-CG 4.41Å; K831-L874 HydrophobicContact CG-CD1 4.37Å; K831-L874 HydrophobicContact CG-CD2 3.45Å; K831-L874 VanDerWaalsContact CG-CD2 3.45Å; K831-L874 HydrophobicContact CG-CG 3.78Å; K831-L874 WeakPolarHBondContact O-CD1 3.46Å; K831-L874 WeakPolarHBondContact O-CD2 3.39Å
832	T	81.1	Confident	66.3	Low	104 Å²	104	91.3 Å²	91.3	64%	0.638	48%	0.476	S	S	*	.	H	α-helix	trans	-68.4	-36.2	172.8	35.7	0	0	0	0	114.4	T830 Q835 K836	T830-T832 PolarHBondContact O-N 3.23Å; T830-T832 VanDerWaalsContact O-N 3.09Å; T830-T832 PolarHBondContact OG1-OG1 2.74Å; T832-Q835 PolarHBondContact O-N 2.59Å; T832-K836 PolarHBondContact O-N 2.95Å; T832-K836 VanDerWaalsContact O-N 3.1Å
833	D	81.3	Confident	68.9	Low	79 Å²	79	88.1 Å²	88.1	42%	0.422	47%	0.467	S	S	.	.	H	α-helix	trans	-71.5	-47.8	-174.5	-170.3	47.9	0	0	0	111.6	T830 Q835 K836 E837	T830-D833 WeakPolarHBondContact O-CB 3.34Å; T830-D833 PolarHBondContact O-N 3.23Å; T830-D833 WeakPolarHBondContact OG1-CB 3.39Å; T830-D833 PolarHBondContact OG1-N 3.29Å; D833-Q835 PolarHBondContact O-N 2.61Å; D833-K836 WeakPolarHBondContact O-CB 3.43Å; D833-K836 PolarHBondContact O-N 3.14Å; D833-E837 PolarHBondContact O-N 3.06Å
834	A	81.1	Confident	71.4	Confident	4 Å²	4	86.8 Å²	86.8	3%	0.033	46%	0.455	C	S	.	.	H	α-helix	trans	-64.8	-22.3	173.8	0	0	0	0	0	113.4	T830 L838 L872 L874	T830-A834 PolarHBondContact O-N 2.69Å; A834-L838 PolarHBondContact O-N 3.21Å; A834-L872 HydrophobicContact CB-CD1 3.58Å; A834-L874 HydrophobicContact CB-CD1 3.99Å
835	Q	79.5	Confident	74	Confident	96 Å²	96	81.8 Å²	81.8	45%	0.449	43%	0.428	S	S	.	.	H	α-helix	trans	-76.4	-34.6	171.6	-171.6	176	-18.4	0	0	111.9	T832 D833 L839 L874	T832-Q835 PolarHBondContact O-N 2.59Å; D833-Q835 PolarHBondContact O-N 2.61Å; Q835-L839 WeakPolarHBondContact O-CG 3.41Å; Q835-L839 PolarHBondContact O-N 3.36Å; Q835-L874 HydrophobicContact CB-CD1 4.05Å; Q835-L874 HydrophobicContact CB-CD2 3.89Å; Q835-L874 HydrophobicContact CG-CD2 4.3Å
836	K	88.2	Confident	76.3	Confident	124 Å²	124	79.4 Å²	79.4	54%	0.539	42%	0.417	S	S	.	.	H	α-helix	trans	-69.3	-47.7	174.6	-168.1	-162	171.9	-154.4	0	111.1	T832 D833 L838 L839 D840	T832-K836 PolarHBondContact O-N 2.95Å; T832-K836 VanDerWaalsContact O-N 3.1Å; D833-K836 WeakPolarHBondContact O-CB 3.43Å; D833-K836 PolarHBondContact O-N 3.14Å; K836-L838 PolarHBondContact O-N 2.93Å; K836-L839 PolarHBondContact O-N 3.45Å; K836-D840 WeakPolarHBondContact CE-OD2 3.21Å; K836-D840 IonicContact NZ-OD2 3.65Å; K836-D840 PolarHBondContact O-N 2.96Å
837	E	88.2	Confident	78.8	Confident	49 Å²	49	81.5 Å²	81.5	23%	0.229	41%	0.412	C	S	.	.	H	α-helix	trans	-57.8	-35.5	178.8	-169.3	179.4	-173.8	0	0	112.3	K829 D833 A841 L865	K829-E837 IonicContact NZ-OE1 3.22Å; K829-E837 IonicContact NZ-OE2 2.7Å; K829-E837 PolarHBondContact NZ-OE2 2.85Å; D833-E837 PolarHBondContact O-N 3.06Å; E837-A841 VanDerWaalsContact O-CB 3.3Å; E837-A841 WeakPolarHBondContact O-CB 3.36Å; E837-A841 PolarHBondContact O-N 3.06Å; E837-A841 VanDerWaalsContact O-N 3.14Å; E837-L865 HydrophobicContact CG-CD1 4.09Å; E837-L865 HydrophobicContact CG-CD2 3.86Å
838	L	88.6	Confident	81	Confident	16 Å²	16	77.6 Å²	77.6	8%	0.084	39%	0.393	C	S	.	.	H	α-helix	trans	-62.5	-48.8	171.4	-178.8	77	0	0	0	112.5	A834 K836 A841 E842 L865 R866 A869 I875	A834-L838 PolarHBondContact O-N 3.21Å; K836-L838 PolarHBondContact O-N 2.93Å; L838-A841 PolarHBondContact O-N 2.97Å; L838-E842 WeakPolarHBondContact O-CG 3.38Å; L838-E842 PolarHBondContact O-N 3.45Å; L838-L865 HydrophobicContact CD1-CB 4.09Å; L838-R866 HydrophobicContact CD1-CB 4.44Å; L838-R866 HydrophobicContact CD1-CG 3.57Å; L838-A869 HydrophobicContact CD2-CB 4.36Å; L838-I875 HydrophobicContact CD1-CD1 4.28Å; L838-I875 HydrophobicContact CD2-CD1 3.76Å; L838-I875 HydrophobicContact CD2-CG1 4.12Å
839	L	87.1	Confident	82.9	Confident	86 Å²	86	76.3 Å²	76.3	45%	0.45	38%	0.379	S	S	.	.	H	α-helix	trans	-66.4	-44.2	-178.5	-77.4	164.6	0	0	0	112	Q835 K836 A841 E842 L843	Q835-L839 WeakPolarHBondContact O-CG 3.41Å; Q835-L839 PolarHBondContact O-N 3.36Å; K836-L839 PolarHBondContact O-N 3.45Å; L839-A841 VanDerWaalsContact C-N 3.28Å; L839-A841 PolarHBondContact O-N 3.48Å; L839-E842 PolarHBondContact O-N 3.5Å; L839-L843 WeakPolarHBondContact O-CG 3.3Å; L839-L843 PolarHBondContact O-N 3Å
840	D	90.3	Very high	84.3	Confident	73 Å²	73	77.6 Å²	77.6	39%	0.39	40%	0.399	S	S	.	.	H	α-helix	trans	-60.6	-40.7	177.1	-67.3	-15.4	0	0	0	110.1	K836 L843 D844	K836-D840 WeakPolarHBondContact CE-OD2 3.21Å; K836-D840 IonicContact NZ-OD2 3.65Å; K836-D840 PolarHBondContact O-N 2.96Å; D840-L843 PolarHBondContact O-N 3.35Å; D840-D844 PolarHBondContact O-N 2.86Å
841	A	87.6	Confident	85.2	Confident	13 Å²	13	76.8 Å²	76.8	11%	0.107	40%	0.396	C	S	.	.	H	α-helix	trans	-70.5	-33.6	174.9	0	0	0	0	0	114	E837 L838 L839 F845 L862 L865	E837-A841 VanDerWaalsContact O-CB 3.3Å; E837-A841 WeakPolarHBondContact O-CB 3.36Å; E837-A841 PolarHBondContact O-N 3.06Å; E837-A841 VanDerWaalsContact O-N 3.14Å; L838-A841 PolarHBondContact O-N 2.97Å; L839-A841 VanDerWaalsContact C-N 3.28Å; L839-A841 PolarHBondContact O-N 3.48Å; A841-F845 WeakPolarHBondContact O-CB 3.45Å; A841-F845 PolarHBondContact O-N 3.36Å; A841-L862 VanDerWaalsContact C-CD1 3.5Å; A841-L862 HydrophobicContact CB-CD1 3.94Å; A841-L862 WeakPolarHBondContact O-CD1 3.39Å; A841-L865 HydrophobicContact CB-CD1 3.56Å
842	E	91.3	Very high	85.2	Confident	45 Å²	45	74.6 Å²	74.6	21%	0.21	41%	0.407	C	S	.	.	H	α-helix	trans	-68.5	-35.2	173.3	-76.1	-175	174.5	0	0	111.7	L838 L839 H846 L862 R866	L838-E842 WeakPolarHBondContact O-CG 3.38Å; L838-E842 PolarHBondContact O-N 3.45Å; L839-E842 PolarHBondContact O-N 3.5Å; E842-H846 PolarHBondContact O-N 3.35Å; E842-H846 VanDerWaalsContact O-N 3.15Å; E842-H846 PolarHBondContact O-ND1 3.07Å; E842-H846 VanDerWaalsContact O-ND1 3.11Å; E842-L862 HydrophobicContact CB-CD1 4.37Å; E842-L862 HydrophobicContact CG-CD1 3.67Å; E842-L862 HydrophobicContact CG-CD2 4.19Å; E842-L862 HydrophobicContact CG-CG 4.16Å; E842-R866 IonicContact OE1-CZ 3.25Å; E842-R866 IonicContact OE1-NE 2.99Å; E842-R866 PolarHBondContact OE1-NE 2.7Å; E842-R866 IonicContact OE1-NH2 2.7Å; E842-R866 PolarHBondContact OE1-NH2 2.9Å
843	L	90.1	Very high	85.3	Confident	117 Å²	117	74.6 Å²	74.6	61%	0.613	40%	0.4	S	S	*	.	H	α-helix	trans	-69.6	-47.3	173.5	-70.3	173.3	0	0	0	112.3	L839 D840 F845 H846 K847	L839-L843 WeakPolarHBondContact O-CG 3.3Å; L839-L843 PolarHBondContact O-N 3Å; D840-L843 PolarHBondContact O-N 3.35Å; L843-F845 VanDerWaalsContact C-N 3.29Å; L843-F845 PolarHBondContact O-N 3.12Å; L843-H846 PolarHBondContact O-N 2.81Å; L843-K847 WeakPolarHBondContact O-CB 3.3Å; L843-K847 PolarHBondContact O-N 3.06Å
844	D	85.3	Confident	84.9	Confident	89 Å²	89	76.9 Å²	76.9	48%	0.476	41%	0.412	S	S	.	.	H	α-helix	trans	-62.1	-36.6	175.3	-94.1	-10.1	0	0	0	111.8	D840 K847 K848 L858	D840-D844 PolarHBondContact O-N 2.86Å; D844-K847 PolarHBondContact O-N 3.4Å; D844-K848 VanDerWaalsContact O-CB 3.29Å; D844-K848 WeakPolarHBondContact O-CB 3.5Å; D844-K848 PolarHBondContact O-N 2.83Å; D844-L858 HydrophobicContact CB-CD1 4.41Å
845	F	88.6	Confident	85.2	Confident	29 Å²	29	77.3 Å²	77.3	13%	0.127	41%	0.414	C	S	.	.	H	α-helix	trans	-62.3	-46.3	175.1	172.8	-120.6	0	0	0	112.5	A841 L843 K848 I849 T855 L858 K859 L862	A841-F845 WeakPolarHBondContact O-CB 3.45Å; A841-F845 PolarHBondContact O-N 3.36Å; L843-F845 VanDerWaalsContact C-N 3.29Å; L843-F845 PolarHBondContact O-N 3.12Å; F845-K848 PolarHBondContact O-N 2.76Å; F845-I849 HydrophobicContact CD2-CD1 4.28Å; F845-I849 HydrophobicContact CD2-CG1 4.42Å; F845-I849 HydrophobicContact CE1-CD1 3.92Å; F845-I849 HydrophobicContact CE2-CD1 3.51Å; F845-I849 HydrophobicContact CE2-CG1 3.94Å; F845-I849 HydrophobicContact CZ-CD1 3.33Å; F845-I849 HydrophobicContact CZ-CG1 4.26Å; F845-I849 PolarHBondContact O-N 3.5Å; F845-T855 HydrophobicContact CD2-CG2 4.47Å; F845-T855 HydrophobicContact CE2-CG2 4.45Å; F845-L858 HydrophobicContact CD2-CB 4.18Å; F845-K859 HydrophobicContact CD2-CG 4.24Å; F845-K859 HydrophobicContact CE2-CD 4.19Å; F845-K859 HydrophobicContact CE2-CG 3.43Å; F845-K859 VanDerWaalsContact CE2-CG 3.43Å; F845-K859 HydrophobicContact CZ-CG 3.88Å; F845-L862 HydrophobicContact CB-CD1 4.19Å; F845-L862 HydrophobicContact CD1-CD2 3.82Å; F845-L862 HydrophobicContact CE1-CD2 4.24Å; F845-L862 HydrophobicContact CG-CD2 4.28Å
846	H	82.8	Confident	85.4	Confident	105 Å²	105	76.3 Å²	76.3	49%	0.486	42%	0.415	S	S	.	.	H	α-helix	trans	-66.8	-40.8	175.1	-63.9	144.1	0	0	0	112	E842 L843 K848 I849 S850	E842-H846 PolarHBondContact O-N 3.35Å; E842-H846 VanDerWaalsContact O-N 3.15Å; E842-H846 PolarHBondContact O-ND1 3.07Å; E842-H846 VanDerWaalsContact O-ND1 3.11Å; L843-H846 PolarHBondContact O-N 2.81Å; H846-K848 VanDerWaalsContact C-N 3.34Å; H846-K848 PolarHBondContact O-N 2.94Å; H846-I849 PolarHBondContact O-N 2.84Å; H846-S850 PolarHBondContact O-N 3.26Å; H846-S850 PolarHBondContact O-OG 3.11Å
847	K	90.2	Very high	85.1	Confident	150 Å²	150	75 Å²	75	65%	0.652	41%	0.414	S	S	*	.	H	α-helix	trans	-60.6	-41.7	176.8	-172.9	179.3	178	-174	0	112	L843 D844 S850 S851	L843-K847 WeakPolarHBondContact O-CB 3.3Å; L843-K847 PolarHBondContact O-N 3.06Å; D844-K847 PolarHBondContact O-N 3.4Å; K847-S850 PolarHBondContact O-N 3.37Å; K847-S851 PolarHBondContact O-N 3.26Å
848	K	84.8	Confident	84.9	Confident	59 Å²	59	74.7 Å²	74.7	26%	0.257	41%	0.413	S	S	.	.	H	α-helix	trans	-77.3	-26.9	179.3	-157.8	170.3	-170.5	71.8	0	113.5	D844 F845 H846 S851 G852 E853 D854 T855 L858	D844-K848 VanDerWaalsContact O-CB 3.29Å; D844-K848 WeakPolarHBondContact O-CB 3.5Å; D844-K848 PolarHBondContact O-N 2.83Å; F845-K848 PolarHBondContact O-N 2.76Å; H846-K848 VanDerWaalsContact C-N 3.34Å; H846-K848 PolarHBondContact O-N 2.94Å; K848-S851 WeakPolarHBondContact CA-OG 3.5Å; K848-S851 PolarHBondContact O-OG 3.14Å; K848-G852 PolarHBondContact O-N 3.37Å; K848-E853 HydrophobicContact CD-CB 4.33Å; K848-E853 HydrophobicContact CG-CB 3.73Å; K848-E853 IonicContact NZ-OE1 3.95Å; K848-E853 PolarHBondContact NZ-OE1 3.34Å; K848-E853 IonicContact NZ-OE2 3.71Å; K848-E853 PolarHBondContact NZ-OE2 3.15Å; K848-E853 PolarHBondContact O-N 2.92Å; K848-D854 WeakPolarHBondContact CE-O 3.43Å; K848-T855 HydrophobicContact CB-CG2 4Å; K848-T855 HydrophobicContact CG-CG2 4.09Å; K848-L858 HydrophobicContact CB-CD1 3.64Å; K848-L858 HydrophobicContact CD-CD1 3.54Å; K848-L858 HydrophobicContact CD-CG 4.16Å; K848-L858 HydrophobicContact CG-CD1 4.17Å
849	I	82.1	Confident	84.6	Confident	83 Å²	83	78.4 Å²	78.4	43%	0.426	43%	0.429	S	S	.	.	H	α-helix	trans	-62.7	-47.3	163.9	-82.4	-176.6	0	0	0	110.2	F845 H846 S851 G852 T855	F845-I849 HydrophobicContact CD2-CD1 4.28Å; F845-I849 HydrophobicContact CD2-CG1 4.42Å; F845-I849 HydrophobicContact CE1-CD1 3.92Å; F845-I849 HydrophobicContact CE2-CD1 3.51Å; F845-I849 HydrophobicContact CE2-CG1 3.94Å; F845-I849 HydrophobicContact CZ-CD1 3.33Å; F845-I849 HydrophobicContact CZ-CG1 4.26Å; F845-I849 PolarHBondContact O-N 3.5Å; H846-I849 PolarHBondContact O-N 2.84Å; I849-S851 VanDerWaalsContact C-N 3.3Å; I849-S851 PolarHBondContact O-N 2.95Å; I849-G852 PolarHBondContact O-N 3.12Å; I849-T855 HydrophobicContact CB-CG2 4.49Å; I849-T855 HydrophobicContact CG1-CG2 3.69Å
850	S	82.2	Confident	84.7	Confident	109 Å²	109	82.2 Å²	82.2	76%	0.762	44%	0.437	S	S	*	.	H	α-helix	trans	-70.6	-21.5	-178.5	-61.8	0	0	0	0	114.1	H846 K847 G852	H846-S850 PolarHBondContact O-N 3.26Å; H846-S850 PolarHBondContact O-OG 3.11Å; K847-S850 PolarHBondContact O-N 3.37Å; S850-G852 VanDerWaalsContact C-N 3.32Å
851	S	83.3	Confident	84.4	Confident	66 Å²	66	83.2 Å²	83.2	46%	0.462	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3.8	169.3	64	0	0	0	0	113.9	K847 K848 I849 E853	K847-S851 PolarHBondContact O-N 3.26Å; K848-S851 WeakPolarHBondContact CA-OG 3.5Å; K848-S851 PolarHBondContact O-OG 3.14Å; I849-S851 VanDerWaalsContact C-N 3.3Å; I849-S851 PolarHBondContact O-N 2.95Å; S851-E853 PolarHBondContact O-N 3.47Å; S851-E853 PolarHBondContact OG-OE2 2.86Å
852	G	75.9	Confident	84.4	Confident	71 Å²	71	82.9 Å²	82.9	73%	0.732	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	7.7	-179.4	0	0	0	0	0	115	K848 I849 S850	K848-G852 PolarHBondContact O-N 3.37Å; I849-G852 PolarHBondContact O-N 3.12Å; S850-G852 VanDerWaalsContact C-N 3.32Å
853	E	82	Confident	84.3	Confident	104 Å²	104	85.2 Å²	85.2	49%	0.486	45%	0.451	S	S	.	.			trans	-78.6	165.9	-179.3	-68.7	177.5	89.1	0	0	112.6	K848 S851 T855	K848-E853 HydrophobicContact CD-CB 4.33Å; K848-E853 HydrophobicContact CG-CB 3.73Å; K848-E853 IonicContact NZ-OE1 3.95Å; K848-E853 PolarHBondContact NZ-OE1 3.34Å; K848-E853 IonicContact NZ-OE2 3.71Å; K848-E853 PolarHBondContact NZ-OE2 3.15Å; K848-E853 PolarHBondContact O-N 2.92Å; S851-E853 PolarHBondContact O-N 3.47Å; S851-E853 PolarHBondContact OG-OE2 2.86Å; E853-T855 WeakPolarHBondContact O-CG2 3.32Å; E853-T855 PolarHBondContact O-N 3.41Å; E853-T855 VanDerWaalsContact O-N 3.16Å
854	D	74.1	Confident	84.1	Confident	127 Å²	127	86.1 Å²	86.1	68%	0.679	45%	0.452	S	S	*	.			trans	-62.2	120.1	179.4	-118.4	-43	0	0	0	112.1	K848	K848-D854 WeakPolarHBondContact CE-O 3.43Å
855	T	86.8	Confident	84.2	Confident	13 Å²	13	82.5 Å²	82.5	8%	0.08	43%	0.433	C	S	.	.			trans	-109.1	5.4	-172.5	45.4	0	0	0	0	112.7	F845 K848 I849 E853 D857 L858 K859	F845-T855 HydrophobicContact CD2-CG2 4.47Å; F845-T855 HydrophobicContact CE2-CG2 4.45Å; K848-T855 HydrophobicContact CB-CG2 4Å; K848-T855 HydrophobicContact CG-CG2 4.09Å; I849-T855 HydrophobicContact CB-CG2 4.49Å; I849-T855 HydrophobicContact CG1-CG2 3.69Å; E853-T855 WeakPolarHBondContact O-CG2 3.32Å; E853-T855 PolarHBondContact O-N 3.41Å; E853-T855 VanDerWaalsContact O-N 3.16Å; T855-D857 PolarHBondContact O-N 2.9Å; T855-L858 PolarHBondContact O-N 3.16Å; T855-K859 WeakPolarHBondContact O-CB 3.39Å; T855-K859 WeakPolarHBondContact O-CD 3.2Å; T855-K859 WeakPolarHBondContact O-CG 3.38Å; T855-K859 PolarHBondContact O-N 2.76Å; T855-K859 PolarHBondContact OG1-NZ 2.9Å
856	T	84.5	Confident	83.8	Confident	75 Å²	75	86.4 Å²	86.4	46%	0.46	45%	0.447	S	S	.	.	H	α-helix	trans	-55.3	-48	-179.4	47.1	0	0	0	0	112.7	R860	T856-R860 PolarHBondContact O-N 2.89Å; T856-R860 VanDerWaalsContact O-N 3.12Å
857	D	82.2	Confident	84	Confident	97 Å²	97	85.9 Å²	85.9	52%	0.519	45%	0.451	S	S	.	.	H	α-helix	trans	-78	-33.4	-179.5	-71.9	-22	0	0	0	113.3	T855 R860 K861	T855-D857 PolarHBondContact O-N 2.9Å; D857-R860 WeakPolarHBondContact O-CB 3.38Å; D857-R860 PolarHBondContact O-N 2.87Å; D857-R860 IonicContact OD1-CZ 3.64Å; D857-R860 IonicContact OD1-NE 3.64Å; D857-R860 IonicContact OD1-NH1 2.81Å; D857-R860 IonicContact OD1-NH2 3.6Å; D857-R860 PolarHBondContact OD1-NH2 2.73Å; D857-K861 PolarHBondContact O-N 2.75Å
858	L	83.1	Confident	83.5	Confident	42 Å²	42	80.7 Å²	80.7	22%	0.22	43%	0.429	C	S	.	.	H	α-helix	trans	-64.1	-42	170.1	-70.7	-169.7	0	0	0	111.3	D844 F845 K848 T855 R860 K861 L862	D844-L858 HydrophobicContact CB-CD1 4.41Å; F845-L858 HydrophobicContact CD2-CB 4.18Å; K848-L858 HydrophobicContact CB-CD1 3.64Å; K848-L858 HydrophobicContact CD-CD1 3.54Å; K848-L858 HydrophobicContact CD-CG 4.16Å; K848-L858 HydrophobicContact CG-CD1 4.17Å; T855-L858 PolarHBondContact O-N 3.16Å; L858-R860 VanDerWaalsContact C-N 3.29Å; L858-R860 PolarHBondContact O-N 2.98Å; L858-K861 PolarHBondContact O-N 2.7Å; L858-L862 VanDerWaalsContact O-CB 3.3Å; L858-L862 WeakPolarHBondContact O-CB 3.38Å; L858-L862 PolarHBondContact O-N 3.31Å
859	K	82.4	Confident	83.2	Confident	94 Å²	94	77.9 Å²	77.9	41%	0.409	42%	0.417	S	S	.	.	H	α-helix	trans	-56.1	-43.6	172.5	-75.4	160.1	175.2	145	0	111.3	F845 T855 L862 V863	F845-K859 HydrophobicContact CD2-CG 4.24Å; F845-K859 HydrophobicContact CE2-CD 4.19Å; F845-K859 HydrophobicContact CE2-CG 3.43Å; F845-K859 VanDerWaalsContact CE2-CG 3.43Å; F845-K859 HydrophobicContact CZ-CG 3.88Å; T855-K859 WeakPolarHBondContact O-CB 3.39Å; T855-K859 WeakPolarHBondContact O-CD 3.2Å; T855-K859 WeakPolarHBondContact O-CG 3.38Å; T855-K859 PolarHBondContact O-N 2.76Å; T855-K859 PolarHBondContact OG1-NZ 2.9Å; K859-L862 WeakPolarHBondContact O-CB 3.5Å; K859-L862 PolarHBondContact O-N 3.45Å; K859-V863 WeakPolarHBondContact O-CG2 3.32Å; K859-V863 PolarHBondContact O-N 3.42Å
860	R	88.4	Confident	83.1	Confident	166 Å²	166	80.6 Å²	80.6	63%	0.626	43%	0.425	S	S	*	.	H	α-helix	trans	-62.6	-51.1	177.8	-159.3	-175.6	-50.2	167.5	11.2	111.6	T856 D857 L858 L862 V863 E864	T856-R860 PolarHBondContact O-N 2.89Å; T856-R860 VanDerWaalsContact O-N 3.12Å; D857-R860 WeakPolarHBondContact O-CB 3.38Å; D857-R860 PolarHBondContact O-N 2.87Å; D857-R860 IonicContact OD1-CZ 3.64Å; D857-R860 IonicContact OD1-NE 3.64Å; D857-R860 IonicContact OD1-NH1 2.81Å; D857-R860 IonicContact OD1-NH2 3.6Å; D857-R860 PolarHBondContact OD1-NH2 2.73Å; L858-R860 VanDerWaalsContact C-N 3.29Å; L858-R860 PolarHBondContact O-N 2.98Å; R860-L862 VanDerWaalsContact C-N 3.29Å; R860-L862 PolarHBondContact O-N 3.36Å; R860-V863 PolarHBondContact O-N 3.23Å; R860-E864 PolarHBondContact O-N 3.4Å
861	K	85.4	Confident	83.1	Confident	94 Å²	94	84 Å²	84	41%	0.409	42%	0.421	S	S	.	.	H	α-helix	trans	-61.9	-35.8	177	-167	178.1	-177.4	-170.8	0	112.1	D857 L858 E864 L865	D857-K861 PolarHBondContact O-N 2.75Å; L858-K861 PolarHBondContact O-N 2.7Å; K861-E864 PolarHBondContact O-N 2.91Å; K861-L865 HydrophobicContact CD-CD1 4.5Å; K861-L865 HydrophobicContact CG-CD1 4.1Å; K861-L865 HydrophobicContact CG-CG 4.38Å; K861-L865 WeakPolarHBondContact O-CB 3.42Å; K861-L865 WeakPolarHBondContact O-CG 3.47Å; K861-L865 PolarHBondContact O-N 3.48Å
862	L	87.6	Confident	82.8	Confident	6 Å²	6	83.6 Å²	83.6	3%	0.031	41%	0.414	C	S	.	.	H	α-helix	trans	-63.9	-43.2	176.1	-146.6	80.1	0	0	0	112.2	A841 E842 F845 L858 K859 R860 E864 R866	A841-L862 VanDerWaalsContact C-CD1 3.5Å; A841-L862 HydrophobicContact CB-CD1 3.94Å; A841-L862 WeakPolarHBondContact O-CD1 3.39Å; E842-L862 HydrophobicContact CB-CD1 4.37Å; E842-L862 HydrophobicContact CG-CD1 3.67Å; E842-L862 HydrophobicContact CG-CD2 4.19Å; E842-L862 HydrophobicContact CG-CG 4.16Å; F845-L862 HydrophobicContact CB-CD1 4.19Å; F845-L862 HydrophobicContact CD1-CD2 3.82Å; F845-L862 HydrophobicContact CE1-CD2 4.24Å; F845-L862 HydrophobicContact CG-CD2 4.28Å; L858-L862 VanDerWaalsContact O-CB 3.3Å; L858-L862 WeakPolarHBondContact O-CB 3.38Å; L858-L862 PolarHBondContact O-N 3.31Å; K859-L862 WeakPolarHBondContact O-CB 3.5Å; K859-L862 PolarHBondContact O-N 3.45Å; R860-L862 VanDerWaalsContact C-N 3.29Å; R860-L862 PolarHBondContact O-N 3.36Å; L862-E864 VanDerWaalsContact C-N 3.35Å; L862-R866 VanDerWaalsContact O-CB 3.25Å; L862-R866 WeakPolarHBondContact O-CB 3.47Å; L862-R866 WeakPolarHBondContact O-CD 3.18Å; L862-R866 WeakPolarHBondContact O-CG 3.45Å; L862-R866 PolarHBondContact O-N 2.91Å
863	V	88.1	Confident	82.6	Confident	93 Å²	93	82.1 Å²	82.1	56%	0.564	40%	0.399	S	S	*	.	H	α-helix	trans	-63.8	-42.9	176.2	169.2	0	0	0	0	110.4	K859 R860 R866 V867	K859-V863 WeakPolarHBondContact O-CG2 3.32Å; K859-V863 PolarHBondContact O-N 3.42Å; R860-V863 PolarHBondContact O-N 3.23Å; V863-R866 PolarHBondContact O-N 2.95Å; V863-V867 WeakPolarHBondContact O-CG2 3.33Å; V863-V867 PolarHBondContact O-N 3.37Å
864	E	86.9	Confident	82	Confident	136 Å²	136	78.7 Å²	78.7	64%	0.636	38%	0.384	S	S	*	.	H	α-helix	trans	-64.3	-48.7	178.2	-173.1	164.4	-146.6	0	0	112.5	R860 K861 L862 R866 V867 E868	R860-E864 PolarHBondContact O-N 3.4Å; K861-E864 PolarHBondContact O-N 2.91Å; L862-E864 VanDerWaalsContact C-N 3.35Å; E864-R866 VanDerWaalsContact C-N 3.32Å; E864-R866 PolarHBondContact O-N 3.18Å; E864-V867 CarbonylContact O-C 3.57Å; E864-V867 WeakPolarHBondContact O-CA 3.43Å; E864-V867 WeakPolarHBondContact O-CB 3.49Å; E864-V867 PolarHBondContact O-N 2.85Å; E864-E868 PolarHBondContact O-N 3.4Å
865	L	86.6	Confident	81.6	Confident	14 Å²	14	75.2 Å²	75.2	7%	0.073	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-36.3	174.9	-71.7	172.5	0	0	0	112.3	E837 L838 A841 K861 V867 E868 A869	E837-L865 HydrophobicContact CG-CD1 4.09Å; E837-L865 HydrophobicContact CG-CD2 3.86Å; L838-L865 HydrophobicContact CD1-CB 4.09Å; A841-L865 HydrophobicContact CB-CD1 3.56Å; K861-L865 HydrophobicContact CD-CD1 4.5Å; K861-L865 HydrophobicContact CG-CD1 4.1Å; K861-L865 HydrophobicContact CG-CG 4.38Å; K861-L865 WeakPolarHBondContact O-CB 3.42Å; K861-L865 WeakPolarHBondContact O-CG 3.47Å; K861-L865 PolarHBondContact O-N 3.48Å; L865-V867 VanDerWaalsContact C-N 3.33Å; L865-V867 PolarHBondContact O-N 3.06Å; L865-E868 PolarHBondContact O-N 2.85Å; L865-A869 VanDerWaalsContact O-CB 3.25Å; L865-A869 WeakPolarHBondContact O-CB 3.24Å; L865-A869 PolarHBondContact O-N 3.38Å
866	R	81.4	Confident	80.3	Confident	111 Å²	111	81.2 Å²	81.2	42%	0.419	40%	0.395	S	S	.	.	H	α-helix	trans	-65.8	-34.4	172.3	-75.5	171.7	171.3	-178.9	-3.1	112.1	L838 E842 L862 V863 E864 K870 I875	L838-R866 HydrophobicContact CD1-CB 4.44Å; L838-R866 HydrophobicContact CD1-CG 3.57Å; E842-R866 IonicContact OE1-CZ 3.25Å; E842-R866 IonicContact OE1-NE 2.99Å; E842-R866 PolarHBondContact OE1-NE 2.7Å; E842-R866 IonicContact OE1-NH2 2.7Å; E842-R866 PolarHBondContact OE1-NH2 2.9Å; L862-R866 VanDerWaalsContact O-CB 3.25Å; L862-R866 WeakPolarHBondContact O-CB 3.47Å; L862-R866 WeakPolarHBondContact O-CD 3.18Å; L862-R866 WeakPolarHBondContact O-CG 3.45Å; L862-R866 PolarHBondContact O-N 2.91Å; V863-R866 PolarHBondContact O-N 2.95Å; E864-R866 VanDerWaalsContact C-N 3.32Å; E864-R866 PolarHBondContact O-N 3.18Å; R866-K870 WeakPolarHBondContact O-CB 3.39Å; R866-K870 PolarHBondContact O-N 2.98Å; R866-I875 HydrophobicContact CB-CD1 4.06Å; R866-I875 HydrophobicContact CG-CD1 3.94Å
867	V	85.3	Confident	78.6	Confident	93 Å²	93	81.7 Å²	81.7	56%	0.564	40%	0.399	S	S	*	.	H	α-helix	trans	-71.3	-41.7	173.6	169	0	0	0	0	111.5	V863 E864 L865 K870 R871	V863-V867 WeakPolarHBondContact O-CG2 3.33Å; V863-V867 PolarHBondContact O-N 3.37Å; E864-V867 CarbonylContact O-C 3.57Å; E864-V867 WeakPolarHBondContact O-CA 3.43Å; E864-V867 WeakPolarHBondContact O-CB 3.49Å; E864-V867 PolarHBondContact O-N 2.85Å; L865-V867 VanDerWaalsContact C-N 3.33Å; L865-V867 PolarHBondContact O-N 3.06Å; V867-K870 PolarHBondContact O-N 3.26Å; V867-R871 WeakPolarHBondContact O-CB 3.36Å; V867-R871 PolarHBondContact O-N 3.02Å
868	E	80.9	Confident	76.7	Confident	41 Å²	41	82.6 Å²	82.6	19%	0.192	41%	0.41	C	S	.	.	H	α-helix	trans	-62.9	-48.2	173.1	170.1	140.4	-84.7	0	0	111.7	K829 E864 L865 K870 R871 L872	K829-E868 IonicContact NZ-OE2 3.97Å; K829-E868 PolarHBondContact NZ-OE2 2.86Å; E864-E868 PolarHBondContact O-N 3.4Å; L865-E868 PolarHBondContact O-N 2.85Å; E868-K870 VanDerWaalsContact C-N 3.28Å; E868-K870 PolarHBondContact O-N 3.07Å; E868-R871 CarbonylContact O-C 3.57Å; E868-R871 WeakPolarHBondContact O-CA 3.41Å; E868-R871 VanDerWaalsContact O-CB 3.3Å; E868-R871 WeakPolarHBondContact O-CB 3.31Å; E868-R871 PolarHBondContact O-N 3.5Å; E868-R871 IonicContact OE1-CZ 3.85Å; E868-R871 IonicContact OE1-NE 3.6Å; E868-R871 IonicContact OE1-NH2 3.73Å; E868-R871 PolarHBondContact OE1-NH2 2.98Å; E868-L872 HydrophobicContact CG-CD1 3.97Å; E868-L872 WeakPolarHBondContact O-CG 3.46Å; E868-L872 PolarHBondContact O-N 3.41Å
869	A	77.9	Confident	74.8	Confident	1 Å²	1	86.2 Å²	86.2	1%	0.008	44%	0.436	C	S	.	.	H	α-helix	trans	-64	-33.1	177.3	0	0	0	0	0	112	L838 L865 L872 G873 L874 I875	L838-A869 HydrophobicContact CD2-CB 4.36Å; L865-A869 VanDerWaalsContact O-CB 3.25Å; L865-A869 WeakPolarHBondContact O-CB 3.24Å; L865-A869 PolarHBondContact O-N 3.38Å; A869-L872 PolarHBondContact O-N 3.38Å; A869-G873 PolarHBondContact O-N 2.92Å; A869-L874 HydrophobicContact CB-CB 4.07Å; A869-L874 HydrophobicContact CB-CD1 4.09Å; A869-L874 WeakPolarHBondContact O-CB 3.32Å; A869-L874 PolarHBondContact O-N 3.22Å; A869-I875 HydrophobicContact CB-CD1 3.73Å; A869-I875 HydrophobicContact CB-CG1 3.76Å; A869-I875 PolarHBondContact O-N 3.48Å
870	K	80.8	Confident	72.5	Confident	139 Å²	139	85.3 Å²	85.3	60%	0.604	45%	0.454	S	S	*	.	H	α-helix	trans	-67.8	-40	170	-172.5	177.2	-178.8	-179.5	0	112.1	R866 V867 E868 L872 G873	R866-K870 WeakPolarHBondContact O-CB 3.39Å; R866-K870 PolarHBondContact O-N 2.98Å; V867-K870 PolarHBondContact O-N 3.26Å; E868-K870 VanDerWaalsContact C-N 3.28Å; E868-K870 PolarHBondContact O-N 3.07Å; K870-L872 VanDerWaalsContact C-N 3.29Å; K870-L872 PolarHBondContact O-N 2.93Å; K870-G873 PolarHBondContact O-N 3.36Å; K870-G873 VanDerWaalsContact O-N 3.09Å
871	R	81.6	Confident	70	Confident	180 Å²	180	87.4 Å²	87.4	68%	0.679	46%	0.462	S	S	*	.	H	α-helix	trans	-61.5	-34.1	173.9	-179	-179.2	76.5	98.6	-7.6	112.3	V867 E868 G873	V867-R871 WeakPolarHBondContact O-CB 3.36Å; V867-R871 PolarHBondContact O-N 3.02Å; E868-R871 CarbonylContact O-C 3.57Å; E868-R871 WeakPolarHBondContact O-CA 3.41Å; E868-R871 VanDerWaalsContact O-CB 3.3Å; E868-R871 WeakPolarHBondContact O-CB 3.31Å; E868-R871 PolarHBondContact O-N 3.5Å; E868-R871 IonicContact OE1-CZ 3.85Å; E868-R871 IonicContact OE1-NE 3.6Å; E868-R871 IonicContact OE1-NH2 3.73Å; E868-R871 PolarHBondContact OE1-NH2 2.98Å; R871-G873 VanDerWaalsContact C-N 3.33Å
872	L	77.2	Confident	67.5	Low	58 Å²	58	86.7 Å²	86.7	30%	0.304	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	2.6	175.4	-62.8	172.6	0	0	0	113.7	K831 A834 E868 A869 K870 L874	K831-L872 PolarHBondContact NZ-O 3.39Å; K831-L872 VanDerWaalsContact NZ-O 3.15Å; A834-L872 HydrophobicContact CB-CD1 3.58Å; E868-L872 HydrophobicContact CG-CD1 3.97Å; E868-L872 WeakPolarHBondContact O-CG 3.46Å; E868-L872 PolarHBondContact O-N 3.41Å; A869-L872 PolarHBondContact O-N 3.38Å; K870-L872 VanDerWaalsContact C-N 3.29Å; K870-L872 PolarHBondContact O-N 2.93Å; L872-L874 HydrophobicContact CB-CD1 4.4Å; L872-L874 PolarHBondContact O-N 3.1Å
873	G	71.9	Confident	65	Low	40 Å²	40	96.3 Å²	96.3	41%	0.412	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	30.1	-179.4	0	0	0	0	0	113.9	K831 A869 K870 R871	K831-G873 VanDerWaalsContact NZ-C 3.31Å; K831-G873 PolarHBondContact NZ-O 3.07Å; A869-G873 PolarHBondContact O-N 2.92Å; K870-G873 PolarHBondContact O-N 3.36Å; K870-G873 VanDerWaalsContact O-N 3.09Å; R871-G873 VanDerWaalsContact C-N 3.33Å
874	L	69.9	Low	62.2	Low	32 Å²	32	95.4 Å²	95.4	17%	0.168	53%	0.526	C	S	.	.			trans	-79.5	-54.6	170.5	-80.5	162.2	0	0	0	110.6	K831 A834 Q835 A869 L872 I876	K831-L874 HydrophobicContact CD-CD2 4.18Å; K831-L874 HydrophobicContact CD-CG 4.41Å; K831-L874 HydrophobicContact CG-CD1 4.37Å; K831-L874 HydrophobicContact CG-CD2 3.45Å; K831-L874 VanDerWaalsContact CG-CD2 3.45Å; K831-L874 HydrophobicContact CG-CG 3.78Å; K831-L874 WeakPolarHBondContact O-CD1 3.46Å; K831-L874 WeakPolarHBondContact O-CD2 3.39Å; A834-L874 HydrophobicContact CB-CD1 3.99Å; Q835-L874 HydrophobicContact CB-CD1 4.05Å; Q835-L874 HydrophobicContact CB-CD2 3.89Å; Q835-L874 HydrophobicContact CG-CD2 4.3Å; A869-L874 HydrophobicContact CB-CB 4.07Å; A869-L874 HydrophobicContact CB-CD1 4.09Å; A869-L874 WeakPolarHBondContact O-CB 3.32Å; A869-L874 PolarHBondContact O-N 3.22Å; L872-L874 HydrophobicContact CB-CD1 4.4Å; L872-L874 PolarHBondContact O-N 3.1Å; L874-I876 PolarHBondContact O-N 2.67Å
875	I	64.2	Low	59.7	Low	55 Å²	55	101.1 Å²	101.1	28%	0.282	54%	0.542	S	S	.	.			trans	-82.9	88.3	177.9	-54	178	0	0	0	108.2	L838 R866 A869	L838-I875 HydrophobicContact CD1-CD1 4.28Å; L838-I875 HydrophobicContact CD2-CD1 3.76Å; L838-I875 HydrophobicContact CD2-CG1 4.12Å; R866-I875 HydrophobicContact CB-CD1 4.06Å; R866-I875 HydrophobicContact CG-CD1 3.94Å; A869-I875 HydrophobicContact CB-CD1 3.73Å; A869-I875 HydrophobicContact CB-CG1 3.76Å; A869-I875 PolarHBondContact O-N 3.48Å
876	I	59.5	Low	57	Low	138 Å²	138	104.3 Å²	104.3	71%	0.708	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64.5	121.3	154.7	-57.7	176	0	0	0	105.7	L874	L874-I876 PolarHBondContact O-N 2.67Å
877	P	49	Very low	54.7	Low	86 Å²	86	108.1 Å²	108.1	56%	0.558	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-60.3	137.8	178.7	25.8	-33.7	0	0	0	109.4
878	P	43.8	Very low	52	Low	115 Å²	115	111.8 Å²	111.8	75%	0.747	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-61.1	129.2	-173.6	24.2	-33.8	0	0	0	110.2	G880	P878-G880 PolarHBondContact O-N 2.89Å; P878-G880 VanDerWaalsContact O-N 3.09Å
879	P	41.4	Very low	49.9	Very low	118 Å²	118	114.1 Å²	114.1	77%	0.766	64%	0.637	S	S	*	*			trans	-64.5	115.7	174.6	26.1	-32.6	0	0	0	108.7	R881	P879-R881 PolarHBondContact O-N 2.82Å
880	G	35.5	Very low	48	Very low	76 Å²	76	120 Å²	120	78%	0.784	68%	0.675	S	S	*	*			trans	-53.8	125.7	177.4	0	0	0	0	0	110.5	P878 G882	P878-G880 PolarHBondContact O-N 2.89Å; P878-G880 VanDerWaalsContact O-N 3.09Å; G880-G882 VanDerWaalsContact C-N 3.34Å; G880-G882 PolarHBondContact O-N 3.32Å
881	R	35.8	Very low	45.5	Very low	210 Å²	210	120.3 Å²	120.3	79%	0.792	68%	0.683	S	S	*	*			trans	-71.1	80.8	-171.2	-81.6	-176.4	168.7	176.4	1.9	113	P879 R883	P879-R881 PolarHBondContact O-N 2.82Å; R881-R883 PolarHBondContact O-N 2.98Å
882	G	31.6	Very low	43.6	Very low	78 Å²	78	117.4 Å²	117.4	80%	0.804	69%	0.688	S	S	*	*			trans	-69.1	115.1	144.5	0	0	0	0	0	108.9	G880	G880-G882 VanDerWaalsContact C-N 3.34Å; G880-G882 PolarHBondContact O-N 3.32Å
883	R	35.3	Very low	41.2	Very low	209 Å²	209	118.2 Å²	118.2	79%	0.789	71%	0.71	S	S	*	*			trans	-98.9	144	179.6	-86.2	-174.1	164.5	-164.4	-0.1	111.6	R881	R881-R883 PolarHBondContact O-N 2.98Å
884	G	29.7	Very low	39.2	Very low	73 Å²	73	120.6 Å²	120.6	75%	0.753	73%	0.726	S	S	*	*			trans	147.6	54.3	176.4	0	0	0	0	0	111.8
885	R	34.3	Very low	37.3	Very low	257 Å²	257	126.9 Å²	126.9	97%	0.97	76%	0.756	S	S	*	*				69.1	84.8	76.1	-156.9	-171.9	-156.3	-149.3	7	112.7
886	G	29.2	Very low	35.6	Very low	80 Å²	80	130.9 Å²	130.9	83%	0.825	77%	0.773	S	S	*	*			trans	-153.1	131.4	165.1	0	0	0	0	0	109.1
887	K	34.8	Very low	34.2	Very low	191 Å²	191	128.5 Å²	128.5	83%	0.83	77%	0.774	S	S	*	*			trans	-92.5	144	176.5	-68.5	-179.6	175.4	-179.2	0	109.5
888	M	26.9	Very low	33.3	Very low	171 Å²	171	128.2 Å²	128.2	84%	0.842	79%	0.787	S	S	*	*				172.9	147.3	108.7	-85.2	-42.8	-169.1	0	0	110.1
889	A	37.2	Very low	32.7	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	80%	0.798	S	S	*	*			trans	-92.8	148.3	147.3	0	0	0	0	0	105.9
890	P	37.9	Very low	32.3	Very low	125 Å²	125	133 Å²	133	81%	0.812	80%	0.798	S	S	*	*				-136.8	-179.5	53.6	40.8	-24.4	0	0	0	115.7
891	D	29.8	Very low	32.1	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	81%	0.806	S	S	*	*			trans	-66.2	161.6	155.3	-144.7	35.3	0	0	0	109.2
892	P	40.3	Very low	32	Very low	120 Å²	120	137 Å²	137	78%	0.779	81%	0.806	S	S	*	*			cis	-128.6	160.3	8.9	40.9	-25.7	0	0	0	115.5
893	G	27.2	Very low	31.9	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	81%	0.81	S	S	*	*			trans	-177.4	139.9	172.1	0	0	0	0	0	115.6
894	A	30.2	Very low	31.6	Very low	90 Å²	90	140.1 Å²	140.1	74%	0.744	81%	0.811	S	S	*	*			trans	-91.3	-177	-175.1	0	0	0	0	0	114.5
895	M	28.9	Very low	32.4	Very low	164 Å²	164	146.8 Å²	146.8	81%	0.808	81%	0.813	S	S	*	*			trans	91	-179.9	163.7	-52.6	-53	-178.2	0	0	118.5
896	H	29.6	Very low	32.6	Very low	138 Å²	138	141.4 Å²	141.4	64%	0.639	80%	0.799	S	S	*	*			trans	-120	162.5	-131.8	-102.5	0.8	0	0	0	116.6
897	A	29.7	Very low	33	Very low	89 Å²	89	146.2 Å²	146.2	74%	0.736	80%	0.802	S	S	*	*			trans	69	108.3	149.3	0	0	0	0	0	120
898	G	30.4	Very low	33.1	Very low	79 Å²	79	145.4 Å²	145.4	81%	0.814	80%	0.803	S	S	*	*			trans	-101.6	-166.1	169.4	0	0	0	0	0	115
899	R	31.6	Very low	34	Very low	262 Å²	262	143.7 Å²	143.7	99%	0.989	80%	0.803	S	S	*	*			trans	-138.8	172.9	168.4	-80.9	178.5	171.1	-172.7	-4.5	109
900	G	32.6	Very low	34.3	Very low	73 Å²	73	150.9 Å²	150.9	75%	0.753	81%	0.81	S	S	*	*			trans	-151.1	163.9	175.6	0	0	0	0	0	113.1
901	R	31	Very low	34.2	Very low	257 Å²	257	150.2 Å²	150.2	97%	0.97	81%	0.809	S	S	*	*			trans	-143.5	150.9	168.9	-98	179.6	174.2	170.7	-2.4	110.5
902	S	34.3	Very low	34.4	Very low	111 Å²	111	146.4 Å²	146.4	78%	0.776	80%	0.804	S	S	*	*			trans	-79.8	155.3	-161.5	-29.3	0	0	0	0	115.2
903	R	29.8	Very low	34.2	Very low	240 Å²	240	147 Å²	147	91%	0.906	81%	0.805	S	S	*	*				-176.6	159.7	129.7	-99.3	157.5	-170.3	-172.6	2.6	111.8
904	S	28.2	Very low	34.8	Very low	113 Å²	113	149.7 Å²	149.7	79%	0.79	81%	0.806	S	S	*	*			trans	62.6	133.8	-178.8	-55.6	0	0	0	0	115
905	R	46.2	Very low	35.4	Very low	214 Å²	214	151.6 Å²	151.6	81%	0.808	80%	0.804	S	S	*	*			cis	73.1	145.6	27.6	-146.4	-178.3	-157	-115.8	10.7	112.9
906	E	38.2	Very low	36.1	Very low	144 Å²	144	154.6 Å²	154.6	67%	0.673	81%	0.806	S	S	*	*			trans	64	60.8	173.6	-74	143.2	-135.6	0	0	117.4
907	M	37.7	Very low	36.8	Very low	181 Å²	181	154 Å²	154	89%	0.892	81%	0.805	S	S	*	*			trans	-153.9	91.9	131.9	-121.8	-173.6	-176.3	0	0	111.6
908	M	37.4	Very low	38.5	Very low	173 Å²	173	155.3 Å²	155.3	85%	0.852	80%	0.804	S	S	*	*			trans	-166.4	31.4	153.5	-132.7	71.3	-171.7	0	0	112.6	R910	M908-R910 PolarHBondContact O-N 3.31Å
909	T	45	Very low	40	Very low	135 Å²	135	155.7 Å²	155.7	83%	0.828	79%	0.79	S	S	*	*			trans	-76.4	56.2	178.2	39.9	0	0	0	0	112.2
910	R	45.1	Very low	41.6	Very low	241 Å²	241	147.1 Å²	147.1	91%	0.909	76%	0.764	S	S	*	*			trans	-164.5	70.4	170.1	-110.6	169.5	-165.9	-128.4	0.5	111.3	M908	M908-R910 PolarHBondContact O-N 3.31Å
911	S	34.3	Very low	43.2	Very low	111 Å²	111	149.5 Å²	149.5	78%	0.776	76%	0.755	S	S	*	*			trans	-126.6	137.2	151.3	-74.7	0	0	0	0	106.9
912	G	35.6	Very low	45.5	Very low	65 Å²	65	142.7 Å²	142.7	67%	0.67	73%	0.729	S	S	*	*			trans	-64.9	157.2	-173.2	0	0	0	0	0	113	V914	G912-V914 PolarHBondContact O-N 3.25Å
913	V	36	Very low	47.8	Very low	132 Å²	132	140 Å²	140	80%	0.8	71%	0.71	S	S	*	*			trans	-63.4	108.3	163.6	-178.8	0	0	0	0	106.9	N915	V913-N915 WeakPolarHBondContact CG1-OD1 3.48Å; V913-N915 PolarHBondContact O-N 3.05Å; V913-N915 VanDerWaalsContact O-N 3.15Å
914	V	40.2	Very low	50.7	Low	131 Å²	131	133.2 Å²	133.2	79%	0.794	68%	0.684	S	S	*	*			trans	-81.1	93.6	174.1	-173.4	0	0	0	0	106.8	G912 R916	G912-V914 PolarHBondContact O-N 3.25Å; V914-R916 PolarHBondContact O-N 3.44Å
915	N	42.3	Very low	53.7	Low	131 Å²	131	129 Å²	129	70%	0.701	65%	0.654	S	S	*	*			trans	-55.8	114.1	176	-75.2	5.5	0	0	0	109.2	V913 M917	V913-N915 WeakPolarHBondContact CG1-OD1 3.48Å; V913-N915 PolarHBondContact O-N 3.05Å; V913-N915 VanDerWaalsContact O-N 3.15Å; N915-M917 PolarHBondContact O-N 3.16Å
916	R	43.1	Very low	55.8	Low	227 Å²	227	118.9 Å²	118.9	86%	0.857	62%	0.615	S	S	*	*			trans	-76.1	102.3	165.4	-79.3	-171.2	169.6	-145.7	-0.9	107.8	V914 V918	V914-R916 PolarHBondContact O-N 3.44Å; R916-V918 HydrophobicContact CB-CG2 4.26Å; R916-V918 PolarHBondContact O-N 3.39Å
917	M	45.2	Very low	58.3	Low	126 Å²	126	112.3 Å²	112.3	62%	0.621	59%	0.586	S	S	*	*			trans	-70.2	81.7	167.5	-65.9	168.6	72.9	0	0	108.8	N915	N915-M917 PolarHBondContact O-N 3.16Å
918	V	63.5	Low	60.8	Low	116 Å²	116	103.7 Å²	103.7	70%	0.703	54%	0.543	S	S	*	.			trans	-86.8	117	166.3	-178.9	0	0	0	0	106.5	R916 D920	R916-V918 HydrophobicContact CB-CG2 4.26Å; R916-V918 PolarHBondContact O-N 3.39Å; V918-D920 PolarHBondContact O-N 2.65Å
919	V	62.3	Low	62.9	Low	86 Å²	86	98.2 Å²	98.2	52%	0.521	52%	0.517	S	S	.	.			trans	-72.1	121.2	172.1	-173.8	0	0	0	0	107.6	H921	V919-H921 VanDerWaalsContact CG1-NE2 3.34Å; V919-H921 WeakPolarHBondContact CG1-NE2 3.48Å; V919-H921 PolarHBondContact O-CD2 2.65Å; V919-H921 PolarHBondContact O-N 2.77Å
920	D	65.4	Low	64.4	Low	82 Å²	82	94.1 Å²	94.1	44%	0.439	50%	0.502	S	S	.	.			trans	-87.9	108.5	179.3	-162.8	-18.1	0	0	0	110.2	V918 R922 R967	V918-D920 PolarHBondContact O-N 2.65Å; D920-R922 WeakPolarHBondContact OD1-CB 3.42Å; D920-R922 WeakPolarHBondContact OD1-CD 3.21Å; D920-R922 WeakPolarHBondContact OD1-CG 3.43Å; D920-R922 PolarHBondContact OD1-N 2.88Å; D920-R967 HydrophobicContact CB-CB 4.45Å; D920-R967 VanDerWaalsContact OD2-CG 3.28Å; D920-R967 WeakPolarHBondContact OD2-CG 3.4Å
921	H	67.2	Low	65.9	Low	123 Å²	123	82.7 Å²	82.7	57%	0.569	46%	0.459	S	S	*	.			trans	-91.1	6.8	178.2	-71.5	-91.8	0	0	0	113.3	Y271 V919	Y271-H921 AromaticContact CE2-CD2 3.64Å; Y271-H921 AromaticContact CE2-NE2 3.27Å; Y271-H921 VanDerWaalsContact CE2-NE2 3.27Å; Y271-H921 WeakPolarHBondContact CE2-NE2 3.41Å; Y271-H921 AromaticContact CZ-CD2 3.87Å; Y271-H921 AromaticContact CZ-NE2 3.74Å; Y271-H921 PolarHBondContact OH-CD2 2.85Å; V919-H921 VanDerWaalsContact CG1-NE2 3.34Å; V919-H921 WeakPolarHBondContact CG1-NE2 3.48Å; V919-H921 PolarHBondContact O-CD2 2.65Å; V919-H921 PolarHBondContact O-N 2.77Å
922	R	78.4	Confident	67.9	Low	114 Å²	114	79 Å²	79	43%	0.43	44%	0.435	S	S	.	.	S	Bend	trans	-67	142.9	172	-63.4	167.9	170.8	-153.6	-6.4	109.4	D278 D920 R924 R967 E971	D278-R922 IonicContact OD1-NH2 2.8Å; D278-R922 PolarHBondContact OD1-NH2 2.59Å; D920-R922 WeakPolarHBondContact OD1-CB 3.42Å; D920-R922 WeakPolarHBondContact OD1-CD 3.21Å; D920-R922 WeakPolarHBondContact OD1-CG 3.43Å; D920-R922 PolarHBondContact OD1-N 2.88Å; R922-R924 PolarHBondContact O-N 2.9Å; R922-R967 HydrophobicContact CB-CG 4.04Å; R922-E971 IonicContact NH1-OE1 2.9Å
923	P	83.4	Confident	69.6	Low	56 Å²	56	80.2 Å²	80.2	36%	0.364	42%	0.423	S	S	.	.			trans	-59.4	132.8	-174.6	23.2	-33.5	0	0	0	111.2	T925 R967 W989	P923-T925 VanDerWaalsContact C-N 3.26Å; P923-R967 WeakPolarHBondContact O-CD 3.3Å; P923-R967 PolarHBondContact O-NH1 2.92Å; P923-W989 HydrophobicContact CG-CB 4.25Å; P923-W989 HydrophobicContact CG-CD2 4.49Å; P923-W989 HydrophobicContact CG-CE3 4.15Å; P923-W989 WeakPolarHBondContact O-CZ3 3.34Å
924	R	90.3	Very high	71.4	Confident	96 Å²	96	81.8 Å²	81.8	36%	0.362	42%	0.422	S	S	.	.			trans	-90.8	11.1	174.9	69.2	-165	-175.6	133.3	8.2	113.3	R922 E950 T963 F964	R922-R924 PolarHBondContact O-N 2.9Å; R924-E950 IonicContact CZ-OE1 3.71Å; R924-E950 VanDerWaalsContact CZ-OE1 3.3Å; R924-E950 IonicContact CZ-OE2 3.35Å; R924-E950 IonicContact NH1-OE1 3.72Å; R924-E950 PolarHBondContact NH1-OE1 3.3Å; R924-E950 VanDerWaalsContact NH1-OE1 3.13Å; R924-E950 IonicContact NH1-OE2 2.7Å; R924-E950 PolarHBondContact NH1-OE2 2.65Å; R924-E950 IonicContact NH2-OE1 2.65Å; R924-E950 PolarHBondContact NH2-OE1 2.98Å; R924-E950 IonicContact NH2-OE2 2.73Å; R924-T963 HydrophobicContact CG-CG2 3.9Å; R924-F964 WeakPolarHBondContact CB-O 3.48Å; R924-F964 WeakPolarHBondContact CD-O 3.44Å; R924-F964 WeakPolarHBondContact CG-O 3.49Å; R924-F964 PolarHBondContact O-N 3.48Å
925	T	91.6	Very high	73.3	Confident	26 Å²	26	76.5 Å²	76.5	16%	0.16	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.2	-171.3	45.2	0	0	0	0	111.2	P923 M962 T963 Y990	P923-T925 VanDerWaalsContact C-N 3.26Å; T925-M962 WeakPolarHBondContact CA-O 3.33Å; T925-T963 HydrophobicContact CG2-CG2 3.99Å; T925-Y990 PolarHBondContact O-N 3.19Å; T925-Y990 PolarHBondContact OG1-O 2.96Å; T925-Y990 VanDerWaalsContact OG1-O 3.07Å
926	L	90	Very high	74.7	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.9	173.7	-62.6	-178.9	0	0	0	110.2	I928 I961 M962 F964 A973 A974 I987 S988 W989	L926-I928 HydrophobicContact CB-CG1 4.3Å; L926-I961 CarbonylContact O-C 3.52Å; L926-I961 VanDerWaalsContact O-CA 3.3Å; L926-I961 WeakPolarHBondContact O-CA 3.32Å; L926-M962 PolarHBondContact N-O 3.3Å; L926-M962 PolarHBondContact O-N 3.01Å; L926-F964 HydrophobicContact CD1-CD2 4.43Å; L926-F964 HydrophobicContact CD1-CE2 3.73Å; L926-F964 HydrophobicContact CD1-CZ 4.42Å; L926-F964 HydrophobicContact CG-CE2 4.16Å; L926-A973 HydrophobicContact CD1-CB 3.76Å; L926-A974 HydrophobicContact CD1-CB 4.18Å; L926-A974 HydrophobicContact CD2-CB 4Å; L926-I987 HydrophobicContact CB-CG2 4.14Å; L926-I987 HydrophobicContact CD1-CG2 3.87Å; L926-I987 HydrophobicContact CD2-CG2 3.85Å; L926-I987 HydrophobicContact CG-CG2 4.18Å; L926-S988 CarbonylContact C-O 3.51Å; L926-S988 WeakPolarHBondContact CA-O 3.46Å; L926-W989 HydrophobicContact CD2-CD2 3.8Å; L926-W989 HydrophobicContact CD2-CE3 3.43Å; L926-W989 VanDerWaalsContact CD2-CE3 3.43Å; L926-W989 HydrophobicContact CD2-CH2 3.68Å; L926-W989 HydrophobicContact CD2-CZ2 4.01Å; L926-W989 HydrophobicContact CD2-CZ3 3.36Å; L926-W989 HydrophobicContact CG-CZ3 4.21Å
927	A	89.9	Confident	76.4	Confident	6 Å²	6	69 Å²	69	5%	0.05	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.7	162.2	0	0	0	0	0	108.2	S988 Y990	A927-S988 PolarHBondContact N-O 3.31Å; A927-S988 PolarHBondContact O-N 3.36Å; A927-S988 PolarHBondContact O-OG 3.29Å; A927-Y990 HydrophobicContact CB-CD2 4.18Å
928	I	89.8	Confident	78.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.4	-175.6	-56.6	173.6	0	0	0	107.3	L926 V931 L939 F943 V960 M962 L985 I987	L926-I928 HydrophobicContact CB-CG1 4.3Å; I928-V931 HydrophobicContact CG2-CG2 3.84Å; I928-L939 HydrophobicContact CD1-CD2 4.45Å; I928-F943 HydrophobicContact CD1-CD1 4.48Å; I928-F943 HydrophobicContact CD1-CD2 4.36Å; I928-F943 HydrophobicContact CD1-CE1 4.01Å; I928-F943 HydrophobicContact CD1-CE2 3.91Å; I928-F943 HydrophobicContact CD1-CZ 3.7Å; I928-V960 PolarHBondContact N-O 2.86Å; I928-V960 PolarHBondContact O-N 3.5Å; I928-M962 HydrophobicContact CD1-CB 4.47Å; I928-M962 HydrophobicContact CD1-CE 3.57Å; I928-L985 HydrophobicContact CG2-CB 4.13Å; I928-L985 HydrophobicContact CG2-CD1 3.8Å; I928-I987 HydrophobicContact CG1-CG1 4.4Å
929	L	83	Confident	79.1	Confident	58 Å²	58	62.4 Å²	62.4	30%	0.304	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	145.4	176.4	-68.5	88.4	0	0	0	111.1	N958 T959 Q986	L929-N958 WeakPolarHBondContact CA-O 3.25Å; L929-T959 HydrophobicContact CD1-CG2 4.44Å; L929-T959 HydrophobicContact CG-CG2 4.18Å; L929-Q986 HydrophobicContact CB-CB 4.2Å; L929-Q986 PolarHBondContact N-O 3.22Å; L929-Q986 PolarHBondContact O-N 3.15Å; L929-Q986 VanDerWaalsContact O-N 3.08Å
930	G	76.3	Confident	80	Confident	49 Å²	49	61 Å²	61	51%	0.505	31%	0.306	S	S	.	.	S	Bend	trans	96.8	25.6	175.4	0	0	0	0	0	114.8	N958	G930-N958 PolarHBondContact N-O 2.98Å
931	V	77.3	Confident	81	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.006	31%	0.313	C	S	.	.			trans	-116.9	128.3	174.4	-170.5	0	0	0	0	108.6	I928 E935 L939 N958 F980 L985	I928-V931 HydrophobicContact CG2-CG2 3.84Å; V931-E935 HydrophobicContact CG1-CB 3.82Å; V931-L939 HydrophobicContact CB-CD1 4.48Å; V931-L939 HydrophobicContact CB-CD2 4.39Å; V931-L939 HydrophobicContact CG1-CB 4.33Å; V931-L939 HydrophobicContact CG1-CD1 4.07Å; V931-L939 HydrophobicContact CG1-CD2 4.1Å; V931-L939 HydrophobicContact CG1-CG 4.39Å; V931-L939 HydrophobicContact CG2-CD1 3.63Å; V931-L939 HydrophobicContact CG2-CD2 4.05Å; V931-L939 HydrophobicContact CG2-CG 4.44Å; V931-N958 WeakPolarHBondContact O-CA 3.39Å; V931-F980 HydrophobicContact CG1-CE1 4.5Å; V931-L985 HydrophobicContact CG2-CD1 3.74Å; V931-L985 HydrophobicContact CG2-CD2 3.64Å; V931-L985 HydrophobicContact CG2-CG 4.3Å
932	A	75.5	Confident	81.8	Confident	33 Å²	33	58 Å²	58	27%	0.273	29%	0.293	S	S	.	.			trans	-78.1	150.9	174.4	0	0	0	0	0	111.2	E934 E935	A932-E934 HydrophobicContact CB-CG 4.13Å; A932-E934 PolarHBondContact O-N 2.81Å; A932-E935 HydrophobicContact CB-CG 4.4Å; A932-E935 PolarHBondContact O-N 2.86Å
933	Q	70.6	Confident	82.2	Confident	92 Å²	92	52.6 Å²	52.6	43%	0.43	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-57	-25.6	-176.6	-173.6	64.3	-7.7	0	0	114.4	K936	Q933-K936 WeakPolarHBondContact O-CB 3.4Å; Q933-K936 VanDerWaalsContact O-CD 3.31Å; Q933-K936 WeakPolarHBondContact O-CD 3.41Å; Q933-K936 VanDerWaalsContact O-CG 3.28Å; Q933-K936 WeakPolarHBondContact O-CG 3.45Å
934	E	75.1	Confident	82.4	Confident	165 Å²	165	53.9 Å²	53.9	77%	0.771	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-72.7	-29.3	173.8	63.3	-169	166.6	0	0	113.4	A932 K936	A932-E934 HydrophobicContact CB-CG 4.13Å; A932-E934 PolarHBondContact O-N 2.81Å; E934-K936 VanDerWaalsContact C-N 3.25Å; E934-K936 PolarHBondContact O-N 3.23Å
935	E	78.4	Confident	82.1	Confident	19 Å²	19	56.3 Å²	56.3	9%	0.089	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-82.9	-0.2	-178.8	-51.7	-163.7	111.6	0	0	112.9	V931 A932 E937 E938 L939 F980 K981 R983	V931-E935 HydrophobicContact CG1-CB 3.82Å; A932-E935 HydrophobicContact CB-CG 4.4Å; A932-E935 PolarHBondContact O-N 2.86Å; E935-E937 VanDerWaalsContact C-N 3.27Å; E935-E937 PolarHBondContact O-N 3.01Å; E935-E938 PolarHBondContact O-N 3.32Å; E935-L939 WeakPolarHBondContact O-CB 3.5Å; E935-L939 PolarHBondContact O-N 2.85Å; E935-F980 HydrophobicContact CB-CE1 4.07Å; E935-F980 HydrophobicContact CB-CZ 4.24Å; E935-K981 WeakPolarHBondContact OE1-CD 3.16Å; E935-K981 WeakPolarHBondContact OE1-CE 3.3Å; E935-K981 IonicContact OE1-NZ 2.76Å; E935-K981 PolarHBondContact OE1-NZ 2.92Å; E935-R983 IonicContact OE1-NH1 3.67Å; E935-R983 IonicContact OE2-NH1 2.71Å; E935-R983 PolarHBondContact OE2-NH1 3.3Å
936	K	71.8	Confident	81.6	Confident	68 Å²	68	57.2 Å²	57.2	30%	0.296	29%	0.294	S	S	.	.	H	α-helix	trans	-52.9	-37.3	-176.1	72.9	-174.7	176.8	168	0	113.7	Q933 E934 L939 M940	Q933-K936 WeakPolarHBondContact O-CB 3.4Å; Q933-K936 VanDerWaalsContact O-CD 3.31Å; Q933-K936 WeakPolarHBondContact O-CD 3.41Å; Q933-K936 VanDerWaalsContact O-CG 3.28Å; Q933-K936 WeakPolarHBondContact O-CG 3.45Å; E934-K936 VanDerWaalsContact C-N 3.25Å; E934-K936 PolarHBondContact O-N 3.23Å; K936-L939 WeakPolarHBondContact O-CB 3.21Å; K936-L939 PolarHBondContact O-N 3.25Å; K936-M940 WeakPolarHBondContact O-CG 3.44Å; K936-M940 PolarHBondContact O-N 3.43Å
937	E	78.8	Confident	81.3	Confident	134 Å²	134	57.7 Å²	57.7	63%	0.626	30%	0.299	S	S	*	.	H	α-helix	trans	-79.3	-38	-172.3	-54.4	-171.9	-178.3	0	0	110.4	E935 L941	E935-E937 VanDerWaalsContact C-N 3.27Å; E935-E937 PolarHBondContact O-N 3.01Å; E937-L941 WeakPolarHBondContact O-CB 3.29Å; E937-L941 PolarHBondContact O-N 3.24Å
938	E	83.2	Confident	81.1	Confident	100 Å²	100	62.4 Å²	62.4	47%	0.467	32%	0.32	S	S	.	.	H	α-helix	trans	-68.5	-34	168.5	-67.9	-176.6	-96.4	0	0	111.9	E935 L941 H942 F980 K981	E935-E938 PolarHBondContact O-N 3.32Å; E938-L941 PolarHBondContact O-N 2.83Å; E938-H942 WeakPolarHBondContact O-CB 3.41Å; E938-H942 PolarHBondContact O-N 3.09Å; E938-F980 HydrophobicContact CB-CE2 4.09Å; E938-F980 HydrophobicContact CB-CZ 3.88Å; E938-K981 WeakPolarHBondContact OE1-CE 3.31Å; E938-K981 IonicContact OE1-NZ 3.78Å; E938-K981 PolarHBondContact OE1-NZ 2.93Å; E938-K981 WeakPolarHBondContact OE2-CE 3.39Å; E938-K981 IonicContact OE2-NZ 2.73Å
939	L	82.9	Confident	80.9	Confident	2 Å²	2	64 Å²	64	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-48.9	173.5	-166.1	77.8	0	0	0	110.9	I928 V931 E935 K936 L941 H942 F943 V960 F980 L985	I928-L939 HydrophobicContact CD1-CD2 4.45Å; V931-L939 HydrophobicContact CB-CD1 4.48Å; V931-L939 HydrophobicContact CB-CD2 4.39Å; V931-L939 HydrophobicContact CG1-CB 4.33Å; V931-L939 HydrophobicContact CG1-CD1 4.07Å; V931-L939 HydrophobicContact CG1-CD2 4.1Å; V931-L939 HydrophobicContact CG1-CG 4.39Å; V931-L939 HydrophobicContact CG2-CD1 3.63Å; V931-L939 HydrophobicContact CG2-CD2 4.05Å; V931-L939 HydrophobicContact CG2-CG 4.44Å; E935-L939 WeakPolarHBondContact O-CB 3.5Å; E935-L939 PolarHBondContact O-N 2.85Å; K936-L939 WeakPolarHBondContact O-CB 3.21Å; K936-L939 PolarHBondContact O-N 3.25Å; L939-L941 PolarHBondContact O-N 3.09Å; L939-H942 WeakPolarHBondContact O-CB 3.46Å; L939-H942 PolarHBondContact O-N 3.2Å; L939-H942 VanDerWaalsContact O-N 3.14Å; L939-F943 HydrophobicContact CD1-CD2 3.88Å; L939-F943 HydrophobicContact CD1-CE2 3.56Å; L939-F943 HydrophobicContact CG-CD2 3.92Å; L939-F943 HydrophobicContact CG-CE2 4.08Å; L939-F943 WeakPolarHBondContact O-CD2 3.49Å; L939-F943 PolarHBondContact O-N 3.47Å; L939-V960 HydrophobicContact CD2-CB 4.32Å; L939-V960 HydrophobicContact CD2-CG1 4.16Å; L939-V960 HydrophobicContact CD2-CG2 4.4Å; L939-F980 HydrophobicContact CB-CZ 4.39Å; L939-F980 HydrophobicContact CD1-CD1 4.45Å; L939-F980 HydrophobicContact CD1-CD2 4.29Å; L939-F980 HydrophobicContact CD1-CE1 4.43Å; L939-F980 HydrophobicContact CD1-CE2 4.28Å; L939-F980 HydrophobicContact CD1-CG 4.37Å; L939-F980 HydrophobicContact CD1-CZ 4.33Å; L939-L985 HydrophobicContact CD1-CD1 3.61Å
940	M	82	Confident	81	Confident	58 Å²	58	66.1 Å²	66.1	29%	0.286	34%	0.337	S	S	.	.	H	α-helix	trans	-56.1	-50.2	173.8	-75	-65.4	-68.4	0	0	110.7	K936 H942 F943 T944 I949 L952 M962	K936-M940 WeakPolarHBondContact O-CG 3.44Å; K936-M940 PolarHBondContact O-N 3.43Å; M940-H942 VanDerWaalsContact C-N 3.26Å; M940-H942 PolarHBondContact O-N 2.68Å; M940-F943 PolarHBondContact O-N 2.9Å; M940-T944 VanDerWaalsContact O-CB 3.3Å; M940-T944 WeakPolarHBondContact O-CB 3.25Å; M940-T944 PolarHBondContact O-N 3.05Å; M940-T944 PolarHBondContact O-OG1 3.33Å; M940-I949 HydrophobicContact CE-CB 4.22Å; M940-I949 HydrophobicContact CE-CD1 3.83Å; M940-I949 HydrophobicContact CE-CG2 3.96Å; M940-I949 HydrophobicContact SD-CD1 3.76Å; M940-I949 HydrophobicContact SD-CG2 4.27Å; M940-L952 HydrophobicContact CG-CD2 4.23Å; M940-L952 HydrophobicContact SD-CB 4.48Å; M940-L952 HydrophobicContact SD-CD1 3.81Å; M940-L952 HydrophobicContact SD-CD2 3.85Å; M940-L952 HydrophobicContact SD-CG 4.27Å; M940-M962 HydrophobicContact SD-SD 3.89Å
941	L	84.6	Confident	81.2	Confident	110 Å²	110	67.2 Å²	67.2	58%	0.576	33%	0.329	S	S	*	.	H	α-helix	trans	-63.7	-28.4	177.8	-173	65.6	0	0	0	113.3	E937 E938 L939 K945	E937-L941 WeakPolarHBondContact O-CB 3.29Å; E937-L941 PolarHBondContact O-N 3.24Å; E938-L941 PolarHBondContact O-N 2.83Å; L939-L941 PolarHBondContact O-N 3.09Å; L941-K945 WeakPolarHBondContact O-CD 3.44Å; L941-K945 WeakPolarHBondContact O-CE 3.35Å; L941-K945 WeakPolarHBondContact O-CG 3.41Å
942	H	84.6	Confident	81.5	Confident	32 Å²	32	69.4 Å²	69.4	15%	0.148	34%	0.34	C	S	.	.	H	α-helix	trans	-72.1	-51.5	174.6	-175.2	-117	0	0	0	111.2	E938 L939 M940 K945 F946 G977 K979 F980	E938-H942 WeakPolarHBondContact O-CB 3.41Å; E938-H942 PolarHBondContact O-N 3.09Å; L939-H942 WeakPolarHBondContact O-CB 3.46Å; L939-H942 PolarHBondContact O-N 3.2Å; L939-H942 VanDerWaalsContact O-N 3.14Å; M940-H942 VanDerWaalsContact C-N 3.26Å; M940-H942 PolarHBondContact O-N 2.68Å; H942-K945 WeakPolarHBondContact O-CB 3.47Å; H942-K945 PolarHBondContact O-N 2.85Å; H942-F946 AromaticContact CE1-CE2 3.76Å; H942-F946 AromaticContact NE2-CE2 3.71Å; H942-F946 WeakPolarHBondContact O-CD2 3.25Å; H942-F946 WeakPolarHBondContact O-CE2 3.37Å; H942-G977 PolarHBondContact CE1-O 3.02Å; H942-G977 VanDerWaalsContact CE1-O 3.31Å; H942-K979 PolarHBondContact CE1-O 2.79Å; H942-K979 PolarHBondContact NE2-O 2.89Å; H942-K979 VanDerWaalsContact NE2-O 3.11Å; H942-F980 HydrophobicContact CB-CD2 3.88Å; H942-F980 HydrophobicContact CB-CE2 3.96Å; H942-F980 AromaticContact CG-CD2 3.77Å; H942-F980 AromaticContact ND1-CD2 3.84Å
943	F	86.1	Confident	81.7	Confident	0 Å²	0	74 Å²	74	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-77.5	-25.3	-174.5	-81	-90.9	0	0	0	114.2	I928 L939 M940 K945 F946 G947 I949 M962 F964 A973 G977 L985 I987	I928-F943 HydrophobicContact CD1-CD1 4.48Å; I928-F943 HydrophobicContact CD1-CD2 4.36Å; I928-F943 HydrophobicContact CD1-CE1 4.01Å; I928-F943 HydrophobicContact CD1-CE2 3.91Å; I928-F943 HydrophobicContact CD1-CZ 3.7Å; L939-F943 HydrophobicContact CD1-CD2 3.88Å; L939-F943 HydrophobicContact CD1-CE2 3.56Å; L939-F943 HydrophobicContact CG-CD2 3.92Å; L939-F943 HydrophobicContact CG-CE2 4.08Å; L939-F943 WeakPolarHBondContact O-CD2 3.49Å; L939-F943 PolarHBondContact O-N 3.47Å; M940-F943 PolarHBondContact O-N 2.9Å; F943-K945 PolarHBondContact O-N 2.82Å; F943-K945 VanDerWaalsContact O-N 3.12Å; F943-F946 PolarHBondContact O-N 3.11Å; F943-G947 PolarHBondContact O-N 3.43Å; F943-G947 VanDerWaalsContact O-N 3.13Å; F943-I949 HydrophobicContact CB-CD1 3.99Å; F943-M962 HydrophobicContact CB-CE 3.29Å; F943-M962 HydrophobicContact CB-SD 4.47Å; F943-M962 HydrophobicContact CD1-CE 3.71Å; F943-M962 HydrophobicContact CD2-CE 3.84Å; F943-M962 HydrophobicContact CE1-CE 4.43Å; F943-M962 HydrophobicContact CG-CE 3.33Å; F943-F964 HydrophobicContact CB-CZ 4.21Å; F943-F964 AromaticContact CD1-CZ 3.97Å; F943-F964 HydrophobicContact CD1-CZ 3.97Å; F943-A973 HydrophobicContact CD1-CB 3.73Å; F943-A973 HydrophobicContact CE1-CB 4.05Å; F943-A973 WeakPolarHBondContact CE1-O 3.33Å; F943-G977 WeakPolarHBondContact CZ-O 3.48Å; F943-L985 HydrophobicContact CE2-CD1 4.09Å; F943-L985 HydrophobicContact CZ-CD1 4.41Å; F943-I987 HydrophobicContact CE1-CD1 3.85Å; F943-I987 HydrophobicContact CZ-CD1 3.72Å
944	T	89	Confident	82.2	Confident	83 Å²	83	74.9 Å²	74.9	51%	0.509	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.3	170.3	-58.4	0	0	0	0	112.3	M940 F946 G947	M940-T944 VanDerWaalsContact O-CB 3.3Å; M940-T944 WeakPolarHBondContact O-CB 3.25Å; M940-T944 PolarHBondContact O-N 3.05Å; M940-T944 PolarHBondContact O-OG1 3.33Å; T944-F946 VanDerWaalsContact C-N 3.28Å; T944-F946 PolarHBondContact O-N 3.15Å; T944-G947 WeakPolarHBondContact CA-O 3.42Å
945	K	83.9	Confident	82	Confident	146 Å²	146	72 Å²	72	64%	0.635	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.6	175.3	-61.8	162.3	-177.1	164.8	0	113.4	L941 H942 F943	L941-K945 WeakPolarHBondContact O-CD 3.44Å; L941-K945 WeakPolarHBondContact O-CE 3.35Å; L941-K945 WeakPolarHBondContact O-CG 3.41Å; H942-K945 WeakPolarHBondContact O-CB 3.47Å; H942-K945 PolarHBondContact O-N 2.85Å; F943-K945 PolarHBondContact O-N 2.82Å; F943-K945 VanDerWaalsContact O-N 3.12Å
946	F	81.3	Confident	81.7	Confident	46 Å²	46	75.6 Å²	75.6	20%	0.202	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-15.5	-177.3	-57.2	-70	0	0	0	113.3	H942 F943 T944 N972 A973 Q976	H942-F946 AromaticContact CE1-CE2 3.76Å; H942-F946 AromaticContact NE2-CE2 3.71Å; H942-F946 WeakPolarHBondContact O-CD2 3.25Å; H942-F946 WeakPolarHBondContact O-CE2 3.37Å; F943-F946 PolarHBondContact O-N 3.11Å; T944-F946 VanDerWaalsContact C-N 3.28Å; T944-F946 PolarHBondContact O-N 3.15Å; F946-N972 HydrophobicContact CB-CB 4.5Å; F946-N972 WeakPolarHBondContact O-CB 3.43Å; F946-A973 HydrophobicContact CB-CB 4.38Å; F946-Q976 HydrophobicContact CD1-CB 3.67Å; F946-Q976 HydrophobicContact CD1-CG 4.46Å; F946-Q976 HydrophobicContact CE1-CB 3.5Å; F946-Q976 VanDerWaalsContact CE1-CB 3.5Å; F946-Q976 HydrophobicContact CE1-CG 4.46Å; F946-Q976 HydrophobicContact CG-CB 4.4Å; F946-Q976 HydrophobicContact CZ-CB 4.13Å
947	G	82.9	Confident	81.6	Confident	10 Å²	10	76 Å²	76	10%	0.103	37%	0.373	C	S	.	.	S	Bend	trans	-175.3	159.3	-179.6	0	0	0	0	0	113.8	F943 T944	F943-G947 PolarHBondContact O-N 3.43Å; F943-G947 VanDerWaalsContact O-N 3.13Å; T944-G947 WeakPolarHBondContact CA-O 3.42Å
948	E	85.2	Confident	81.6	Confident	105 Å²	105	74.4 Å²	74.4	49%	0.491	37%	0.369	S	S	.	.			trans	-82	120.1	174.6	-160.9	-178.8	141.7	0	0	109.2	F964 K965 E969	E948-F964 WeakPolarHBondContact O-CA 3.4Å; E948-K965 HydrophobicContact CB-CB 4.09Å; E948-K965 HydrophobicContact CB-CD 4.01Å; E948-K965 HydrophobicContact CG-CD 4.03Å; E948-K965 PolarHBondContact O-N 2.95Å; E948-K965 WeakPolarHBondContact OE1-CD 3.39Å; E948-K965 IonicContact OE1-NZ 2.84Å; E948-K965 PolarHBondContact OE1-NZ 2.83Å; E948-K965 VanDerWaalsContact OE2-CD 3.28Å; E948-K965 WeakPolarHBondContact OE2-CD 3.44Å; E948-K965 IonicContact OE2-NZ 2.59Å; E948-K965 PolarHBondContact OE2-NZ 3.2Å; E948-E969 WeakPolarHBondContact CB-OE2 3.48Å; E948-E969 PolarHBondContact N-OE2 3.32Å
949	I	87.3	Confident	81.5	Confident	32 Å²	32	70.2 Å²	70.2	16%	0.164	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	121.9	-177.1	-59	163	0	0	0	108.4	M940 F943 M962 F964	M940-I949 HydrophobicContact CE-CB 4.22Å; M940-I949 HydrophobicContact CE-CD1 3.83Å; M940-I949 HydrophobicContact CE-CG2 3.96Å; M940-I949 HydrophobicContact SD-CD1 3.76Å; M940-I949 HydrophobicContact SD-CG2 4.27Å; F943-I949 HydrophobicContact CB-CD1 3.99Å; I949-M962 HydrophobicContact CD1-CE 4.09Å; I949-M962 HydrophobicContact CD1-CG 4.38Å; I949-M962 HydrophobicContact CD1-SD 3.7Å; I949-M962 HydrophobicContact CG1-CE 4.49Å; I949-M962 HydrophobicContact CG1-CG 4.27Å; I949-M962 HydrophobicContact CG1-SD 4.22Å; I949-M962 HydrophobicContact CG2-CG 3.59Å; I949-M962 HydrophobicContact CG2-SD 4.19Å; I949-F964 HydrophobicContact CG1-CD1 4.21Å; I949-F964 HydrophobicContact CG1-CE1 3.8Å; I949-F964 HydrophobicContact CG1-CZ 4.26Å
950	E	84.3	Confident	81.8	Confident	103 Å²	103	70.3 Å²	70.3	48%	0.481	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-32.5	-178.5	-171.7	176.5	128.5	0	0	112.1	R924 T963	R924-E950 IonicContact CZ-OE1 3.71Å; R924-E950 VanDerWaalsContact CZ-OE1 3.3Å; R924-E950 IonicContact CZ-OE2 3.35Å; R924-E950 IonicContact NH1-OE1 3.72Å; R924-E950 PolarHBondContact NH1-OE1 3.3Å; R924-E950 VanDerWaalsContact NH1-OE1 3.13Å; R924-E950 IonicContact NH1-OE2 2.7Å; R924-E950 PolarHBondContact NH1-OE2 2.65Å; R924-E950 IonicContact NH2-OE1 2.65Å; R924-E950 PolarHBondContact NH2-OE1 2.98Å; R924-E950 IonicContact NH2-OE2 2.73Å; E950-T963 HydrophobicContact CB-CG2 4.48Å; E950-T963 PolarHBondContact N-O 2.99Å
951	E	80.7	Confident	82.1	Confident	73 Å²	73	68 Å²	68	34%	0.341	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	147.9	-178	-163.1	-170.4	-169	0	0	111.2	R953 T963	E951-R953 VanDerWaalsContact CD-NE 3.25Å; E951-R953 VanDerWaalsContact CD-NH2 3.26Å; E951-R953 HydrophobicContact CG-CG 4.44Å; E951-R953 IonicContact OE1-CZ 2.72Å; E951-R953 IonicContact OE1-NE 3.81Å; E951-R953 PolarHBondContact OE1-NE 2.88Å; E951-R953 IonicContact OE1-NH2 3.41Å; E951-R953 PolarHBondContact OE1-NH2 3.14Å; E951-R953 IonicContact OE2-CZ 3.2Å; E951-R953 IonicContact OE2-NE 2.73Å; E951-R953 PolarHBondContact OE2-NE 3.41Å; E951-R953 IonicContact OE2-NH2 3.82Å; E951-R953 PolarHBondContact OE2-NH2 3.4Å; E951-T963 HydrophobicContact CB-CG2 4.46Å; E951-T963 PolarHBondContact N-O 3.35Å; E951-T963 PolarHBondContact O-N 2.68Å; E951-T963 PolarHBondContact OE2-OG1 2.98Å
952	L	82.8	Confident	82.4	Confident	47 Å²	47	62.8 Å²	62.8	25%	0.246	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.5	174.8	-170.8	76.8	0	0	0	108.9	M940 Y954 V960 M962	M940-L952 HydrophobicContact CG-CD2 4.23Å; M940-L952 HydrophobicContact SD-CB 4.48Å; M940-L952 HydrophobicContact SD-CD1 3.81Å; M940-L952 HydrophobicContact SD-CD2 3.85Å; M940-L952 HydrophobicContact SD-CG 4.27Å; L952-Y954 HydrophobicContact CD2-CE1 4.4Å; L952-Y954 HydrophobicContact CD2-CE2 4.33Å; L952-Y954 WeakPolarHBondContact CD2-OH 3.3Å; L952-V960 HydrophobicContact CD1-CG1 3.43Å; L952-V960 VanDerWaalsContact CD1-CG1 3.43Å; L952-V960 HydrophobicContact CG-CG1 4.21Å; L952-M962 HydrophobicContact CD1-CB 4.08Å; L952-M962 HydrophobicContact CD1-CG 3.68Å; L952-M962 HydrophobicContact CD1-SD 3.53Å; L952-M962 VanDerWaalsContact CD1-SD 3.53Å
953	R	81.1	Confident	82.7	Confident	130 Å²	130	61.6 Å²	61.6	49%	0.491	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.5	173.6	-54.9	-174.8	-166.9	170.2	11.3	110.2	E951 I961	E951-R953 VanDerWaalsContact CD-NE 3.25Å; E951-R953 VanDerWaalsContact CD-NH2 3.26Å; E951-R953 HydrophobicContact CG-CG 4.44Å; E951-R953 IonicContact OE1-CZ 2.72Å; E951-R953 IonicContact OE1-NE 3.81Å; E951-R953 PolarHBondContact OE1-NE 2.88Å; E951-R953 IonicContact OE1-NH2 3.41Å; E951-R953 PolarHBondContact OE1-NH2 3.14Å; E951-R953 IonicContact OE2-CZ 3.2Å; E951-R953 IonicContact OE2-NE 2.73Å; E951-R953 PolarHBondContact OE2-NE 3.41Å; E951-R953 IonicContact OE2-NH2 3.82Å; E951-R953 PolarHBondContact OE2-NH2 3.4Å; R953-I961 HydrophobicContact CB-CB 4.29Å; R953-I961 PolarHBondContact N-O 2.88Å; R953-I961 PolarHBondContact O-N 3.39Å; R953-I961 VanDerWaalsContact O-O 3.12Å
954	Y	79.7	Confident	82.9	Confident	109 Å²	109	61.6 Å²	61.6	43%	0.427	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	135.6	171.5	-54	-86.3	0	0	0	108.3	L952 V960	L952-Y954 HydrophobicContact CD2-CE1 4.4Å; L952-Y954 HydrophobicContact CD2-CE2 4.33Å; L952-Y954 WeakPolarHBondContact CD2-OH 3.3Å; Y954-V960 HydrophobicContact CD1-CG2 4.4Å
955	Q	72.5	Confident	82.9	Confident	106 Å²	106	62.8 Å²	62.8	50%	0.495	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-45.6	174.9	-177.7	148	66.3	0	0	111	T959 I961	Q955-T959 HydrophobicContact CB-CG2 4.11Å; Q955-T959 PolarHBondContact N-O 3.41Å; Q955-T959 VanDerWaalsContact N-O 3.08Å; Q955-I961 HydrophobicContact CB-CD1 3.91Å; Q955-I961 HydrophobicContact CB-CG1 4.36Å
956	D	71.3	Confident	82.9	Confident	93 Å²	93	57.6 Å²	57.6	50%	0.497	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	168.7	174.9	-43.6	-78.8	0	0	0	109.9	N958 T959	D956-N958 PolarHBondContact O-N 2.92Å; D956-T959 PolarHBondContact N-O 2.97Å; D956-T959 PolarHBondContact O-N 2.96Å; D956-T959 WeakPolarHBondContact OD2-CB 3.21Å; D956-T959 PolarHBondContact OD2-OG1 3.19Å
957	A	70.2	Confident	83.2	Confident	77 Å²	77	56.9 Å²	56.9	64%	0.636	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-18.6	177.8	0	0	0	0	0	115.3
958	N	77.4	Confident	83.4	Confident	100 Å²	100	59.7 Å²	59.7	54%	0.535	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	5.5	178	-65.8	-27.8	0	0	0	113.5	L929 G930 V931 D956	L929-N958 WeakPolarHBondContact CA-O 3.25Å; G930-N958 PolarHBondContact N-O 2.98Å; V931-N958 WeakPolarHBondContact O-CA 3.39Å; D956-N958 PolarHBondContact O-N 2.92Å
959	T	82.4	Confident	83.7	Confident	12 Å²	12	57.1 Å²	57.1	7%	0.074	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	110.6	-170.8	-51.5	0	0	0	0	111	L929 Q955 D956	L929-T959 HydrophobicContact CD1-CG2 4.44Å; L929-T959 HydrophobicContact CG-CG2 4.18Å; Q955-T959 HydrophobicContact CB-CG2 4.11Å; Q955-T959 PolarHBondContact N-O 3.41Å; Q955-T959 VanDerWaalsContact N-O 3.08Å; D956-T959 PolarHBondContact N-O 2.97Å; D956-T959 PolarHBondContact O-N 2.96Å; D956-T959 WeakPolarHBondContact OD2-CB 3.21Å; D956-T959 PolarHBondContact OD2-OG1 3.19Å
960	V	87.6	Confident	83.8	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.03	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.2	-179.7	-179.2	0	0	0	0	109.9	I928 L939 L952 Y954	I928-V960 PolarHBondContact N-O 2.86Å; I928-V960 PolarHBondContact O-N 3.5Å; L939-V960 HydrophobicContact CD2-CB 4.32Å; L939-V960 HydrophobicContact CD2-CG1 4.16Å; L939-V960 HydrophobicContact CD2-CG2 4.4Å; L952-V960 HydrophobicContact CD1-CG1 3.43Å; L952-V960 VanDerWaalsContact CD1-CG1 3.43Å; L952-V960 HydrophobicContact CG-CG1 4.21Å; Y954-V960 HydrophobicContact CD1-CG2 4.4Å
961	I	90.3	Very high	84	Confident	9 Å²	9	53.6 Å²	53.6	5%	0.046	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	132.1	172.1	-56	162.2	0	0	0	108.6	L926 R953 Q955 Y990	L926-I961 CarbonylContact O-C 3.52Å; L926-I961 VanDerWaalsContact O-CA 3.3Å; L926-I961 WeakPolarHBondContact O-CA 3.32Å; R953-I961 HydrophobicContact CB-CB 4.29Å; R953-I961 PolarHBondContact N-O 2.88Å; R953-I961 PolarHBondContact O-N 3.39Å; R953-I961 VanDerWaalsContact O-O 3.12Å; Q955-I961 HydrophobicContact CB-CD1 3.91Å; Q955-I961 HydrophobicContact CB-CG1 4.36Å; I961-Y990 HydrophobicContact CD1-CD1 4.47Å; I961-Y990 HydrophobicContact CD1-CD2 3.8Å; I961-Y990 HydrophobicContact CD1-CE1 4.15Å; I961-Y990 HydrophobicContact CD1-CE2 3.44Å; I961-Y990 VanDerWaalsContact CD1-CE2 3.44Å; I961-Y990 HydrophobicContact CD1-CG 4.3Å; I961-Y990 HydrophobicContact CG1-CD2 3.89Å; I961-Y990 HydrophobicContact CG1-CE2 4.07Å; I961-Y990 HydrophobicContact CG1-CG 4.24Å; I961-Y990 HydrophobicContact CG2-CD1 3.85Å; I961-Y990 HydrophobicContact CG2-CD2 4.34Å; I961-Y990 HydrophobicContact CG2-CE1 4.36Å; I961-Y990 HydrophobicContact CG2-CG 3.83Å
962	M	89.8	Confident	84.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	122	-175.5	-156.5	155.5	68.2	0	0	111.3	T925 L926 I928 M940 F943 I949 L952 F964	T925-M962 WeakPolarHBondContact CA-O 3.33Å; L926-M962 PolarHBondContact N-O 3.3Å; L926-M962 PolarHBondContact O-N 3.01Å; I928-M962 HydrophobicContact CD1-CB 4.47Å; I928-M962 HydrophobicContact CD1-CE 3.57Å; M940-M962 HydrophobicContact SD-SD 3.89Å; F943-M962 HydrophobicContact CB-CE 3.29Å; F943-M962 HydrophobicContact CB-SD 4.47Å; F943-M962 HydrophobicContact CD1-CE 3.71Å; F943-M962 HydrophobicContact CD2-CE 3.84Å; F943-M962 HydrophobicContact CE1-CE 4.43Å; F943-M962 HydrophobicContact CG-CE 3.33Å; I949-M962 HydrophobicContact CD1-CE 4.09Å; I949-M962 HydrophobicContact CD1-CG 4.38Å; I949-M962 HydrophobicContact CD1-SD 3.7Å; I949-M962 HydrophobicContact CG1-CE 4.49Å; I949-M962 HydrophobicContact CG1-CG 4.27Å; I949-M962 HydrophobicContact CG1-SD 4.22Å; I949-M962 HydrophobicContact CG2-CG 3.59Å; I949-M962 HydrophobicContact CG2-SD 4.19Å; L952-M962 HydrophobicContact CD1-CB 4.08Å; L952-M962 HydrophobicContact CD1-CG 3.68Å; L952-M962 HydrophobicContact CD1-SD 3.53Å; L952-M962 VanDerWaalsContact CD1-SD 3.53Å; M962-F964 HydrophobicContact CB-CE2 4.42Å; M962-F964 HydrophobicContact CE-CE2 4.03Å; M962-F964 HydrophobicContact CE-CZ 3.64Å; M962-F964 HydrophobicContact CG-CE2 4.36Å
963	T	90.8	Very high	84.8	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.043	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.4	-179.2	-51.5	0	0	0	0	108.9	R924 T925 E950 E951	R924-T963 HydrophobicContact CG-CG2 3.9Å; T925-T963 HydrophobicContact CG2-CG2 3.99Å; E950-T963 HydrophobicContact CB-CG2 4.48Å; E950-T963 PolarHBondContact N-O 2.99Å; E951-T963 HydrophobicContact CB-CG2 4.46Å; E951-T963 PolarHBondContact N-O 3.35Å; E951-T963 PolarHBondContact O-N 2.68Å; E951-T963 PolarHBondContact OE2-OG1 2.98Å
964	F	90.3	Very high	85.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	151.8	173.4	-67.4	-97.6	0	0	0	111.3	R924 L926 F943 E948 I949 M962 E969 A970 A973	R924-F964 WeakPolarHBondContact CB-O 3.48Å; R924-F964 WeakPolarHBondContact CD-O 3.44Å; R924-F964 WeakPolarHBondContact CG-O 3.49Å; R924-F964 PolarHBondContact O-N 3.48Å; L926-F964 HydrophobicContact CD1-CD2 4.43Å; L926-F964 HydrophobicContact CD1-CE2 3.73Å; L926-F964 HydrophobicContact CD1-CZ 4.42Å; L926-F964 HydrophobicContact CG-CE2 4.16Å; F943-F964 HydrophobicContact CB-CZ 4.21Å; F943-F964 AromaticContact CD1-CZ 3.97Å; F943-F964 HydrophobicContact CD1-CZ 3.97Å; E948-F964 WeakPolarHBondContact O-CA 3.4Å; I949-F964 HydrophobicContact CG1-CD1 4.21Å; I949-F964 HydrophobicContact CG1-CE1 3.8Å; I949-F964 HydrophobicContact CG1-CZ 4.26Å; M962-F964 HydrophobicContact CB-CE2 4.42Å; M962-F964 HydrophobicContact CE-CE2 4.03Å; M962-F964 HydrophobicContact CE-CZ 3.64Å; M962-F964 HydrophobicContact CG-CE2 4.36Å; F964-E969 HydrophobicContact CB-CB 4.35Å; F964-E969 HydrophobicContact CD1-CB 4.32Å; F964-A970 HydrophobicContact CB-CB 4Å; F964-A970 HydrophobicContact CD2-CB 3.87Å; F964-A970 HydrophobicContact CG-CB 4.1Å; F964-A973 HydrophobicContact CD1-CB 4.5Å; F964-A973 HydrophobicContact CE1-CB 3.72Å; F964-A973 HydrophobicContact CE2-CB 3.82Å; F964-A973 HydrophobicContact CZ-CB 3.31Å
965	K	88.4	Confident	85.4	Confident	108 Å²	108	47.3 Å²	47.3	47%	0.47	26%	0.262	S	S	.	.	S	Bend	trans	-60.5	-44.3	177.8	-169.5	172.4	-178.4	175.5	0	112.1	E948	E948-K965 HydrophobicContact CB-CB 4.09Å; E948-K965 HydrophobicContact CB-CD 4.01Å; E948-K965 HydrophobicContact CG-CD 4.03Å; E948-K965 PolarHBondContact O-N 2.95Å; E948-K965 WeakPolarHBondContact OE1-CD 3.39Å; E948-K965 IonicContact OE1-NZ 2.84Å; E948-K965 PolarHBondContact OE1-NZ 2.83Å; E948-K965 VanDerWaalsContact OE2-CD 3.28Å; E948-K965 WeakPolarHBondContact OE2-CD 3.44Å; E948-K965 IonicContact OE2-NZ 2.59Å; E948-K965 PolarHBondContact OE2-NZ 3.2Å
966	S	84.9	Confident	85.8	Confident	38 Å²	38	47.1 Å²	47.1	27%	0.266	26%	0.261	S	S	.	.	S	Bend	trans	-114.1	147.6	173.7	-178.4	0	0	0	0	113.2	S968 E969 A970	S966-S968 VanDerWaalsContact C-N 3.29Å; S966-S968 PolarHBondContact O-N 3.19Å; S966-S968 PolarHBondContact OG-N 2.99Å; S966-S968 PolarHBondContact OG-OG 2.83Å; S966-E969 VanDerWaalsContact CB-OE1 3.3Å; S966-E969 WeakPolarHBondContact CB-OE1 3.38Å; S966-E969 WeakPolarHBondContact O-CB 3.46Å; S966-E969 PolarHBondContact O-N 2.93Å; S966-A970 PolarHBondContact O-N 2.99Å
967	R	87.4	Confident	86.4	Confident	30 Å²	30	42.7 Å²	42.7	11%	0.113	24%	0.237	C	C	.	.	H	α-helix	trans	-62.6	-33.4	168.5	173	60.9	-169.9	-162.9	8.5	112.3	D920 R922 P923 E969 A970 E971 W989	D920-R967 HydrophobicContact CB-CB 4.45Å; D920-R967 VanDerWaalsContact OD2-CG 3.28Å; D920-R967 WeakPolarHBondContact OD2-CG 3.4Å; R922-R967 HydrophobicContact CB-CG 4.04Å; P923-R967 WeakPolarHBondContact O-CD 3.3Å; P923-R967 PolarHBondContact O-NH1 2.92Å; R967-E969 VanDerWaalsContact C-N 3.27Å; R967-E969 PolarHBondContact O-N 3.26Å; R967-A970 PolarHBondContact O-N 2.62Å; R967-E971 IonicContact CZ-OE1 3.52Å; R967-E971 IonicContact NE-OE1 3.17Å; R967-E971 PolarHBondContact NE-OE1 3.06Å; R967-E971 IonicContact NH2-OE1 2.66Å; R967-E971 PolarHBondContact NH2-OE1 3.31Å; R967-E971 WeakPolarHBondContact O-CG 3.34Å; R967-E971 PolarHBondContact O-N 2.65Å; R967-W989 VanDerWaalsContact CZ-CZ2 3.44Å; R967-W989 VanDerWaalsContact NH1-CD2 3.34Å; R967-W989 VanDerWaalsContact NH2-CZ2 3.33Å
968	S	87.8	Confident	87.1	Confident	70 Å²	70	40.1 Å²	40.1	49%	0.49	22%	0.216	S	C	.	.	H	α-helix	trans	-66.4	-32.2	176.3	60.8	0	0	0	0	112.5	S966 N972	S966-S968 VanDerWaalsContact C-N 3.29Å; S966-S968 PolarHBondContact O-N 3.19Å; S966-S968 PolarHBondContact OG-N 2.99Å; S966-S968 PolarHBondContact OG-OG 2.83Å; S968-N972 PolarHBondContact O-N 3.15Å
969	E	90.7	Very high	87.4	Confident	51 Å²	51	43 Å²	43	24%	0.238	22%	0.224	C	C	.	.	H	α-helix	trans	-73.9	-43.1	175.5	-75.1	162.9	-138.2	0	0	110.7	E948 F964 S966 R967 E971 N972 A973	E948-E969 WeakPolarHBondContact CB-OE2 3.48Å; E948-E969 PolarHBondContact N-OE2 3.32Å; F964-E969 HydrophobicContact CB-CB 4.35Å; F964-E969 HydrophobicContact CD1-CB 4.32Å; S966-E969 VanDerWaalsContact CB-OE1 3.3Å; S966-E969 WeakPolarHBondContact CB-OE1 3.38Å; S966-E969 WeakPolarHBondContact O-CB 3.46Å; S966-E969 PolarHBondContact O-N 2.93Å; R967-E969 VanDerWaalsContact C-N 3.27Å; R967-E969 PolarHBondContact O-N 3.26Å; E969-E971 VanDerWaalsContact C-N 3.29Å; E969-E971 PolarHBondContact O-N 3.46Å; E969-N972 PolarHBondContact O-N 3.06Å; E969-A973 VanDerWaalsContact O-CB 3.3Å; E969-A973 WeakPolarHBondContact O-CB 3.39Å; E969-A973 PolarHBondContact O-N 3.42Å
970	A	89.4	Confident	87.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.5	-37.1	170.2	0	0	0	0	0	112.5	F964 S966 R967 A973 A974 W989	F964-A970 HydrophobicContact CB-CB 4Å; F964-A970 HydrophobicContact CD2-CB 3.87Å; F964-A970 HydrophobicContact CG-CB 4.1Å; S966-A970 PolarHBondContact O-N 2.99Å; R967-A970 PolarHBondContact O-N 2.62Å; A970-A973 PolarHBondContact O-N 2.85Å; A970-A974 WeakPolarHBondContact O-CB 3.44Å; A970-A974 PolarHBondContact O-N 3.26Å; A970-W989 HydrophobicContact CB-CH2 3.64Å; A970-W989 HydrophobicContact CB-CZ3 3.64Å
971	E	89.5	Confident	86.8	Confident	60 Å²	60	46.6 Å²	46.6	28%	0.28	24%	0.238	S	C	.	.	H	α-helix	trans	-71.2	-37.7	175.8	-75.7	-174.4	178.7	0	0	112.3	R922 R967 E969 A974 N975 W989	R922-E971 IonicContact NH1-OE1 2.9Å; R967-E971 IonicContact CZ-OE1 3.52Å; R967-E971 IonicContact NE-OE1 3.17Å; R967-E971 PolarHBondContact NE-OE1 3.06Å; R967-E971 IonicContact NH2-OE1 2.66Å; R967-E971 PolarHBondContact NH2-OE1 3.31Å; R967-E971 WeakPolarHBondContact O-CG 3.34Å; R967-E971 PolarHBondContact O-N 2.65Å; E969-E971 VanDerWaalsContact C-N 3.29Å; E969-E971 PolarHBondContact O-N 3.46Å; E971-A974 PolarHBondContact O-N 2.74Å; E971-N975 WeakPolarHBondContact O-CB 3.46Å; E971-N975 PolarHBondContact O-N 2.89Å; E971-N975 PolarHBondContact O-ND2 3.38Å; E971-W989 HydrophobicContact CG-CH2 3.92Å; E971-W989 HydrophobicContact CG-CZ2 3.89Å
972	N	89.1	Confident	86.1	Confident	77 Å²	77	52.8 Å²	52.8	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-45.9	169.8	-90.3	-20.4	0	0	0	111.6	F946 S968 E969 A974 N975 Q976	F946-N972 HydrophobicContact CB-CB 4.5Å; F946-N972 WeakPolarHBondContact O-CB 3.43Å; S968-N972 PolarHBondContact O-N 3.15Å; E969-N972 PolarHBondContact O-N 3.06Å; N972-A974 PolarHBondContact O-N 3.33Å; N972-N975 PolarHBondContact O-N 3.09Å; N972-Q976 WeakPolarHBondContact O-CB 3.39Å; N972-Q976 WeakPolarHBondContact O-CG 3.22Å; N972-Q976 PolarHBondContact O-N 3.22Å; N972-Q976 PolarHBondContact OD1-NE2 2.96Å
973	A	90.1	Very high	85.6	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.3	-45.3	175.1	0	0	0	0	0	112.4	L926 F943 F946 F964 E969 A970 G977	L926-A973 HydrophobicContact CD1-CB 3.76Å; F943-A973 HydrophobicContact CD1-CB 3.73Å; F943-A973 HydrophobicContact CE1-CB 4.05Å; F943-A973 WeakPolarHBondContact CE1-O 3.33Å; F946-A973 HydrophobicContact CB-CB 4.38Å; F964-A973 HydrophobicContact CD1-CB 4.5Å; F964-A973 HydrophobicContact CE1-CB 3.72Å; F964-A973 HydrophobicContact CE2-CB 3.82Å; F964-A973 HydrophobicContact CZ-CB 3.31Å; E969-A973 VanDerWaalsContact O-CB 3.3Å; E969-A973 WeakPolarHBondContact O-CB 3.39Å; E969-A973 PolarHBondContact O-N 3.42Å; A970-A973 PolarHBondContact O-N 2.85Å; A973-G977 WeakPolarHBondContact O-CA 3.49Å; A973-G977 PolarHBondContact O-N 3.3Å
974	A	87.4	Confident	85.2	Confident	23 Å²	23	65.4 Å²	65.4	19%	0.19	34%	0.342	C	S	.	.	H	α-helix	trans	-66.3	-40.9	178	0	0	0	0	0	113	L926 A970 E971 N972 I987 W989	L926-A974 HydrophobicContact CD1-CB 4.18Å; L926-A974 HydrophobicContact CD2-CB 4Å; A970-A974 WeakPolarHBondContact O-CB 3.44Å; A970-A974 PolarHBondContact O-N 3.26Å; E971-A974 PolarHBondContact O-N 2.74Å; N972-A974 PolarHBondContact O-N 3.33Å; A974-I987 HydrophobicContact CB-CG2 4.24Å; A974-W989 HydrophobicContact CB-CH2 4.47Å; A974-W989 HydrophobicContact CB-CZ2 4Å
975	N	86.4	Confident	85.1	Confident	128 Å²	128	65.8 Å²	65.8	68%	0.684	34%	0.344	S	S	*	.	H	α-helix	trans	-80.3	-30	-176.5	-72.7	-58.3	0	0	0	113.8	E971 N972	E971-N975 WeakPolarHBondContact O-CB 3.46Å; E971-N975 PolarHBondContact O-N 2.89Å; E971-N975 PolarHBondContact O-ND2 3.38Å; N972-N975 PolarHBondContact O-N 3.09Å
976	Q	81.6	Confident	84.9	Confident	101 Å²	101	67.1 Å²	67.1	47%	0.472	35%	0.352	S	S	.	.	H	α-helix	trans	-114.6	-38.3	-172.5	-53.7	-174.1	40.6	0	0	112.8	F946 N972 A978	F946-Q976 HydrophobicContact CD1-CB 3.67Å; F946-Q976 HydrophobicContact CD1-CG 4.46Å; F946-Q976 HydrophobicContact CE1-CB 3.5Å; F946-Q976 VanDerWaalsContact CE1-CB 3.5Å; F946-Q976 HydrophobicContact CE1-CG 4.46Å; F946-Q976 HydrophobicContact CG-CB 4.4Å; F946-Q976 HydrophobicContact CZ-CB 4.13Å; N972-Q976 WeakPolarHBondContact O-CB 3.39Å; N972-Q976 WeakPolarHBondContact O-CG 3.22Å; N972-Q976 PolarHBondContact O-N 3.22Å; N972-Q976 PolarHBondContact OD1-NE2 2.96Å; Q976-A978 PolarHBondContact O-N 3.1Å
977	G	83.6	Confident	85.2	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-7.6	-178.8	0	0	0	0	0	114.8	H942 F943 A973 K979	H942-G977 PolarHBondContact CE1-O 3.02Å; H942-G977 VanDerWaalsContact CE1-O 3.31Å; F943-G977 WeakPolarHBondContact CZ-O 3.48Å; A973-G977 WeakPolarHBondContact O-CA 3.49Å; A973-G977 PolarHBondContact O-N 3.3Å; G977-K979 PolarHBondContact O-N 3.36Å; G977-K979 VanDerWaalsContact O-N 3.13Å
978	A	83.8	Confident	85.3	Confident	23 Å²	23	67.8 Å²	67.8	19%	0.19	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.5	176.5	0	0	0	0	0	114.2	Q976 V984 L985 I987	Q976-A978 PolarHBondContact O-N 3.1Å; A978-V984 CarbonylContact O-C 3.49Å; A978-V984 VanDerWaalsContact O-CA 3.26Å; A978-V984 WeakPolarHBondContact O-CA 3.38Å; A978-L985 PolarHBondContact O-N 3.22Å; A978-I987 HydrophobicContact CB-CD1 3.91Å; A978-I987 HydrophobicContact CB-CG1 4.39Å
979	K	83.9	Confident	85.5	Confident	162 Å²	162	68.5 Å²	68.5	70%	0.704	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	105.8	177.4	-65.4	179.5	-178.3	178.2	0	110.7	H942 G977	H942-K979 PolarHBondContact CE1-O 2.79Å; H942-K979 PolarHBondContact NE2-O 2.89Å; H942-K979 VanDerWaalsContact NE2-O 3.11Å; G977-K979 PolarHBondContact O-N 3.36Å; G977-K979 VanDerWaalsContact O-N 3.13Å
980	F	82.6	Confident	85.2	Confident	7 Å²	7	68.3 Å²	68.3	3%	0.031	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	129	-176.9	179.5	-108.5	0	0	0	110.5	V931 E935 E938 L939 H942 S982 R983 L985	V931-F980 HydrophobicContact CG1-CE1 4.5Å; E935-F980 HydrophobicContact CB-CE1 4.07Å; E935-F980 HydrophobicContact CB-CZ 4.24Å; E938-F980 HydrophobicContact CB-CE2 4.09Å; E938-F980 HydrophobicContact CB-CZ 3.88Å; L939-F980 HydrophobicContact CB-CZ 4.39Å; L939-F980 HydrophobicContact CD1-CD1 4.45Å; L939-F980 HydrophobicContact CD1-CD2 4.29Å; L939-F980 HydrophobicContact CD1-CE1 4.43Å; L939-F980 HydrophobicContact CD1-CE2 4.28Å; L939-F980 HydrophobicContact CD1-CG 4.37Å; L939-F980 HydrophobicContact CD1-CZ 4.33Å; H942-F980 HydrophobicContact CB-CD2 3.88Å; H942-F980 HydrophobicContact CB-CE2 3.96Å; H942-F980 AromaticContact CG-CD2 3.77Å; H942-F980 AromaticContact ND1-CD2 3.84Å; F980-S982 PolarHBondContact O-N 2.99Å; F980-S982 VanDerWaalsContact O-N 3.14Å; F980-R983 PolarHBondContact N-O 2.93Å; F980-R983 WeakPolarHBondContact O-CA 3.36Å; F980-R983 WeakPolarHBondContact O-CB 3.46Å; F980-R983 PolarHBondContact O-N 3.43Å; F980-L985 HydrophobicContact CB-CD1 3.53Å; F980-L985 HydrophobicContact CB-CD2 4.22Å; F980-L985 HydrophobicContact CB-CG 3.73Å; F980-L985 HydrophobicContact CD1-CD1 4.23Å; F980-L985 HydrophobicContact CD1-CD2 4.26Å; F980-L985 HydrophobicContact CG-CD1 4Å
981	K	76.1	Confident	84.8	Confident	85 Å²	85	76.6 Å²	76.6	37%	0.37	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	45	44.8	-178.9	-63.7	-177.4	176.6	-171.1	0	114.3	E935 E938 R983	E935-K981 WeakPolarHBondContact OE1-CD 3.16Å; E935-K981 WeakPolarHBondContact OE1-CE 3.3Å; E935-K981 IonicContact OE1-NZ 2.76Å; E935-K981 PolarHBondContact OE1-NZ 2.92Å; E938-K981 WeakPolarHBondContact OE1-CE 3.31Å; E938-K981 IonicContact OE1-NZ 3.78Å; E938-K981 PolarHBondContact OE1-NZ 2.93Å; E938-K981 WeakPolarHBondContact OE2-CE 3.39Å; E938-K981 IonicContact OE2-NZ 2.73Å; K981-R983 PolarHBondContact O-N 2.99Å
982	S	74.7	Confident	84	Confident	139 Å²	139	78.6 Å²	78.6	97%	0.972	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	6.1	-175.4	-53.3	0	0	0	0	116.2	F980	F980-S982 PolarHBondContact O-N 2.99Å; F980-S982 VanDerWaalsContact O-N 3.14Å
983	R	78.6	Confident	82.7	Confident	150 Å²	150	84.2 Å²	84.2	57%	0.566	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	165.6	168.5	-57.6	176.6	-177.1	149.3	0.6	110.1	E935 F980 K981	E935-R983 IonicContact OE1-NH1 3.67Å; E935-R983 IonicContact OE2-NH1 2.71Å; E935-R983 PolarHBondContact OE2-NH1 3.3Å; F980-R983 PolarHBondContact N-O 2.93Å; F980-R983 WeakPolarHBondContact O-CA 3.36Å; F980-R983 WeakPolarHBondContact O-CB 3.46Å; F980-R983 PolarHBondContact O-N 3.43Å; K981-R983 PolarHBondContact O-N 2.99Å
984	V	83.4	Confident	80.1	Confident	121 Å²	121	89.3 Å²	89.3	73%	0.733	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	120.9	169.4	-178.2	0	0	0	0	108.6	A978	A978-V984 CarbonylContact O-C 3.49Å; A978-V984 VanDerWaalsContact O-CA 3.26Å; A978-V984 WeakPolarHBondContact O-CA 3.38Å
985	L	87.4	Confident	77.7	Confident	8 Å²	8	96.3 Å²	96.3	4%	0.042	49%	0.492	C	S	.	.			trans	-82.2	141.9	176.2	-57.8	-178.2	0	0	0	110.3	I928 V931 L939 F943 A978 F980 I987	I928-L985 HydrophobicContact CG2-CB 4.13Å; I928-L985 HydrophobicContact CG2-CD1 3.8Å; V931-L985 HydrophobicContact CG2-CD1 3.74Å; V931-L985 HydrophobicContact CG2-CD2 3.64Å; V931-L985 HydrophobicContact CG2-CG 4.3Å; L939-L985 HydrophobicContact CD1-CD1 3.61Å; F943-L985 HydrophobicContact CE2-CD1 4.09Å; F943-L985 HydrophobicContact CZ-CD1 4.41Å; A978-L985 PolarHBondContact O-N 3.22Å; F980-L985 HydrophobicContact CB-CD1 3.53Å; F980-L985 HydrophobicContact CB-CD2 4.22Å; F980-L985 HydrophobicContact CB-CG 3.73Å; F980-L985 HydrophobicContact CD1-CD1 4.23Å; F980-L985 HydrophobicContact CD1-CD2 4.26Å; F980-L985 HydrophobicContact CG-CD1 4Å; L985-I987 HydrophobicContact CB-CG1 4.41Å; L985-I987 PolarHBondContact O-N 2.82Å; L985-I987 VanDerWaalsContact O-N 3.13Å
986	Q	85.1	Confident	75	Confident	136 Å²	136	95 Å²	95	64%	0.636	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	90.6	175.1	179.6	173.6	-9.9	0	0	109.2	L929	L929-Q986 HydrophobicContact CB-CB 4.2Å; L929-Q986 PolarHBondContact N-O 3.22Å; L929-Q986 PolarHBondContact O-N 3.15Å; L929-Q986 VanDerWaalsContact O-N 3.08Å
987	I	90.5	Very high	72.6	Confident	34 Å²	34	96.8 Å²	96.8	17%	0.174	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132.3	174.8	-52.8	-177	0	0	0	109.9	L926 I928 F943 A974 A978 L985	L926-I987 HydrophobicContact CB-CG2 4.14Å; L926-I987 HydrophobicContact CD1-CG2 3.87Å; L926-I987 HydrophobicContact CD2-CG2 3.85Å; L926-I987 HydrophobicContact CG-CG2 4.18Å; I928-I987 HydrophobicContact CG1-CG1 4.4Å; F943-I987 HydrophobicContact CE1-CD1 3.85Å; F943-I987 HydrophobicContact CZ-CD1 3.72Å; A974-I987 HydrophobicContact CB-CG2 4.24Å; A978-I987 HydrophobicContact CB-CD1 3.91Å; A978-I987 HydrophobicContact CB-CG1 4.39Å; L985-I987 HydrophobicContact CB-CG1 4.41Å; L985-I987 PolarHBondContact O-N 2.82Å; L985-I987 VanDerWaalsContact O-N 3.13Å
988	S	89.6	Confident	69.9	Low	49 Å²	49	102.7 Å²	102.7	34%	0.343	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	162	172.5	63.6	0	0	0	0	110.8	L926 A927 Y990	L926-S988 CarbonylContact C-O 3.51Å; L926-S988 WeakPolarHBondContact CA-O 3.46Å; A927-S988 PolarHBondContact N-O 3.31Å; A927-S988 PolarHBondContact O-N 3.36Å; A927-S988 PolarHBondContact O-OG 3.29Å; S988-Y990 PolarHBondContact O-N 2.97Å
989	W	91.3	Very high	67.6	Low	85 Å²	85	106.7 Å²	106.7	32%	0.322	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.1	115.1	173.4	-68.7	102.9	0	0	0	109.6	P923 L926 R967 A970 E971 A974 K991	P923-W989 HydrophobicContact CG-CB 4.25Å; P923-W989 HydrophobicContact CG-CD2 4.49Å; P923-W989 HydrophobicContact CG-CE3 4.15Å; P923-W989 WeakPolarHBondContact O-CZ3 3.34Å; L926-W989 HydrophobicContact CD2-CD2 3.8Å; L926-W989 HydrophobicContact CD2-CE3 3.43Å; L926-W989 VanDerWaalsContact CD2-CE3 3.43Å; L926-W989 HydrophobicContact CD2-CH2 3.68Å; L926-W989 HydrophobicContact CD2-CZ2 4.01Å; L926-W989 HydrophobicContact CD2-CZ3 3.36Å; L926-W989 HydrophobicContact CG-CZ3 4.21Å; R967-W989 VanDerWaalsContact CZ-CZ2 3.44Å; R967-W989 VanDerWaalsContact NH1-CD2 3.34Å; R967-W989 VanDerWaalsContact NH2-CZ2 3.33Å; A970-W989 HydrophobicContact CB-CH2 3.64Å; A970-W989 HydrophobicContact CB-CZ3 3.64Å; E971-W989 HydrophobicContact CG-CH2 3.92Å; E971-W989 HydrophobicContact CG-CZ2 3.89Å; A974-W989 HydrophobicContact CB-CH2 4.47Å; A974-W989 HydrophobicContact CB-CZ2 4Å; W989-K991 PolarHBondContact O-N 3.35Å
990	Y	86	Confident	65.2	Low	46 Å²	46	107.6 Å²	107.6	18%	0.18	58%	0.58	C	S	.	*			trans	-67.3	125	177.4	-179.7	-107.2	0	0	0	109.7	T925 A927 I961 S988 P992	T925-Y990 PolarHBondContact O-N 3.19Å; T925-Y990 PolarHBondContact OG1-O 2.96Å; T925-Y990 VanDerWaalsContact OG1-O 3.07Å; A927-Y990 HydrophobicContact CB-CD2 4.18Å; I961-Y990 HydrophobicContact CD1-CD1 4.47Å; I961-Y990 HydrophobicContact CD1-CD2 3.8Å; I961-Y990 HydrophobicContact CD1-CE1 4.15Å; I961-Y990 HydrophobicContact CD1-CE2 3.44Å; I961-Y990 VanDerWaalsContact CD1-CE2 3.44Å; I961-Y990 HydrophobicContact CD1-CG 4.3Å; I961-Y990 HydrophobicContact CG1-CD2 3.89Å; I961-Y990 HydrophobicContact CG1-CE2 4.07Å; I961-Y990 HydrophobicContact CG1-CG 4.24Å; I961-Y990 HydrophobicContact CG2-CD1 3.85Å; I961-Y990 HydrophobicContact CG2-CD2 4.34Å; I961-Y990 HydrophobicContact CG2-CE1 4.36Å; I961-Y990 HydrophobicContact CG2-CG 3.83Å; S988-Y990 PolarHBondContact O-N 2.97Å; Y990-P992 HydrophobicContact CE1-CB 4.25Å
991	K	80.3	Confident	63.6	Low	175 Å²	175	112.4 Å²	112.4	76%	0.761	61%	0.612	S	S	*	*			trans	-104.6	124.9	167.7	-63.1	-178.5	-179.4	-178.4	0	107.4	W989 K993	W989-K991 PolarHBondContact O-N 3.35Å; K991-K993 PolarHBondContact O-N 3.35Å
992	P	73.5	Confident	61.3	Low	102 Å²	102	117.7 Å²	117.7	66%	0.662	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-61.9	131	172.2	27.4	-33.3	0	0	0	109.2	Y990 S994	Y990-P992 HydrophobicContact CE1-CB 4.25Å; P992-S994 PolarHBondContact O-N 3.49Å
993	K	61.5	Low	59.4	Low	194 Å²	194	115.4 Å²	115.4	84%	0.843	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-72.8	123.3	171.9	-164.4	171.4	-176.2	-177.9	0	107.9	K991 L995	K991-K993 PolarHBondContact O-N 3.35Å; K993-L995 PolarHBondContact O-N 3.49Å
994	S	34.1	Very low	57.2	Low	107 Å²	107	117 Å²	117	75%	0.748	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-66.5	119.6	178.1	47.8	0	0	0	0	110.2	P992 S996	P992-S994 PolarHBondContact O-N 3.49Å; S994-S996 PolarHBondContact O-N 3.02Å
995	L	38.4	Very low	54.6	Low	170 Å²	170	116.5 Å²	116.5	89%	0.89	63%	0.63	S	S	*	*			trans	-77.8	99.7	165.2	-69.3	169.5	0	0	0	107.7	K993	K993-L995 PolarHBondContact O-N 3.49Å
996	S	28.6	Very low	51.8	Low	102 Å²	102	121.7 Å²	121.7	71%	0.713	66%	0.663	S	S	*	*			trans	-74.7	116.7	166.8	46.7	0	0	0	0	108.7	S994 T998	S994-S996 PolarHBondContact O-N 3.02Å; S996-T998 PolarHBondContact O-N 3.3Å
997	V	30.8	Very low	49.2	Very low	138 Å²	138	122.2 Å²	122.2	84%	0.836	66%	0.663	S	S	*	*			trans	-84.4	109.4	172.9	177.1	0	0	0	0	108.3
998	T	28.9	Very low	46.2	Very low	123 Å²	123	127.2 Å²	127.2	76%	0.755	69%	0.69	S	S	*	*			trans	-144.5	100.7	168.4	47.8	0	0	0	0	108.7	S996	S996-T998 PolarHBondContact O-N 3.3Å
999	S	33.8	Very low	43.3	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	72%	0.719	S	S	*	*			trans	-76.6	149.2	152.7	48.1	0	0	0	0	108.8
1000	E	34.5	Very low	40.4	Very low	181 Å²	181	137.7 Å²	137.7	85%	0.846	74%	0.737	S	S	*	*			cis	-146.6	-170.4	-9.7	-122.7	-147.2	129.4	0	0	108.9
1001	P	48.9	Very low	37.6	Very low	108 Å²	108	143.6 Å²	143.6	70%	0.701	76%	0.764	S	S	*	*			trans	-88.6	153.1	-157.2	35.9	-37.2	0	0	0	115.3
1002	E	26.8	Very low	35.1	Very low	197 Å²	197	139.3 Å²	139.3	92%	0.921	76%	0.761	S	S	*	*			trans	-135.8	154.4	141.2	-158.6	166.1	-140.8	0	0	107.9
1003	A	36	Very low	33	Very low	90 Å²	90	143.3 Å²	143.3	74%	0.744	77%	0.768	S	S	*	*			trans	-144	140.8	-167.7	0	0	0	0	0	112.1
1004	E	31.8	Very low	31.2	Very low	185 Å²	185	142.2 Å²	142.2	86%	0.864	77%	0.766	S	S	*	*			trans	-179.1	155.6	156	-106.5	-164.2	-167.6	0	0	109.2
1005	E	28.6	Very low	30.9	Very low	109 Å²	109	141.2 Å²	141.2	51%	0.509	76%	0.764	S	S	.	*			cis	-151.1	-157.9	-13.1	-152.4	-127.1	-175.9	0	0	109.7	K1007	E1005-K1007 IonicContact OE1-NZ 3.39Å; E1005-K1007 PolarHBondContact OE1-NZ 3.25Å; E1005-K1007 IonicContact OE2-NZ 3.22Å; E1005-K1007 PolarHBondContact OE2-NZ 2.75Å
1006	T	29.4	Very low	30.2	Very low	118 Å²	118	138.8 Å²	138.8	72%	0.724	76%	0.761	S	S	*	*			trans	75.1	102.8	178.6	70.5	0	0	0	0	116.3
1007	K	29.7	Very low	30	Very low	146 Å²	146	139 Å²	139	64%	0.635	76%	0.763	S	S	*	*				88.4	144.1	57.8	-82.5	-170.7	166.1	87.7	0	113.9	E1005	E1005-K1007 IonicContact OE1-NZ 3.39Å; E1005-K1007 PolarHBondContact OE1-NZ 3.25Å; E1005-K1007 IonicContact OE2-NZ 3.22Å; E1005-K1007 PolarHBondContact OE2-NZ 2.75Å
1008	D	27.5	Very low	29.6	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	77%	0.765	S	S	*	*			cis	-135.8	156.3	6	-84.1	-64.2	0	0	0	111.4
1009	E	28.1	Very low	29.6	Very low	201 Å²	201	144.8 Å²	144.8	94%	0.939	77%	0.768	S	S	*	*			trans	-143.8	159	148.8	-156.1	164.5	-137.4	0	0	109.9
1010	E	31.4	Very low	29.9	Very low	153 Å²	153	145.8 Å²	145.8	72%	0.715	77%	0.772	S	S	*	*			trans	-103.5	146.4	-151.7	-147.4	-158.9	143.7	0	0	116.4
1011	K	26.9	Very low	29.5	Very low	169 Å²	169	139.9 Å²	139.9	74%	0.735	76%	0.76	S	S	*	*			trans	86.8	82	143	-118.2	-170.9	-165	86.4	0	121.9
1012	A	28.6	Very low	28.5	Very low	85 Å²	85	141.1 Å²	141.1	70%	0.702	76%	0.761	S	S	*	*				74.3	126.8	113	0	0	0	0	0	124.6
1013	K	29.3	Very low	28.7	Very low	187 Å²	187	139.6 Å²	139.6	81%	0.813	75%	0.753	S	S	*	*			trans	76.8	152.6	151.6	-62.9	178.6	179.2	-167.5	0	117.8
1014	E	23.6	Very low	28.4	Very low	170 Å²	170	144.8 Å²	144.8	79%	0.794	76%	0.763	S	S	*	*			cis	-147.2	174.4	16.8	-158.1	149.1	-147.6	0	0	114.4
1015	A	26.6	Very low	28.3	Very low	86 Å²	86	139.3 Å²	139.3	71%	0.711	76%	0.756	S	S	*	*			trans	-5	134	171.7	0	0	0	0	0	120.9
1016	S	23.9	Very low	28.7	Very low	119 Å²	119	143.8 Å²	143.8	83%	0.832	77%	0.768	S	S	*	*				82.9	114.5	51.7	-173.7	0	0	0	0	115.9
1017	S	24.6	Very low	28.8	Very low	106 Å²	106	144.6 Å²	144.6	74%	0.741	76%	0.764	S	S	*	*			trans	-178.5	114.3	150.6	-179.4	0	0	0	0	115.3
1018	Y	23.7	Very low	29	Very low	227 Å²	227	143.3 Å²	143.3	89%	0.89	76%	0.763	S	S	*	*			trans	47.2	135.4	141.1	-82.1	-92	0	0	0	126.4
1019	L	27.6	Very low	29.2	Very low	156 Å²	156	145.2 Å²	145.2	82%	0.817	77%	0.768	S	S	*	*			trans	-75.4	178.5	153.3	-72.7	171.8	0	0	0	111.2
1020	P	39.4	Very low	29.7	Very low	129 Å²	129	144.2 Å²	144.2	84%	0.838	76%	0.763	S	S	*	*			cis	-136.5	-160.5	20.6	47.1	-27.1	0	0	0	113.8
1021	G	27.3	Very low	29.7	Very low	57 Å²	57	146.6 Å²	146.6	59%	0.588	77%	0.774	S	S	*	*			cis	179.5	-165.2	7.5	0	0	0	0	0	114.3
1022	N	27.1	Very low	30.2	Very low	133 Å²	133	146.5 Å²	146.5	71%	0.711	78%	0.777	S	S	*	*			trans	71.7	124.2	179.1	-59.7	87.4	0	0	0	116.3
1023	E	31	Very low	30.3	Very low	165 Å²	165	151.3 Å²	151.3	77%	0.771	78%	0.784	S	S	*	*			cis	79.7	139.1	40.6	-58.9	147.6	-149.6	0	0	112.3
1024	E	29.9	Very low	30.5	Very low	200 Å²	200	149 Å²	149	94%	0.935	78%	0.781	S	S	*	*			cis	-119.3	-176.3	4.4	-58.2	161.3	107.7	0	0	109.8
1025	G	31.1	Very low	31.1	Very low	70 Å²	70	147.2 Å²	147.2	72%	0.722	78%	0.777	S	S	*	*			cis	-173	161.4	-3.3	0	0	0	0	0	107.3
1026	R	36.7	Very low	31.5	Very low	203 Å²	203	150 Å²	150	77%	0.766	78%	0.78	S	S	*	*			cis	83.6	135.5	29.8	-113.4	-163.9	156.2	-138.2	-26.7	114.6	D1028	R1026-D1028 IonicContact CZ-OD2 2.75Å; R1026-D1028 IonicContact NE-OD2 3.15Å; R1026-D1028 IonicContact NH2-OD2 2.79Å; R1026-D1028 PolarHBondContact NH2-OD2 2.68Å; R1026-D1028 VanDerWaalsContact NH2-OD2 3.12Å
1027	E	30.9	Very low	32.1	Very low	135 Å²	135	153.2 Å²	153.2	63%	0.631	78%	0.782	S	S	*	*			cis	-136.5	145.9	11.5	-72.9	169.1	168.1	0	0	109.1
1028	D	32.8	Very low	32.6	Very low	118 Å²	118	156.4 Å²	156.4	63%	0.631	79%	0.79	S	S	*	*				71.6	154.4	87.3	-40.6	-28.4	0	0	0	111.8	R1026	R1026-D1028 IonicContact CZ-OD2 2.75Å; R1026-D1028 IonicContact NE-OD2 3.15Å; R1026-D1028 IonicContact NH2-OD2 2.79Å; R1026-D1028 PolarHBondContact NH2-OD2 2.68Å; R1026-D1028 VanDerWaalsContact NH2-OD2 3.12Å
1029	E	33.6	Very low	33	Very low	181 Å²	181	152.3 Å²	152.3	85%	0.846	78%	0.784	S	S	*	*			cis	-131.5	157.1	16.3	-61.4	154.6	141.3	0	0	108.7
1030	E	37.6	Very low	33.3	Very low	179 Å²	179	152.6 Å²	152.6	84%	0.836	78%	0.781	S	S	*	*			cis	75.5	121.8	42.7	-80.1	-176.7	-170.1	0	0	116.7
1031	E	32.3	Very low	32.8	Very low	203 Å²	203	152.7 Å²	152.7	95%	0.949	78%	0.775	S	S	*	*			trans	-159.8	141.8	148.3	-132.3	171.6	-150.7	0	0	108.8
1032	E	35.8	Very low	33.2	Very low	168 Å²	168	156.1 Å²	156.1	79%	0.785	78%	0.775	S	S	*	*			trans	-116.6	161	-169	-59.9	178.9	121.5	0	0	112.6
1033	E	31.8	Very low	33.5	Very low	185 Å²	185	153.7 Å²	153.7	86%	0.864	77%	0.769	S	S	*	*			trans	-179.4	114.9	151.4	-102	171.5	-168.2	0	0	104.9
1034	D	33.7	Very low	33.6	Very low	138 Å²	138	155.7 Å²	155.7	74%	0.738	77%	0.769	S	S	*	*				59.5	139.1	65.5	-66.5	-12.5	0	0	0	112.7
1035	D	35.9	Very low	34	Very low	134 Å²	134	151.1 Å²	151.1	72%	0.717	76%	0.76	S	S	*	*			cis	-153.9	-175	8.8	-148.2	-18.8	0	0	0	111.7
1036	D	35.3	Very low	33.8	Very low	145 Å²	145	158.8 Å²	158.8	78%	0.775	77%	0.767	S	S	*	*			trans	77.8	125.2	152.7	-79.8	-38.5	0	0	0	121.7
1037	E	36.2	Very low	33.7	Very low	186 Å²	186	160.3 Å²	160.3	87%	0.869	77%	0.773	S	S	*	*			trans	-73.1	157.1	169	-49.1	172.3	140.6	0	0	111.6
1038	D	34.5	Very low	33.8	Very low	172 Å²	172	169.2 Å²	169.2	92%	0.92	80%	0.8	S	S	*	*				-160.8	149.8	129	-137.7	-19.9	0	0	0	111.5
1039	D	33.1	Very low	33.9	Very low	141 Å²	141	171.8 Å²	171.8	75%	0.754	81%	0.809	S	S	*	*			trans	-114.2	-178.3	-163.2	-139.3	-30.8	0	0	0	113.6
1040	E	34	Very low	33.9	Very low	163 Å²	163	171.3 Å²	171.3	76%	0.762	81%	0.807	S	S	*	*			trans	31.2	119.2	158.4	-56.1	-165.2	150.7	0	0	120.5
1041	N	29.5	Very low	33.7	Very low	131 Å²	131	170.9 Å²	170.9	70%	0.701	81%	0.805	S	S	*	*				157.2	143.3	84.8	-147.8	9.2	0	0	0	117.5
1042	E	34	Very low	33.8	Very low	129 Å²	129	169 Å²	169	60%	0.603	80%	0.797	S	S	*	*			trans	34.3	113.8	147.1	-86.4	-144.7	99.7	0	0	125.6
1043	S	35.2	Very low	33.6	Very low	81 Å²	81	169.1 Å²	169.1	57%	0.566	80%	0.798	S	S	*	*				79.2	145.5	110.2	-65.1	0	0	0	0	123.6
1044	R	32.4	Very low	33.8	Very low	207 Å²	207	168 Å²	168	78%	0.781	79%	0.793	S	S	*	*			trans	77.5	147.1	168.2	-53	167.7	-178.9	88.3	1.8	114.5
1045	S	37.3	Very low	33.8	Very low	105 Å²	105	170.1 Å²	170.1	73%	0.734	80%	0.797	S	S	*	*			cis	-136	124.6	-1	60.2	0	0	0	0	109.8
1046	W	28.4	Very low	33.6	Very low	230 Å²	230	172.9 Å²	172.9	87%	0.871	80%	0.803	S	S	*	*				53	81.7	86.7	-70.8	53.7	0	0	0	115.3
1047	R	33.1	Very low	33.5	Very low	236 Å²	236	175.3 Å²	175.3	89%	0.891	81%	0.806	S	S	*	*				156.8	115.9	126	-85.6	161	178.9	164.4	1.2	113.5
1048	R	34.1	Very low	33.2	Very low	322 Å²	322	174.3 Å²	174.3	100%	1.215	80%	0.8	S	S	*	*			trans	-158.7	0	130.9	-106.2	170.3	-160.9	-121.1	3.6	109.4

Retrieved 1,048 of 1,048 residues in 1148.5 ms (Link to these results)

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