A0A3Q0KKW8_SCHMA Loading...

Putative hepatoma derived growth factor

AlphaFold DB , UniProt , Accession A0A3Q0KKW8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,154 aa.

						>A0A3Q0KKW8_SCHMA|A0A3Q0KKW8
MSHSPGDKVFAKIKGFPNWPARVNPLPHDVQIPKGKLPIFFYGTYQVSFVSVKNIVPYEKFKDKWGKPKPSAQFMAAMNEIEANPGIYMLGEDPRAENFLHQFYDFKPIGSECVRQYKRQYSRKSKVDNDQPLSTTKRGTSSNDQINRVSDDTSSEISTDQSRVNSLDPAPEDSNDEETLIDDTNHHLQFNNYQQVDISCPELLSPSSTIDRPSDEKDSYQENREARRLARKMQKKAEKKALKKAAKREAKRLAKEKRAERRARREAKRELKRLHKLEKCRLTEQGSLDFDVQESNTRNPDVNLESSSNHAWDENHWSSASHSEPVQTNEDSTDSSSNKPIVPTLDDKCANPLLFIHQPNDDDDGIFSTHQNDNSSSDGELLTKEMKFSNTTPSEYDKPEYSIGNKRTGIFLHSDESDNESSQLLNGAMKLESSEIPPKKKAKTELINDNDDDDDDRMCHSEMKIMSSSKSTGHHSQTNNEQDVKQSVAVTEATDLLAVEGFNNSKSPVSELLSDAVTKHGVITTTTSNNNNSKRKKSEQHRSRLRKKKPISISLDSEEDEINSEKKVINLHGSSSSSSPSPLSLSNDSDVENSKSKDQPSSQLKEKSRDSSPKSSTINKSNRSRKSRNQKSNQKTNNNNNLKMKSKQSEVKPTTASNTSVRDEKRISNDSSGIRHVTPSNDPVTQLNQCCRDLKTSLIKGHENFVEAVQLLNKVRSIPVRLPQLAEAWDLMDCIKKCRRYKLSSEVREAAQTTFQFFQSLQANTTKEELSKAQALIASHQNRIHSIQDSVMENTSKTDSLPTSTDVDNKQTLQNNTNSNNSESTSNHATDTNTNTTTTITNEPENLTADLEAKVDDVLSRIRATEERMAAAAVSSTRSDTPYKSISNHVTNSSIRSTGGRTIRASAVAAATAHMHDEEDEESVMSRVEQVAAYEAGSIDYSNSASLGSPPPPPPPPPSLSFSSVGPSDQLEAKTSPSVDHLDLDSRIQLFMSAASSQKSVRSSNSNPVISVGKSEMTPKAQSHHIQQNSTSITSSTSSSSTSSSTLPSTSLSSSSLLPVLLAKRKVIADKLAAVKASGSPIKSCHPVTSPLPSPTSNNNELNIVEKLSSSIITTPITTTTTTTIHTPPLLTKRLNTAKMPSKDEELYDLLDIC
					

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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	56.8	Low	88.5	Confident	157 Å²	157	54.1 Å²	54.1	77%	0.773	32%	0.324	S	S	*	.				0	139	0	-64.8	-179.9	-178.4	0	0	107	P57	M1-P57 HydrophobicContact SD-CG 3.72Å
2	S	78.7	Confident	89.1	Confident	116 Å²	116	58 Å²	58	81%	0.811	33%	0.334	S	S	*	.			trans	-78.2	149.1	164.7	45.4	0	0	0	0	109.1
3	H	86.5	Confident	89.5	Confident	30 Å²	30	57.3 Å²	57.3	14%	0.139	33%	0.327	C	S	.	.			trans	-124.8	139.2	171.6	-68.5	-80	0	0	0	109.3	D7 V23 L37	H3-D7 WeakPolarHBondContact CA-OD2 3.47Å; H3-D7 IonicContact CG-OD2 2.59Å; H3-D7 IonicContact ND1-OD2 3.94Å; H3-V23 HydrophobicContact CB-CG2 4.13Å; H3-L37 HydrophobicContact CB-CD1 3.83Å
4	S	88.7	Confident	89.8	Confident	62 Å²	62	68 Å²	68	43%	0.434	37%	0.368	S	S	.	.			trans	-100	158.3	178.6	-39.2	0	0	0	0	110.7	D7 V23	S4-D7 WeakPolarHBondContact CB-OD1 3.49Å; S4-D7 PolarHBondContact N-OD1 2.86Å; S4-D7 PolarHBondContact N-OD2 3.31Å; S4-D7 VanDerWaalsContact O-CB 3.29Å; S4-D7 WeakPolarHBondContact O-CB 3.47Å; S4-D7 VanDerWaalsContact O-CG 3.27Å; S4-D7 PolarHBondContact O-N 2.74Å; S4-V23 VanDerWaalsContact O-CB 3.3Å; S4-V23 WeakPolarHBondContact O-CB 3.41Å
5	P	90.2	Very high	89.9	Confident	94 Å²	94	68.9 Å²	68.9	61%	0.61	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	138.1	162.3	-22.1	34.6	0	0	0	110.8	P25	P5-P25 HydrophobicContact CB-CB 4.03Å
6	G	92.2	Very high	90	Very high	26 Å²	26	72.2 Å²	72.2	27%	0.268	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-22.6	-173.5	0	0	0	0	0	114.6	K8 V23	G6-K8 PolarHBondContact O-N 2.79Å; G6-V23 PolarHBondContact N-O 3Å
7	D	95.1	Very high	90.1	Very high	51 Å²	51	70.9 Å²	70.9	27%	0.273	40%	0.403	S	S	.	.			trans	-54.9	126.3	-176.9	-79.6	13.4	0	0	0	112.4	H3 S4 V9 R22 V23	H3-D7 WeakPolarHBondContact CA-OD2 3.47Å; H3-D7 IonicContact CG-OD2 2.59Å; H3-D7 IonicContact ND1-OD2 3.94Å; S4-D7 WeakPolarHBondContact CB-OD1 3.49Å; S4-D7 PolarHBondContact N-OD1 2.86Å; S4-D7 PolarHBondContact N-OD2 3.31Å; S4-D7 VanDerWaalsContact O-CB 3.29Å; S4-D7 WeakPolarHBondContact O-CB 3.47Å; S4-D7 VanDerWaalsContact O-CG 3.27Å; S4-D7 PolarHBondContact O-N 2.74Å; D7-V9 HydrophobicContact CB-CG1 4.33Å; D7-R22 CarbonylContact O-C 3.54Å; D7-R22 VanDerWaalsContact O-CA 3.25Å; D7-R22 WeakPolarHBondContact O-CA 3.49Å; D7-V23 HydrophobicContact CB-CB 4.48Å; D7-V23 HydrophobicContact CB-CG2 4.12Å; D7-V23 PolarHBondContact O-N 3.07Å
8	K	95.7	Very high	90.3	Very high	59 Å²	59	68.4 Å²	68.4	26%	0.257	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	127.9	167.8	-60.6	-170.7	-176.5	-161.8	0	109.7	G6 Y58 E59 I81	G6-K8 PolarHBondContact O-N 2.79Å; K8-Y58 VanDerWaalsContact C-CB 3.49Å; K8-Y58 HydrophobicContact CB-CD1 4.37Å; K8-Y58 HydrophobicContact CB-CG 4.19Å; K8-Y58 HydrophobicContact CD-CD1 4.39Å; K8-Y58 WeakPolarHBondContact O-CB 3.41Å; K8-Y58 PolarHBondContact O-N 3.37Å; K8-E59 WeakPolarHBondContact CB-OE1 3.49Å; K8-I81 HydrophobicContact CB-CD1 4.3Å; K8-I81 HydrophobicContact CD-CG1 4.11Å; K8-I81 HydrophobicContact CG-CG1 4.4Å; K8-I81 PolarHBondContact NZ-O 3.48Å
9	V	96.4	Very high	90.6	Very high	0 Å²	0	66 Å²	66	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	155	-175.6	-68.9	0	0	0	0	111.9	D7 A21 V23 I39 I55 V56	D7-V9 HydrophobicContact CB-CG1 4.33Å; V9-A21 HydrophobicContact CG2-CB 4.15Å; V9-A21 PolarHBondContact N-O 2.79Å; V9-A21 CarbonylContact O-C 3.5Å; V9-A21 WeakPolarHBondContact O-CA 3.21Å; V9-A21 PolarHBondContact O-N 3.27Å; V9-V23 HydrophobicContact CG1-CG2 4.26Å; V9-V23 HydrophobicContact CG2-CG2 4.34Å; V9-I39 HydrophobicContact CG2-CD1 4.19Å; V9-I55 HydrophobicContact CB-CG2 3.82Å; V9-I55 HydrophobicContact CG1-CG2 3.64Å; V9-I55 HydrophobicContact CG2-CG2 4.04Å; V9-V56 CarbonylContact C-O 3.6Å; V9-V56 VanDerWaalsContact CA-O 3.32Å; V9-V56 WeakPolarHBondContact CA-O 3.05Å; V9-V56 WeakPolarHBondContact CB-O 3.5Å
10	F	96.3	Very high	90.9	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	132.3	152.6	-75.2	-81.8	0	0	0	108.9	N18 W19 P20 V56 Y58 F61 W65 M78	F10-N18 HydrophobicContact CB-CB 4.16Å; F10-N18 HydrophobicContact CD1-CB 4.45Å; F10-W19 WeakPolarHBondContact CA-O 3.29Å; F10-P20 HydrophobicContact CE1-CG 4.08Å; F10-V56 HydrophobicContact CB-CG2 4.2Å; F10-V56 PolarHBondContact N-O 3.07Å; F10-V56 WeakPolarHBondContact O-CG2 3.23Å; F10-V56 PolarHBondContact O-N 3.29Å; F10-V56 VanDerWaalsContact O-N 3.1Å; F10-Y58 AromaticContact CD2-CD2 3.78Å; F10-Y58 HydrophobicContact CD2-CD2 3.78Å; F10-Y58 HydrophobicContact CD2-CE2 4.46Å; F10-Y58 HydrophobicContact CE1-CD2 4.27Å; F10-Y58 HydrophobicContact CE1-CE2 4.13Å; F10-Y58 AromaticContact CE2-CD2 3.28Å; F10-Y58 HydrophobicContact CE2-CD2 3.28Å; F10-Y58 AromaticContact CE2-CE2 3.6Å; F10-Y58 HydrophobicContact CE2-CE2 3.6Å; F10-Y58 HydrophobicContact CE2-CG 4.16Å; F10-Y58 HydrophobicContact CG-CD2 4.44Å; F10-Y58 AromaticContact CZ-CD2 3.57Å; F10-Y58 HydrophobicContact CZ-CD2 3.57Å; F10-Y58 AromaticContact CZ-CE2 3.39Å; F10-Y58 HydrophobicContact CZ-CE2 3.39Å; F10-F61 HydrophobicContact CD2-CB 4.13Å; F10-F61 HydrophobicContact CE2-CB 4.45Å; F10-W65 HydrophobicContact CB-CE3 3.72Å; F10-W65 HydrophobicContact CB-CZ3 4.09Å; F10-W65 HydrophobicContact CD1-CB 4.06Å; F10-W65 HydrophobicContact CD1-CE3 4.41Å; F10-W65 AromaticContact CD2-CE3 3.82Å; F10-W65 HydrophobicContact CD2-CE3 3.82Å; F10-W65 HydrophobicContact CD2-CZ3 4.49Å; F10-W65 HydrophobicContact CE1-CB 3.9Å; F10-W65 HydrophobicContact CE2-CB 4.49Å; F10-W65 HydrophobicContact CG-CB 4.43Å; F10-W65 AromaticContact CG-CE3 3.73Å; F10-W65 HydrophobicContact CG-CE3 3.73Å; F10-W65 HydrophobicContact CG-CZ3 4.49Å; F10-W65 HydrophobicContact CZ-CB 4.13Å; F10-M78 HydrophobicContact CE1-SD 4.13Å; F10-M78 HydrophobicContact CZ-SD 4.08Å
11	A	96.8	Very high	91.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140	179.1	0	0	0	0	0	111.5	N18 W19 A21 I39 F41	A11-N18 WeakPolarHBondContact O-CA 3.44Å; A11-W19 PolarHBondContact N-O 2.82Å; A11-W19 PolarHBondContact O-N 3.46Å; A11-A21 HydrophobicContact CB-CB 3.9Å; A11-I39 HydrophobicContact CB-CG2 3.75Å; A11-F41 HydrophobicContact CB-CE1 3.88Å; A11-F41 HydrophobicContact CB-CZ 3.88Å
12	K	95.7	Very high	93.1	Very high	101 Å²	101	52.2 Å²	52.2	44%	0.439	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.4	-179.7	-164.8	-179.2	-174	173	0	112.5	N18 N54	K12-N18 WeakPolarHBondContact CB-OD1 3.38Å; K12-N18 WeakPolarHBondContact CD-OD1 3.2Å; K12-N18 WeakPolarHBondContact CG-OD1 3.45Å; K12-N54 HydrophobicContact CB-CB 4.13Å; K12-N54 PolarHBondContact N-O 3.42Å; K12-N54 WeakPolarHBondContact O-CB 3.13Å; K12-N54 PolarHBondContact O-ND2 3.35Å
13	I	94.4	Very high	93.9	Very high	49 Å²	49	46.9 Å²	46.9	25%	0.251	26%	0.263	S	S	.	.			trans	-106.9	162.9	169.7	59.8	176.4	0	0	0	110.8	G15 F16 F41 V50	I13-G15 PolarHBondContact O-N 2.9Å; I13-F16 HydrophobicContact CD1-CB 4.38Å; I13-F16 HydrophobicContact CD1-CD2 3.72Å; I13-F16 HydrophobicContact CD1-CE2 4.22Å; I13-F16 HydrophobicContact CD1-CG 4.08Å; I13-F16 HydrophobicContact CG1-CB 3.79Å; I13-F16 HydrophobicContact CG1-CD2 3.71Å; I13-F16 HydrophobicContact CG1-CG 3.98Å; I13-F16 PolarHBondContact O-N 3.22Å; I13-F41 HydrophobicContact CG2-CE1 4.41Å; I13-F41 HydrophobicContact CG2-CZ 3.82Å; I13-V50 HydrophobicContact CG2-CG2 3.91Å
14	K	93	Very high	94.2	Very high	207 Å²	207	45.5 Å²	45.5	90%	0.9	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	125.4	-176.1	-174.7	-169	174.6	-165.9	0	109.7
15	G	91.7	Very high	94.1	Very high	82 Å²	82	43.7 Å²	43.7	85%	0.845	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.9	-15.9	178.7	0	0	0	0	0	114.8	I13	I13-G15 PolarHBondContact O-N 2.9Å
16	F	91.2	Very high	93.8	Very high	121 Å²	121	40.4 Å²	40.4	53%	0.531	22%	0.22	S	C	.	.	S	Bend	trans	-111.3	157.1	-175.8	-65.9	-96.2	0	0	0	111.9	I13	I13-F16 HydrophobicContact CD1-CB 4.38Å; I13-F16 HydrophobicContact CD1-CD2 3.72Å; I13-F16 HydrophobicContact CD1-CE2 4.22Å; I13-F16 HydrophobicContact CD1-CG 4.08Å; I13-F16 HydrophobicContact CG1-CB 3.79Å; I13-F16 HydrophobicContact CG1-CD2 3.71Å; I13-F16 HydrophobicContact CG1-CG 3.98Å; I13-F16 PolarHBondContact O-N 3.22Å
17	P	93	Very high	93	Very high	50 Å²	50	40.3 Å²	40.3	33%	0.325	22%	0.215	S	C	.	.			trans	-64.6	172.7	167.8	30.1	-36.3	0	0	0	111.4	W19	P17-W19 HydrophobicContact CG-CE3 4.27Å; P17-W19 PolarHBondContact O-N 3.05Å
18	N	93.9	Very high	91.6	Very high	26 Å²	26	44 Å²	44	14%	0.139	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	123.6	166.8	-45.2	-58.7	0	0	0	108.1	F10 A11 K12 W65	F10-N18 HydrophobicContact CB-CB 4.16Å; F10-N18 HydrophobicContact CD1-CB 4.45Å; A11-N18 WeakPolarHBondContact O-CA 3.44Å; K12-N18 WeakPolarHBondContact CB-OD1 3.38Å; K12-N18 WeakPolarHBondContact CD-OD1 3.2Å; K12-N18 WeakPolarHBondContact CG-OD1 3.45Å; N18-W65 HydrophobicContact CB-CD2 3.97Å; N18-W65 HydrophobicContact CB-CE3 4.1Å; N18-W65 HydrophobicContact CB-CG 4.14Å; N18-W65 VanDerWaalsContact ND2-CD2 3.33Å; N18-W65 PolarHBondContact ND2-NE1 3.3Å
19	W	96	Very high	90.6	Very high	23 Å²	23	45.9 Å²	45.9	9%	0.087	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.7	-171.1	-162.4	-88.1	0	0	0	111.2	F10 A11 P17 A21 F41 Y42 T44 Q73 F74 A77	F10-W19 WeakPolarHBondContact CA-O 3.29Å; A11-W19 PolarHBondContact N-O 2.82Å; A11-W19 PolarHBondContact O-N 3.46Å; P17-W19 HydrophobicContact CG-CE3 4.27Å; P17-W19 PolarHBondContact O-N 3.05Å; W19-A21 PolarHBondContact O-N 2.66Å; W19-F41 HydrophobicContact CB-CD1 3.94Å; W19-F41 HydrophobicContact CB-CE1 4.18Å; W19-F41 AromaticContact CD1-CD1 3.76Å; W19-F41 HydrophobicContact CG-CD1 4.05Å; W19-Y42 PolarHBondContact NE1-O 2.87Å; W19-T44 HydrophobicContact CZ2-CG2 3.91Å; W19-Q73 HydrophobicContact CH2-CB 4Å; W19-Q73 HydrophobicContact CZ2-CB 4.18Å; W19-F74 HydrophobicContact CD2-CD2 4.13Å; W19-F74 AromaticContact CE3-CD2 3.72Å; W19-F74 HydrophobicContact CE3-CD2 3.72Å; W19-F74 HydrophobicContact CE3-CE2 4.42Å; W19-F74 HydrophobicContact CH2-CB 3.83Å; W19-F74 HydrophobicContact CH2-CD2 4.25Å; W19-F74 HydrophobicContact CZ2-CB 4.43Å; W19-F74 HydrophobicContact CZ3-CB 4.02Å; W19-F74 AromaticContact CZ3-CD2 3.79Å; W19-F74 HydrophobicContact CZ3-CD2 3.79Å; W19-F74 HydrophobicContact CZ3-CG 4.42Å; W19-A77 HydrophobicContact CZ2-CB 4.06Å
20	P	96.5	Very high	89.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	128	175.9	-19.8	33	0	0	0	111.3	F10 Y42 Y58 F74 A77 M78 I81	F10-P20 HydrophobicContact CE1-CG 4.08Å; P20-Y42 PolarHBondContact O-N 2.87Å; P20-Y58 HydrophobicContact CB-CE2 4.48Å; P20-F74 HydrophobicContact CG-CE2 4.34Å; P20-A77 HydrophobicContact CB-CB 4.3Å; P20-A77 HydrophobicContact CG-CB 4Å; P20-M78 HydrophobicContact CB-SD 4.4Å; P20-M78 HydrophobicContact CG-CG 3.82Å; P20-M78 HydrophobicContact CG-SD 3.52Å; P20-M78 VanDerWaalsContact CG-SD 3.52Å; P20-I81 HydrophobicContact CB-CB 4.37Å; P20-I81 HydrophobicContact CB-CD1 4Å; P20-I81 HydrophobicContact CB-CG2 4.08Å
21	A	97.1	Very high	88.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	170.5	-170.7	0	0	0	0	0	112.1	V9 A11 W19 I39 F40 F41 Y42 I81	V9-A21 HydrophobicContact CG2-CB 4.15Å; V9-A21 PolarHBondContact N-O 2.79Å; V9-A21 CarbonylContact O-C 3.5Å; V9-A21 WeakPolarHBondContact O-CA 3.21Å; V9-A21 PolarHBondContact O-N 3.27Å; A11-A21 HydrophobicContact CB-CB 3.9Å; W19-A21 PolarHBondContact O-N 2.66Å; A21-I39 HydrophobicContact CB-CG2 3.55Å; A21-F40 CarbonylContact C-O 3.54Å; A21-F40 WeakPolarHBondContact CA-O 3.4Å; A21-F40 WeakPolarHBondContact CB-O 3.31Å; A21-F41 HydrophobicContact CB-CD1 4.43Å; A21-Y42 VanDerWaalsContact C-CE2 3.4Å; A21-I81 WeakPolarHBondContact O-CD1 3.43Å
22	R	96.1	Very high	88.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	154.8	165.6	65	167.2	-176	-98.4	-11.3	111.2	D7 N24 I39 F40 Y42 P85 I87 Y88	D7-R22 CarbonylContact O-C 3.54Å; D7-R22 VanDerWaalsContact O-CA 3.25Å; D7-R22 WeakPolarHBondContact O-CA 3.49Å; R22-N24 PolarHBondContact NE-OD1 2.64Å; R22-N24 PolarHBondContact NH2-OD1 2.73Å; R22-N24 PolarHBondContact O-N 3.43Å; R22-I39 WeakPolarHBondContact O-CA 3.49Å; R22-F40 HydrophobicContact CG-CB 3.99Å; R22-F40 HydrophobicContact CG-CD1 4.08Å; R22-F40 HydrophobicContact CG-CG 4.42Å; R22-F40 PolarHBondContact N-O 2.8Å; R22-F40 PolarHBondContact O-N 3.32Å; R22-Y42 HydrophobicContact CB-CE2 4.08Å; R22-Y42 HydrophobicContact CG-CE2 4.28Å; R22-P85 PolarHBondContact NH1-O 3.46Å; R22-I87 PolarHBondContact NH1-O 3Å; R22-I87 PolarHBondContact NH2-O 3.2Å; R22-Y88 PolarHBondContact NH2-O 3.36Å
23	V	95.6	Very high	88	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.018	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	116.5	163.3	-176.7	0	0	0	0	107.8	H3 S4 G6 D7 V9 L37 P38 I39	H3-V23 HydrophobicContact CB-CG2 4.13Å; S4-V23 VanDerWaalsContact O-CB 3.3Å; S4-V23 WeakPolarHBondContact O-CB 3.41Å; G6-V23 PolarHBondContact N-O 3Å; D7-V23 HydrophobicContact CB-CB 4.48Å; D7-V23 HydrophobicContact CB-CG2 4.12Å; D7-V23 PolarHBondContact O-N 3.07Å; V9-V23 HydrophobicContact CG1-CG2 4.26Å; V9-V23 HydrophobicContact CG2-CG2 4.34Å; V23-L37 HydrophobicContact CG1-CB 4.37Å; V23-L37 HydrophobicContact CG2-CD1 4.31Å; V23-P38 WeakPolarHBondContact CA-O 3.35Å; V23-I39 HydrophobicContact CB-CD1 4.34Å; V23-I39 HydrophobicContact CG2-CD1 3.83Å
24	N	91.6	Very high	87.6	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-83.9	127.8	-171.2	-160.1	64.6	0	0	0	110.9	R22 L26 P38 F40 L100	R22-N24 PolarHBondContact NE-OD1 2.64Å; R22-N24 PolarHBondContact NH2-OD1 2.73Å; R22-N24 PolarHBondContact O-N 3.43Å; N24-L26 PolarHBondContact O-N 3.03Å; N24-P38 PolarHBondContact N-O 2.68Å; N24-P38 VanDerWaalsContact O-CG 3.31Å; N24-P38 WeakPolarHBondContact O-CG 3.45Å; N24-F40 HydrophobicContact CB-CB 4.06Å; N24-L100 VanDerWaalsContact ND2-CD2 3.28Å; N24-L100 WeakPolarHBondContact ND2-CD2 3.11Å
25	P	87.5	Confident	87.4	Confident	24 Å²	24	57.4 Å²	57.4	16%	0.156	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-64.9	130.4	172.3	26.8	-32.2	0	0	0	110.3	P5 M89 L90	P5-P25 HydrophobicContact CB-CB 4.03Å; P25-M89 HydrophobicContact CG-CG 3.52Å; P25-M89 HydrophobicContact CG-SD 4.06Å; P25-L90 HydrophobicContact CG-CB 4.38Å
26	L	83.2	Confident	87.5	Confident	25 Å²	25	57.7 Å²	57.7	13%	0.131	30%	0.297	C	S	.	.			trans	-126.8	137.8	174.4	-64.1	-177.8	0	0	0	109.9	N24 V30 P38 F49 Y104 F106	N24-L26 PolarHBondContact O-N 3.03Å; L26-V30 HydrophobicContact CD1-CB 4.33Å; L26-V30 HydrophobicContact CD1-CG1 3.98Å; L26-P38 HydrophobicContact CD1-CB 3.51Å; L26-P38 HydrophobicContact CD1-CG 3.77Å; L26-P38 HydrophobicContact CG-CB 4.07Å; L26-P38 HydrophobicContact CG-CG 4.06Å; L26-F49 HydrophobicContact CD1-CE1 4.37Å; L26-Y104 HydrophobicContact CD1-CD1 4.49Å; L26-Y104 HydrophobicContact CD1-CE1 4.03Å; L26-Y104 HydrophobicContact CD1-CE2 4.25Å; L26-Y104 HydrophobicContact CD2-CD2 3.79Å; L26-Y104 HydrophobicContact CD2-CE2 3.56Å; L26-Y104 HydrophobicContact CD2-CG 4.44Å; L26-F106 HydrophobicContact CD2-CZ 4.41Å
27	P	76.2	Confident	87.6	Confident	25 Å²	25	53.5 Å²	53.5	16%	0.162	28%	0.28	C	S	.	.			trans	-47	145.7	163	-31.7	35.2	0	0	0	113	D29 V30 L90 F106	P27-D29 PolarHBondContact O-N 3.36Å; P27-D29 VanDerWaalsContact O-N 3.08Å; P27-V30 PolarHBondContact O-N 2.67Å; P27-L90 VanDerWaalsContact CD-CD2 3.47Å; P27-L90 HydrophobicContact CG-CD2 3.69Å; P27-F106 HydrophobicContact CB-CD1 4.26Å; P27-F106 HydrophobicContact CB-CE1 4.05Å; P27-F106 HydrophobicContact CG-CD1 3.99Å; P27-F106 HydrophobicContact CG-CE1 3.58Å
28	H	66.4	Low	87.7	Confident	128 Å²	128	51.3 Å²	51.3	59%	0.593	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.3	-174.9	-72.6	-26.8	0	0	0	115	V30 Y117	H28-V30 VanDerWaalsContact C-N 3.28Å; H28-V30 PolarHBondContact O-N 3.21Å; H28-Y117 AromaticContact CD2-CE1 3.73Å; H28-Y117 AromaticContact CD2-CE2 3.61Å; H28-Y117 AromaticContact CD2-CZ 3.35Å; H28-Y117 AromaticContact CE1-CE1 3.8Å; H28-Y117 AromaticContact CG-CZ 3.86Å; H28-Y117 PolarHBondContact N-OH 3.04Å; H28-Y117 AromaticContact NE2-CD1 3.72Å; H28-Y117 AromaticContact NE2-CE1 3.34Å; H28-Y117 VanDerWaalsContact NE2-CE1 3.34Å; H28-Y117 WeakPolarHBondContact NE2-CE1 3.33Å; H28-Y117 AromaticContact NE2-CZ 3.52Å
29	D	73.9	Confident	87.8	Confident	98 Å²	98	50.1 Å²	50.1	52%	0.524	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.7	178.8	-59.1	-45.3	0	0	0	113.4	P27 Q31	P27-D29 PolarHBondContact O-N 3.36Å; P27-D29 VanDerWaalsContact O-N 3.08Å; D29-Q31 PolarHBondContact O-N 3.44Å
30	V	77.3	Confident	87.8	Confident	20 Å²	20	49 Å²	49	12%	0.121	26%	0.255	C	S	.	.	S	Bend	trans	-83.2	113.9	-179.9	-175.2	0	0	0	0	110.8	L26 P27 H28 I32 Y104 F106	L26-V30 HydrophobicContact CD1-CB 4.33Å; L26-V30 HydrophobicContact CD1-CG1 3.98Å; P27-V30 PolarHBondContact O-N 2.67Å; H28-V30 VanDerWaalsContact C-N 3.28Å; H28-V30 PolarHBondContact O-N 3.21Å; V30-I32 PolarHBondContact O-N 3.41Å; V30-Y104 HydrophobicContact CG1-CD1 3.72Å; V30-Y104 HydrophobicContact CG1-CE1 4.31Å; V30-Y104 HydrophobicContact CG1-CG 4.27Å; V30-F106 HydrophobicContact CG2-CD1 3.81Å; V30-F106 HydrophobicContact CG2-CE1 3.32Å; V30-F106 HydrophobicContact CG2-CZ 4.03Å
31	Q	79.7	Confident	87.8	Confident	178 Å²	178	49.3 Å²	49.3	83%	0.832	26%	0.257	S	S	*	.			trans	-72.6	97.4	-175.5	-62.7	-174.8	24.1	0	0	112.8	D29 P33	D29-Q31 PolarHBondContact O-N 3.44Å; Q31-P33 WeakPolarHBondContact O-CD 3.3Å
32	I	86	Confident	87.7	Confident	80 Å²	80	49.4 Å²	49.4	41%	0.41	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-71	125.1	174.6	-55.7	170.1	0	0	0	110.1	V30 K34 K36 P38 F49	V30-I32 PolarHBondContact O-N 3.41Å; I32-K34 PolarHBondContact O-N 3.32Å; I32-K36 WeakPolarHBondContact CG2-O 3.35Å; I32-P38 HydrophobicContact CD1-CG 4.14Å; I32-F49 HydrophobicContact CB-CE1 4.37Å; I32-F49 HydrophobicContact CG1-CE1 4.2Å; I32-F49 HydrophobicContact CG2-CD1 4.23Å; I32-F49 HydrophobicContact CG2-CE1 4.17Å
33	P	87.6	Confident	87.6	Confident	55 Å²	55	50.4 Å²	50.4	36%	0.357	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-64.7	134	178.2	-21.6	32.8	0	0	0	112.8	Q31 G35 K36 F49	Q31-P33 WeakPolarHBondContact O-CD 3.3Å; P33-G35 PolarHBondContact O-N 3.44Å; P33-K36 HydrophobicContact CB-CD 4.16Å; P33-K36 HydrophobicContact CG-CD 4.49Å; P33-K36 WeakPolarHBondContact O-CB 3.38Å; P33-K36 PolarHBondContact O-N 3.09Å; P33-K36 VanDerWaalsContact O-N 3.07Å; P33-F49 HydrophobicContact CG-CD2 4.25Å; P33-F49 HydrophobicContact CG-CG 4.23Å
34	K	86	Confident	87.5	Confident	214 Å²	214	52.3 Å²	52.3	93%	0.93	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	130.7	-178.6	-64.6	-174.2	178.7	-175.8	0	112.2	I32 K36	I32-K34 PolarHBondContact O-N 3.32Å; K34-K36 VanDerWaalsContact C-N 3.34Å
35	G	89.6	Confident	87.6	Confident	52 Å²	52	56.4 Å²	56.4	54%	0.536	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	12.1	-179.7	0	0	0	0	0	115.2	P33 S51 V52	P33-G35 PolarHBondContact O-N 3.44Å; G35-S51 WeakPolarHBondContact O-CA 3.48Å; G35-S51 PolarHBondContact O-OG 3.32Å; G35-V52 PolarHBondContact O-N 3.31Å
36	K	93.1	Very high	87.9	Confident	88 Å²	88	60.8 Å²	60.8	38%	0.383	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	162.7	173.4	-58.9	-170.3	168.4	-160	0	112.1	I32 P33 K34 F49 V50	I32-K36 WeakPolarHBondContact CG2-O 3.35Å; P33-K36 HydrophobicContact CB-CD 4.16Å; P33-K36 HydrophobicContact CG-CD 4.49Å; P33-K36 WeakPolarHBondContact O-CB 3.38Å; P33-K36 PolarHBondContact O-N 3.09Å; P33-K36 VanDerWaalsContact O-N 3.07Å; K34-K36 VanDerWaalsContact C-N 3.34Å; K36-F49 HydrophobicContact CB-CB 4.25Å; K36-F49 HydrophobicContact CD-CB 3.66Å; K36-F49 WeakPolarHBondContact CD-O 3.41Å; K36-F49 PolarHBondContact NZ-O 3.45Å; K36-V50 CarbonylContact C-O 3.59Å; K36-V50 WeakPolarHBondContact CA-O 3.48Å; K36-V50 WeakPolarHBondContact CB-O 3.38Å
37	L	93.1	Very high	88.4	Confident	34 Å²	34	60.5 Å²	60.5	18%	0.178	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	148	169.5	-65.9	171.4	0	0	0	109.5	H3 V23 I39 F49 V50 V52 I55	H3-L37 HydrophobicContact CB-CD1 3.83Å; V23-L37 HydrophobicContact CG1-CB 4.37Å; V23-L37 HydrophobicContact CG2-CD1 4.31Å; L37-I39 HydrophobicContact CB-CD1 4.3Å; L37-F49 WeakPolarHBondContact O-CA 3.48Å; L37-V50 PolarHBondContact N-O 3.42Å; L37-V50 PolarHBondContact O-N 2.95Å; L37-V52 HydrophobicContact CD1-CG2 4.26Å; L37-V52 HydrophobicContact CG-CG2 4.16Å; L37-I55 HydrophobicContact CB-CD1 3.89Å; L37-I55 HydrophobicContact CD1-CD1 3.96Å; L37-I55 HydrophobicContact CG-CD1 4.31Å
38	P	94.5	Very high	89.2	Confident	4 Å²	4	61.3 Å²	61.3	3%	0.026	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	124.1	167.9	30.6	-34.1	0	0	0	109.6	V23 N24 L26 I32 F49	V23-P38 WeakPolarHBondContact CA-O 3.35Å; N24-P38 PolarHBondContact N-O 2.68Å; N24-P38 VanDerWaalsContact O-CG 3.31Å; N24-P38 WeakPolarHBondContact O-CG 3.45Å; L26-P38 HydrophobicContact CD1-CB 3.51Å; L26-P38 HydrophobicContact CD1-CG 3.77Å; L26-P38 HydrophobicContact CG-CB 4.07Å; L26-P38 HydrophobicContact CG-CG 4.06Å; I32-P38 HydrophobicContact CD1-CG 4.14Å; P38-F49 HydrophobicContact CB-CD1 4.16Å; P38-F49 HydrophobicContact CB-CE1 3.99Å
39	I	96	Very high	90.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.2	-178.4	-62.4	-54.5	0	0	0	109.9	V9 A11 A21 R22 V23 L37 F41 V47 S48 V50 I55	V9-I39 HydrophobicContact CG2-CD1 4.19Å; A11-I39 HydrophobicContact CB-CG2 3.75Å; A21-I39 HydrophobicContact CB-CG2 3.55Å; R22-I39 WeakPolarHBondContact O-CA 3.49Å; V23-I39 HydrophobicContact CB-CD1 4.34Å; V23-I39 HydrophobicContact CG2-CD1 3.83Å; L37-I39 HydrophobicContact CB-CD1 4.3Å; I39-F41 HydrophobicContact CB-CE2 3.9Å; I39-F41 HydrophobicContact CB-CZ 4.43Å; I39-F41 HydrophobicContact CG2-CD2 3.87Å; I39-F41 HydrophobicContact CG2-CE1 4.47Å; I39-F41 HydrophobicContact CG2-CE2 3.42Å; I39-F41 VanDerWaalsContact CG2-CE2 3.42Å; I39-F41 HydrophobicContact CG2-CZ 3.77Å; I39-V47 CarbonylContact O-C 3.53Å; I39-V47 VanDerWaalsContact O-CA 3.32Å; I39-V47 WeakPolarHBondContact O-CA 3.47Å; I39-V47 WeakPolarHBondContact O-CG1 3.33Å; I39-S48 PolarHBondContact N-O 2.78Å; I39-S48 PolarHBondContact O-N 2.85Å; I39-V50 HydrophobicContact CB-CB 4.45Å; I39-V50 HydrophobicContact CB-CG2 3.9Å; I39-V50 HydrophobicContact CG1-CB 3.76Å; I39-V50 HydrophobicContact CG1-CG2 3.77Å; I39-V50 HydrophobicContact CG2-CG2 4.48Å; I39-I55 HydrophobicContact CD1-CD1 3.76Å; I39-I55 HydrophobicContact CD1-CG1 4.24Å; I39-I55 HydrophobicContact CG1-CD1 3.91Å; I39-I55 HydrophobicContact CG1-CG1 4.33Å
40	F	96.2	Very high	91.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.4	168.4	171.2	-83.8	0	0	0	109.4	A21 R22 N24 Y42 Y45 V47 I87 Y88 F99	A21-F40 CarbonylContact C-O 3.54Å; A21-F40 WeakPolarHBondContact CA-O 3.4Å; A21-F40 WeakPolarHBondContact CB-O 3.31Å; R22-F40 HydrophobicContact CG-CB 3.99Å; R22-F40 HydrophobicContact CG-CD1 4.08Å; R22-F40 HydrophobicContact CG-CG 4.42Å; R22-F40 PolarHBondContact N-O 2.8Å; R22-F40 PolarHBondContact O-N 3.32Å; N24-F40 HydrophobicContact CB-CB 4.06Å; F40-Y42 HydrophobicContact CD1-CD1 4.35Å; F40-Y42 HydrophobicContact CD1-CE1 4.36Å; F40-Y42 AromaticContact CE1-CD1 3.74Å; F40-Y42 HydrophobicContact CE1-CD1 3.74Å; F40-Y42 AromaticContact CE1-CE1 3.93Å; F40-Y42 HydrophobicContact CE1-CE1 3.93Å; F40-Y42 HydrophobicContact CE1-CG 4.19Å; F40-Y45 HydrophobicContact CE2-CD1 4.43Å; F40-Y45 AromaticContact CZ-CD1 3.82Å; F40-Y45 HydrophobicContact CZ-CD1 3.82Å; F40-V47 HydrophobicContact CB-CG1 4.45Å; F40-V47 HydrophobicContact CD2-CG2 4.27Å; F40-I87 HydrophobicContact CE1-CG2 4.17Å; F40-I87 HydrophobicContact CZ-CG2 4.09Å; F40-I87 WeakPolarHBondContact CZ-O 3.2Å; F40-Y88 HydrophobicContact CE2-CD2 4.02Å; F40-Y88 HydrophobicContact CZ-CD2 4.08Å; F40-F99 AromaticContact CD2-CE1 3.88Å; F40-F99 HydrophobicContact CD2-CE1 3.88Å; F40-F99 HydrophobicContact CD2-CZ 4.06Å; F40-F99 AromaticContact CE2-CE1 3.71Å; F40-F99 HydrophobicContact CE2-CE1 3.71Å; F40-F99 AromaticContact CE2-CZ 3.68Å; F40-F99 HydrophobicContact CE2-CZ 3.68Å
41	F	96.7	Very high	92.4	Very high	7 Å²	7	54.5 Å²	54.5	3%	0.031	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.7	-177.6	-68.9	-104.3	0	0	0	110.2	A11 I13 W19 A21 I39 Y45 Q46 S48 V50	A11-F41 HydrophobicContact CB-CE1 3.88Å; A11-F41 HydrophobicContact CB-CZ 3.88Å; I13-F41 HydrophobicContact CG2-CE1 4.41Å; I13-F41 HydrophobicContact CG2-CZ 3.82Å; W19-F41 HydrophobicContact CB-CD1 3.94Å; W19-F41 HydrophobicContact CB-CE1 4.18Å; W19-F41 AromaticContact CD1-CD1 3.76Å; W19-F41 HydrophobicContact CG-CD1 4.05Å; A21-F41 HydrophobicContact CB-CD1 4.43Å; I39-F41 HydrophobicContact CB-CE2 3.9Å; I39-F41 HydrophobicContact CB-CZ 4.43Å; I39-F41 HydrophobicContact CG2-CD2 3.87Å; I39-F41 HydrophobicContact CG2-CE1 4.47Å; I39-F41 HydrophobicContact CG2-CE2 3.42Å; I39-F41 VanDerWaalsContact CG2-CE2 3.42Å; I39-F41 HydrophobicContact CG2-CZ 3.77Å; F41-Y45 WeakPolarHBondContact O-CA 3.46Å; F41-Y45 PolarHBondContact O-N 3.14Å; F41-Q46 WeakPolarHBondContact CD2-O 3.37Å; F41-Q46 PolarHBondContact N-O 3.05Å; F41-S48 WeakPolarHBondContact CE2-OG 3.45Å; F41-V50 HydrophobicContact CE2-CG2 4.17Å; F41-V50 HydrophobicContact CZ-CG2 3.91Å
42	Y	96	Very high	93.1	Very high	1 Å²	1	49 Å²	49	0%	0.004	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	153.3	178.8	-65.5	-82.8	0	0	0	111.2	W19 P20 A21 R22 F40 T44 A77 E80 I81 P85 I87	W19-Y42 PolarHBondContact NE1-O 2.87Å; P20-Y42 PolarHBondContact O-N 2.87Å; A21-Y42 VanDerWaalsContact C-CE2 3.4Å; R22-Y42 HydrophobicContact CB-CE2 4.08Å; R22-Y42 HydrophobicContact CG-CE2 4.28Å; F40-Y42 HydrophobicContact CD1-CD1 4.35Å; F40-Y42 HydrophobicContact CD1-CE1 4.36Å; F40-Y42 AromaticContact CE1-CD1 3.74Å; F40-Y42 HydrophobicContact CE1-CD1 3.74Å; F40-Y42 AromaticContact CE1-CE1 3.93Å; F40-Y42 HydrophobicContact CE1-CE1 3.93Å; F40-Y42 HydrophobicContact CE1-CG 4.19Å; Y42-T44 PolarHBondContact O-N 3.36Å; Y42-A77 WeakPolarHBondContact O-CB 3.25Å; Y42-E80 VanDerWaalsContact CA-OE1 3.23Å; Y42-E80 WeakPolarHBondContact CA-OE1 3.28Å; Y42-E80 VanDerWaalsContact CB-OE1 3.31Å; Y42-E80 WeakPolarHBondContact CB-OE1 3.34Å; Y42-E80 HydrophobicContact CD1-CB 4.38Å; Y42-E80 HydrophobicContact CD1-CG 3.91Å; Y42-E80 WeakPolarHBondContact CD1-OE1 3.4Å; Y42-I81 HydrophobicContact CD1-CB 4.4Å; Y42-I81 HydrophobicContact CD2-CB 3.65Å; Y42-I81 HydrophobicContact CD2-CD1 3.72Å; Y42-I81 HydrophobicContact CD2-CG1 3.77Å; Y42-I81 HydrophobicContact CE1-CB 4.48Å; Y42-I81 HydrophobicContact CE2-CB 3.75Å; Y42-I81 HydrophobicContact CE2-CD1 3.47Å; Y42-I81 VanDerWaalsContact CE2-CD1 3.47Å; Y42-I81 HydrophobicContact CE2-CG1 3.38Å; Y42-I81 HydrophobicContact CG-CB 4Å; Y42-P85 WeakPolarHBondContact OH-CA 3.49Å; Y42-P85 PolarHBondContact OH-O 3.09Å; Y42-I87 HydrophobicContact CD1-CG2 4.11Å; Y42-I87 HydrophobicContact CE1-CG2 4.02Å
43	G	93.4	Very high	93.5	Very high	21 Å²	21	53.8 Å²	53.8	22%	0.216	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	-14.8	179.4	0	0	0	0	0	116.1	E80	G43-E80 PolarHBondContact N-OE1 2.85Å
44	T	93.2	Very high	93.9	Very high	44 Å²	44	53.8 Å²	53.8	27%	0.27	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-14.4	171.9	65	0	0	0	0	113.2	W19 Y42 Q46	W19-T44 HydrophobicContact CZ2-CG2 3.91Å; Y42-T44 PolarHBondContact O-N 3.36Å; T44-Q46 PolarHBondContact O-N 3.19Å; T44-Q46 VanDerWaalsContact O-N 3.07Å
45	Y	94.3	Very high	94.3	Very high	87 Å²	87	43.9 Å²	43.9	34%	0.341	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	26.5	-177	-47.6	-55.6	0	0	0	114.1	F40 F41 E80 I87 Y88 F99	F40-Y45 HydrophobicContact CE2-CD1 4.43Å; F40-Y45 AromaticContact CZ-CD1 3.82Å; F40-Y45 HydrophobicContact CZ-CD1 3.82Å; F41-Y45 WeakPolarHBondContact O-CA 3.46Å; F41-Y45 PolarHBondContact O-N 3.14Å; Y45-E80 WeakPolarHBondContact CE1-OE1 3.4Å; Y45-E80 PolarHBondContact OH-OE2 3.28Å; Y45-I87 HydrophobicContact CE1-CD1 3.93Å; Y45-Y88 HydrophobicContact CD1-CD2 4.24Å; Y45-Y88 AromaticContact CD1-CE2 4Å; Y45-Y88 HydrophobicContact CD1-CE2 4Å; Y45-Y88 HydrophobicContact CE1-CE2 4.21Å; Y45-Y88 HydrophobicContact CG-CE2 4.27Å; Y45-F99 VanDerWaalsContact O-CZ 3.31Å; Y45-F99 WeakPolarHBondContact O-CZ 3.39Å
46	Q	94.1	Very high	94.6	Very high	116 Å²	116	43.2 Å²	43.2	54%	0.542	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	145.4	175.7	-66.3	-174.9	-0.8	0	0	110.5	F41 T44	F41-Q46 WeakPolarHBondContact CD2-O 3.37Å; F41-Q46 PolarHBondContact N-O 3.05Å; T44-Q46 PolarHBondContact O-N 3.19Å; T44-Q46 VanDerWaalsContact O-N 3.07Å
47	V	93.4	Very high	94.7	Very high	18 Å²	18	39.9 Å²	39.9	11%	0.109	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	133	175.3	-149.4	0	0	0	0	109.8	I39 F40 F99 F103 Y104	I39-V47 CarbonylContact O-C 3.53Å; I39-V47 VanDerWaalsContact O-CA 3.32Å; I39-V47 WeakPolarHBondContact O-CA 3.47Å; I39-V47 WeakPolarHBondContact O-CG1 3.33Å; F40-V47 HydrophobicContact CB-CG1 4.45Å; F40-V47 HydrophobicContact CD2-CG2 4.27Å; V47-F99 HydrophobicContact CG2-CE1 3.75Å; V47-F99 HydrophobicContact CG2-CZ 3.8Å; V47-F103 HydrophobicContact CB-CD1 4.41Å; V47-F103 HydrophobicContact CB-CG 4.32Å; V47-F103 HydrophobicContact CG2-CD1 4.27Å; V47-F103 HydrophobicContact CG2-CD2 3.85Å; V47-F103 HydrophobicContact CG2-CE1 4.45Å; V47-F103 HydrophobicContact CG2-CE2 4.07Å; V47-F103 HydrophobicContact CG2-CG 3.97Å; V47-F103 HydrophobicContact CG2-CZ 4.36Å; V47-Y104 HydrophobicContact CB-CE2 4.47Å; V47-Y104 HydrophobicContact CG1-CE2 4.02Å; V47-Y104 WeakPolarHBondContact CG1-OH 3.46Å
48	S	93.3	Very high	94.8	Very high	42 Å²	42	38.5 Å²	38.5	29%	0.294	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	160	177.9	72.7	0	0	0	0	114.3	I39 F41 V50	I39-S48 PolarHBondContact N-O 2.78Å; I39-S48 PolarHBondContact O-N 2.85Å; F41-S48 WeakPolarHBondContact CE2-OG 3.45Å; S48-V50 PolarHBondContact O-N 3.22Å
49	F	94.5	Very high	94.7	Very high	57 Å²	57	43.8 Å²	43.8	25%	0.25	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	105.3	175.4	-63.1	-70.3	0	0	0	111.6	L26 I32 P33 K36 L37 P38 Y104	L26-F49 HydrophobicContact CD1-CE1 4.37Å; I32-F49 HydrophobicContact CB-CE1 4.37Å; I32-F49 HydrophobicContact CG1-CE1 4.2Å; I32-F49 HydrophobicContact CG2-CD1 4.23Å; I32-F49 HydrophobicContact CG2-CE1 4.17Å; P33-F49 HydrophobicContact CG-CD2 4.25Å; P33-F49 HydrophobicContact CG-CG 4.23Å; K36-F49 HydrophobicContact CB-CB 4.25Å; K36-F49 HydrophobicContact CD-CB 3.66Å; K36-F49 WeakPolarHBondContact CD-O 3.41Å; K36-F49 PolarHBondContact NZ-O 3.45Å; L37-F49 WeakPolarHBondContact O-CA 3.48Å; P38-F49 HydrophobicContact CB-CD1 4.16Å; P38-F49 HydrophobicContact CB-CE1 3.99Å; F49-Y104 HydrophobicContact CE1-CE1 4.33Å; F49-Y104 AromaticContact CE2-CE1 3.95Å; F49-Y104 HydrophobicContact CE2-CE1 3.95Å; F49-Y104 HydrophobicContact CZ-CD1 4.36Å; F49-Y104 AromaticContact CZ-CE1 3.59Å; F49-Y104 HydrophobicContact CZ-CE1 3.59Å
50	V	95.2	Very high	94.6	Very high	7 Å²	7	50.6 Å²	50.6	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	143.1	-179	-175.1	0	0	0	0	110	I13 K36 L37 I39 F41 S48 N54 I55	I13-V50 HydrophobicContact CG2-CG2 3.91Å; K36-V50 CarbonylContact C-O 3.59Å; K36-V50 WeakPolarHBondContact CA-O 3.48Å; K36-V50 WeakPolarHBondContact CB-O 3.38Å; L37-V50 PolarHBondContact N-O 3.42Å; L37-V50 PolarHBondContact O-N 2.95Å; I39-V50 HydrophobicContact CB-CB 4.45Å; I39-V50 HydrophobicContact CB-CG2 3.9Å; I39-V50 HydrophobicContact CG1-CB 3.76Å; I39-V50 HydrophobicContact CG1-CG2 3.77Å; I39-V50 HydrophobicContact CG2-CG2 4.48Å; F41-V50 HydrophobicContact CE2-CG2 4.17Å; F41-V50 HydrophobicContact CZ-CG2 3.91Å; S48-V50 PolarHBondContact O-N 3.22Å; V50-N54 HydrophobicContact CG1-CB 3.78Å; V50-I55 HydrophobicContact CB-CD1 4.07Å; V50-I55 HydrophobicContact CB-CG1 4.24Å; V50-I55 HydrophobicContact CG1-CD1 4.16Å; V50-I55 HydrophobicContact CG1-CG1 3.85Å
51	S	94.2	Very high	94.4	Very high	40 Å²	40	53.3 Å²	53.3	28%	0.28	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	143.3	178.8	-172.9	0	0	0	0	111.8	G35 K53 N54	G35-S51 WeakPolarHBondContact O-CA 3.48Å; G35-S51 PolarHBondContact O-OG 3.32Å; S51-K53 PolarHBondContact O-N 3.09Å; S51-K53 VanDerWaalsContact O-N 3.08Å; S51-N54 WeakPolarHBondContact O-CA 3.45Å; S51-N54 WeakPolarHBondContact O-CB 3.27Å; S51-N54 PolarHBondContact O-N 3.46Å
52	V	94.3	Very high	94.2	Very high	61 Å²	61	56.7 Å²	56.7	37%	0.37	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-52.6	-35.6	-177.1	-175.4	0	0	0	0	112.9	G35 L37 N54 I55	G35-V52 PolarHBondContact O-N 3.31Å; L37-V52 HydrophobicContact CD1-CG2 4.26Å; L37-V52 HydrophobicContact CG-CG2 4.16Å; V52-N54 PolarHBondContact O-N 3.36Å; V52-N54 VanDerWaalsContact O-N 3.15Å; V52-I55 PolarHBondContact O-N 3.18Å; V52-I55 VanDerWaalsContact O-N 3.11Å
53	K	94.3	Very high	94	Very high	181 Å²	181	63 Å²	63	79%	0.787	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-66.5	-12	177.3	72.9	-177.7	-174.3	176.7	0	115.2	S51	S51-K53 PolarHBondContact O-N 3.09Å; S51-K53 VanDerWaalsContact O-N 3.08Å
54	N	95.6	Very high	93.9	Very high	55 Å²	55	68.5 Å²	68.5	29%	0.294	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-106.8	9.1	177.9	-76.7	27.5	0	0	0	111.9	K12 V50 S51 V52	K12-N54 HydrophobicContact CB-CB 4.13Å; K12-N54 PolarHBondContact N-O 3.42Å; K12-N54 WeakPolarHBondContact O-CB 3.13Å; K12-N54 PolarHBondContact O-ND2 3.35Å; V50-N54 HydrophobicContact CG1-CB 3.78Å; S51-N54 WeakPolarHBondContact O-CA 3.45Å; S51-N54 WeakPolarHBondContact O-CB 3.27Å; S51-N54 PolarHBondContact O-N 3.46Å; V52-N54 PolarHBondContact O-N 3.36Å; V52-N54 VanDerWaalsContact O-N 3.15Å
55	I	95.5	Very high	93.8	Very high	7 Å²	7	68.9 Å²	68.9	4%	0.036	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	138.6	-177.1	-62.2	162.6	0	0	0	108	V9 L37 I39 V50 V52	V9-I55 HydrophobicContact CB-CG2 3.82Å; V9-I55 HydrophobicContact CG1-CG2 3.64Å; V9-I55 HydrophobicContact CG2-CG2 4.04Å; L37-I55 HydrophobicContact CB-CD1 3.89Å; L37-I55 HydrophobicContact CD1-CD1 3.96Å; L37-I55 HydrophobicContact CG-CD1 4.31Å; I39-I55 HydrophobicContact CD1-CD1 3.76Å; I39-I55 HydrophobicContact CD1-CG1 4.24Å; I39-I55 HydrophobicContact CG1-CD1 3.91Å; I39-I55 HydrophobicContact CG1-CG1 4.33Å; V50-I55 HydrophobicContact CB-CD1 4.07Å; V50-I55 HydrophobicContact CB-CG1 4.24Å; V50-I55 HydrophobicContact CG1-CD1 4.16Å; V50-I55 HydrophobicContact CG1-CG1 3.85Å; V52-I55 PolarHBondContact O-N 3.18Å; V52-I55 VanDerWaalsContact O-N 3.11Å
56	V	94.7	Very high	93.4	Very high	37 Å²	37	65.5 Å²	65.5	22%	0.224	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	137.6	-170.4	-100.1	0	0	0	0	109.2	V9 F10 F61 W65	V9-V56 CarbonylContact C-O 3.6Å; V9-V56 VanDerWaalsContact CA-O 3.32Å; V9-V56 WeakPolarHBondContact CA-O 3.05Å; V9-V56 WeakPolarHBondContact CB-O 3.5Å; F10-V56 HydrophobicContact CB-CG2 4.2Å; F10-V56 PolarHBondContact N-O 3.07Å; F10-V56 WeakPolarHBondContact O-CG2 3.23Å; F10-V56 PolarHBondContact O-N 3.29Å; F10-V56 VanDerWaalsContact O-N 3.1Å; V56-F61 HydrophobicContact CB-CD2 3.97Å; V56-F61 HydrophobicContact CB-CE2 4Å; V56-F61 HydrophobicContact CG1-CD2 4.28Å; V56-F61 HydrophobicContact CG1-CE2 3.81Å; V56-F61 HydrophobicContact CG1-CZ 4.33Å; V56-W65 HydrophobicContact CB-CH2 4.26Å; V56-W65 HydrophobicContact CB-CZ3 3.92Å; V56-W65 HydrophobicContact CG1-CH2 4.4Å; V56-W65 HydrophobicContact CG2-CE3 4.4Å; V56-W65 HydrophobicContact CG2-CH2 3.72Å; V56-W65 HydrophobicContact CG2-CZ3 3.36Å
57	P	95.6	Very high	92.9	Very high	18 Å²	18	66.6 Å²	66.6	12%	0.117	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	141.2	-173.5	-23.9	33.1	0	0	0	113.3	M1 K60 F61	M1-P57 HydrophobicContact SD-CG 3.72Å; P57-K60 HydrophobicContact CB-CB 4.4Å; P57-K60 HydrophobicContact CB-CD 4.36Å; P57-K60 HydrophobicContact CB-CG 4.35Å; P57-K60 HydrophobicContact CG-CD 4.38Å; P57-F61 WeakPolarHBondContact O-CD2 3.49Å
58	Y	95.3	Very high	92.1	Very high	6 Å²	6	71 Å²	71	2%	0.024	36%	0.355	C	S	.	.	S	Bend	trans	-64	-53.1	-176	179.7	-107	0	0	0	112	K8 F10 P20 K60 F61 K62 M78 I81 E82	K8-Y58 VanDerWaalsContact C-CB 3.49Å; K8-Y58 HydrophobicContact CB-CD1 4.37Å; K8-Y58 HydrophobicContact CB-CG 4.19Å; K8-Y58 HydrophobicContact CD-CD1 4.39Å; K8-Y58 WeakPolarHBondContact O-CB 3.41Å; K8-Y58 PolarHBondContact O-N 3.37Å; F10-Y58 AromaticContact CD2-CD2 3.78Å; F10-Y58 HydrophobicContact CD2-CD2 3.78Å; F10-Y58 HydrophobicContact CD2-CE2 4.46Å; F10-Y58 HydrophobicContact CE1-CD2 4.27Å; F10-Y58 HydrophobicContact CE1-CE2 4.13Å; F10-Y58 AromaticContact CE2-CD2 3.28Å; F10-Y58 HydrophobicContact CE2-CD2 3.28Å; F10-Y58 AromaticContact CE2-CE2 3.6Å; F10-Y58 HydrophobicContact CE2-CE2 3.6Å; F10-Y58 HydrophobicContact CE2-CG 4.16Å; F10-Y58 HydrophobicContact CG-CD2 4.44Å; F10-Y58 AromaticContact CZ-CD2 3.57Å; F10-Y58 HydrophobicContact CZ-CD2 3.57Å; F10-Y58 AromaticContact CZ-CE2 3.39Å; F10-Y58 HydrophobicContact CZ-CE2 3.39Å; P20-Y58 HydrophobicContact CB-CE2 4.48Å; Y58-K60 PolarHBondContact O-N 3.48Å; Y58-F61 CarbonylContact O-C 3.54Å; Y58-F61 PolarHBondContact O-N 3.2Å; Y58-K62 HydrophobicContact CE1-CD 4.23Å; Y58-K62 PolarHBondContact O-N 3.03Å; Y58-M78 HydrophobicContact CE2-CE 4.35Å; Y58-M78 HydrophobicContact CE2-SD 4.14Å; Y58-M78 WeakPolarHBondContact OH-CE 3.43Å; Y58-I81 HydrophobicContact CD1-CD1 4.43Å; Y58-I81 HydrophobicContact CD2-CD1 3.68Å; Y58-I81 HydrophobicContact CE1-CG2 4.34Å; Y58-I81 HydrophobicContact CE2-CD1 3.87Å; Y58-I81 HydrophobicContact CE2-CG2 3.92Å; Y58-I81 HydrophobicContact CG-CD1 3.99Å; Y58-E82 HydrophobicContact CE1-CG 4.38Å; Y58-E82 VanDerWaalsContact CE1-OE1 3.31Å; Y58-E82 WeakPolarHBondContact CE1-OE1 3.49Å; Y58-E82 PolarHBondContact OH-OE1 3.31Å
59	E	93.3	Very high	91.3	Very high	115 Å²	115	72.9 Å²	72.9	54%	0.537	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-34	-172.2	-62.3	65.4	-141.7	0	0	111.9	K8 F61	K8-E59 WeakPolarHBondContact CB-OE1 3.49Å; E59-F61 VanDerWaalsContact C-N 3.31Å; E59-F61 PolarHBondContact O-N 3.45Å
60	K	92.8	Very high	90.3	Very high	143 Å²	143	75.4 Å²	75.4	62%	0.622	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-9.6	-178	-62	-175.2	-178.9	178.5	0	113.9	P57 Y58	P57-K60 HydrophobicContact CB-CB 4.4Å; P57-K60 HydrophobicContact CB-CD 4.36Å; P57-K60 HydrophobicContact CB-CG 4.35Å; P57-K60 HydrophobicContact CG-CD 4.38Å; Y58-K60 PolarHBondContact O-N 3.48Å
61	F	92.9	Very high	89.8	Confident	57 Å²	57	77.5 Å²	77.5	25%	0.25	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	5	-176.1	-67.8	-79.7	0	0	0	114.3	F10 V56 P57 Y58 E59 D63 K64 W65	F10-F61 HydrophobicContact CD2-CB 4.13Å; F10-F61 HydrophobicContact CE2-CB 4.45Å; V56-F61 HydrophobicContact CB-CD2 3.97Å; V56-F61 HydrophobicContact CB-CE2 4Å; V56-F61 HydrophobicContact CG1-CD2 4.28Å; V56-F61 HydrophobicContact CG1-CE2 3.81Å; V56-F61 HydrophobicContact CG1-CZ 4.33Å; P57-F61 WeakPolarHBondContact O-CD2 3.49Å; Y58-F61 CarbonylContact O-C 3.54Å; Y58-F61 PolarHBondContact O-N 3.2Å; E59-F61 VanDerWaalsContact C-N 3.31Å; E59-F61 PolarHBondContact O-N 3.45Å; F61-D63 VanDerWaalsContact C-N 3.28Å; F61-D63 PolarHBondContact O-N 3.23Å; F61-K64 HydrophobicContact CD1-CB 4.47Å; F61-K64 HydrophobicContact CD1-CD 4.09Å; F61-K64 PolarHBondContact O-N 3.39Å; F61-W65 HydrophobicContact CB-CD2 4.26Å; F61-W65 HydrophobicContact CB-CE3 3.4Å; F61-W65 VanDerWaalsContact CB-CE3 3.4Å; F61-W65 HydrophobicContact CB-CH2 4.14Å; F61-W65 HydrophobicContact CB-CZ3 3.31Å; F61-W65 HydrophobicContact CD1-CE3 4.31Å; F61-W65 AromaticContact CD1-CH2 3.55Å; F61-W65 HydrophobicContact CD1-CH2 3.55Å; F61-W65 HydrophobicContact CD1-CZ2 4.14Å; F61-W65 AromaticContact CD1-CZ3 3.65Å; F61-W65 HydrophobicContact CD1-CZ3 3.65Å; F61-W65 HydrophobicContact CD2-CH2 4.27Å; F61-W65 AromaticContact CD2-CZ3 3.87Å; F61-W65 HydrophobicContact CD2-CZ3 3.87Å; F61-W65 AromaticContact CE1-CH2 3.95Å; F61-W65 HydrophobicContact CE1-CH2 3.95Å; F61-W65 HydrophobicContact CE1-CZ3 4.4Å; F61-W65 AromaticContact CG-CE3 3.96Å; F61-W65 HydrophobicContact CG-CE3 3.96Å; F61-W65 AromaticContact CG-CH2 3.74Å; F61-W65 HydrophobicContact CG-CH2 3.74Å; F61-W65 AromaticContact CG-CZ3 3.33Å; F61-W65 HydrophobicContact CG-CZ3 3.33Å; F61-W65 HydrophobicContact CZ-CH2 4.46Å; F61-W65 PolarHBondContact O-N 3.15Å
62	K	93	Very high	89.5	Confident	78 Å²	78	79 Å²	79	34%	0.339	41%	0.41	S	S	.	.	H	α-helix	trans	-50	-48	173.3	-178.5	174.8	173.3	172.6	0	111.2	Y58 K64 W65 G66 M78 E82	Y58-K62 HydrophobicContact CE1-CD 4.23Å; Y58-K62 PolarHBondContact O-N 3.03Å; K62-K64 PolarHBondContact O-N 3.48Å; K62-K64 VanDerWaalsContact O-N 3.14Å; K62-W65 PolarHBondContact O-N 2.81Å; K62-G66 WeakPolarHBondContact O-CA 3.44Å; K62-G66 PolarHBondContact O-N 2.94Å; K62-M78 HydrophobicContact CG-CE 4.48Å; K62-E82 WeakPolarHBondContact CD-OE1 3.41Å; K62-E82 WeakPolarHBondContact CE-OE1 3.35Å; K62-E82 IonicContact NZ-OE1 3.53Å; K62-E82 PolarHBondContact NZ-OE1 2.91Å; K62-E82 IonicContact NZ-OE2 2.66Å; K62-E82 PolarHBondContact NZ-OE2 2.92Å
63	D	91.3	Very high	89.3	Confident	134 Å²	134	81.8 Å²	81.8	72%	0.717	42%	0.419	S	S	*	.	H	α-helix	trans	-62.9	-23.3	178.8	-52	-30.9	0	0	0	114.1	F61 K67	F61-D63 VanDerWaalsContact C-N 3.28Å; F61-D63 PolarHBondContact O-N 3.23Å; D63-K67 WeakPolarHBondContact O-CE 3.48Å
64	K	91.3	Very high	89.2	Confident	136 Å²	136	73.2 Å²	73.2	59%	0.591	38%	0.382	S	S	*	.	H	α-helix	trans	-94.6	-37.4	-175.8	-168.6	177.4	-176.8	173.4	0	113	F61 K62	F61-K64 HydrophobicContact CD1-CB 4.47Å; F61-K64 HydrophobicContact CD1-CD 4.09Å; F61-K64 PolarHBondContact O-N 3.39Å; K62-K64 PolarHBondContact O-N 3.48Å; K62-K64 VanDerWaalsContact O-N 3.14Å
65	W	90.5	Very high	89	Confident	51 Å²	51	75 Å²	75	19%	0.193	39%	0.389	C	S	.	.	H	α-helix	trans	-120.9	-26.6	-174.6	-60.3	-40.9	0	0	0	114.4	F10 N18 V56 F61 K62 K67 F74	F10-W65 HydrophobicContact CB-CE3 3.72Å; F10-W65 HydrophobicContact CB-CZ3 4.09Å; F10-W65 HydrophobicContact CD1-CB 4.06Å; F10-W65 HydrophobicContact CD1-CE3 4.41Å; F10-W65 AromaticContact CD2-CE3 3.82Å; F10-W65 HydrophobicContact CD2-CE3 3.82Å; F10-W65 HydrophobicContact CD2-CZ3 4.49Å; F10-W65 HydrophobicContact CE1-CB 3.9Å; F10-W65 HydrophobicContact CE2-CB 4.49Å; F10-W65 HydrophobicContact CG-CB 4.43Å; F10-W65 AromaticContact CG-CE3 3.73Å; F10-W65 HydrophobicContact CG-CE3 3.73Å; F10-W65 HydrophobicContact CG-CZ3 4.49Å; F10-W65 HydrophobicContact CZ-CB 4.13Å; N18-W65 HydrophobicContact CB-CD2 3.97Å; N18-W65 HydrophobicContact CB-CE3 4.1Å; N18-W65 HydrophobicContact CB-CG 4.14Å; N18-W65 VanDerWaalsContact ND2-CD2 3.33Å; N18-W65 PolarHBondContact ND2-NE1 3.3Å; V56-W65 HydrophobicContact CB-CH2 4.26Å; V56-W65 HydrophobicContact CB-CZ3 3.92Å; V56-W65 HydrophobicContact CG1-CH2 4.4Å; V56-W65 HydrophobicContact CG2-CE3 4.4Å; V56-W65 HydrophobicContact CG2-CH2 3.72Å; V56-W65 HydrophobicContact CG2-CZ3 3.36Å; F61-W65 HydrophobicContact CB-CD2 4.26Å; F61-W65 HydrophobicContact CB-CE3 3.4Å; F61-W65 VanDerWaalsContact CB-CE3 3.4Å; F61-W65 HydrophobicContact CB-CH2 4.14Å; F61-W65 HydrophobicContact CB-CZ3 3.31Å; F61-W65 HydrophobicContact CD1-CE3 4.31Å; F61-W65 AromaticContact CD1-CH2 3.55Å; F61-W65 HydrophobicContact CD1-CH2 3.55Å; F61-W65 HydrophobicContact CD1-CZ2 4.14Å; F61-W65 AromaticContact CD1-CZ3 3.65Å; F61-W65 HydrophobicContact CD1-CZ3 3.65Å; F61-W65 HydrophobicContact CD2-CH2 4.27Å; F61-W65 AromaticContact CD2-CZ3 3.87Å; F61-W65 HydrophobicContact CD2-CZ3 3.87Å; F61-W65 AromaticContact CE1-CH2 3.95Å; F61-W65 HydrophobicContact CE1-CH2 3.95Å; F61-W65 HydrophobicContact CE1-CZ3 4.4Å; F61-W65 AromaticContact CG-CE3 3.96Å; F61-W65 HydrophobicContact CG-CE3 3.96Å; F61-W65 AromaticContact CG-CH2 3.74Å; F61-W65 HydrophobicContact CG-CH2 3.74Å; F61-W65 AromaticContact CG-CZ3 3.33Å; F61-W65 HydrophobicContact CG-CZ3 3.33Å; F61-W65 HydrophobicContact CZ-CH2 4.46Å; F61-W65 PolarHBondContact O-N 3.15Å; K62-W65 PolarHBondContact O-N 2.81Å; W65-K67 PolarHBondContact O-N 2.83Å; W65-F74 VanDerWaalsContact O-CZ 3.24Å; W65-F74 WeakPolarHBondContact O-CZ 3.23Å
66	G	86.6	Confident	88.9	Confident	16 Å²	16	76.9 Å²	76.9	17%	0.165	41%	0.406	C	S	.	.			trans	-77.1	13.5	175.3	0	0	0	0	0	115	K62 M78	K62-G66 WeakPolarHBondContact O-CA 3.44Å; K62-G66 PolarHBondContact O-N 2.94Å; G66-M78 VanDerWaalsContact CA-CE 3.44Å; G66-M78 WeakPolarHBondContact CA-SD 3.34Å
67	K	84.1	Confident	88.9	Confident	139 Å²	139	75.1 Å²	75.1	60%	0.604	40%	0.395	S	S	*	.	S	Bend	trans	-64.4	141	167.2	-61.5	-166.6	178.3	-165.8	0	109.2	D63 W65	D63-K67 WeakPolarHBondContact O-CE 3.48Å; W65-K67 PolarHBondContact O-N 2.83Å
68	P	75.2	Confident	88.9	Confident	112 Å²	112	75.4 Å²	75.4	73%	0.727	40%	0.395	S	S	*	.			trans	-58.3	144.9	-179.3	24.2	-34.1	0	0	0	111.3	M75	P68-M75 HydrophobicContact CB-SD 4.26Å
69	K	77.1	Confident	88.7	Confident	80 Å²	80	80.5 Å²	80.5	35%	0.348	42%	0.423	S	S	.	.			trans	-131.6	153.6	-179.7	-72.3	-171.3	174	-169.8	0	109.4	S71 F74	K69-S71 PolarHBondContact O-N 3.11Å; K69-F74 HydrophobicContact CB-CD1 3.91Å; K69-F74 HydrophobicContact CB-CE1 4.5Å; K69-F74 HydrophobicContact CB-CG 4.36Å; K69-F74 HydrophobicContact CD-CD1 4.14Å; K69-F74 HydrophobicContact CD-CE1 4.16Å; K69-F74 HydrophobicContact CD-CG 4.36Å; K69-F74 HydrophobicContact CD-CZ 4.39Å; K69-F74 HydrophobicContact CG-CD1 4.08Å; K69-F74 HydrophobicContact CG-CE1 4.19Å
70	P	74	Confident	88.8	Confident	111 Å²	111	76.1 Å²	76.1	72%	0.721	40%	0.403	S	S	*	.	S	Bend	trans	-63.6	-11.7	-178.5	24.9	-34.9	0	0	0	114.6	A72	P70-A72 PolarHBondContact O-N 3.34Å
71	S	83.9	Confident	88.9	Confident	51 Å²	51	69.3 Å²	69.3	36%	0.357	37%	0.373	S	S	.	.			trans	-74.9	110.7	170.5	178.5	0	0	0	0	110.9	K69 Q73 F74 M75	K69-S71 PolarHBondContact O-N 3.11Å; S71-Q73 PolarHBondContact O-N 3.33Å; S71-F74 WeakPolarHBondContact O-CB 3.42Å; S71-F74 PolarHBondContact O-N 3.48Å; S71-M75 PolarHBondContact O-N 2.95Å
72	A	88.8	Confident	89	Confident	72 Å²	72	70.6 Å²	70.6	60%	0.595	38%	0.38	S	S	*	.	H	α-helix	trans	-55.4	-37.1	174.6	0	0	0	0	0	112.8	P70 F74 M75 A76	P70-A72 PolarHBondContact O-N 3.34Å; A72-F74 VanDerWaalsContact C-N 3.31Å; A72-F74 PolarHBondContact O-N 2.9Å; A72-M75 PolarHBondContact O-N 3.12Å; A72-A76 PolarHBondContact O-N 3.02Å
73	Q	89.4	Confident	89	Confident	119 Å²	119	69.8 Å²	69.8	56%	0.556	39%	0.388	S	S	*	.	H	α-helix	trans	-62	-35.5	175.3	-69.1	176	-11.1	0	0	112.6	W19 S71 A76 A77	W19-Q73 HydrophobicContact CH2-CB 4Å; W19-Q73 HydrophobicContact CZ2-CB 4.18Å; S71-Q73 PolarHBondContact O-N 3.33Å; Q73-A76 PolarHBondContact O-N 3.28Å; Q73-A77 WeakPolarHBondContact O-CB 3.39Å; Q73-A77 PolarHBondContact O-N 3.28Å
74	F	93	Very high	89	Confident	1 Å²	1	68 Å²	68	0%	0.004	38%	0.378	C	S	.	.	H	α-helix	trans	-68.3	-39.1	176	-174.9	-92.9	0	0	0	111.5	W19 P20 W65 K69 S71 A72 A77 M78	W19-F74 HydrophobicContact CD2-CD2 4.13Å; W19-F74 AromaticContact CE3-CD2 3.72Å; W19-F74 HydrophobicContact CE3-CD2 3.72Å; W19-F74 HydrophobicContact CE3-CE2 4.42Å; W19-F74 HydrophobicContact CH2-CB 3.83Å; W19-F74 HydrophobicContact CH2-CD2 4.25Å; W19-F74 HydrophobicContact CZ2-CB 4.43Å; W19-F74 HydrophobicContact CZ3-CB 4.02Å; W19-F74 AromaticContact CZ3-CD2 3.79Å; W19-F74 HydrophobicContact CZ3-CD2 3.79Å; W19-F74 HydrophobicContact CZ3-CG 4.42Å; P20-F74 HydrophobicContact CG-CE2 4.34Å; W65-F74 VanDerWaalsContact O-CZ 3.24Å; W65-F74 WeakPolarHBondContact O-CZ 3.23Å; K69-F74 HydrophobicContact CB-CD1 3.91Å; K69-F74 HydrophobicContact CB-CE1 4.5Å; K69-F74 HydrophobicContact CB-CG 4.36Å; K69-F74 HydrophobicContact CD-CD1 4.14Å; K69-F74 HydrophobicContact CD-CE1 4.16Å; K69-F74 HydrophobicContact CD-CG 4.36Å; K69-F74 HydrophobicContact CD-CZ 4.39Å; K69-F74 HydrophobicContact CG-CD1 4.08Å; K69-F74 HydrophobicContact CG-CE1 4.19Å; S71-F74 WeakPolarHBondContact O-CB 3.42Å; S71-F74 PolarHBondContact O-N 3.48Å; A72-F74 VanDerWaalsContact C-N 3.31Å; A72-F74 PolarHBondContact O-N 2.9Å; F74-A77 PolarHBondContact O-N 3.5Å; F74-M78 HydrophobicContact CD1-CG 4.09Å; F74-M78 HydrophobicContact CE1-CG 3.69Å; F74-M78 HydrophobicContact CE1-SD 4.37Å; F74-M78 HydrophobicContact CZ-CG 4.12Å; F74-M78 HydrophobicContact CZ-SD 4.35Å; F74-M78 WeakPolarHBondContact O-CB 3.37Å; F74-M78 WeakPolarHBondContact O-CG 3.43Å; F74-M78 PolarHBondContact O-N 2.69Å
75	M	91.8	Very high	89.1	Confident	91 Å²	91	63.6 Å²	63.6	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-69.5	-37.8	175.6	-63.4	-169.4	-68.3	0	0	111.9	P68 S71 A72 M78 N79	P68-M75 HydrophobicContact CB-SD 4.26Å; S71-M75 PolarHBondContact O-N 2.95Å; A72-M75 PolarHBondContact O-N 3.12Å; M75-M78 PolarHBondContact O-N 3.32Å; M75-N79 PolarHBondContact O-N 3.48Å
76	A	93.3	Very high	89	Confident	47 Å²	47	61.9 Å²	61.9	39%	0.388	36%	0.362	S	S	.	.	H	α-helix	trans	-59.7	-49.2	171	0	0	0	0	0	111.4	A72 Q73 M78 N79 E80	A72-A76 PolarHBondContact O-N 3.02Å; Q73-A76 PolarHBondContact O-N 3.28Å; A76-M78 VanDerWaalsContact C-N 3.31Å; A76-M78 PolarHBondContact O-N 3.22Å; A76-N79 PolarHBondContact O-N 3.34Å; A76-N79 VanDerWaalsContact O-N 3.11Å; A76-E80 VanDerWaalsContact O-CB 3.29Å; A76-E80 WeakPolarHBondContact O-CB 3.45Å; A76-E80 PolarHBondContact O-N 3.16Å
77	A	94.8	Very high	89.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.1	-38.5	176.3	0	0	0	0	0	113.4	W19 P20 Y42 Q73 F74 I81	W19-A77 HydrophobicContact CZ2-CB 4.06Å; P20-A77 HydrophobicContact CB-CB 4.3Å; P20-A77 HydrophobicContact CG-CB 4Å; Y42-A77 WeakPolarHBondContact O-CB 3.25Å; Q73-A77 WeakPolarHBondContact O-CB 3.39Å; Q73-A77 PolarHBondContact O-N 3.28Å; F74-A77 PolarHBondContact O-N 3.5Å; A77-I81 WeakPolarHBondContact O-CG2 3.42Å; A77-I81 PolarHBondContact O-N 3.48Å; A77-I81 VanDerWaalsContact O-N 3.16Å
78	M	94.1	Very high	89.5	Confident	24 Å²	24	58.2 Å²	58.2	12%	0.118	34%	0.341	C	S	.	.	H	α-helix	trans	-68.5	-31.2	175.5	-81	-64	-52.4	0	0	113.4	F10 P20 Y58 K62 G66 F74 M75 A76 I81	F10-M78 HydrophobicContact CE1-SD 4.13Å; F10-M78 HydrophobicContact CZ-SD 4.08Å; P20-M78 HydrophobicContact CB-SD 4.4Å; P20-M78 HydrophobicContact CG-CG 3.82Å; P20-M78 HydrophobicContact CG-SD 3.52Å; P20-M78 VanDerWaalsContact CG-SD 3.52Å; Y58-M78 HydrophobicContact CE2-CE 4.35Å; Y58-M78 HydrophobicContact CE2-SD 4.14Å; Y58-M78 WeakPolarHBondContact OH-CE 3.43Å; K62-M78 HydrophobicContact CG-CE 4.48Å; G66-M78 VanDerWaalsContact CA-CE 3.44Å; G66-M78 WeakPolarHBondContact CA-SD 3.34Å; F74-M78 HydrophobicContact CD1-CG 4.09Å; F74-M78 HydrophobicContact CE1-CG 3.69Å; F74-M78 HydrophobicContact CE1-SD 4.37Å; F74-M78 HydrophobicContact CZ-CG 4.12Å; F74-M78 HydrophobicContact CZ-SD 4.35Å; F74-M78 WeakPolarHBondContact O-CB 3.37Å; F74-M78 WeakPolarHBondContact O-CG 3.43Å; F74-M78 PolarHBondContact O-N 2.69Å; M75-M78 PolarHBondContact O-N 3.32Å; A76-M78 VanDerWaalsContact C-N 3.31Å; A76-M78 PolarHBondContact O-N 3.22Å; M78-I81 WeakPolarHBondContact O-CG2 3.23Å
79	N	92.7	Very high	90.3	Very high	113 Å²	113	53.9 Å²	53.9	60%	0.604	31%	0.311	S	S	*	.	H	α-helix	trans	-78.7	-42.3	174.4	-167.8	27.4	0	0	0	110.9	M75 A76 I81 E82 A83	M75-N79 PolarHBondContact O-N 3.48Å; A76-N79 PolarHBondContact O-N 3.34Å; A76-N79 VanDerWaalsContact O-N 3.11Å; N79-I81 PolarHBondContact O-N 3.36Å; N79-E82 PolarHBondContact O-N 2.68Å; N79-E82 VanDerWaalsContact O-N 3.11Å; N79-A83 WeakPolarHBondContact O-CB 3.18Å; N79-A83 PolarHBondContact O-N 2.74Å
80	E	95.2	Very high	90.7	Very high	24 Å²	24	52.3 Å²	52.3	11%	0.112	31%	0.307	C	S	.	.	H	α-helix	trans	-65.8	-39.3	-175.8	-169.7	-178.2	100.1	0	0	113.3	Y42 G43 Y45 A76 E82 N84 I87	Y42-E80 VanDerWaalsContact CA-OE1 3.23Å; Y42-E80 WeakPolarHBondContact CA-OE1 3.28Å; Y42-E80 VanDerWaalsContact CB-OE1 3.31Å; Y42-E80 WeakPolarHBondContact CB-OE1 3.34Å; Y42-E80 HydrophobicContact CD1-CB 4.38Å; Y42-E80 HydrophobicContact CD1-CG 3.91Å; Y42-E80 WeakPolarHBondContact CD1-OE1 3.4Å; G43-E80 PolarHBondContact N-OE1 2.85Å; Y45-E80 WeakPolarHBondContact CE1-OE1 3.4Å; Y45-E80 PolarHBondContact OH-OE2 3.28Å; A76-E80 VanDerWaalsContact O-CB 3.29Å; A76-E80 WeakPolarHBondContact O-CB 3.45Å; A76-E80 PolarHBondContact O-N 3.16Å; E80-E82 PolarHBondContact O-N 3.48Å; E80-N84 CarbonylContact O-C 3.57Å; E80-N84 VanDerWaalsContact O-C 3.26Å; E80-N84 WeakPolarHBondContact O-CA 3.36Å; E80-N84 PolarHBondContact O-N 2.98Å; E80-I87 HydrophobicContact CG-CG2 4.28Å
81	I	95.1	Very high	91.1	Very high	0 Å²	0	51 Å²	51	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-19.3	174.2	-169	164.7	0	0	0	113.2	K8 P20 A21 Y42 Y58 A77 M78 N79	K8-I81 HydrophobicContact CB-CD1 4.3Å; K8-I81 HydrophobicContact CD-CG1 4.11Å; K8-I81 HydrophobicContact CG-CG1 4.4Å; K8-I81 PolarHBondContact NZ-O 3.48Å; P20-I81 HydrophobicContact CB-CB 4.37Å; P20-I81 HydrophobicContact CB-CD1 4Å; P20-I81 HydrophobicContact CB-CG2 4.08Å; A21-I81 WeakPolarHBondContact O-CD1 3.43Å; Y42-I81 HydrophobicContact CD1-CB 4.4Å; Y42-I81 HydrophobicContact CD2-CB 3.65Å; Y42-I81 HydrophobicContact CD2-CD1 3.72Å; Y42-I81 HydrophobicContact CD2-CG1 3.77Å; Y42-I81 HydrophobicContact CE1-CB 4.48Å; Y42-I81 HydrophobicContact CE2-CB 3.75Å; Y42-I81 HydrophobicContact CE2-CD1 3.47Å; Y42-I81 VanDerWaalsContact CE2-CD1 3.47Å; Y42-I81 HydrophobicContact CE2-CG1 3.38Å; Y42-I81 HydrophobicContact CG-CB 4Å; Y58-I81 HydrophobicContact CD1-CD1 4.43Å; Y58-I81 HydrophobicContact CD2-CD1 3.68Å; Y58-I81 HydrophobicContact CE1-CG2 4.34Å; Y58-I81 HydrophobicContact CE2-CD1 3.87Å; Y58-I81 HydrophobicContact CE2-CG2 3.92Å; Y58-I81 HydrophobicContact CG-CD1 3.99Å; A77-I81 WeakPolarHBondContact O-CG2 3.42Å; A77-I81 PolarHBondContact O-N 3.48Å; A77-I81 VanDerWaalsContact O-N 3.16Å; M78-I81 WeakPolarHBondContact O-CG2 3.23Å; N79-I81 PolarHBondContact O-N 3.36Å
82	E	93.4	Very high	91.1	Very high	84 Å²	84	54.6 Å²	54.6	39%	0.393	32%	0.324	S	S	.	.	H	α-helix	trans	-99	-42.4	179.6	-56	-160.2	166.1	0	0	111.7	Y58 K62 N79 E80	Y58-E82 HydrophobicContact CE1-CG 4.38Å; Y58-E82 VanDerWaalsContact CE1-OE1 3.31Å; Y58-E82 WeakPolarHBondContact CE1-OE1 3.49Å; Y58-E82 PolarHBondContact OH-OE1 3.31Å; K62-E82 WeakPolarHBondContact CD-OE1 3.41Å; K62-E82 WeakPolarHBondContact CE-OE1 3.35Å; K62-E82 IonicContact NZ-OE1 3.53Å; K62-E82 PolarHBondContact NZ-OE1 2.91Å; K62-E82 IonicContact NZ-OE2 2.66Å; K62-E82 PolarHBondContact NZ-OE2 2.92Å; N79-E82 PolarHBondContact O-N 2.68Å; N79-E82 VanDerWaalsContact O-N 3.11Å; E80-E82 PolarHBondContact O-N 3.48Å
83	A	93.3	Very high	91	Very high	60 Å²	60	52 Å²	52	50%	0.496	30%	0.3	S	S	.	.	H	α-helix	trans	-78	-44.6	178	0	0	0	0	0	114.1	N79	N79-A83 WeakPolarHBondContact O-CB 3.18Å; N79-A83 PolarHBondContact O-N 2.74Å
84	N	91.3	Very high	90.9	Very high	98 Å²	98	52 Å²	52	52%	0.524	31%	0.311	S	S	.	.			trans	-134.8	58.3	-169.5	-68	-57	0	0	0	112.8	E80 G86 I87	E80-N84 CarbonylContact O-C 3.57Å; E80-N84 VanDerWaalsContact O-C 3.26Å; E80-N84 WeakPolarHBondContact O-CA 3.36Å; E80-N84 PolarHBondContact O-N 2.98Å; N84-G86 PolarHBondContact O-N 3.02Å; N84-G86 VanDerWaalsContact O-N 3.12Å; N84-I87 HydrophobicContact CB-CB 4.35Å; N84-I87 WeakPolarHBondContact O-CB 3.43Å; N84-I87 VanDerWaalsContact O-CG2 3.22Å; N84-I87 WeakPolarHBondContact O-CG2 3.19Å; N84-I87 PolarHBondContact O-N 3.39Å; N84-I87 VanDerWaalsContact O-N 3.12Å
85	P	92.8	Very high	90.6	Very high	42 Å²	42	58.5 Å²	58.5	27%	0.273	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-26.4	-178.8	26.1	-35.6	0	0	0	114.1	R22 Y42 I87	R22-P85 PolarHBondContact NH1-O 3.46Å; Y42-P85 WeakPolarHBondContact OH-CA 3.49Å; Y42-P85 PolarHBondContact OH-O 3.09Å; P85-I87 VanDerWaalsContact C-N 3.34Å; P85-I87 PolarHBondContact O-N 3.4Å
86	G	89.4	Confident	90.5	Very high	16 Å²	16	54.2 Å²	54.2	17%	0.165	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-2.4	178	0	0	0	0	0	116.2	N84 Y88 M89 E92	N84-G86 PolarHBondContact O-N 3.02Å; N84-G86 VanDerWaalsContact O-N 3.12Å; G86-Y88 PolarHBondContact O-N 3.09Å; G86-Y88 VanDerWaalsContact O-N 3.14Å; G86-M89 WeakPolarHBondContact O-CB 3.46Å; G86-M89 PolarHBondContact O-N 3.01Å; G86-E92 WeakPolarHBondContact CA-OE2 3.22Å
87	I	92.3	Very high	90.1	Very high	24 Å²	24	57.5 Å²	57.5	12%	0.123	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	118.5	-174.8	-168.7	166.7	0	0	0	111.8	R22 F40 Y42 Y45 E80 N84 P85 M89	R22-I87 PolarHBondContact NH1-O 3Å; R22-I87 PolarHBondContact NH2-O 3.2Å; F40-I87 HydrophobicContact CE1-CG2 4.17Å; F40-I87 HydrophobicContact CZ-CG2 4.09Å; F40-I87 WeakPolarHBondContact CZ-O 3.2Å; Y42-I87 HydrophobicContact CD1-CG2 4.11Å; Y42-I87 HydrophobicContact CE1-CG2 4.02Å; Y45-I87 HydrophobicContact CE1-CD1 3.93Å; E80-I87 HydrophobicContact CG-CG2 4.28Å; N84-I87 HydrophobicContact CB-CB 4.35Å; N84-I87 WeakPolarHBondContact O-CB 3.43Å; N84-I87 VanDerWaalsContact O-CG2 3.22Å; N84-I87 WeakPolarHBondContact O-CG2 3.19Å; N84-I87 PolarHBondContact O-N 3.39Å; N84-I87 VanDerWaalsContact O-N 3.12Å; P85-I87 VanDerWaalsContact C-N 3.34Å; P85-I87 PolarHBondContact O-N 3.4Å; I87-M89 PolarHBondContact O-N 3.27Å
88	Y	89.1	Confident	89.7	Confident	53 Å²	53	63.6 Å²	63.6	21%	0.208	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	29.2	-168.6	-48.1	-66.4	0	0	0	115.4	R22 F40 Y45 G86 D93 R95 F99	R22-Y88 PolarHBondContact NH2-O 3.36Å; F40-Y88 HydrophobicContact CE2-CD2 4.02Å; F40-Y88 HydrophobicContact CZ-CD2 4.08Å; Y45-Y88 HydrophobicContact CD1-CD2 4.24Å; Y45-Y88 AromaticContact CD1-CE2 4Å; Y45-Y88 HydrophobicContact CD1-CE2 4Å; Y45-Y88 HydrophobicContact CE1-CE2 4.21Å; Y45-Y88 HydrophobicContact CG-CE2 4.27Å; G86-Y88 PolarHBondContact O-N 3.09Å; G86-Y88 VanDerWaalsContact O-N 3.14Å; Y88-D93 PolarHBondContact N-OD2 3.09Å; Y88-R95 HydrophobicContact CD1-CB 4.07Å; Y88-R95 HydrophobicContact CE1-CB 3.98Å; Y88-F99 HydrophobicContact CD1-CB 3.59Å; Y88-F99 HydrophobicContact CD1-CD1 4.3Å; Y88-F99 HydrophobicContact CD1-CD2 4.12Å; Y88-F99 AromaticContact CD1-CG 3.74Å; Y88-F99 HydrophobicContact CD1-CG 3.74Å; Y88-F99 HydrophobicContact CD2-CD1 4.41Å; Y88-F99 HydrophobicContact CD2-CD2 4.07Å; Y88-F99 HydrophobicContact CD2-CE2 4.16Å; Y88-F99 HydrophobicContact CD2-CG 4.2Å; Y88-F99 HydrophobicContact CD2-CZ 4.39Å; Y88-F99 HydrophobicContact CE1-CB 4.09Å; Y88-F99 HydrophobicContact CE1-CD2 4.26Å; Y88-F99 HydrophobicContact CE1-CG 4.28Å; Y88-F99 HydrophobicContact CE2-CD2 4.22Å; Y88-F99 HydrophobicContact CE2-CE2 4.37Å; Y88-F99 HydrophobicContact CG-CB 4.06Å; Y88-F99 AromaticContact CG-CD1 3.87Å; Y88-F99 HydrophobicContact CG-CD1 3.87Å; Y88-F99 HydrophobicContact CG-CD2 4.02Å; Y88-F99 HydrophobicContact CG-CE1 4.35Å; Y88-F99 HydrophobicContact CG-CE2 4.47Å; Y88-F99 AromaticContact CG-CG 3.69Å; Y88-F99 HydrophobicContact CG-CG 3.69Å
89	M	90.8	Very high	89.5	Confident	21 Å²	21	63.6 Å²	63.6	10%	0.103	35%	0.353	C	S	.	.			trans	-83.4	125.8	168.7	-158.4	-171.9	-40.6	0	0	109.9	P25 G86 I87 G91 E92 D93 A96	P25-M89 HydrophobicContact CG-CG 3.52Å; P25-M89 HydrophobicContact CG-SD 4.06Å; G86-M89 WeakPolarHBondContact O-CB 3.46Å; G86-M89 PolarHBondContact O-N 3.01Å; I87-M89 PolarHBondContact O-N 3.27Å; M89-G91 PolarHBondContact O-N 3.23Å; M89-E92 HydrophobicContact CB-CB 4.3Å; M89-E92 HydrophobicContact CB-CG 4.45Å; M89-E92 WeakPolarHBondContact CE-OE2 3.24Å; M89-E92 PolarHBondContact O-N 2.88Å; M89-E92 HydrophobicContact SD-CG 4.49Å; M89-D93 PolarHBondContact O-N 3.03Å; M89-A96 WeakPolarHBondContact O-CB 3.44Å
90	L	85.5	Confident	89.2	Confident	48 Å²	48	58.2 Å²	58.2	25%	0.251	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	123	-180	-176.4	66.4	0	0	0	110.9	P25 P27 A96 E97 L100	P25-L90 HydrophobicContact CG-CB 4.38Å; P27-L90 VanDerWaalsContact CD-CD2 3.47Å; P27-L90 HydrophobicContact CG-CD2 3.69Å; L90-A96 HydrophobicContact CB-CB 4.49Å; L90-E97 HydrophobicContact CD1-CG 3.43Å; L90-E97 VanDerWaalsContact CD1-CG 3.43Å; L90-L100 HydrophobicContact CB-CD1 4.02Å
91	G	82.4	Confident	88.7	Confident	82 Å²	82	62.1 Å²	62.1	85%	0.845	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	-11.1	-175.8	0	0	0	0	0	114.9	M89	M89-G91 PolarHBondContact O-N 3.23Å
92	E	85.3	Confident	88.2	Confident	128 Å²	128	69.2 Å²	69.2	60%	0.598	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	-44.7	173.4	-61	-174.2	173.5	0	0	112	G86 M89	G86-E92 WeakPolarHBondContact CA-OE2 3.22Å; M89-E92 HydrophobicContact CB-CB 4.3Å; M89-E92 HydrophobicContact CB-CG 4.45Å; M89-E92 WeakPolarHBondContact CE-OE2 3.24Å; M89-E92 PolarHBondContact O-N 2.88Å; M89-E92 HydrophobicContact SD-CG 4.49Å
93	D	86.7	Confident	87.9	Confident	18 Å²	18	69.1 Å²	69.1	10%	0.096	37%	0.374	C	S	.	.			trans	-106.8	119.6	-179.3	-173.4	-22	0	0	0	109.9	Y88 M89 R95 A96	Y88-D93 PolarHBondContact N-OD2 3.09Å; M89-D93 PolarHBondContact O-N 3.03Å; D93-R95 PolarHBondContact O-N 3.07Å; D93-R95 VanDerWaalsContact O-N 3.08Å; D93-R95 VanDerWaalsContact OD1-CB 3.25Å; D93-R95 WeakPolarHBondContact OD1-CB 3.18Å; D93-R95 WeakPolarHBondContact OD1-CG 3.4Å; D93-R95 IonicContact OD1-CZ 3.18Å; D93-R95 PolarHBondContact OD1-N 3.41Å; D93-R95 IonicContact OD1-NE 2.91Å; D93-R95 PolarHBondContact OD1-NE 3.19Å; D93-R95 IonicContact OD1-NH2 2.8Å; D93-R95 IonicContact OD2-CZ 3.91Å; D93-R95 IonicContact OD2-NE 2.69Å; D93-R95 PolarHBondContact OD2-NE 3.05Å; D93-R95 IonicContact OD2-NH2 3.23Å; D93-R95 PolarHBondContact OD2-NH2 2.94Å; D93-A96 HydrophobicContact CB-CB 4.37Å; D93-A96 WeakPolarHBondContact O-CB 3.49Å; D93-A96 PolarHBondContact O-N 3.02Å
94	P	86.6	Confident	87.4	Confident	119 Å²	119	67.2 Å²	67.2	77%	0.773	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-16	-180	26.8	-35.1	0	0	0	113.2	A96	P94-A96 VanDerWaalsContact C-N 3.3Å
95	R	87.9	Confident	86.5	Confident	137 Å²	137	70.5 Å²	70.5	52%	0.517	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-11.5	174.3	-53.9	167.2	-63.8	178.3	6.4	112.5	Y88 D93 E97 F99	Y88-R95 HydrophobicContact CD1-CB 4.07Å; Y88-R95 HydrophobicContact CE1-CB 3.98Å; D93-R95 PolarHBondContact O-N 3.07Å; D93-R95 VanDerWaalsContact O-N 3.08Å; D93-R95 VanDerWaalsContact OD1-CB 3.25Å; D93-R95 WeakPolarHBondContact OD1-CB 3.18Å; D93-R95 WeakPolarHBondContact OD1-CG 3.4Å; D93-R95 IonicContact OD1-CZ 3.18Å; D93-R95 PolarHBondContact OD1-N 3.41Å; D93-R95 IonicContact OD1-NE 2.91Å; D93-R95 PolarHBondContact OD1-NE 3.19Å; D93-R95 IonicContact OD1-NH2 2.8Å; D93-R95 IonicContact OD2-CZ 3.91Å; D93-R95 IonicContact OD2-NE 2.69Å; D93-R95 PolarHBondContact OD2-NE 3.05Å; D93-R95 IonicContact OD2-NH2 3.23Å; D93-R95 PolarHBondContact OD2-NH2 2.94Å; R95-E97 VanDerWaalsContact C-N 3.34Å; R95-E97 PolarHBondContact O-N 3.34Å; R95-F99 WeakPolarHBondContact O-CB 3.37Å; R95-F99 PolarHBondContact O-N 3.43Å
96	A	88.7	Confident	85.2	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-62.4	-36.6	-175.3	0	0	0	0	0	113	M89 L90 D93 P94 F99 L100	M89-A96 WeakPolarHBondContact O-CB 3.44Å; L90-A96 HydrophobicContact CB-CB 4.49Å; D93-A96 HydrophobicContact CB-CB 4.37Å; D93-A96 WeakPolarHBondContact O-CB 3.49Å; D93-A96 PolarHBondContact O-N 3.02Å; P94-A96 VanDerWaalsContact C-N 3.3Å; A96-F99 PolarHBondContact O-N 3.35Å; A96-L100 VanDerWaalsContact O-CB 3.3Å; A96-L100 WeakPolarHBondContact O-CB 3.48Å; A96-L100 WeakPolarHBondContact O-CG 3.38Å; A96-L100 PolarHBondContact O-N 2.93Å
97	E	84.5	Confident	83.6	Confident	116 Å²	116	77.7 Å²	77.7	54%	0.542	39%	0.394	S	S	.	.	H	α-helix	trans	-62	-59.7	178.5	-68	-177.7	177	0	0	110.4	L90 R95 F99 L100 H101	L90-E97 HydrophobicContact CD1-CG 3.43Å; L90-E97 VanDerWaalsContact CD1-CG 3.43Å; R95-E97 VanDerWaalsContact C-N 3.34Å; R95-E97 PolarHBondContact O-N 3.34Å; E97-F99 VanDerWaalsContact C-N 3.26Å; E97-F99 PolarHBondContact O-N 3.38Å; E97-L100 PolarHBondContact O-N 3.21Å; E97-L100 VanDerWaalsContact O-N 3.07Å; E97-H101 WeakPolarHBondContact O-CB 3.37Å; E97-H101 PolarHBondContact O-CD2 3.28Å; E97-H101 VanDerWaalsContact O-CG 3.25Å; E97-H101 PolarHBondContact O-N 3.47Å
98	N	86.5	Confident	81.6	Confident	128 Å²	128	82.6 Å²	82.6	68%	0.684	43%	0.427	S	S	*	.	H	α-helix	trans	-55.4	-38.6	176.8	-71.1	-25.4	0	0	0	113.3
99	F	89.8	Confident	79.4	Confident	24 Å²	24	85.8 Å²	85.8	11%	0.105	45%	0.447	C	S	.	.	H	α-helix	trans	-65.5	-48.2	174.7	170.1	-94.4	0	0	0	112.1	F40 Y45 V47 Y88 R95 A96 E97 H101 Q102 F103	F40-F99 AromaticContact CD2-CE1 3.88Å; F40-F99 HydrophobicContact CD2-CE1 3.88Å; F40-F99 HydrophobicContact CD2-CZ 4.06Å; F40-F99 AromaticContact CE2-CE1 3.71Å; F40-F99 HydrophobicContact CE2-CE1 3.71Å; F40-F99 AromaticContact CE2-CZ 3.68Å; F40-F99 HydrophobicContact CE2-CZ 3.68Å; Y45-F99 VanDerWaalsContact O-CZ 3.31Å; Y45-F99 WeakPolarHBondContact O-CZ 3.39Å; V47-F99 HydrophobicContact CG2-CE1 3.75Å; V47-F99 HydrophobicContact CG2-CZ 3.8Å; Y88-F99 HydrophobicContact CD1-CB 3.59Å; Y88-F99 HydrophobicContact CD1-CD1 4.3Å; Y88-F99 HydrophobicContact CD1-CD2 4.12Å; Y88-F99 AromaticContact CD1-CG 3.74Å; Y88-F99 HydrophobicContact CD1-CG 3.74Å; Y88-F99 HydrophobicContact CD2-CD1 4.41Å; Y88-F99 HydrophobicContact CD2-CD2 4.07Å; Y88-F99 HydrophobicContact CD2-CE2 4.16Å; Y88-F99 HydrophobicContact CD2-CG 4.2Å; Y88-F99 HydrophobicContact CD2-CZ 4.39Å; Y88-F99 HydrophobicContact CE1-CB 4.09Å; Y88-F99 HydrophobicContact CE1-CD2 4.26Å; Y88-F99 HydrophobicContact CE1-CG 4.28Å; Y88-F99 HydrophobicContact CE2-CD2 4.22Å; Y88-F99 HydrophobicContact CE2-CE2 4.37Å; Y88-F99 HydrophobicContact CG-CB 4.06Å; Y88-F99 AromaticContact CG-CD1 3.87Å; Y88-F99 HydrophobicContact CG-CD1 3.87Å; Y88-F99 HydrophobicContact CG-CD2 4.02Å; Y88-F99 HydrophobicContact CG-CE1 4.35Å; Y88-F99 HydrophobicContact CG-CE2 4.47Å; Y88-F99 AromaticContact CG-CG 3.69Å; Y88-F99 HydrophobicContact CG-CG 3.69Å; R95-F99 WeakPolarHBondContact O-CB 3.37Å; R95-F99 PolarHBondContact O-N 3.43Å; A96-F99 PolarHBondContact O-N 3.35Å; E97-F99 VanDerWaalsContact C-N 3.26Å; E97-F99 PolarHBondContact O-N 3.38Å; F99-H101 VanDerWaalsContact C-N 3.32Å; F99-H101 PolarHBondContact O-N 2.85Å; F99-Q102 VanDerWaalsContact O-CB 3.29Å; F99-Q102 WeakPolarHBondContact O-CB 3.46Å; F99-Q102 PolarHBondContact O-N 3.18Å; F99-F103 HydrophobicContact CD2-CE2 4.19Å; F99-F103 HydrophobicContact CE1-CD2 4.35Å; F99-F103 HydrophobicContact CE1-CE2 4.14Å; F99-F103 AromaticContact CE2-CE2 3.64Å; F99-F103 HydrophobicContact CE2-CE2 3.64Å; F99-F103 HydrophobicContact CE2-CZ 4.32Å; F99-F103 HydrophobicContact CZ-CD2 4.25Å; F99-F103 AromaticContact CZ-CE2 3.6Å; F99-F103 HydrophobicContact CZ-CE2 3.6Å; F99-F103 HydrophobicContact CZ-CZ 4.31Å; F99-F103 WeakPolarHBondContact O-CD2 3.45Å
100	L	86.5	Confident	77	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.005	47%	0.471	C	S	.	.	H	α-helix	trans	-70.2	-29.6	-178.2	-66.7	174.2	0	0	0	112.2	N24 L90 A96 E97 Q102 F103 Y104 F106	N24-L100 VanDerWaalsContact ND2-CD2 3.28Å; N24-L100 WeakPolarHBondContact ND2-CD2 3.11Å; L90-L100 HydrophobicContact CB-CD1 4.02Å; A96-L100 VanDerWaalsContact O-CB 3.3Å; A96-L100 WeakPolarHBondContact O-CB 3.48Å; A96-L100 WeakPolarHBondContact O-CG 3.38Å; A96-L100 PolarHBondContact O-N 2.93Å; E97-L100 PolarHBondContact O-N 3.21Å; E97-L100 VanDerWaalsContact O-N 3.07Å; L100-Q102 PolarHBondContact O-N 2.92Å; L100-Q102 VanDerWaalsContact O-N 3.16Å; L100-F103 PolarHBondContact O-N 3.3Å; L100-Y104 HydrophobicContact CB-CD2 4.36Å; L100-Y104 HydrophobicContact CD2-CD2 4.27Å; L100-Y104 HydrophobicContact CD2-CE2 4.08Å; L100-Y104 PolarHBondContact O-N 2.95Å; L100-F106 HydrophobicContact CB-CE2 3.72Å; L100-F106 HydrophobicContact CB-CZ 4.08Å
101	H	84.4	Confident	74.7	Confident	105 Å²	105	91.4 Å²	91.4	49%	0.486	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.3	172.8	-72.7	-158.9	0	0	0	112.6	E97 F99 F103 F106	E97-H101 WeakPolarHBondContact O-CB 3.37Å; E97-H101 PolarHBondContact O-CD2 3.28Å; E97-H101 VanDerWaalsContact O-CG 3.25Å; E97-H101 PolarHBondContact O-N 3.47Å; F99-H101 VanDerWaalsContact C-N 3.32Å; F99-H101 PolarHBondContact O-N 2.85Å; H101-F103 VanDerWaalsContact C-N 3.33Å; H101-F106 AromaticContact CD2-CD2 3.21Å; H101-F106 WeakPolarHBondContact CD2-CD2 3.33Å; H101-F106 AromaticContact CD2-CE2 3.8Å; H101-F106 AromaticContact NE2-CD2 3.76Å
102	Q	86	Confident	72.7	Confident	150 Å²	150	96.1 Å²	96.1	70%	0.701	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-21.5	173.2	-166.6	177	34.5	0	0	113.4	F99 L100	F99-Q102 VanDerWaalsContact O-CB 3.29Å; F99-Q102 WeakPolarHBondContact O-CB 3.46Å; F99-Q102 PolarHBondContact O-N 3.18Å; L100-Q102 PolarHBondContact O-N 2.92Å; L100-Q102 VanDerWaalsContact O-N 3.16Å
103	F	85.3	Confident	70.4	Confident	81 Å²	81	93 Å²	93	36%	0.355	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-16	-173.7	-61	-84.9	0	0	0	114	V47 F99 L100 H101	V47-F103 HydrophobicContact CB-CD1 4.41Å; V47-F103 HydrophobicContact CB-CG 4.32Å; V47-F103 HydrophobicContact CG2-CD1 4.27Å; V47-F103 HydrophobicContact CG2-CD2 3.85Å; V47-F103 HydrophobicContact CG2-CE1 4.45Å; V47-F103 HydrophobicContact CG2-CE2 4.07Å; V47-F103 HydrophobicContact CG2-CG 3.97Å; V47-F103 HydrophobicContact CG2-CZ 4.36Å; F99-F103 HydrophobicContact CD2-CE2 4.19Å; F99-F103 HydrophobicContact CE1-CD2 4.35Å; F99-F103 HydrophobicContact CE1-CE2 4.14Å; F99-F103 AromaticContact CE2-CE2 3.64Å; F99-F103 HydrophobicContact CE2-CE2 3.64Å; F99-F103 HydrophobicContact CE2-CZ 4.32Å; F99-F103 HydrophobicContact CZ-CD2 4.25Å; F99-F103 AromaticContact CZ-CE2 3.6Å; F99-F103 HydrophobicContact CZ-CE2 3.6Å; F99-F103 HydrophobicContact CZ-CZ 4.31Å; F99-F103 WeakPolarHBondContact O-CD2 3.45Å; L100-F103 PolarHBondContact O-N 3.3Å; H101-F103 VanDerWaalsContact C-N 3.33Å
104	Y	83.8	Confident	68.1	Low	20 Å²	20	99.4 Å²	99.4	8%	0.078	53%	0.533	C	S	.	.	S	Bend	trans	-143.5	131.4	-173	-56.8	-68.9	0	0	0	112	L26 V30 V47 F49 L100 F106	L26-Y104 HydrophobicContact CD1-CD1 4.49Å; L26-Y104 HydrophobicContact CD1-CE1 4.03Å; L26-Y104 HydrophobicContact CD1-CE2 4.25Å; L26-Y104 HydrophobicContact CD2-CD2 3.79Å; L26-Y104 HydrophobicContact CD2-CE2 3.56Å; L26-Y104 HydrophobicContact CD2-CG 4.44Å; V30-Y104 HydrophobicContact CG1-CD1 3.72Å; V30-Y104 HydrophobicContact CG1-CE1 4.31Å; V30-Y104 HydrophobicContact CG1-CG 4.27Å; V47-Y104 HydrophobicContact CB-CE2 4.47Å; V47-Y104 HydrophobicContact CG1-CE2 4.02Å; V47-Y104 WeakPolarHBondContact CG1-OH 3.46Å; F49-Y104 HydrophobicContact CE1-CE1 4.33Å; F49-Y104 AromaticContact CE2-CE1 3.95Å; F49-Y104 HydrophobicContact CE2-CE1 3.95Å; F49-Y104 HydrophobicContact CZ-CD1 4.36Å; F49-Y104 AromaticContact CZ-CE1 3.59Å; F49-Y104 HydrophobicContact CZ-CE1 3.59Å; L100-Y104 HydrophobicContact CB-CD2 4.36Å; L100-Y104 HydrophobicContact CD2-CD2 4.27Å; L100-Y104 HydrophobicContact CD2-CE2 4.08Å; L100-Y104 PolarHBondContact O-N 2.95Å; Y104-F106 HydrophobicContact CD2-CE2 4.39Å; Y104-F106 HydrophobicContact CD2-CZ 4.22Å; Y104-F106 HydrophobicContact CG-CE2 4.46Å; Y104-F106 HydrophobicContact CG-CZ 4.31Å; Y104-F106 WeakPolarHBondContact O-CD2 3.44Å; Y104-F106 PolarHBondContact O-N 3.24Å
105	D	72	Confident	65.9	Low	167 Å²	167	104.2 Å²	104.2	89%	0.893	54%	0.536	S	S	*	.			trans	-73.3	92.9	174.4	-58.6	-47.4	0	0	0	110.7
106	F	65.2	Low	63.6	Low	45 Å²	45	103.5 Å²	103.5	20%	0.197	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-81.6	138.4	171.5	-65	-74	0	0	0	111.4	L26 P27 V30 L100 H101 Y104	L26-F106 HydrophobicContact CD2-CZ 4.41Å; P27-F106 HydrophobicContact CB-CD1 4.26Å; P27-F106 HydrophobicContact CB-CE1 4.05Å; P27-F106 HydrophobicContact CG-CD1 3.99Å; P27-F106 HydrophobicContact CG-CE1 3.58Å; V30-F106 HydrophobicContact CG2-CD1 3.81Å; V30-F106 HydrophobicContact CG2-CE1 3.32Å; V30-F106 HydrophobicContact CG2-CZ 4.03Å; L100-F106 HydrophobicContact CB-CE2 3.72Å; L100-F106 HydrophobicContact CB-CZ 4.08Å; H101-F106 AromaticContact CD2-CD2 3.21Å; H101-F106 WeakPolarHBondContact CD2-CD2 3.33Å; H101-F106 AromaticContact CD2-CE2 3.8Å; H101-F106 AromaticContact NE2-CD2 3.76Å; Y104-F106 HydrophobicContact CD2-CE2 4.39Å; Y104-F106 HydrophobicContact CD2-CZ 4.22Å; Y104-F106 HydrophobicContact CG-CE2 4.46Å; Y104-F106 HydrophobicContact CG-CZ 4.31Å; Y104-F106 WeakPolarHBondContact O-CD2 3.44Å; Y104-F106 PolarHBondContact O-N 3.24Å
107	K	56.8	Low	61	Low	165 Å²	165	110.8 Å²	110.8	72%	0.717	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-87.8	127	162.2	-67.6	-169.2	174.2	-169.6	0	108.2	I109	K107-I109 PolarHBondContact O-N 3.41Å
108	P	49.7	Very low	58.9	Low	126 Å²	126	114.3 Å²	114.3	82%	0.818	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-61.8	129.9	174.3	25.6	-33	0	0	0	109.4	G110	P108-G110 VanDerWaalsContact C-N 3.34Å; P108-G110 PolarHBondContact O-N 2.99Å
109	I	43.4	Very low	56.7	Low	120 Å²	120	115.5 Å²	115.5	62%	0.615	58%	0.575	S	S	*	*			trans	-77.7	87.6	-175.1	-62.5	176.6	0	0	0	109.1	K107 S111	K107-I109 PolarHBondContact O-N 3.41Å; I109-S111 PolarHBondContact O-N 3.44Å
110	G	39.4	Very low	54.5	Low	60 Å²	60	122 Å²	122	62%	0.619	61%	0.606	S	S	*	*			trans	-65.5	93.7	167.4	0	0	0	0	0	111.1	P108 E112	P108-G110 VanDerWaalsContact C-N 3.34Å; P108-G110 PolarHBondContact O-N 2.99Å; G110-E112 VanDerWaalsContact C-N 3.27Å; G110-E112 PolarHBondContact O-N 3.36Å
111	S	38.7	Very low	52.3	Low	128 Å²	128	133.4 Å²	133.4	90%	0.895	65%	0.651	S	S	*	*	S	Bend	trans	54.4	0.7	153.6	53.4	0	0	0	0	121.3	I109	I109-S111 PolarHBondContact O-N 3.44Å
112	E	40.5	Very low	49.9	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	65%	0.654	S	S	*	*			trans	-141.7	53.2	-173.1	-154.2	168.2	-164.1	0	0	117.6	G110	G110-E112 VanDerWaalsContact C-N 3.27Å; G110-E112 PolarHBondContact O-N 3.36Å
113	C	35	Very low	47.5	Very low	64 Å²	64	134.2 Å²	134.2	43%	0.432	66%	0.655	S	S	.	*			trans	-149.1	35	165.3	-151.6	0	0	0	0	118.1	R115	C113-R115 PolarHBondContact O-N 3.34Å
114	V	39.1	Very low	45	Very low	152 Å²	152	140.6 Å²	140.6	92%	0.921	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	8.1	178.5	-170.1	0	0	0	0	113.5
115	R	39.7	Very low	42.8	Very low	219 Å²	219	144.8 Å²	144.8	83%	0.826	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	-2.6	-166.9	-61.6	-171.3	-172.3	-118.2	3	117.1	C113	C113-R115 PolarHBondContact O-N 3.34Å
116	Q	39.6	Very low	41.3	Very low	123 Å²	123	145.8 Å²	145.8	58%	0.575	71%	0.712	S	S	*	*	S	Bend	trans	-102.6	-29.5	-174.5	-62	-154.9	15	0	0	116.1	K118 R119	Q116-K118 PolarHBondContact O-N 3.34Å; Q116-R119 WeakPolarHBondContact O-CB 3.47Å; Q116-R119 PolarHBondContact O-N 2.79Å
117	Y	35.9	Very low	40	Very low	153 Å²	153	148.6 Å²	148.6	60%	0.6	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-21.6	-171.8	-92.7	-94.5	0	0	0	115.8	H28	H28-Y117 AromaticContact CD2-CE1 3.73Å; H28-Y117 AromaticContact CD2-CE2 3.61Å; H28-Y117 AromaticContact CD2-CZ 3.35Å; H28-Y117 AromaticContact CE1-CE1 3.8Å; H28-Y117 AromaticContact CG-CZ 3.86Å; H28-Y117 PolarHBondContact N-OH 3.04Å; H28-Y117 AromaticContact NE2-CD1 3.72Å; H28-Y117 AromaticContact NE2-CE1 3.34Å; H28-Y117 VanDerWaalsContact NE2-CE1 3.34Å; H28-Y117 WeakPolarHBondContact NE2-CE1 3.33Å; H28-Y117 AromaticContact NE2-CZ 3.52Å
118	K	40.6	Very low	39.2	Very low	189 Å²	189	147.8 Å²	147.8	82%	0.822	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	4.8	177	-154.5	167	-175.6	173	0	114.3	Q116 S122	Q116-K118 PolarHBondContact O-N 3.34Å; K118-S122 PolarHBondContact O-OG 3.48Å
119	R	40.4	Very low	38.5	Very low	153 Å²	153	148.3 Å²	148.3	58%	0.577	73%	0.732	S	S	*	*	S	Bend	trans	-107.6	-10.3	-166.5	-159	168.3	-73	-147.5	-5.1	115.4	Q116	Q116-R119 WeakPolarHBondContact O-CB 3.47Å; Q116-R119 PolarHBondContact O-N 2.79Å
120	Q	42.3	Very low	38.3	Very low	161 Å²	161	149.2 Å²	149.2	75%	0.752	74%	0.737	S	S	*	*	S	Bend	trans	-97.5	-18.6	-176.9	-71.9	-74.8	-18.9	0	0	114.8
121	Y	40.9	Very low	38.2	Very low	240 Å²	240	154.9 Å²	154.9	94%	0.941	75%	0.748	S	S	*	*	S	Bend	trans	-108.9	2.4	-179	-92.7	-88.8	0	0	0	115.1
122	S	34.2	Very low	38.2	Very low	78 Å²	78	154 Å²	154	55%	0.545	74%	0.74	S	S	.	*			trans	-139.7	99.3	176.8	61.3	0	0	0	0	111.9	K118	K118-S122 PolarHBondContact O-OG 3.48Å
123	R	34.9	Very low	38	Very low	194 Å²	194	152.9 Å²	152.9	73%	0.732	74%	0.738	S	S	*	*			trans	-166.1	66.5	167.4	-106.8	157.4	-165.6	-139.7	-3.4	111.7
124	K	32.9	Very low	38	Very low	215 Å²	215	154.1 Å²	154.1	94%	0.935	75%	0.747	S	S	*	*	S	Bend	trans	-132.3	49.4	163.8	-166	143.2	-175.3	171.5	0	112.2
125	S	38.3	Very low	38	Very low	109 Å²	109	153 Å²	153	76%	0.762	74%	0.741	S	S	*	*			trans	-153.5	163.5	166.1	53.1	0	0	0	0	106
126	K	39.6	Very low	37.7	Very low	188 Å²	188	148.4 Å²	148.4	82%	0.817	74%	0.738	S	S	*	*			cis	151.3	20.9	38.1	-77.9	-164	164.7	-168.2	0	114.2
127	V	39.1	Very low	37.7	Very low	104 Å²	104	150.6 Å²	150.6	63%	0.63	75%	0.745	S	S	*	*			trans	78.3	152.4	158.5	158.6	0	0	0	0	119
128	D	39.9	Very low	37.7	Very low	148 Å²	148	153.9 Å²	153.9	79%	0.791	76%	0.757	S	S	*	*			trans	71.1	146.7	164	-66.3	-22.1	0	0	0	126
129	N	33.6	Very low	37.4	Very low	137 Å²	137	148.3 Å²	148.3	73%	0.733	75%	0.753	S	S	*	*			trans	58.9	142.5	171.6	-94.6	29.3	0	0	0	119.6
130	D	40	Very low	37.3	Very low	138 Å²	138	147.2 Å²	147.2	74%	0.738	76%	0.763	S	S	*	*			cis	-146.3	171	17.7	-111	-58.3	0	0	0	113.3
131	Q	37.8	Very low	36.9	Very low	179 Å²	179	144.9 Å²	144.9	84%	0.836	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80.2	152.1	173.4	-84.8	-167.4	-0.4	0	0	114.1
132	P	37.9	Very low	36.8	Very low	111 Å²	111	137.7 Å²	137.7	72%	0.721	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-90	153.4	158.6	35.7	-31.9	0	0	0	113.6
133	L	37.3	Very low	36.9	Very low	156 Å²	156	140.5 Å²	140.5	82%	0.817	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-52.8	144.4	175.4	-74.6	68.5	0	0	0	112.4
134	S	35	Very low	37.1	Very low	89 Å²	89	137.9 Å²	137.9	62%	0.622	76%	0.759	S	S	*	*			cis	90.2	144.1	37.8	93.7	0	0	0	0	115.2
135	T	38.8	Very low	37.4	Very low	128 Å²	128	135.9 Å²	135.9	79%	0.785	75%	0.753	S	S	*	*			trans	67.6	112.8	-175.6	70.2	0	0	0	0	114.6
136	T	32.4	Very low	37.4	Very low	124 Å²	124	138.8 Å²	138.8	76%	0.761	76%	0.758	S	S	*	*			cis	95.8	103.8	20.8	-45.4	0	0	0	0	115.3
137	K	40.3	Very low	37.2	Very low	168 Å²	168	135.7 Å²	135.7	73%	0.73	75%	0.751	S	S	*	*				176	129.7	124.7	-94.8	152.8	-169	170.1	0	114.3
138	R	34.7	Very low	37.1	Very low	223 Å²	223	141.2 Å²	141.2	84%	0.842	76%	0.76	S	S	*	*			trans	29.9	128.1	135.3	-50.7	-180	-67.8	-149.5	7.4	117.2
139	G	34.9	Very low	36.9	Very low	72 Å²	72	140.8 Å²	140.8	74%	0.742	76%	0.762	S	S	*	*			cis	155.8	-173.4	31.2	0	0	0	0	0	106.4
140	T	37.7	Very low	37.4	Very low	130 Å²	130	139.4 Å²	139.4	80%	0.798	76%	0.764	S	S	*	*			cis	-163.2	146.4	2.9	-56.4	0	0	0	0	107.3
141	S	34.6	Very low	37.4	Very low	112 Å²	112	140.4 Å²	140.4	78%	0.783	77%	0.769	S	S	*	*			trans	63.9	157.7	170.8	-75.1	0	0	0	0	117
142	S	38.6	Very low	37.6	Very low	89 Å²	89	138.1 Å²	138.1	62%	0.622	76%	0.762	S	S	*	*			cis	-167.8	145.8	-15.6	44.3	0	0	0	0	109.3
143	N	37.6	Very low	37.6	Very low	136 Å²	136	138.4 Å²	138.4	73%	0.727	76%	0.763	S	S	*	*			trans	58.1	145.3	151.6	-65.9	47.3	0	0	0	118.7
144	D	38.7	Very low	37.7	Very low	140 Å²	140	136.4 Å²	136.4	75%	0.749	76%	0.762	S	S	*	*			cis	-145	168.5	-6	-109.2	-37	0	0	0	111
145	Q	38.2	Very low	38	Very low	173 Å²	173	137.1 Å²	137.1	81%	0.808	77%	0.767	S	S	*	*			trans	-84.2	149.8	175.5	-57.3	170.9	39.9	0	0	111.2
146	I	38.1	Very low	38.1	Very low	170 Å²	170	139.4 Å²	139.4	87%	0.872	77%	0.768	S	S	*	*			trans	-163.5	151.9	133.7	-104	151.2	0	0	0	110.6
147	N	36.2	Very low	38.5	Very low	122 Å²	122	140.1 Å²	140.1	65%	0.652	77%	0.766	S	S	*	*			trans	-91.9	153.4	-179	-97.1	-77.2	0	0	0	112.1
148	R	36.8	Very low	38.4	Very low	220 Å²	220	136.4 Å²	136.4	83%	0.83	76%	0.761	S	S	*	*			trans	33.3	134.8	137.2	-53.3	170.2	-173	-156.5	-2.8	119.3
149	V	36.8	Very low	38.6	Very low	139 Å²	139	130.9 Å²	130.9	84%	0.842	75%	0.753	S	S	*	*				-159.9	167.4	100.9	138.9	0	0	0	0	108.8
150	S	42.4	Very low	38.8	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	75%	0.749	S	S	*	*			trans	-118.7	152.6	-174.6	-48.1	0	0	0	0	111.9
151	D	40.3	Very low	38.8	Very low	159 Å²	159	134.5 Å²	134.5	85%	0.85	75%	0.745	S	S	*	*			trans	-127.8	155	162.9	-71.1	-41.1	0	0	0	108.5
152	D	41.5	Very low	38.8	Very low	131 Å²	131	134.3 Å²	134.3	70%	0.701	74%	0.744	S	S	*	*			cis	-158.5	145.8	-27.4	-176.9	26.8	0	0	0	109.2
153	T	39.8	Very low	38.7	Very low	118 Å²	118	140.5 Å²	140.5	72%	0.724	75%	0.754	S	S	*	*				155.9	134.4	125.8	44.9	0	0	0	0	112.1
154	S	39.5	Very low	38.6	Very low	114 Å²	114	139.2 Å²	139.2	80%	0.797	75%	0.75	S	S	*	*			trans	-160	-171.4	-174.2	-75.7	0	0	0	0	108.7
155	S	39.2	Very low	38.4	Very low	104 Å²	104	139.3 Å²	139.3	73%	0.727	75%	0.751	S	S	*	*			cis	-155.6	-158.3	16.7	-39.6	0	0	0	0	110.8
156	E	42.1	Very low	38.2	Very low	176 Å²	176	136 Å²	136	82%	0.822	75%	0.747	S	S	*	*			trans	75.5	164	158.5	-51	-139.2	98.5	0	0	117
157	I	41.5	Very low	38.3	Very low	138 Å²	138	135 Å²	135	71%	0.708	74%	0.742	S	S	*	*			cis	-133.2	159.6	3.9	-166.9	55.4	0	0	0	112.3
158	S	37.4	Very low	38.3	Very low	90 Å²	90	136 Å²	136	63%	0.629	75%	0.748	S	S	*	*			trans	-91	-175.3	174.5	-158	0	0	0	0	110.3
159	T	38.7	Very low	38.6	Very low	108 Å²	108	130.9 Å²	130.9	66%	0.663	74%	0.743	S	S	*	*			cis	-160	160.7	14.1	-35	0	0	0	0	110.7
160	D	39.2	Very low	38.9	Very low	124 Å²	124	128.6 Å²	128.6	66%	0.663	74%	0.738	S	S	*	*			trans	90.7	123.8	132.9	-103	-12.7	0	0	0	126.5
161	Q	37.7	Very low	39.1	Very low	153 Å²	153	129.4 Å²	129.4	72%	0.715	74%	0.741	S	S	*	*			trans	55.1	123.4	130.2	-84.5	175.6	78.8	0	0	124.8
162	S	35	Very low	39	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	74%	0.742	S	S	*	*			trans	75.9	161.6	144.2	86.1	0	0	0	0	116.9
163	R	36.1	Very low	38.9	Very low	219 Å²	219	130.8 Å²	130.8	83%	0.826	74%	0.743	S	S	*	*			cis	-156.1	141.2	8.2	-152.5	-176.8	174.1	-165.4	-1	111.1
164	V	36.4	Very low	38.8	Very low	108 Å²	108	129.4 Å²	129.4	66%	0.655	74%	0.738	S	S	*	*			trans	34.9	133.4	155.2	-59.9	0	0	0	0	122.8
165	N	33.1	Very low	38.7	Very low	142 Å²	142	131 Å²	131	76%	0.759	74%	0.738	S	S	*	*			trans	39.5	124.7	130.9	-47	15.6	0	0	0	119.8
166	S	35.6	Very low	38.5	Very low	104 Å²	104	133.2 Å²	133.2	73%	0.727	74%	0.741	S	S	*	*				-179.8	125	98.7	-74.6	0	0	0	0	113.7
167	L	38.8	Very low	38.3	Very low	149 Å²	149	133.2 Å²	133.2	78%	0.78	74%	0.741	S	S	*	*				44	111.7	130	-65.2	147.8	0	0	0	119.8
168	D	36.4	Very low	38.2	Very low	144 Å²	144	134.5 Å²	134.5	77%	0.77	74%	0.744	S	S	*	*				50.5	163	115.1	-81.2	-41.8	0	0	0	122.8
169	P	42.4	Very low	37.9	Very low	111 Å²	111	135 Å²	135	72%	0.721	74%	0.743	S	S	*	*			cis	-125.5	-176.5	-15	28.6	-7.5	0	0	0	112.8
170	A	44.3	Very low	37.6	Very low	91 Å²	91	136.4 Å²	136.4	75%	0.752	75%	0.746	S	S	*	*			trans	-76.3	162.9	167	0	0	0	0	0	112.9
171	P	46.4	Very low	37.3	Very low	126 Å²	126	136.9 Å²	136.9	82%	0.818	75%	0.747	S	S	*	*			trans	-104.9	129.6	152.1	34.1	-25.4	0	0	0	111.2
172	E	39.1	Very low	37.1	Very low	184 Å²	184	136.4 Å²	136.4	86%	0.86	75%	0.75	S	S	*	*			trans	-84.6	141.7	157.4	-65.6	-165.2	177.4	0	0	109.9
173	D	37.7	Very low	37.2	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	75%	0.749	S	S	*	*			trans	-160.3	121.5	144.9	-114.2	-28.6	0	0	0	105.4
174	S	37.6	Very low	37.1	Very low	89 Å²	89	133.5 Å²	133.5	62%	0.622	75%	0.747	S	S	*	*			cis	59.9	116.4	46.5	126	0	0	0	0	111.6
175	N	39	Very low	37	Very low	149 Å²	149	135.2 Å²	135.2	80%	0.797	75%	0.752	S	S	*	*			trans	179.6	125.8	154.7	-102.4	-76.3	0	0	0	107.4
176	D	34.8	Very low	37.1	Very low	149 Å²	149	137.1 Å²	137.1	80%	0.797	76%	0.756	S	S	*	*			trans	-98.3	-176.2	-179.2	-69.1	-81.8	0	0	0	111.6
177	E	36.4	Very low	36.8	Very low	176 Å²	176	138.3 Å²	138.3	82%	0.822	75%	0.75	S	S	*	*			trans	66.1	159.3	170.9	-54.3	-162.8	117.6	0	0	115.8
178	E	40	Very low	36.6	Very low	165 Å²	165	138.5 Å²	138.5	77%	0.771	75%	0.751	S	S	*	*			cis	-106.7	159.6	-4.6	-71.8	-177.1	114.2	0	0	110.1
179	T	32.3	Very low	36.2	Very low	100 Å²	100	137.3 Å²	137.3	61%	0.613	74%	0.741	S	S	*	*				41.3	145.9	74.8	107.3	0	0	0	0	114.1
180	L	32.2	Very low	35.8	Very low	139 Å²	139	141.3 Å²	141.3	73%	0.728	75%	0.748	S	S	*	*			cis	-157.8	168.8	28.1	-160.4	61.6	0	0	0	112
181	I	32.5	Very low	35.2	Very low	133 Å²	133	142.3 Å²	142.3	68%	0.682	74%	0.74	S	S	*	*			trans	-20.2	143.2	153.9	-48.7	158.3	0	0	0	113.3
182	D	33.8	Very low	34.5	Very low	143 Å²	143	143 Å²	143	77%	0.765	74%	0.737	S	S	*	*				-162.4	168.8	57.7	-149.2	-6.5	0	0	0	116.4
183	D	36.3	Very low	34.2	Very low	141 Å²	141	145.6 Å²	145.6	75%	0.754	74%	0.74	S	S	*	*			trans	-67.2	153.3	159.7	-78.7	-57.3	0	0	0	111.6
184	T	34.7	Very low	34	Very low	127 Å²	127	146.6 Å²	146.6	78%	0.779	74%	0.741	S	S	*	*			trans	179.7	144.3	132.8	-83.8	0	0	0	0	112.2
185	N	33.6	Very low	34	Very low	143 Å²	143	151.6 Å²	151.6	77%	0.765	76%	0.755	S	S	*	*			trans	-66.3	134.9	172	-76.1	-91	0	0	0	111.7
186	H	35.8	Very low	33.8	Very low	182 Å²	182	149 Å²	149	84%	0.843	74%	0.744	S	S	*	*			trans	-123.1	88.6	140.3	-106.7	-77.9	0	0	0	111.4	L188	H186-L188 PolarHBondContact O-N 3.45Å
187	H	29.2	Very low	33.9	Very low	130 Å²	130	150 Å²	150	60%	0.602	75%	0.749	S	S	*	*			trans	-55.1	109.5	164.6	168.1	97.7	0	0	0	110.2	Q189	H187-Q189 PolarHBondContact NE2-OE1 3.34Å
188	L	33.7	Very low	34.1	Very low	152 Å²	152	148.6 Å²	148.6	80%	0.796	75%	0.746	S	S	*	*			trans	-114.9	108.4	161	-97.9	170.7	0	0	0	109.1	H186 F190	H186-L188 PolarHBondContact O-N 3.45Å; L188-F190 PolarHBondContact O-N 3.24Å
189	Q	28.5	Very low	34.3	Very low	119 Å²	119	146 Å²	146	56%	0.556	75%	0.746	S	S	*	*			trans	-92	77.5	-162.8	-169.1	-178.5	22	0	0	111.7	H187 N191	H187-Q189 PolarHBondContact NE2-OE1 3.34Å; Q189-N191 VanDerWaalsContact C-N 3.34Å; Q189-N191 PolarHBondContact O-N 3.15Å; Q189-N191 VanDerWaalsContact O-N 3.09Å
190	F	33.4	Very low	34.5	Very low	196 Å²	196	147.2 Å²	147.2	86%	0.86	76%	0.757	S	S	*	*			trans	-82	84.9	167.1	-85.2	-77.5	0	0	0	110.8	L188	L188-F190 PolarHBondContact O-N 3.24Å
191	N	31.3	Very low	34.9	Very low	112 Å²	112	146 Å²	146	60%	0.599	76%	0.757	S	S	*	*			trans	-63.4	162.7	170.5	-77.8	-29.1	0	0	0	111.8	Q189	Q189-N191 VanDerWaalsContact C-N 3.34Å; Q189-N191 PolarHBondContact O-N 3.15Å; Q189-N191 VanDerWaalsContact O-N 3.09Å
192	N	33.5	Very low	35	Very low	141 Å²	141	147.6 Å²	147.6	75%	0.754	76%	0.762	S	S	*	*			trans	-44.1	143.4	174.9	-60.2	-78.4	0	0	0	113.6
193	Y	32.8	Very low	35	Very low	237 Å²	237	147.7 Å²	147.7	93%	0.929	76%	0.762	S	S	*	*			trans	-118.4	132.5	131	-108	-90.4	0	0	0	109.1
194	Q	33.6	Very low	35.1	Very low	156 Å²	156	148.5 Å²	148.5	73%	0.729	77%	0.765	S	S	*	*			trans	-76.9	154.6	177.9	-63.7	158.9	-20.7	0	0	109.5	V196	Q194-V196 HydrophobicContact CB-CG1 4.24Å
195	Q	35.8	Very low	35.3	Very low	194 Å²	194	148 Å²	148	91%	0.907	77%	0.767	S	S	*	*			trans	-119	120.2	149.1	-167.9	151.7	27.3	0	0	107.1
196	V	36	Very low	36.2	Very low	93 Å²	93	147 Å²	147	56%	0.564	77%	0.768	S	S	*	*			trans	-110.7	131.6	-174.6	-78	0	0	0	0	109.8	Q194 I198	Q194-V196 HydrophobicContact CB-CG1 4.24Å; V196-I198 PolarHBondContact O-N 2.94Å
197	D	35.8	Very low	36.2	Very low	171 Å²	171	143.4 Å²	143.4	91%	0.914	76%	0.763	S	S	*	*			trans	-84.5	94.3	168.9	-70.3	-53.7	0	0	0	109.4
198	I	41.8	Very low	36.9	Very low	146 Å²	146	142.3 Å²	142.3	75%	0.749	77%	0.77	S	S	*	*			trans	-137.9	138.5	170.2	-57.3	-179	0	0	0	108.9	V196	V196-I198 PolarHBondContact O-N 2.94Å
199	S	43.1	Very low	37.3	Very low	111 Å²	111	141 Å²	141	78%	0.776	77%	0.769	S	S	*	*			trans	-103.3	133	-177.5	-53.5	0	0	0	0	113.2
200	C	37.5	Very low	38.1	Very low	125 Å²	125	143.3 Å²	143.3	85%	0.845	78%	0.783	S	S	*	*			trans	62.5	167.9	164.1	-75.8	0	0	0	0	117.3
201	P	41.1	Very low	38.7	Very low	113 Å²	113	140.3 Å²	140.3	73%	0.734	78%	0.776	S	S	*	*			cis	-124.6	163.6	0.6	41.5	-27.4	0	0	0	116.4
202	E	33.3	Very low	39.4	Very low	167 Å²	167	145.6 Å²	145.6	78%	0.78	79%	0.788	S	S	*	*			trans	45.9	115.1	133.7	-153.6	161.9	-176	0	0	124
203	L	34.8	Very low	40.1	Very low	145 Å²	145	143.6 Å²	143.6	76%	0.759	78%	0.782	S	S	*	*			trans	74.1	150.1	146.9	-72.6	173.6	0	0	0	124.1
204	L	38.4	Very low	40.6	Very low	159 Å²	159	137.2 Å²	137.2	83%	0.832	77%	0.773	S	S	*	*			trans	85.7	143.7	164.3	-52.2	-171.5	0	0	0	121.2
205	S	37.6	Very low	41.4	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	78%	0.777	S	S	*	*			trans	175.9	168.6	-176.1	-93.1	0	0	0	0	108.9
206	P	53.7	Low	42.2	Very low	120 Å²	120	134.1 Å²	134.1	78%	0.779	76%	0.763	S	S	*	*			cis	-136.7	-167.2	-12.8	34.4	-13.1	0	0	0	114.4
207	S	36.3	Very low	42.9	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	77%	0.773	S	S	*	*			trans	103.4	107.4	137	-161.1	0	0	0	0	121.2
208	S	42.2	Very low	43.9	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	76%	0.764	S	S	*	*				174.7	111.7	117.4	62.7	0	0	0	0	110.4
209	T	42.7	Very low	44.5	Very low	124 Å²	124	133.1 Å²	133.1	76%	0.761	75%	0.753	S	S	*	*				79.8	116.2	85.2	-55.9	0	0	0	0	115.3
210	I	46.5	Very low	45.4	Very low	168 Å²	168	135.3 Å²	135.3	86%	0.862	75%	0.746	S	S	*	*			trans	-179.6	159.8	139.6	-94.3	156.6	0	0	0	110.8
211	D	44.6	Very low	47	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	73%	0.726	S	S	*	*			trans	-64.9	141.5	-162.3	-83.9	-82.7	0	0	0	120.7
212	R	45.8	Very low	48.5	Very low	224 Å²	224	135.3 Å²	135.3	85%	0.845	72%	0.723	S	S	*	*				41.9	158.8	107.5	-109.9	178.3	160.1	-168.6	-6.5	120.7
213	P	47.8	Very low	50.6	Low	98 Å²	98	132.4 Å²	132.4	64%	0.636	71%	0.714	S	S	*	*			cis	-145.9	173.6	8.8	44.2	-24.6	0	0	0	120.6
214	S	44	Very low	53.1	Low	104 Å²	104	132.2 Å²	132.2	73%	0.727	70%	0.703	S	S	*	*			trans	101.5	-49.8	139.2	-70.6	0	0	0	0	124.5	E216	S214-E216 VanDerWaalsContact C-N 3.29Å; S214-E216 PolarHBondContact O-N 3.4Å
215	D	51	Low	55.3	Low	155 Å²	155	129.2 Å²	129.2	83%	0.829	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	10.9	-158.3	-64.8	-26	0	0	0	117.8	K217	D215-K217 VanDerWaalsContact C-N 3.34Å; D215-K217 PolarHBondContact O-N 2.95Å
216	E	51.5	Low	57.6	Low	129 Å²	129	126.2 Å²	126.2	60%	0.603	67%	0.667	S	S	*	*	H	α-helix	trans	-70.7	-20.5	-166.7	-149	-172	150.9	0	0	115.3	S214 Y220	S214-E216 VanDerWaalsContact C-N 3.29Å; S214-E216 PolarHBondContact O-N 3.4Å; E216-Y220 HydrophobicContact CG-CE2 3.98Å; E216-Y220 VanDerWaalsContact O-CD2 3.32Å; E216-Y220 WeakPolarHBondContact O-CD2 3.34Å; E216-Y220 WeakPolarHBondContact OE1-CE2 3.44Å; E216-Y220 PolarHBondContact OE1-OH 3.36Å
217	K	51.8	Low	59.3	Low	179 Å²	179	128.5 Å²	128.5	78%	0.778	66%	0.66	S	S	*	*	H	α-helix	trans	-74	-37.9	-165.7	-81	-171.5	175.3	178.9	0	115.5	D215 Y220	D215-K217 VanDerWaalsContact C-N 3.34Å; D215-K217 PolarHBondContact O-N 2.95Å; K217-Y220 PolarHBondContact O-N 3.48Å
218	D	55.6	Low	62	Low	135 Å²	135	129.1 Å²	129.1	72%	0.722	65%	0.646	S	S	*	*	H	α-helix	trans	-74.6	-31.4	-174.7	-69.1	-26.8	0	0	0	111.9	Y220 Q221 E222	D218-Y220 VanDerWaalsContact C-N 3.29Å; D218-Y220 PolarHBondContact O-N 2.88Å; D218-Q221 PolarHBondContact O-N 3.17Å; D218-E222 PolarHBondContact O-N 3.3Å
219	S	54.4	Low	64.4	Low	75 Å²	75	129.1 Å²	129.1	52%	0.524	64%	0.637	S	S	.	*	H	α-helix	trans	-52.1	-43.1	171.6	177.6	0	0	0	0	112.8	Q221 E222 N223	S219-Q221 VanDerWaalsContact C-N 3.32Å; S219-Q221 PolarHBondContact O-N 2.9Å; S219-E222 PolarHBondContact O-N 2.93Å; S219-N223 VanDerWaalsContact O-CB 3.24Å; S219-N223 WeakPolarHBondContact O-CB 3.28Å; S219-N223 PolarHBondContact O-N 2.93Å
220	Y	62.5	Low	66.7	Low	158 Å²	158	126.1 Å²	126.1	62%	0.62	62%	0.624	S	S	*	*	H	α-helix	trans	-65.4	-33.1	177	-77	-72.6	0	0	0	113.4	E216 K217 D218 R224	E216-Y220 HydrophobicContact CG-CE2 3.98Å; E216-Y220 VanDerWaalsContact O-CD2 3.32Å; E216-Y220 WeakPolarHBondContact O-CD2 3.34Å; E216-Y220 WeakPolarHBondContact OE1-CE2 3.44Å; E216-Y220 PolarHBondContact OE1-OH 3.36Å; K217-Y220 PolarHBondContact O-N 3.48Å; D218-Y220 VanDerWaalsContact C-N 3.29Å; D218-Y220 PolarHBondContact O-N 2.88Å; Y220-R224 WeakPolarHBondContact O-CB 3.39Å; Y220-R224 PolarHBondContact O-N 3.44Å
221	Q	70.9	Confident	69	Low	93 Å²	93	125.5 Å²	125.5	44%	0.435	61%	0.611	S	S	.	*	H	α-helix	trans	-78.3	-42.4	177.8	-174.3	80.1	-39.6	0	0	111	D218 S219 N223 R224 E225	D218-Q221 PolarHBondContact O-N 3.17Å; S219-Q221 VanDerWaalsContact C-N 3.32Å; S219-Q221 PolarHBondContact O-N 2.9Å; Q221-N223 PolarHBondContact O-N 3.2Å; Q221-R224 VanDerWaalsContact O-CB 3.32Å; Q221-R224 WeakPolarHBondContact O-CB 3.4Å; Q221-R224 PolarHBondContact O-N 3.21Å; Q221-R224 VanDerWaalsContact O-N 3.15Å; Q221-E225 WeakPolarHBondContact O-CG 3.4Å; Q221-E225 PolarHBondContact O-N 3.32Å
222	E	72.6	Confident	71.4	Confident	144 Å²	144	126.3 Å²	126.3	67%	0.673	61%	0.608	S	S	*	*	H	α-helix	trans	-61.6	-44	175.4	-174.5	174.8	-162.3	0	0	111.5	D218 S219 R224 E225 A226	D218-E222 PolarHBondContact O-N 3.3Å; S219-E222 PolarHBondContact O-N 2.93Å; E222-R224 PolarHBondContact O-N 3.29Å; E222-E225 CarbonylContact O-C 3.45Å; E222-E225 WeakPolarHBondContact O-CA 3.45Å; E222-E225 WeakPolarHBondContact O-CB 3.5Å; E222-E225 PolarHBondContact O-N 3.23Å; E222-A226 WeakPolarHBondContact O-CB 2.98Å; E222-A226 PolarHBondContact O-N 2.88Å
223	N	79.1	Confident	73.7	Confident	107 Å²	107	121 Å²	121	57%	0.572	60%	0.595	S	S	*	*	H	α-helix	trans	-60.3	-36.3	175.6	-166.1	-30.7	0	0	0	111.6	S219 Q221 R227	S219-N223 VanDerWaalsContact O-CB 3.24Å; S219-N223 WeakPolarHBondContact O-CB 3.28Å; S219-N223 PolarHBondContact O-N 2.93Å; Q221-N223 PolarHBondContact O-N 3.2Å; N223-R227 VanDerWaalsContact O-CB 3.28Å; N223-R227 WeakPolarHBondContact O-CB 3.28Å; N223-R227 PolarHBondContact O-N 2.96Å
224	R	85.3	Confident	75.8	Confident	140 Å²	140	121.8 Å²	121.8	53%	0.528	59%	0.59	S	S	.	*	H	α-helix	trans	-67.3	-38.4	173.4	-168.9	-172.4	-169.6	-163.5	7	112.6	Y220 Q221 E222 R228	Y220-R224 WeakPolarHBondContact O-CB 3.39Å; Y220-R224 PolarHBondContact O-N 3.44Å; Q221-R224 VanDerWaalsContact O-CB 3.32Å; Q221-R224 WeakPolarHBondContact O-CB 3.4Å; Q221-R224 PolarHBondContact O-N 3.21Å; Q221-R224 VanDerWaalsContact O-N 3.15Å; E222-R224 PolarHBondContact O-N 3.29Å; R224-R228 WeakPolarHBondContact O-CD 3.44Å; R224-R228 VanDerWaalsContact O-CG 3.27Å; R224-R228 WeakPolarHBondContact O-CG 3.17Å; R224-R228 PolarHBondContact O-N 2.92Å
225	E	86.2	Confident	78.3	Confident	96 Å²	96	124 Å²	124	45%	0.449	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-48	174.1	-68.8	-75.3	103.1	0	0	111.2	Q221 E222 R227 R228 L229	Q221-E225 WeakPolarHBondContact O-CG 3.4Å; Q221-E225 PolarHBondContact O-N 3.32Å; E222-E225 CarbonylContact O-C 3.45Å; E222-E225 WeakPolarHBondContact O-CA 3.45Å; E222-E225 WeakPolarHBondContact O-CB 3.5Å; E222-E225 PolarHBondContact O-N 3.23Å; E225-R227 VanDerWaalsContact C-N 3.33Å; E225-R227 PolarHBondContact O-N 2.89Å; E225-R228 CarbonylContact O-C 3.26Å; E225-R228 WeakPolarHBondContact O-CA 3.31Å; E225-R228 VanDerWaalsContact O-CB 3.32Å; E225-R228 WeakPolarHBondContact O-CB 3.4Å; E225-R228 PolarHBondContact O-N 2.91Å; E225-R228 IonicContact OE1-CZ 2.69Å; E225-R228 IonicContact OE1-NH1 2.87Å; E225-R228 PolarHBondContact OE1-NH1 3.06Å; E225-L229 PolarHBondContact O-N 2.82Å
226	A	85.2	Confident	80.4	Confident	55 Å²	55	123.3 Å²	123.3	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-57.3	-44.7	174.5	0	0	0	0	0	111.5	E222 R228 L229 A230	E222-A226 WeakPolarHBondContact O-CB 2.98Å; E222-A226 PolarHBondContact O-N 2.88Å; A226-R228 VanDerWaalsContact C-N 3.32Å; A226-R228 PolarHBondContact O-N 2.99Å; A226-L229 PolarHBondContact O-N 3.47Å; A226-L229 VanDerWaalsContact O-N 3.16Å; A226-A230 WeakPolarHBondContact O-CB 3.42Å; A226-A230 PolarHBondContact O-N 2.82Å
227	R	89.2	Confident	82.3	Confident	168 Å²	168	120.1 Å²	120.1	63%	0.634	57%	0.571	S	S	*	*	H	α-helix	trans	-67.5	-28.4	176.3	-158.3	174.4	-168.9	-161.8	5.8	113	N223 E225 R231	N223-R227 VanDerWaalsContact O-CB 3.28Å; N223-R227 WeakPolarHBondContact O-CB 3.28Å; N223-R227 PolarHBondContact O-N 2.96Å; E225-R227 VanDerWaalsContact C-N 3.33Å; E225-R227 PolarHBondContact O-N 2.89Å; R227-R231 VanDerWaalsContact O-CG 3.32Å; R227-R231 WeakPolarHBondContact O-CG 3.47Å; R227-R231 PolarHBondContact O-N 2.56Å
228	R	92.9	Very high	84.3	Confident	120 Å²	120	116.1 Å²	116.1	45%	0.453	56%	0.556	S	S	.	*	H	α-helix	trans	-70.1	-43.1	168.6	-75.4	162.6	162.3	-178.9	-5.2	111.3	R224 E225 A226 R231 K232	R224-R228 WeakPolarHBondContact O-CD 3.44Å; R224-R228 VanDerWaalsContact O-CG 3.27Å; R224-R228 WeakPolarHBondContact O-CG 3.17Å; R224-R228 PolarHBondContact O-N 2.92Å; E225-R228 CarbonylContact O-C 3.26Å; E225-R228 WeakPolarHBondContact O-CA 3.31Å; E225-R228 VanDerWaalsContact O-CB 3.32Å; E225-R228 WeakPolarHBondContact O-CB 3.4Å; E225-R228 PolarHBondContact O-N 2.91Å; E225-R228 IonicContact OE1-CZ 2.69Å; E225-R228 IonicContact OE1-NH1 2.87Å; E225-R228 PolarHBondContact OE1-NH1 3.06Å; A226-R228 VanDerWaalsContact C-N 3.32Å; A226-R228 PolarHBondContact O-N 2.99Å; R228-R231 PolarHBondContact O-N 2.89Å; R228-K232 WeakPolarHBondContact O-CG 3.5Å; R228-K232 PolarHBondContact O-N 2.86Å
229	L	92.2	Very high	86.2	Confident	107 Å²	107	117.7 Å²	117.7	56%	0.56	56%	0.556	S	S	*	*	H	α-helix	trans	-66.4	-44.6	179.6	-175.4	61.6	0	0	0	111.8	E225 A226 R231 K232 M233	E225-L229 PolarHBondContact O-N 2.82Å; A226-L229 PolarHBondContact O-N 3.47Å; A226-L229 VanDerWaalsContact O-N 3.16Å; L229-R231 VanDerWaalsContact C-N 3.34Å; L229-R231 PolarHBondContact O-N 2.83Å; L229-K232 WeakPolarHBondContact O-CB 3.37Å; L229-K232 PolarHBondContact O-N 3.1Å; L229-K232 VanDerWaalsContact O-N 3.09Å; L229-M233 WeakPolarHBondContact O-CG 3.17Å; L229-M233 PolarHBondContact O-N 3.11Å
230	A	91.9	Very high	88.2	Confident	60 Å²	60	121.7 Å²	121.7	50%	0.496	56%	0.564	S	S	.	*	H	α-helix	trans	-55.7	-46.9	173	0	0	0	0	0	111.5	A226 K232 M233 Q234	A226-A230 WeakPolarHBondContact O-CB 3.42Å; A226-A230 PolarHBondContact O-N 2.82Å; A230-K232 PolarHBondContact O-N 2.99Å; A230-M233 PolarHBondContact O-N 2.7Å; A230-Q234 WeakPolarHBondContact O-CB 3.22Å; A230-Q234 PolarHBondContact O-N 2.76Å
231	R	93.8	Very high	89.6	Confident	155 Å²	155	117 Å²	117	59%	0.585	56%	0.557	S	S	*	*	H	α-helix	trans	-63.4	-34.8	174.8	-75.8	174.5	170	-170.8	-3.3	113.4	R227 R228 L229 K235	R227-R231 VanDerWaalsContact O-CG 3.32Å; R227-R231 WeakPolarHBondContact O-CG 3.47Å; R227-R231 PolarHBondContact O-N 2.56Å; R228-R231 PolarHBondContact O-N 2.89Å; L229-R231 VanDerWaalsContact C-N 3.34Å; L229-R231 PolarHBondContact O-N 2.83Å; R231-K235 WeakPolarHBondContact O-CG 3.31Å; R231-K235 PolarHBondContact O-N 2.76Å; R231-K235 VanDerWaalsContact O-N 3.16Å
232	K	95.6	Very high	90.7	Very high	150 Å²	150	118.7 Å²	118.7	65%	0.652	57%	0.569	S	S	*	*	H	α-helix	trans	-65.7	-42.9	171.9	-74.1	175	179.7	175.9	0	111.2	R228 L229 A230 K236	R228-K232 WeakPolarHBondContact O-CG 3.5Å; R228-K232 PolarHBondContact O-N 2.86Å; L229-K232 WeakPolarHBondContact O-CB 3.37Å; L229-K232 PolarHBondContact O-N 3.1Å; L229-K232 VanDerWaalsContact O-N 3.09Å; A230-K232 PolarHBondContact O-N 2.99Å; K232-K236 WeakPolarHBondContact O-CB 3.38Å; K232-K236 PolarHBondContact O-N 2.89Å
233	M	93.5	Very high	91.9	Very high	114 Å²	114	119.9 Å²	119.9	56%	0.562	57%	0.572	S	S	*	*	H	α-helix	trans	-68.3	-43.3	179.3	-73.6	-66.9	-80.1	0	0	112.2	L229 A230 K236 A237	L229-M233 WeakPolarHBondContact O-CG 3.17Å; L229-M233 PolarHBondContact O-N 3.11Å; A230-M233 PolarHBondContact O-N 2.7Å; M233-K236 WeakPolarHBondContact O-CB 3.34Å; M233-K236 PolarHBondContact O-N 2.63Å; M233-K236 VanDerWaalsContact O-N 3.14Å; M233-K236 HydrophobicContact SD-CD 4.46Å; M233-A237 PolarHBondContact O-N 3.32Å
234	Q	93	Very high	92.6	Very high	113 Å²	113	120.1 Å²	120.1	53%	0.528	57%	0.568	S	S	.	*	H	α-helix	trans	-56.7	-52.6	173.3	-174.7	-174.6	-18.3	0	0	111	A230 K236 A237 E238	A230-Q234 WeakPolarHBondContact O-CB 3.22Å; A230-Q234 PolarHBondContact O-N 2.76Å; Q234-K236 PolarHBondContact O-N 2.9Å; Q234-A237 CarbonylContact O-C 3.58Å; Q234-A237 WeakPolarHBondContact O-CA 3.4Å; Q234-A237 WeakPolarHBondContact O-CB 3.34Å; Q234-A237 PolarHBondContact O-N 2.9Å; Q234-E238 HydrophobicContact CG-CG 4.39Å; Q234-E238 WeakPolarHBondContact CG-OE1 3.44Å; Q234-E238 PolarHBondContact NE2-OE1 3.37Å; Q234-E238 WeakPolarHBondContact O-CG 3.37Å; Q234-E238 PolarHBondContact O-N 3.14Å
235	K	95.7	Very high	92.9	Very high	150 Å²	150	115.6 Å²	115.6	65%	0.652	56%	0.561	S	S	*	*	H	α-helix	trans	-59.4	-30.7	176.3	-73.6	-175.7	174.8	-168.9	0	113.6	R231 E238 K239	R231-K235 WeakPolarHBondContact O-CG 3.31Å; R231-K235 PolarHBondContact O-N 2.76Å; R231-K235 VanDerWaalsContact O-N 3.16Å; K235-E238 WeakPolarHBondContact CA-OE2 3.42Å; K235-K239 VanDerWaalsContact O-CB 3.26Å; K235-K239 WeakPolarHBondContact O-CB 3.32Å; K235-K239 PolarHBondContact O-N 3.2Å
236	K	95.2	Very high	93.4	Very high	142 Å²	142	113.4 Å²	113.4	62%	0.617	56%	0.559	S	S	*	*	H	α-helix	trans	-73.4	-33.9	175	-168.9	176.6	-178.5	179.8	0	111.9	K232 M233 Q234 K240	K232-K236 WeakPolarHBondContact O-CB 3.38Å; K232-K236 PolarHBondContact O-N 2.89Å; M233-K236 WeakPolarHBondContact O-CB 3.34Å; M233-K236 PolarHBondContact O-N 2.63Å; M233-K236 VanDerWaalsContact O-N 3.14Å; M233-K236 HydrophobicContact SD-CD 4.46Å; Q234-K236 PolarHBondContact O-N 2.9Å; K236-K240 PolarHBondContact O-N 2.97Å
237	A	92.4	Very high	93.9	Very high	61 Å²	61	117.9 Å²	117.9	50%	0.504	57%	0.568	S	S	.	*	H	α-helix	trans	-71.2	-49.3	172.5	0	0	0	0	0	111.5	M233 Q234 K239 K240 A241	M233-A237 PolarHBondContact O-N 3.32Å; Q234-A237 CarbonylContact O-C 3.58Å; Q234-A237 WeakPolarHBondContact O-CA 3.4Å; Q234-A237 WeakPolarHBondContact O-CB 3.34Å; Q234-A237 PolarHBondContact O-N 2.9Å; A237-K239 VanDerWaalsContact C-N 3.35Å; A237-K239 PolarHBondContact O-N 3.39Å; A237-K240 CarbonylContact O-C 3.57Å; A237-K240 WeakPolarHBondContact O-CA 3.18Å; A237-K240 WeakPolarHBondContact O-CB 3.27Å; A237-K240 PolarHBondContact O-N 2.82Å; A237-A241 PolarHBondContact O-N 3.26Å
238	E	92.5	Very high	94	Very high	96 Å²	96	116.2 Å²	116.2	45%	0.449	56%	0.562	S	S	.	*	H	α-helix	trans	-54.2	-47.8	174.5	-70	165.4	174.1	0	0	111.4	Q234 K235 K240 A241 L242	Q234-E238 HydrophobicContact CG-CG 4.39Å; Q234-E238 WeakPolarHBondContact CG-OE1 3.44Å; Q234-E238 PolarHBondContact NE2-OE1 3.37Å; Q234-E238 WeakPolarHBondContact O-CG 3.37Å; Q234-E238 PolarHBondContact O-N 3.14Å; K235-E238 WeakPolarHBondContact CA-OE2 3.42Å; E238-K240 VanDerWaalsContact C-N 3.29Å; E238-K240 PolarHBondContact O-N 2.86Å; E238-A241 PolarHBondContact O-N 3.45Å; E238-A241 VanDerWaalsContact O-N 3.13Å; E238-L242 WeakPolarHBondContact O-CB 3.24Å; E238-L242 PolarHBondContact O-N 2.89Å
239	K	96.3	Very high	93.9	Very high	167 Å²	167	116 Å²	116	73%	0.726	57%	0.566	S	S	*	*	H	α-helix	trans	-64.6	-29.3	176.5	-170.7	169.5	-177.1	173.3	0	113.1	K235 A237 K243	K235-K239 VanDerWaalsContact O-CB 3.26Å; K235-K239 WeakPolarHBondContact O-CB 3.32Å; K235-K239 PolarHBondContact O-N 3.2Å; A237-K239 VanDerWaalsContact C-N 3.35Å; A237-K239 PolarHBondContact O-N 3.39Å; K239-K243 WeakPolarHBondContact O-CB 3.41Å; K239-K243 PolarHBondContact O-N 3.39Å
240	K	95.5	Very high	94	Very high	160 Å²	160	113.8 Å²	113.8	70%	0.696	56%	0.563	S	S	*	*	H	α-helix	trans	-72.2	-42.9	170.2	-94	-173.1	172.7	-175	0	111.6	K236 A237 E238 K243 K244	K236-K240 PolarHBondContact O-N 2.97Å; A237-K240 CarbonylContact O-C 3.57Å; A237-K240 WeakPolarHBondContact O-CA 3.18Å; A237-K240 WeakPolarHBondContact O-CB 3.27Å; A237-K240 PolarHBondContact O-N 2.82Å; E238-K240 VanDerWaalsContact C-N 3.29Å; E238-K240 PolarHBondContact O-N 2.86Å; K240-K243 PolarHBondContact O-N 2.9Å; K240-K244 PolarHBondContact O-N 3.13Å
241	A	93.4	Very high	94.2	Very high	58 Å²	58	117.9 Å²	117.9	48%	0.479	57%	0.569	S	S	.	*	H	α-helix	trans	-62.5	-48.5	178.2	0	0	0	0	0	111.3	A237 E238 K243 K244 A245	A237-A241 PolarHBondContact O-N 3.26Å; E238-A241 PolarHBondContact O-N 3.45Å; E238-A241 VanDerWaalsContact O-N 3.13Å; A241-K243 VanDerWaalsContact C-N 3.33Å; A241-K243 PolarHBondContact O-N 2.81Å; A241-K244 CarbonylContact O-C 3.39Å; A241-K244 WeakPolarHBondContact O-CA 3.49Å; A241-K244 VanDerWaalsContact O-CB 3.31Å; A241-K244 WeakPolarHBondContact O-CB 3.35Å; A241-K244 PolarHBondContact O-N 3.04Å; A241-A245 PolarHBondContact O-N 2.88Å
242	L	94.5	Very high	94.2	Very high	129 Å²	129	115.7 Å²	115.7	68%	0.675	56%	0.561	S	S	*	*	H	α-helix	trans	-60.5	-40.2	176.9	-167.8	67.4	0	0	0	112.1	E238 K244 A245 A246	E238-L242 WeakPolarHBondContact O-CB 3.24Å; E238-L242 PolarHBondContact O-N 2.89Å; L242-K244 VanDerWaalsContact C-N 3.31Å; L242-K244 PolarHBondContact O-N 3.48Å; L242-A245 PolarHBondContact O-N 2.96Å; L242-A246 PolarHBondContact O-N 3.21Å
243	K	96.1	Very high	94.2	Very high	169 Å²	169	112.7 Å²	112.7	74%	0.735	55%	0.552	S	S	*	*	H	α-helix	trans	-67.8	-27.3	173.5	-171.3	170.9	-178.2	174.9	0	113.1	K239 K240 A241 K247	K239-K243 WeakPolarHBondContact O-CB 3.41Å; K239-K243 PolarHBondContact O-N 3.39Å; K240-K243 PolarHBondContact O-N 2.9Å; A241-K243 VanDerWaalsContact C-N 3.33Å; A241-K243 PolarHBondContact O-N 2.81Å; K243-K247 WeakPolarHBondContact O-CB 3.49Å; K243-K247 PolarHBondContact O-N 3.38Å
244	K	95.2	Very high	94.2	Very high	112 Å²	112	110.3 Å²	110.3	49%	0.487	55%	0.55	S	S	.	*	H	α-helix	trans	-74.2	-41.3	172.2	-172.2	-171.4	175.8	-163.5	0	110.7	K240 A241 L242 K247 R248	K240-K244 PolarHBondContact O-N 3.13Å; A241-K244 CarbonylContact O-C 3.39Å; A241-K244 WeakPolarHBondContact O-CA 3.49Å; A241-K244 VanDerWaalsContact O-CB 3.31Å; A241-K244 WeakPolarHBondContact O-CB 3.35Å; A241-K244 PolarHBondContact O-N 3.04Å; L242-K244 VanDerWaalsContact C-N 3.31Å; L242-K244 PolarHBondContact O-N 3.48Å; K244-K247 PolarHBondContact O-N 3.42Å; K244-R248 PolarHBondContact O-N 2.98Å
245	A	91.4	Very high	94.3	Very high	46 Å²	46	112.3 Å²	112.3	38%	0.38	56%	0.557	S	S	.	*	H	α-helix	trans	-63.5	-54.9	177.1	0	0	0	0	0	112.1	A241 L242 K247 R248 E249	A241-A245 PolarHBondContact O-N 2.88Å; L242-A245 PolarHBondContact O-N 2.96Å; A245-K247 PolarHBondContact O-N 2.9Å; A245-K247 VanDerWaalsContact O-N 3.08Å; A245-R248 CarbonylContact O-C 3.58Å; A245-R248 WeakPolarHBondContact O-CA 3.21Å; A245-R248 VanDerWaalsContact O-CB 3.31Å; A245-R248 WeakPolarHBondContact O-CB 3.46Å; A245-R248 PolarHBondContact O-N 3.33Å; A245-E249 PolarHBondContact O-N 3.25Å
246	A	95.1	Very high	94.2	Very high	50 Å²	50	110.1 Å²	110.1	41%	0.413	55%	0.549	S	S	.	.	H	α-helix	trans	-57.9	-29	176.6	0	0	0	0	0	113	L242 A250	L242-A246 PolarHBondContact O-N 3.21Å; A246-A250 VanDerWaalsContact O-CB 3.29Å; A246-A250 WeakPolarHBondContact O-CB 3.4Å; A246-A250 PolarHBondContact O-N 3.18Å
247	K	96.2	Very high	94.1	Very high	149 Å²	149	109.7 Å²	109.7	65%	0.648	55%	0.547	S	S	*	.	H	α-helix	trans	-78.5	-22.1	173.6	-170.7	171.2	-178.4	176.1	0	113.7	K243 K244 A245 K251	K243-K247 WeakPolarHBondContact O-CB 3.49Å; K243-K247 PolarHBondContact O-N 3.38Å; K244-K247 PolarHBondContact O-N 3.42Å; A245-K247 PolarHBondContact O-N 2.9Å; A245-K247 VanDerWaalsContact O-N 3.08Å; K247-K251 WeakPolarHBondContact O-CG 3.41Å
248	R	92.7	Very high	94.2	Very high	132 Å²	132	116.4 Å²	116.4	50%	0.498	56%	0.56	S	S	.	*	H	α-helix	trans	-74.3	-49.9	166.8	-73.6	169.8	159.3	170.5	-11.3	109.3	K244 A245 K251 R252 D917	K244-R248 PolarHBondContact O-N 2.98Å; A245-R248 CarbonylContact O-C 3.58Å; A245-R248 WeakPolarHBondContact O-CA 3.21Å; A245-R248 VanDerWaalsContact O-CB 3.31Å; A245-R248 WeakPolarHBondContact O-CB 3.46Å; A245-R248 PolarHBondContact O-N 3.33Å; R248-K251 WeakPolarHBondContact O-CA 3.5Å; R248-K251 WeakPolarHBondContact O-CB 3.39Å; R248-K251 PolarHBondContact O-N 3.31Å; R248-K251 VanDerWaalsContact O-N 3.08Å; R248-R252 PolarHBondContact O-N 3.07Å; R248-D917 IonicContact CZ-OD2 3.12Å; R248-D917 IonicContact NH1-OD2 3.25Å; R248-D917 PolarHBondContact NH1-OD2 2.71Å; R248-D917 VanDerWaalsContact NH1-OD2 3.11Å; R248-D917 IonicContact NH2-OD2 2.96Å; R248-D917 PolarHBondContact NH2-OD2 2.92Å
249	E	90.3	Very high	94.2	Very high	117 Å²	117	114.2 Å²	114.2	55%	0.547	56%	0.558	S	S	.	*	H	α-helix	trans	-58	-51.5	179.5	-173.1	-168	171.6	0	0	112.9	A245 K251 R252 L253	A245-E249 PolarHBondContact O-N 3.25Å; E249-K251 PolarHBondContact O-N 2.88Å; E249-K251 VanDerWaalsContact O-N 3.1Å; E249-R252 WeakPolarHBondContact O-CA 3.28Å; E249-R252 VanDerWaalsContact O-CB 3.29Å; E249-R252 WeakPolarHBondContact O-CB 3.41Å; E249-R252 PolarHBondContact O-N 3.28Å; E249-L253 PolarHBondContact O-N 3.3Å
250	A	94	Very high	94.1	Very high	59 Å²	59	112 Å²	112	49%	0.488	55%	0.55	S	S	.	*	H	α-helix	trans	-59.6	-25.8	176.7	0	0	0	0	0	113	A246 A254	A246-A250 VanDerWaalsContact O-CB 3.29Å; A246-A250 WeakPolarHBondContact O-CB 3.4Å; A246-A250 PolarHBondContact O-N 3.18Å; A250-A254 VanDerWaalsContact O-CB 3.24Å; A250-A254 WeakPolarHBondContact O-CB 3.41Å; A250-A254 PolarHBondContact O-N 3.24Å; A250-A254 VanDerWaalsContact O-N 3.15Å
251	K	95.8	Very high	94	Very high	146 Å²	146	112.4 Å²	112.4	64%	0.635	55%	0.547	S	S	*	.	H	α-helix	trans	-78.2	-32.9	171	-75.9	-179.3	171.3	-167.6	0	112.9	K247 R248 E249 K255	K247-K251 WeakPolarHBondContact O-CG 3.41Å; R248-K251 WeakPolarHBondContact O-CA 3.5Å; R248-K251 WeakPolarHBondContact O-CB 3.39Å; R248-K251 PolarHBondContact O-N 3.31Å; R248-K251 VanDerWaalsContact O-N 3.08Å; E249-K251 PolarHBondContact O-N 2.88Å; E249-K251 VanDerWaalsContact O-N 3.1Å; K251-K255 WeakPolarHBondContact O-CB 3.46Å; K251-K255 PolarHBondContact O-N 3.41Å
252	R	94.9	Very high	94	Very high	109 Å²	109	118.2 Å²	118.2	41%	0.411	56%	0.557	S	S	.	*	H	α-helix	trans	-59.2	-57.5	171.8	-164.5	178.6	100.9	163.1	6.3	109	R248 E249 A254 K255 E256 E922	R248-R252 PolarHBondContact O-N 3.07Å; E249-R252 WeakPolarHBondContact O-CA 3.28Å; E249-R252 VanDerWaalsContact O-CB 3.29Å; E249-R252 WeakPolarHBondContact O-CB 3.41Å; E249-R252 PolarHBondContact O-N 3.28Å; R252-A254 VanDerWaalsContact C-N 3.33Å; R252-A254 PolarHBondContact O-N 3.45Å; R252-K255 WeakPolarHBondContact O-CB 3.47Å; R252-K255 PolarHBondContact O-N 2.97Å; R252-E256 WeakPolarHBondContact O-CB 3.36Å; R252-E256 PolarHBondContact O-N 3.27Å; R252-E922 IonicContact CZ-OE2 3.68Å; R252-E922 VanDerWaalsContact CZ-OE2 3.23Å; R252-E922 IonicContact NH1-OE2 3.32Å; R252-E922 PolarHBondContact NH1-OE2 2.82Å; R252-E922 IonicContact NH2-OE2 3.43Å; R252-E922 PolarHBondContact NH2-OE2 3.3Å
253	L	93.9	Very high	94	Very high	88 Å²	88	114.8 Å²	114.8	46%	0.461	55%	0.547	S	S	.	.	H	α-helix	trans	-58.7	-38.6	179	-63.5	172.1	0	0	0	113	E249 K257	E249-L253 PolarHBondContact O-N 3.3Å; L253-K257 VanDerWaalsContact O-CB 3.24Å; L253-K257 WeakPolarHBondContact O-CB 3.35Å; L253-K257 PolarHBondContact O-N 3.04Å
254	A	94.9	Very high	94	Very high	64 Å²	64	116.1 Å²	116.1	53%	0.529	55%	0.548	S	S	.	.	H	α-helix	trans	-69.9	-31.9	176.6	0	0	0	0	0	113.6	A250 R252 R258	A250-A254 VanDerWaalsContact O-CB 3.24Å; A250-A254 WeakPolarHBondContact O-CB 3.41Å; A250-A254 PolarHBondContact O-N 3.24Å; A250-A254 VanDerWaalsContact O-N 3.15Å; R252-A254 VanDerWaalsContact C-N 3.33Å; R252-A254 PolarHBondContact O-N 3.45Å; A254-R258 WeakPolarHBondContact O-CB 3.49Å; A254-R258 PolarHBondContact O-N 3.42Å
255	K	94.8	Very high	94	Very high	155 Å²	155	119.4 Å²	119.4	67%	0.674	56%	0.557	S	S	*	*	H	α-helix	trans	-73.2	-43.7	174.1	-177.1	-171.5	175.2	-165.5	0	110.7	K251 R252 R258 A259	K251-K255 WeakPolarHBondContact O-CB 3.46Å; K251-K255 PolarHBondContact O-N 3.41Å; R252-K255 WeakPolarHBondContact O-CB 3.47Å; R252-K255 PolarHBondContact O-N 2.97Å; K255-R258 WeakPolarHBondContact O-CB 3.38Å; K255-R258 PolarHBondContact O-N 3.47Å; K255-A259 PolarHBondContact O-N 3.5Å
256	E	92.8	Very high	94.1	Very high	104 Å²	104	122.2 Å²	122.2	49%	0.486	56%	0.562	S	S	.	*	H	α-helix	trans	-61.5	-53.7	178.1	-174.8	178.1	175.5	0	0	112	R252 R258 A259 E260	R252-E256 WeakPolarHBondContact O-CB 3.36Å; R252-E256 PolarHBondContact O-N 3.27Å; E256-R258 PolarHBondContact O-N 3.07Å; E256-A259 WeakPolarHBondContact O-CA 3.44Å; E256-A259 WeakPolarHBondContact O-CB 3.27Å; E256-A259 PolarHBondContact O-N 3.2Å; E256-E260 PolarHBondContact O-N 3.28Å
257	K	94.1	Very high	94.1	Very high	132 Å²	132	122.9 Å²	122.9	57%	0.574	57%	0.567	S	S	*	*	H	α-helix	trans	-60.7	-17.9	174.1	-166.5	167.5	-171.1	164.9	0	113.6	L253 R261	L253-K257 VanDerWaalsContact O-CB 3.24Å; L253-K257 WeakPolarHBondContact O-CB 3.35Å; L253-K257 PolarHBondContact O-N 3.04Å; K257-R261 WeakPolarHBondContact O-CB 3.41Å; K257-R261 WeakPolarHBondContact O-CD 3.37Å; K257-R261 VanDerWaalsContact O-CG 3.23Å; K257-R261 WeakPolarHBondContact O-CG 3.49Å
258	R	94.3	Very high	94.1	Very high	203 Å²	203	122.8 Å²	122.8	77%	0.766	57%	0.567	S	S	*	*	H	α-helix	trans	-86.1	-32.4	171	-172.2	178.9	-179	92.5	-2	112.5	A254 K255 E256 R262	A254-R258 WeakPolarHBondContact O-CB 3.49Å; A254-R258 PolarHBondContact O-N 3.42Å; K255-R258 WeakPolarHBondContact O-CB 3.38Å; K255-R258 PolarHBondContact O-N 3.47Å; E256-R258 PolarHBondContact O-N 3.07Å; R258-R262 PolarHBondContact O-N 3Å
259	A	92.6	Very high	94.2	Very high	49 Å²	49	125 Å²	125	41%	0.405	58%	0.576	S	S	.	*	H	α-helix	trans	-71.1	-45.7	173.3	0	0	0	0	0	111.5	K255 E256 R261 R262 A263	K255-A259 PolarHBondContact O-N 3.5Å; E256-A259 WeakPolarHBondContact O-CA 3.44Å; E256-A259 WeakPolarHBondContact O-CB 3.27Å; E256-A259 PolarHBondContact O-N 3.2Å; A259-R261 VanDerWaalsContact C-N 3.33Å; A259-R261 PolarHBondContact O-N 3Å; A259-R262 WeakPolarHBondContact O-CA 3.39Å; A259-R262 WeakPolarHBondContact O-CB 3.47Å; A259-R262 PolarHBondContact O-N 3.07Å; A259-A263 PolarHBondContact O-N 2.92Å
260	E	92.7	Very high	94.4	Very high	122 Å²	122	123 Å²	123	57%	0.57	57%	0.566	S	S	*	*	H	α-helix	trans	-57.5	-45.1	174.1	-168.8	-149.9	162.5	0	0	111.5	E256 R262 A263 R264	E256-E260 PolarHBondContact O-N 3.28Å; E260-R262 PolarHBondContact O-N 3.38Å; E260-R262 VanDerWaalsContact O-N 3.15Å; E260-A263 PolarHBondContact O-N 3.26Å; E260-R264 PolarHBondContact O-N 3.1Å
261	R	94.5	Very high	94.5	Very high	168 Å²	168	126 Å²	126	63%	0.634	57%	0.573	S	S	*	*	H	α-helix	trans	-62.6	-15.9	172.2	-80.5	178.1	166.5	-166.7	-5.2	114.2	K257 A259 R265	K257-R261 WeakPolarHBondContact O-CB 3.41Å; K257-R261 WeakPolarHBondContact O-CD 3.37Å; K257-R261 VanDerWaalsContact O-CG 3.23Å; K257-R261 WeakPolarHBondContact O-CG 3.49Å; A259-R261 VanDerWaalsContact C-N 3.33Å; A259-R261 PolarHBondContact O-N 3Å; R261-R265 VanDerWaalsContact O-CD 3.27Å; R261-R265 WeakPolarHBondContact O-CD 3.42Å; R261-R265 WeakPolarHBondContact O-CG 3.5Å
262	R	93.5	Very high	94.5	Very high	180 Å²	180	126.3 Å²	126.3	68%	0.679	57%	0.574	S	S	*	*	H	α-helix	trans	-85.2	-52.8	170.2	-167.1	-177.8	-175.8	113	-1.3	110.1	R258 A259 E260 R264 R265 E266	R258-R262 PolarHBondContact O-N 3Å; A259-R262 WeakPolarHBondContact O-CA 3.39Å; A259-R262 WeakPolarHBondContact O-CB 3.47Å; A259-R262 PolarHBondContact O-N 3.07Å; E260-R262 PolarHBondContact O-N 3.38Å; E260-R262 VanDerWaalsContact O-N 3.15Å; R262-R264 VanDerWaalsContact C-N 3.32Å; R262-R264 PolarHBondContact O-N 2.95Å; R262-R265 WeakPolarHBondContact O-CA 3.38Å; R262-R265 WeakPolarHBondContact O-CB 3.45Å; R262-R265 PolarHBondContact O-N 3.13Å; R262-E266 PolarHBondContact O-N 3.43Å
263	A	94.6	Very high	94.5	Very high	57 Å²	57	126.5 Å²	126.5	47%	0.471	58%	0.575	S	S	.	*	H	α-helix	trans	-54.1	-44.4	177.5	0	0	0	0	0	112.5	A259 E260 R265 E266 A267	A259-A263 PolarHBondContact O-N 2.92Å; E260-A263 PolarHBondContact O-N 3.26Å; A263-R265 PolarHBondContact O-N 3.15Å; A263-E266 WeakPolarHBondContact O-CA 3.45Å; A263-E266 VanDerWaalsContact O-CB 3.3Å; A263-E266 WeakPolarHBondContact O-CB 3.46Å; A263-E266 PolarHBondContact O-N 2.92Å; A263-A267 PolarHBondContact O-N 3.41Å
264	R	95.7	Very high	94.5	Very high	197 Å²	197	126.3 Å²	126.3	74%	0.743	57%	0.574	S	S	*	*	H	α-helix	trans	-64.6	-24.1	176.6	-170.4	170.7	178.9	177.6	0.4	113.9	E260 R262 K268	E260-R264 PolarHBondContact O-N 3.1Å; R262-R264 VanDerWaalsContact C-N 3.32Å; R262-R264 PolarHBondContact O-N 2.95Å; R264-K268 WeakPolarHBondContact O-CB 3.48Å; R264-K268 PolarHBondContact O-N 2.86Å
265	R	95.3	Very high	94.5	Very high	180 Å²	180	130 Å²	130	68%	0.679	58%	0.58	S	S	*	*	H	α-helix	trans	-82.4	-30.3	172.5	-70.2	172	173.1	171.5	-6.1	112.1	R261 R262 A263 R269	R261-R265 VanDerWaalsContact O-CD 3.27Å; R261-R265 WeakPolarHBondContact O-CD 3.42Å; R261-R265 WeakPolarHBondContact O-CG 3.5Å; R262-R265 WeakPolarHBondContact O-CA 3.38Å; R262-R265 WeakPolarHBondContact O-CB 3.45Å; R262-R265 PolarHBondContact O-N 3.13Å; A263-R265 PolarHBondContact O-N 3.15Å; R265-R269 WeakPolarHBondContact O-CG 3.14Å; R265-R269 PolarHBondContact O-N 3.32Å
266	E	92.7	Very high	94.5	Very high	106 Å²	106	129.7 Å²	129.7	50%	0.495	58%	0.579	S	S	.	*	H	α-helix	trans	-69.1	-53	175.6	-153.8	130.4	-135.6	0	0	110.2	R262 A263 K268 R269 E270	R262-E266 PolarHBondContact O-N 3.43Å; A263-E266 WeakPolarHBondContact O-CA 3.45Å; A263-E266 VanDerWaalsContact O-CB 3.3Å; A263-E266 WeakPolarHBondContact O-CB 3.46Å; A263-E266 PolarHBondContact O-N 2.92Å; E266-K268 VanDerWaalsContact C-N 3.29Å; E266-K268 PolarHBondContact O-N 3.29Å; E266-R269 WeakPolarHBondContact O-CA 3.39Å; E266-R269 WeakPolarHBondContact O-CB 3.43Å; E266-R269 PolarHBondContact O-N 3.25Å; E266-E270 PolarHBondContact O-N 3.1Å
267	A	95.2	Very high	94.4	Very high	63 Å²	63	129 Å²	129	52%	0.521	58%	0.578	S	S	.	*	H	α-helix	trans	-56.5	-39.1	172.5	0	0	0	0	0	112.8	A263 R269 E270 L271	A263-A267 PolarHBondContact O-N 3.41Å; A267-R269 VanDerWaalsContact C-N 3.28Å; A267-R269 PolarHBondContact O-N 2.89Å; A267-E270 PolarHBondContact O-N 3.1Å; A267-L271 WeakPolarHBondContact O-CB 3.44Å; A267-L271 PolarHBondContact O-N 2.75Å
268	K	97	Very high	94.2	Very high	147 Å²	147	126.6 Å²	126.6	64%	0.639	57%	0.569	S	S	*	*	H	α-helix	trans	-70.7	-18.9	175.1	-172.8	164.9	-176.3	171.1	0	113.6	R264 E266	R264-K268 WeakPolarHBondContact O-CB 3.48Å; R264-K268 PolarHBondContact O-N 2.86Å; E266-K268 VanDerWaalsContact C-N 3.29Å; E266-K268 PolarHBondContact O-N 3.29Å
269	R	95.7	Very high	94.1	Very high	180 Å²	180	123.7 Å²	123.7	68%	0.679	56%	0.562	S	S	*	*	H	α-helix	trans	-81.5	-45	169.5	-73.7	163.8	173.3	174.9	-6.6	110.7	R265 E266 A267 K272 R273	R265-R269 WeakPolarHBondContact O-CG 3.14Å; R265-R269 PolarHBondContact O-N 3.32Å; E266-R269 WeakPolarHBondContact O-CA 3.39Å; E266-R269 WeakPolarHBondContact O-CB 3.43Å; E266-R269 PolarHBondContact O-N 3.25Å; A267-R269 VanDerWaalsContact C-N 3.28Å; A267-R269 PolarHBondContact O-N 2.89Å; R269-K272 CarbonylContact O-C 3.55Å; R269-K272 WeakPolarHBondContact O-CA 3.37Å; R269-K272 WeakPolarHBondContact O-CB 3.37Å; R269-K272 PolarHBondContact O-N 3.28Å; R269-K272 VanDerWaalsContact O-N 3.08Å; R269-R273 PolarHBondContact O-N 3.47Å
270	E	93.9	Very high	93.8	Very high	74 Å²	74	123.8 Å²	123.8	35%	0.346	56%	0.559	S	S	.	*	H	α-helix	trans	-67.2	-41.2	-178.5	-170.7	53.8	-155.3	0	0	112	E266 A267 K272 R273 L274	E266-E270 PolarHBondContact O-N 3.1Å; A267-E270 PolarHBondContact O-N 3.1Å; E270-K272 PolarHBondContact O-N 3.49Å; E270-R273 VanDerWaalsContact CD-NE 3.27Å; E270-R273 CarbonylContact O-C 3.59Å; E270-R273 WeakPolarHBondContact O-CA 3.47Å; E270-R273 WeakPolarHBondContact O-CB 3.48Å; E270-R273 PolarHBondContact O-N 3.21Å; E270-R273 IonicContact OE1-CZ 2.7Å; E270-R273 IonicContact OE1-NE 3.64Å; E270-R273 PolarHBondContact OE1-NE 3.34Å; E270-R273 IonicContact OE1-NH2 2.61Å; E270-R273 PolarHBondContact OE1-NH2 3.45Å; E270-R273 WeakPolarHBondContact OE2-CD 3.45Å; E270-R273 IonicContact OE2-CZ 3.85Å; E270-R273 IonicContact OE2-NE 2.57Å; E270-R273 PolarHBondContact OE2-NE 2.97Å; E270-L274 HydrophobicContact CG-CD1 4.4Å; E270-L274 HydrophobicContact CG-CG 4.44Å; E270-L274 WeakPolarHBondContact O-CG 3.32Å; E270-L274 PolarHBondContact O-N 2.85Å
271	L	95.4	Very high	93.4	Very high	122 Å²	122	123.1 Å²	123.1	64%	0.639	55%	0.551	S	S	*	*	H	α-helix	trans	-56.8	-34.5	170.8	-175.3	63.8	0	0	0	112.5	A267 H275	A267-L271 WeakPolarHBondContact O-CB 3.44Å; A267-L271 PolarHBondContact O-N 2.75Å; L271-H275 VanDerWaalsContact O-CB 3.29Å; L271-H275 WeakPolarHBondContact O-CB 3.12Å; L271-H275 PolarHBondContact O-N 2.7Å
272	K	96.2	Very high	92.7	Very high	152 Å²	152	119.9 Å²	119.9	66%	0.661	55%	0.546	S	S	*	.	H	α-helix	trans	-74.3	-30.5	172.6	-81.2	-166.8	169.3	-155	0	113.2	R269 E270 K276	R269-K272 CarbonylContact O-C 3.55Å; R269-K272 WeakPolarHBondContact O-CA 3.37Å; R269-K272 WeakPolarHBondContact O-CB 3.37Å; R269-K272 PolarHBondContact O-N 3.28Å; R269-K272 VanDerWaalsContact O-N 3.08Å; E270-K272 PolarHBondContact O-N 3.49Å; K272-K276 WeakPolarHBondContact O-CB 3.39Å; K272-K276 PolarHBondContact O-N 3.45Å; K272-K276 VanDerWaalsContact O-N 3.11Å
273	R	94.5	Very high	91.9	Very high	113 Å²	113	115.5 Å²	115.5	43%	0.426	54%	0.539	S	S	.	.	H	α-helix	trans	-69.2	-48.8	174.9	-163.7	-174	72.9	94.3	7.7	110.2	R269 E270 K276 L277	R269-R273 PolarHBondContact O-N 3.47Å; E270-R273 VanDerWaalsContact CD-NE 3.27Å; E270-R273 CarbonylContact O-C 3.59Å; E270-R273 WeakPolarHBondContact O-CA 3.47Å; E270-R273 WeakPolarHBondContact O-CB 3.48Å; E270-R273 PolarHBondContact O-N 3.21Å; E270-R273 IonicContact OE1-CZ 2.7Å; E270-R273 IonicContact OE1-NE 3.64Å; E270-R273 PolarHBondContact OE1-NE 3.34Å; E270-R273 IonicContact OE1-NH2 2.61Å; E270-R273 PolarHBondContact OE1-NH2 3.45Å; E270-R273 WeakPolarHBondContact OE2-CD 3.45Å; E270-R273 IonicContact OE2-CZ 3.85Å; E270-R273 IonicContact OE2-NE 2.57Å; E270-R273 PolarHBondContact OE2-NE 2.97Å; R273-K276 WeakPolarHBondContact O-CB 3.29Å; R273-K276 PolarHBondContact O-N 3.14Å; R273-K276 VanDerWaalsContact O-N 3.14Å; R273-L277 WeakPolarHBondContact O-CG 3.21Å; R273-L277 PolarHBondContact O-N 3.2Å
274	L	95	Very high	90.9	Very high	84 Å²	84	119.1 Å²	119.1	44%	0.44	55%	0.547	S	S	.	.	H	α-helix	trans	-60.1	-47.4	175.7	-63.6	175.7	0	0	0	111.7	E270 K276 L277 E278	E270-L274 HydrophobicContact CG-CD1 4.4Å; E270-L274 HydrophobicContact CG-CG 4.44Å; E270-L274 WeakPolarHBondContact O-CG 3.32Å; E270-L274 PolarHBondContact O-N 2.85Å; L274-K276 VanDerWaalsContact C-N 3.26Å; L274-K276 PolarHBondContact O-N 3.21Å; L274-L277 PolarHBondContact O-N 2.76Å; L274-L277 VanDerWaalsContact O-N 3.11Å; L274-E278 PolarHBondContact O-N 3.02Å
275	H	94.7	Very high	89.5	Confident	141 Å²	141	115.4 Å²	115.4	65%	0.653	54%	0.538	S	S	*	.	H	α-helix	trans	-62.9	-29.5	175.4	-176.7	-99.2	0	0	0	113.3	L271 K279	L271-H275 VanDerWaalsContact O-CB 3.29Å; L271-H275 WeakPolarHBondContact O-CB 3.12Å; L271-H275 PolarHBondContact O-N 2.7Å; H275-K279 WeakPolarHBondContact O-CB 3.27Å; H275-K279 PolarHBondContact O-N 3.16Å
276	K	93.8	Very high	88	Confident	150 Å²	150	110.3 Å²	110.3	65%	0.652	54%	0.541	S	S	*	.	H	α-helix	trans	-71.3	-43.1	171.8	-170.3	-174.3	175.7	-168.1	0	111.4	K272 R273 L274 K279 C280	K272-K276 WeakPolarHBondContact O-CB 3.39Å; K272-K276 PolarHBondContact O-N 3.45Å; K272-K276 VanDerWaalsContact O-N 3.11Å; R273-K276 WeakPolarHBondContact O-CB 3.29Å; R273-K276 PolarHBondContact O-N 3.14Å; R273-K276 VanDerWaalsContact O-N 3.14Å; L274-K276 VanDerWaalsContact C-N 3.26Å; L274-K276 PolarHBondContact O-N 3.21Å; K276-K279 PolarHBondContact O-N 3.08Å; K276-C280 PolarHBondContact O-N 3.03Å; K276-C280 VanDerWaalsContact O-N 3.08Å; K276-C280 PolarHBondContact O-SG 3.15Å
277	L	91.2	Very high	86.3	Confident	90 Å²	90	109.8 Å²	109.8	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-63.7	-45.8	178.4	-72	170	0	0	0	111.8	R273 L274 K279 C280 R281	R273-L277 WeakPolarHBondContact O-CG 3.21Å; R273-L277 PolarHBondContact O-N 3.2Å; L274-L277 PolarHBondContact O-N 2.76Å; L274-L277 VanDerWaalsContact O-N 3.11Å; L277-K279 VanDerWaalsContact C-N 3.3Å; L277-K279 PolarHBondContact O-N 3.36Å; L277-C280 WeakPolarHBondContact O-CA 3.43Å; L277-C280 WeakPolarHBondContact O-CB 3.34Å; L277-C280 PolarHBondContact O-N 2.96Å; L277-R281 PolarHBondContact O-N 3.3Å
278	E	90.5	Very high	84.3	Confident	81 Å²	81	114 Å²	114	38%	0.379	56%	0.562	S	S	.	*	H	α-helix	trans	-64.8	-35.8	178	-172.2	59.7	-166.3	0	0	111.7	L274 C280 R281 L282	L274-E278 PolarHBondContact O-N 3.02Å; E278-C280 VanDerWaalsContact C-N 3.33Å; E278-C280 PolarHBondContact O-N 3.12Å; E278-R281 PolarHBondContact O-N 2.61Å; E278-R281 IonicContact OE1-CZ 3.62Å; E278-R281 IonicContact OE1-NE 3.36Å; E278-R281 PolarHBondContact OE1-NE 3.37Å; E278-R281 IonicContact OE1-NH2 3.78Å; E278-R281 PolarHBondContact OE1-NH2 3.21Å; E278-R281 IonicContact OE2-CZ 2.69Å; E278-R281 IonicContact OE2-NE 3.84Å; E278-R281 PolarHBondContact OE2-NE 2.76Å; E278-R281 IonicContact OE2-NH2 3.11Å; E278-L282 HydrophobicContact CG-CD1 4.3Å; E278-L282 VanDerWaalsContact O-CG 3.31Å; E278-L282 WeakPolarHBondContact O-CG 3.35Å; E278-L282 PolarHBondContact O-N 3.31Å
279	K	91.2	Very high	82.3	Confident	141 Å²	141	113.9 Å²	113.9	61%	0.613	57%	0.568	S	S	*	*	H	α-helix	trans	-62.1	-38.9	171.1	-176.2	166.6	-178.1	170.5	0	112.5	H275 K276 L277 T283	H275-K279 WeakPolarHBondContact O-CB 3.27Å; H275-K279 PolarHBondContact O-N 3.16Å; K276-K279 PolarHBondContact O-N 3.08Å; L277-K279 VanDerWaalsContact C-N 3.3Å; L277-K279 PolarHBondContact O-N 3.36Å; K279-T283 PolarHBondContact O-N 3.14Å; K279-T283 PolarHBondContact O-OG1 3.04Å; K279-T283 VanDerWaalsContact O-OG1 3.14Å
280	C	85.7	Confident	80.1	Confident	52 Å²	52	115.1 Å²	115.1	35%	0.351	58%	0.579	S	S	.	*	H	α-helix	trans	-64.9	-46.4	173.7	-69.5	0	0	0	0	111.6	K276 L277 E278 L282 T283 E284	K276-C280 PolarHBondContact O-N 3.03Å; K276-C280 VanDerWaalsContact O-N 3.08Å; K276-C280 PolarHBondContact O-SG 3.15Å; L277-C280 WeakPolarHBondContact O-CA 3.43Å; L277-C280 WeakPolarHBondContact O-CB 3.34Å; L277-C280 PolarHBondContact O-N 2.96Å; E278-C280 VanDerWaalsContact C-N 3.33Å; E278-C280 PolarHBondContact O-N 3.12Å; C280-L282 VanDerWaalsContact C-N 3.3Å; C280-L282 PolarHBondContact O-N 3.12Å; C280-T283 WeakPolarHBondContact CA-OG1 3.46Å; C280-T283 PolarHBondContact O-N 2.85Å; C280-T283 VanDerWaalsContact O-N 3.07Å; C280-T283 PolarHBondContact O-OG1 3.43Å; C280-E284 WeakPolarHBondContact O-CG 3.23Å; C280-E284 PolarHBondContact O-N 3.24Å
281	R	84.6	Confident	77.6	Confident	107 Å²	107	119.7 Å²	119.7	40%	0.404	61%	0.606	S	S	.	*	H	α-helix	trans	-57.9	-41.6	179.2	-160	-172.7	71.7	68.9	8.2	112.2	L277 E278 E284 Q285	L277-R281 PolarHBondContact O-N 3.3Å; E278-R281 PolarHBondContact O-N 2.61Å; E278-R281 IonicContact OE1-CZ 3.62Å; E278-R281 IonicContact OE1-NE 3.36Å; E278-R281 PolarHBondContact OE1-NE 3.37Å; E278-R281 IonicContact OE1-NH2 3.78Å; E278-R281 PolarHBondContact OE1-NH2 3.21Å; E278-R281 IonicContact OE2-CZ 2.69Å; E278-R281 IonicContact OE2-NE 3.84Å; E278-R281 PolarHBondContact OE2-NE 2.76Å; E278-R281 IonicContact OE2-NH2 3.11Å; R281-E284 PolarHBondContact O-N 3.2Å; R281-Q285 PolarHBondContact O-N 3.03Å; R281-Q285 VanDerWaalsContact O-N 3.14Å
282	L	81	Confident	75.3	Confident	101 Å²	101	120 Å²	120	53%	0.529	61%	0.612	S	S	.	*	H	α-helix	trans	-68.3	-36.8	175.7	-69.5	169.2	0	0	0	112.6	E278 C280 G286	E278-L282 HydrophobicContact CG-CD1 4.3Å; E278-L282 VanDerWaalsContact O-CG 3.31Å; E278-L282 WeakPolarHBondContact O-CG 3.35Å; E278-L282 PolarHBondContact O-N 3.31Å; C280-L282 VanDerWaalsContact C-N 3.3Å; C280-L282 PolarHBondContact O-N 3.12Å; L282-G286 PolarHBondContact O-N 3.41Å
283	T	76.6	Confident	72.6	Confident	87 Å²	87	120.5 Å²	120.5	53%	0.534	62%	0.617	S	S	.	*	H	α-helix	trans	-72	-28	174.9	46.9	0	0	0	0	113.6	K279 C280	K279-T283 PolarHBondContact O-N 3.14Å; K279-T283 PolarHBondContact O-OG1 3.04Å; K279-T283 VanDerWaalsContact O-OG1 3.14Å; C280-T283 WeakPolarHBondContact CA-OG1 3.46Å; C280-T283 PolarHBondContact O-N 2.85Å; C280-T283 VanDerWaalsContact O-N 3.07Å; C280-T283 PolarHBondContact O-OG1 3.43Å
284	E	73.9	Confident	70	Confident	134 Å²	134	122.6 Å²	122.6	63%	0.626	63%	0.632	S	S	*	*	H	α-helix	trans	-74.7	-40.8	175.9	-73.8	166.3	-179.3	0	0	111.5	C280 R281 G286 S287	C280-E284 WeakPolarHBondContact O-CG 3.23Å; C280-E284 PolarHBondContact O-N 3.24Å; R281-E284 PolarHBondContact O-N 3.2Å; E284-G286 VanDerWaalsContact C-N 3.33Å; E284-G286 PolarHBondContact O-N 3.46Å; E284-S287 PolarHBondContact O-N 2.95Å
285	Q	66.2	Low	67.5	Low	119 Å²	119	123.2 Å²	123.2	56%	0.556	64%	0.643	S	S	*	*	H	α-helix	trans	-68.1	-30.3	175.1	-68	-165	-69.5	0	0	113.2	R281 S287	R281-Q285 PolarHBondContact O-N 3.03Å; R281-Q285 VanDerWaalsContact O-N 3.14Å; Q285-S287 PolarHBondContact O-N 2.57Å
286	G	62.8	Low	64.9	Low	72 Å²	72	123.7 Å²	123.7	74%	0.742	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	4.7	179.4	0	0	0	0	0	116.1	L282 E284	L282-G286 PolarHBondContact O-N 3.41Å; E284-G286 VanDerWaalsContact C-N 3.33Å; E284-G286 PolarHBondContact O-N 3.46Å
287	S	57.7	Low	62.4	Low	95 Å²	95	122.1 Å²	122.1	66%	0.664	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	11.4	-170.4	-168.2	0	0	0	0	114.9	E284 Q285	E284-S287 PolarHBondContact O-N 2.95Å; Q285-S287 PolarHBondContact O-N 2.57Å
288	L	53.7	Low	60	Low	153 Å²	153	128.6 Å²	128.6	80%	0.801	67%	0.672	S	S	*	*	S	Bend	trans	-121.5	-4.7	-176.4	-76.9	169.4	0	0	0	115.3
289	D	54.6	Low	57.7	Low	144 Å²	144	132.2 Å²	132.2	77%	0.77	69%	0.694	S	S	*	*	S	Bend	trans	-114.1	54.2	-176.8	-74.2	-48.4	0	0	0	112.9
290	F	48.9	Very low	55.7	Low	206 Å²	206	131 Å²	131	90%	0.904	70%	0.701	S	S	*	*			trans	-163.2	79.9	169.2	-114.4	-69.1	0	0	0	113.5
291	D	42.6	Very low	53.8	Low	170 Å²	170	136 Å²	136	91%	0.909	72%	0.724	S	S	*	*			trans	-167.1	56.3	158.2	-117.7	-21.3	0	0	0	114
292	V	46.8	Very low	52.1	Low	128 Å²	128	136.1 Å²	136.1	78%	0.776	74%	0.736	S	S	*	*			trans	-141.5	106.5	174.2	177.4	0	0	0	0	111.1
293	Q	39.1	Very low	50.1	Low	162 Å²	162	138.1 Å²	138.1	76%	0.757	75%	0.747	S	S	*	*			trans	59	133.9	132.3	-150.4	155.5	5.9	0	0	119.2
294	E	38.7	Very low	48.5	Very low	157 Å²	157	140.9 Å²	140.9	73%	0.734	76%	0.758	S	S	*	*			cis	-153.6	-179.2	-2.5	-139.6	169.9	138	0	0	111
295	S	43	Very low	46.9	Very low	98 Å²	98	142.1 Å²	142.1	69%	0.685	76%	0.764	S	S	*	*			trans	-65	144.9	-175	57.4	0	0	0	0	116.9
296	N	39.9	Very low	45.6	Very low	150 Å²	150	141.3 Å²	141.3	80%	0.802	77%	0.771	S	S	*	*				-154.1	163.1	123.1	-131.9	-47.1	0	0	0	115.1
297	T	43.1	Very low	44.3	Very low	117 Å²	117	143.7 Å²	143.7	72%	0.718	78%	0.776	S	S	*	*			trans	-72.1	170.9	-174.9	62.8	0	0	0	0	113.1
298	R	40.3	Very low	43.3	Very low	226 Å²	226	144.1 Å²	144.1	85%	0.853	78%	0.78	S	S	*	*			cis	-171.2	125.7	34.4	-163	176.6	-172	170.6	2.3	115.2
299	N	41.5	Very low	42.6	Very low	158 Å²	158	144 Å²	144	85%	0.845	78%	0.78	S	S	*	*			trans	51.5	155.4	156.2	-79.3	14.2	0	0	0	123.8
300	P	48.6	Very low	41.4	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	78%	0.778	S	S	*	*			trans	-116	-178.2	-173.9	44.4	-33.4	0	0	0	114.6
301	D	46.6	Very low	40.7	Very low	156 Å²	156	139 Å²	139	83%	0.834	77%	0.769	S	S	*	*			trans	-143.1	170.2	156.4	-135.7	-34.3	0	0	0	112.8
302	V	48.4	Very low	40.2	Very low	110 Å²	110	141.1 Å²	141.1	67%	0.667	77%	0.765	S	S	*	*			trans	-89.5	156.6	-149.8	-63.8	0	0	0	0	119.4
303	N	40.4	Very low	39.5	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	76%	0.763	S	S	*	*			trans	65.9	153.4	153.2	-65.1	-24.4	0	0	0	118.2
304	L	42.4	Very low	39.2	Very low	144 Å²	144	141 Å²	141	75%	0.754	76%	0.76	S	S	*	*			cis	-133.9	166.8	11.6	-90.3	97	0	0	0	113.4
305	E	39.1	Very low	38.9	Very low	160 Å²	160	138.8 Å²	138.8	75%	0.748	75%	0.753	S	S	*	*			trans	53.4	100.9	147.3	-72.6	175.7	118.6	0	0	122.6
306	S	39.8	Very low	38.4	Very low	102 Å²	102	140.6 Å²	140.6	71%	0.713	75%	0.751	S	S	*	*				63.1	92.3	111.5	-55.9	0	0	0	0	120.6
307	S	36.3	Very low	38.1	Very low	122 Å²	122	145 Å²	145	85%	0.853	76%	0.756	S	S	*	*				48.8	94.4	118.8	-55.4	0	0	0	0	119.8
308	S	36.6	Very low	37.5	Very low	105 Å²	105	144.4 Å²	144.4	73%	0.734	76%	0.757	S	S	*	*				-163.2	128.3	115.1	-164.7	0	0	0	0	112.3
309	N	37.5	Very low	37.2	Very low	150 Å²	150	139.7 Å²	139.7	80%	0.802	76%	0.759	S	S	*	*			trans	36.3	97.4	157	-60.1	-23.1	0	0	0	118.7	A311	N309-A311 PolarHBondContact O-N 2.89Å
310	H	30.7	Very low	36.7	Very low	158 Å²	158	136.6 Å²	136.6	73%	0.731	76%	0.755	S	S	*	*			trans	-51.6	125.4	154.4	-90.2	12.9	0	0	0	111.6	W312	H310-W312 AromaticContact CE1-NE1 3.92Å; H310-W312 AromaticContact NE2-CE2 3.96Å; H310-W312 AromaticContact NE2-CZ2 3.64Å
311	A	33.3	Very low	36.1	Very low	87 Å²	87	136.6 Å²	136.6	72%	0.719	76%	0.757	S	S	*	*			trans	-150.4	76.9	149.4	0	0	0	0	0	108.5	N309 D313	N309-A311 PolarHBondContact O-N 2.89Å; A311-D313 WeakPolarHBondContact O-CB 3.44Å; A311-D313 PolarHBondContact O-N 3.28Å
312	W	33.3	Very low	35.6	Very low	215 Å²	215	137.6 Å²	137.6	81%	0.814	76%	0.757	S	S	*	*			trans	-59.8	119.6	156.6	-44.4	-20.7	0	0	0	105.2	H310	H310-W312 AromaticContact CE1-NE1 3.92Å; H310-W312 AromaticContact NE2-CE2 3.96Å; H310-W312 AromaticContact NE2-CZ2 3.64Å
313	D	32.1	Very low	35.1	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	74%	0.742	S	S	*	*			cis	61.2	145.8	29.7	-147.7	9.4	0	0	0	114.1	A311	A311-D313 WeakPolarHBondContact O-CB 3.44Å; A311-D313 PolarHBondContact O-N 3.28Å
314	E	32.1	Very low	35	Very low	150 Å²	150	131.9 Å²	131.9	70%	0.701	72%	0.724	S	S	*	*			trans	26.9	96.7	165.7	-86.5	-161.3	-159.3	0	0	119.2
315	N	32.8	Very low	34.5	Very low	110 Å²	110	129.6 Å²	129.6	59%	0.588	72%	0.718	S	S	*	*				151.9	154.2	91.3	-89.2	-36	0	0	0	115.2
316	H	32.1	Very low	34.4	Very low	136 Å²	136	126 Å²	126	63%	0.63	71%	0.707	S	S	*	*			trans	44.1	119.4	151.3	-54.6	172.7	0	0	0	118.5
317	W	33.9	Very low	34.3	Very low	241 Å²	241	129 Å²	129	91%	0.913	71%	0.709	S	S	*	*				-158.3	147.9	52.5	-106.6	-65.1	0	0	0	114.6
318	S	30.9	Very low	34.4	Very low	106 Å²	106	129 Å²	129	74%	0.741	70%	0.704	S	S	*	*			trans	-74.1	158.1	163.5	-58	0	0	0	0	111.9
319	S	33.3	Very low	34.5	Very low	127 Å²	127	130 Å²	130	89%	0.888	70%	0.701	S	S	*	*			trans	-147.6	82.1	158.9	-79.4	0	0	0	0	110.6
320	A	31.5	Very low	34.6	Very low	92 Å²	92	130.2 Å²	130.2	76%	0.76	70%	0.697	S	S	*	*			trans	-96.5	131.6	163.5	0	0	0	0	0	108.4
321	S	35.8	Very low	35.2	Very low	116 Å²	116	129.6 Å²	129.6	81%	0.811	70%	0.699	S	S	*	*			trans	-150.6	53.2	178.6	-73.4	0	0	0	0	112.7
322	H	36.4	Very low	35.6	Very low	177 Å²	177	129.1 Å²	129.1	82%	0.819	69%	0.691	S	S	*	*			trans	-112.5	137.9	139.5	-77.2	-84.8	0	0	0	105.9
323	S	37.9	Very low	36.1	Very low	50 Å²	50	125.3 Å²	125.3	35%	0.35	69%	0.692	S	S	.	*			cis	-167.6	158.4	7.2	32.4	0	0	0	0	111.7	V522	S323-V522 VanDerWaalsContact OG-CG1 3.23Å; S323-V522 WeakPolarHBondContact OG-CG1 3.35Å
324	E	36.8	Very low	36.5	Very low	84 Å²	84	125.4 Å²	125.4	39%	0.393	69%	0.692	S	S	.	*			trans	63.3	150.1	169.6	-59.7	-152.1	125.8	0	0	120.6	H520 G521 V522	E324-H520 IonicContact OE1-CE1 3.74Å; E324-H520 IonicContact OE1-CG 3.64Å; E324-H520 IonicContact OE1-ND1 2.74Å; E324-H520 PolarHBondContact OE1-ND1 2.84Å; E324-G521 PolarHBondContact OE2-N 3.33Å; E324-V522 HydrophobicContact CB-CB 3.94Å; E324-V522 HydrophobicContact CG-CB 4.01Å; E324-V522 HydrophobicContact CG-CG2 4.15Å; E324-V522 WeakPolarHBondContact OE2-CG2 3.41Å; E324-V522 PolarHBondContact OE2-N 3.39Å
325	P	33.1	Very low	37	Very low	96 Å²	96	122.8 Å²	122.8	62%	0.623	69%	0.691	S	S	*	*			trans	-107.6	159.2	169	39.9	-32.3	0	0	0	112.9
326	V	37.2	Very low	37.4	Very low	85 Å²	85	123 Å²	123	52%	0.515	70%	0.7	S	S	.	*			trans	-163.4	143.9	149.8	112.5	0	0	0	0	112.1
327	Q	37.6	Very low	37.9	Very low	164 Å²	164	120.3 Å²	120.3	77%	0.766	70%	0.697	S	S	*	*			trans	47.5	112.6	161.4	-64.4	167	1.9	0	0	117.4
328	T	38.4	Very low	38.3	Very low	121 Å²	121	115.6 Å²	115.6	74%	0.742	69%	0.69	S	S	*	*				-178	163.4	67.4	40.6	0	0	0	0	107.2
329	N	38.1	Very low	38.6	Very low	126 Å²	126	119.9 Å²	119.9	67%	0.674	70%	0.695	S	S	*	*			cis	-157.3	-176.5	-7.6	-110	22.1	0	0	0	107.9
330	E	40.3	Very low	39	Very low	155 Å²	155	118.6 Å²	118.6	72%	0.724	68%	0.684	S	S	*	*			trans	-7.5	144	168.7	-13.6	-56.3	94	0	0	118
331	D	42	Very low	39.2	Very low	145 Å²	145	121.7 Å²	121.7	78%	0.775	69%	0.686	S	S	*	*			cis	-170.6	160.7	43.8	-169.4	12.1	0	0	0	113.8
332	S	42.1	Very low	39.3	Very low	78 Å²	78	122.3 Å²	122.3	55%	0.545	68%	0.684	S	S	.	*			trans	54.1	112.5	149	-76.2	0	0	0	0	124.7
333	T	44.3	Very low	39.6	Very low	135 Å²	135	118.7 Å²	118.7	83%	0.828	68%	0.677	S	S	*	*			trans	71.3	152.3	135.7	65.8	0	0	0	0	119.4
334	D	39.5	Very low	39.5	Very low	139 Å²	139	121.8 Å²	121.8	74%	0.743	69%	0.694	S	S	*	*			cis	-143.9	163.9	8.4	-165.8	13.1	0	0	0	112.5
335	S	42.3	Very low	39.5	Very low	96 Å²	96	124.6 Å²	124.6	67%	0.671	71%	0.711	S	S	*	*			trans	25.1	148.6	146.3	-72.5	0	0	0	0	122.2
336	S	42.6	Very low	39.8	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	72%	0.715	S	S	*	*			cis	-173.5	166.5	-11	-154.6	0	0	0	0	105.9
337	S	42.9	Very low	39.9	Very low	81 Å²	81	127.6 Å²	127.6	57%	0.566	72%	0.719	S	S	*	*			cis	-158.7	171.6	14	71.5	0	0	0	0	110.6
338	N	40.8	Very low	40.1	Very low	141 Å²	141	127.5 Å²	127.5	75%	0.754	72%	0.715	S	S	*	*			trans	50.2	109.9	145.3	-55.4	-19.8	0	0	0	118.8
339	K	38.6	Very low	40	Very low	196 Å²	196	127.6 Å²	127.6	85%	0.852	72%	0.72	S	S	*	*			cis	56.8	152.6	26	-92.4	-169.9	-178.7	179.1	0	113.8
340	P	40.8	Very low	40.1	Very low	100 Å²	100	126.2 Å²	126.2	65%	0.649	73%	0.726	S	S	*	*			cis	-146.9	-157.5	-20.5	39	-16.9	0	0	0	113.9
341	I	35.5	Very low	39.9	Very low	158 Å²	158	124.6 Å²	124.6	81%	0.81	72%	0.722	S	S	*	*			trans	85	136.5	146.1	-78.8	172.2	0	0	0	121
342	V	38.2	Very low	39.8	Very low	128 Å²	128	123 Å²	123	78%	0.776	72%	0.72	S	S	*	*			trans	-77.3	141	173	167.9	0	0	0	0	109.9
343	P	42.7	Very low	39.5	Very low	102 Å²	102	125.3 Å²	125.3	66%	0.662	73%	0.725	S	S	*	*				-162.4	166.3	100.3	42.2	-20.9	0	0	0	120.7
344	T	35.2	Very low	39	Very low	115 Å²	115	125.1 Å²	125.1	71%	0.706	72%	0.718	S	S	*	*			trans	67.3	140.8	141.8	42.3	0	0	0	0	124.2
345	L	37.5	Very low	38.8	Very low	143 Å²	143	126.5 Å²	126.5	75%	0.749	72%	0.718	S	S	*	*			trans	41.2	131.5	133.7	-64.4	166.2	0	0	0	118.9
346	D	40.5	Very low	38.6	Very low	132 Å²	132	128.4 Å²	128.4	71%	0.706	72%	0.719	S	S	*	*			cis	-158.7	137.5	49.1	-89.7	-48.5	0	0	0	109.1
347	D	38.7	Very low	38.3	Very low	112 Å²	112	131.6 Å²	131.6	60%	0.599	72%	0.721	S	S	*	*				76.8	93.7	68.9	-169.6	53	0	0	0	115.4
348	K	41.1	Very low	37.8	Very low	161 Å²	161	136 Å²	136	70%	0.7	73%	0.733	S	S	*	*				169.4	141	125.6	-91.2	159.8	-166.8	75.2	0	115.9
349	C	36.4	Very low	38	Very low	124 Å²	124	134.4 Å²	134.4	84%	0.838	73%	0.73	S	S	*	*			trans	56.6	139.4	141.2	-62.6	0	0	0	0	121.5
350	A	40.2	Very low	37.8	Very low	97 Å²	97	131 Å²	131	80%	0.802	72%	0.722	S	S	*	*			cis	-157.4	161.1	-7.2	0	0	0	0	0	112.6
351	N	36.9	Very low	37.8	Very low	120 Å²	120	132 Å²	132	64%	0.642	72%	0.721	S	S	*	*			trans	-77.1	162.1	165.6	-136.9	-15.4	0	0	0	109.6	L353	N351-L353 PolarHBondContact OD1-N 3.16Å
352	P	39.7	Very low	38.1	Very low	111 Å²	111	131 Å²	131	72%	0.721	72%	0.718	S	S	*	*				-132.7	157.1	68.7	20.7	3.3	0	0	0	113.1
353	L	35.8	Very low	38.4	Very low	128 Å²	128	131.7 Å²	131.7	67%	0.67	72%	0.717	S	S	*	*				57.2	140.2	62.2	-56.1	174.4	0	0	0	113.4	N351	N351-L353 PolarHBondContact OD1-N 3.16Å
354	L	34	Very low	38.4	Very low	130 Å²	130	134.4 Å²	134.4	68%	0.681	73%	0.726	S	S	*	*			cis	-164.9	-166.6	-25.2	-156.7	91.1	0	0	0	106.2
355	F	35.3	Very low	38.6	Very low	169 Å²	169	132.4 Å²	132.4	74%	0.741	73%	0.729	S	S	*	*			trans	67.9	101.8	160.3	-78.4	-71.7	0	0	0	120.6
356	I	36.6	Very low	38.7	Very low	135 Å²	135	133.1 Å²	133.1	69%	0.692	73%	0.731	S	S	*	*				66.8	145.8	115.9	-74.3	-169.5	0	0	0	121.5
357	H	36.4	Very low	38.6	Very low	180 Å²	180	134 Å²	134	83%	0.833	73%	0.729	S	S	*	*			trans	85.6	120.7	162.5	-95.8	-66.4	0	0	0	120.5
358	Q	33.3	Very low	38.6	Very low	175 Å²	175	133 Å²	133	82%	0.818	73%	0.731	S	S	*	*			trans	-61	158.6	145.4	-73.2	175.7	-66.5	0	0	109.9
359	P	43.9	Very low	38.5	Very low	106 Å²	106	130.8 Å²	130.8	69%	0.688	73%	0.731	S	S	*	*			cis	-148.1	-179.9	36	44.2	-24.5	0	0	0	118.6
360	N	36.4	Very low	38.7	Very low	126 Å²	126	132.6 Å²	132.6	67%	0.674	73%	0.727	S	S	*	*			trans	60	132.7	139.5	-82	48.4	0	0	0	124.5
361	D	39.8	Very low	38.6	Very low	120 Å²	120	135.1 Å²	135.1	64%	0.642	72%	0.722	S	S	*	*			trans	80	128.9	133.1	-51.2	-11.1	0	0	0	123.1
362	D	41.5	Very low	38.6	Very low	137 Å²	137	136.3 Å²	136.3	73%	0.733	73%	0.728	S	S	*	*			trans	75	118.7	144.9	-52	-14.6	0	0	0	125.4
363	D	45	Very low	39	Very low	142 Å²	142	137.4 Å²	137.4	76%	0.759	73%	0.728	S	S	*	*			trans	78.6	133.9	133	-59.8	-16.6	0	0	0	128.1
364	D	42.1	Very low	39.2	Very low	159 Å²	159	137.6 Å²	137.6	85%	0.85	73%	0.73	S	S	*	*			trans	67.8	110.8	142.5	-73.6	-15.6	0	0	0	127.8
365	G	40.2	Very low	39.5	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	73%	0.734	S	S	*	*			trans	81.5	166.8	131.4	0	0	0	0	0	122.2
366	I	39.6	Very low	39.7	Very low	157 Å²	157	133.7 Å²	133.7	81%	0.805	73%	0.734	S	S	*	*			cis	-168.3	148.5	-25.3	-125.3	171.9	0	0	0	112.7
367	F	38	Very low	40.2	Very low	152 Å²	152	132.7 Å²	132.7	67%	0.667	74%	0.739	S	S	*	*			trans	77	123.6	156.5	-92.8	-130.1	0	0	0	127.4
368	S	39.4	Very low	40.4	Very low	89 Å²	89	131.6 Å²	131.6	62%	0.622	74%	0.739	S	S	*	*				62.5	160.6	125.5	-53.2	0	0	0	0	123.3
369	T	39.2	Very low	41.1	Very low	115 Å²	115	127 Å²	127	71%	0.706	74%	0.74	S	S	*	*			cis	-166.9	166.6	12.8	-12.5	0	0	0	0	115.3
370	H	40.3	Very low	40.9	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.755	75%	0.748	S	S	*	*			trans	62.3	163	157	-75.9	-81.4	0	0	0	121.4
371	Q	37.8	Very low	41.3	Very low	149 Å²	149	132.8 Å²	132.8	70%	0.696	76%	0.758	S	S	*	*			cis	-170.1	-168.6	-42.4	-144.8	176.8	0.2	0	0	111.3
372	N	36.9	Very low	41.2	Very low	145 Å²	145	133.3 Å²	133.3	78%	0.775	76%	0.76	S	S	*	*			trans	86.6	159.1	173.2	-54.1	-3.1	0	0	0	117.2
373	D	47.3	Very low	41	Very low	135 Å²	135	132.1 Å²	132.1	72%	0.722	76%	0.758	S	S	*	*			cis	177.2	160.4	-42.7	-111.7	48.5	0	0	0	108.1
374	N	39.6	Very low	41.1	Very low	132 Å²	132	135 Å²	135	71%	0.706	76%	0.763	S	S	*	*			cis	-166.7	-176.6	-12.9	-150.2	-43.2	0	0	0	109.5
375	S	40.7	Very low	40.8	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	76%	0.755	S	S	*	*			trans	70.4	155.8	163.4	-71.5	0	0	0	0	120
376	S	39.9	Very low	41.3	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	76%	0.761	S	S	*	*			cis	-172.7	152.1	-18.3	174.2	0	0	0	0	111.2
377	S	46.3	Very low	41.3	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	75%	0.751	S	S	*	*			trans	153.1	139.8	133.3	-169.9	0	0	0	0	114
378	D	41.8	Very low	41.4	Very low	157 Å²	157	141.1 Å²	141.1	84%	0.84	76%	0.763	S	S	*	*			trans	-106.5	177	-167.5	-53.2	-84.8	0	0	0	116
379	G	47.5	Very low	41.2	Very low	80 Å²	80	141.5 Å²	141.5	83%	0.825	77%	0.765	S	S	*	*			trans	-175.5	98	168	0	0	0	0	0	114.4
380	E	40.1	Very low	40.9	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.864	77%	0.77	S	S	*	*			trans	-85.9	160	176.6	-60.3	-173.2	118.2	0	0	113.7
381	L	44.5	Very low	40.6	Very low	168 Å²	168	141.3 Å²	141.3	88%	0.88	77%	0.771	S	S	*	*			trans	-157.3	162.6	145.2	-111.5	-179.8	0	0	0	114
382	L	38.4	Very low	40.3	Very low	130 Å²	130	140.7 Å²	140.7	68%	0.681	78%	0.777	S	S	*	*			trans	-90.3	142.5	-149.7	-95.5	71.3	0	0	0	119.2
383	T	35.9	Very low	40.5	Very low	112 Å²	112	139.5 Å²	139.5	69%	0.687	78%	0.777	S	S	*	*			trans	61.6	129.3	138	64.1	0	0	0	0	122.6
384	K	47.8	Very low	40	Very low	203 Å²	203	137.7 Å²	137.7	88%	0.883	78%	0.775	S	S	*	*				-170.2	151.7	97.3	-100.2	165.8	-175.8	171.7	0	112.4
385	E	36.5	Very low	39.7	Very low	145 Å²	145	138.7 Å²	138.7	68%	0.678	78%	0.776	S	S	*	*			trans	-82.5	152.9	178	-63.7	-168	148.4	0	0	113.2	K387	E385-K387 WeakPolarHBondContact OE1-CE 3.32Å; E385-K387 IonicContact OE1-NZ 2.68Å; E385-K387 PolarHBondContact OE1-NZ 3.41Å; E385-K387 IonicContact OE2-NZ 2.64Å; E385-K387 PolarHBondContact OE2-NZ 2.7Å
386	M	49.8	Very low	39.6	Very low	181 Å²	181	142.6 Å²	142.6	89%	0.892	78%	0.775	S	S	*	*			trans	-146.8	130.6	132.6	-160.9	63.5	170.4	0	0	109.2
387	K	39	Very low	39.5	Very low	134 Å²	134	144.5 Å²	144.5	58%	0.583	78%	0.777	S	S	*	*			trans	-99.1	142.2	-174.8	-61.7	-179.3	171.6	92.2	0	111.3	E385	E385-K387 WeakPolarHBondContact OE1-CE 3.32Å; E385-K387 IonicContact OE1-NZ 2.68Å; E385-K387 PolarHBondContact OE1-NZ 3.41Å; E385-K387 IonicContact OE2-NZ 2.64Å; E385-K387 PolarHBondContact OE2-NZ 2.7Å
388	F	40.9	Very low	39	Very low	211 Å²	211	146.5 Å²	146.5	93%	0.925	77%	0.771	S	S	*	*			trans	-152.9	143.8	138.3	-96.2	-66.3	0	0	0	109.9
389	S	35.2	Very low	38.9	Very low	96 Å²	96	145.3 Å²	145.3	67%	0.671	77%	0.772	S	S	*	*			trans	-152.5	140.8	-165	55.9	0	0	0	0	112.1
390	N	32	Very low	38.2	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	77%	0.765	S	S	*	*			trans	59	140.5	160	-57.4	-7.8	0	0	0	118.2
391	T	35.2	Very low	38	Very low	125 Å²	125	151 Å²	151	77%	0.767	77%	0.769	S	S	*	*				167.4	118.5	103.5	-67.1	0	0	0	0	110.1
392	T	31.8	Very low	37.3	Very low	135 Å²	135	147.9 Å²	147.9	83%	0.828	76%	0.76	S	S	*	*			trans	-90	151.1	156.3	43.4	0	0	0	0	109.6
393	P	41.3	Very low	37.3	Very low	121 Å²	121	149.8 Å²	149.8	79%	0.786	77%	0.769	S	S	*	*			trans	-133.3	157.7	141.6	35.5	-24.2	0	0	0	112.6
394	S	35.4	Very low	37.3	Very low	97 Å²	97	147.5 Å²	147.5	68%	0.678	77%	0.768	S	S	*	*			trans	-96.3	167.4	172.6	56.8	0	0	0	0	111.6
395	E	34	Very low	36.7	Very low	153 Å²	153	145.3 Å²	145.3	72%	0.715	77%	0.766	S	S	*	*			trans	50.9	120.5	133.4	-165	172.3	-148.1	0	0	119.7
396	Y	37.4	Very low	36.9	Very low	192 Å²	192	148.3 Å²	148.3	75%	0.753	78%	0.777	S	S	*	*				-179.1	130.4	116	-111.4	-86.7	0	0	0	113.9
397	D	39.2	Very low	36.3	Very low	146 Å²	146	151.1 Å²	151.1	78%	0.781	78%	0.778	S	S	*	*			trans	51.1	155	150.9	-84.1	-29	0	0	0	127.2
398	K	35.4	Very low	36.4	Very low	156 Å²	156	152 Å²	152	68%	0.678	79%	0.794	S	S	*	*			trans	-79.9	172.9	173.5	-62.1	178	166.8	-176.5	0	112.5	E400	K398-E400 HydrophobicContact CD-CG 4.36Å; K398-E400 IonicContact NZ-OE1 2.7Å; K398-E400 PolarHBondContact NZ-OE1 2.69Å
399	P	40	Very low	36.3	Very low	131 Å²	131	144.8 Å²	144.8	85%	0.851	78%	0.78	S	S	*	*				-136.2	167	95.1	37.9	-28	0	0	0	114.9
400	E	33.2	Very low	36.6	Very low	144 Å²	144	147.7 Å²	147.7	67%	0.673	79%	0.786	S	S	*	*			trans	-92.4	150.5	175.2	-60	176	167.8	0	0	111.4	K398	K398-E400 HydrophobicContact CD-CG 4.36Å; K398-E400 IonicContact NZ-OE1 2.7Å; K398-E400 PolarHBondContact NZ-OE1 2.69Å
401	Y	34.7	Very low	36.7	Very low	242 Å²	242	148.6 Å²	148.6	95%	0.949	78%	0.784	S	S	*	*			trans	-155.6	156.9	144.6	-113.6	-77.4	0	0	0	110.7
402	S	30.8	Very low	36.6	Very low	101 Å²	101	148.4 Å²	148.4	71%	0.706	78%	0.777	S	S	*	*			trans	-130.3	178.8	-170.6	-171.6	0	0	0	0	111.9
403	I	37	Very low	36.9	Very low	170 Å²	170	149.6 Å²	149.6	87%	0.872	77%	0.773	S	S	*	*			trans	78.5	136.8	177.5	-47	153.9	0	0	0	113.6
404	G	36.4	Very low	36.6	Very low	64 Å²	64	147.7 Å²	147.7	66%	0.66	76%	0.762	S	S	*	*			cis	166.5	151.6	-10.8	0	0	0	0	0	115.3
405	N	35.4	Very low	36.7	Very low	158 Å²	158	149.9 Å²	149.9	85%	0.845	77%	0.766	S	S	*	*			trans	45.6	115.8	156.7	-65.5	-7.4	0	0	0	123.1
406	K	41	Very low	36.9	Very low	208 Å²	208	152.1 Å²	152.1	90%	0.904	78%	0.777	S	S	*	*			trans	-178.3	126.7	131.6	-90.6	141.7	-172.6	177.1	0	107.5
407	R	37.3	Very low	37	Very low	239 Å²	239	147 Å²	147	90%	0.902	77%	0.77	S	S	*	*			cis	94.3	85.4	20.5	-164.5	-168.8	-177.2	175.1	3.1	116
408	T	41	Very low	37	Very low	152 Å²	152	146.3 Å²	146.3	93%	0.933	77%	0.765	S	S	*	*			trans	178.7	138.1	145.7	28.2	0	0	0	0	108.3
409	G	37.9	Very low	37.1	Very low	61 Å²	61	145.6 Å²	145.6	63%	0.629	77%	0.769	S	S	*	*			cis	164.4	153.9	-12.8	0	0	0	0	0	112.7
410	I	41.3	Very low	37	Very low	157 Å²	157	147 Å²	147	81%	0.805	77%	0.765	S	S	*	*			trans	54.4	145.3	148.8	68.9	177.1	0	0	0	120.6
411	F	34.3	Very low	37.2	Very low	169 Å²	169	144.6 Å²	144.6	74%	0.741	76%	0.763	S	S	*	*			cis	-152.2	151.2	-3.6	-121	-152	0	0	0	106.9
412	L	34.5	Very low	37.3	Very low	120 Å²	120	137.8 Å²	137.8	63%	0.628	75%	0.751	S	S	*	*				50.7	137.4	85.1	-46.5	-174.3	0	0	0	114.1
413	H	37.2	Very low	37.6	Very low	161 Å²	161	140.7 Å²	140.7	75%	0.745	75%	0.754	S	S	*	*			cis	-159.1	164.7	15.2	-133.8	-153.9	0	0	0	113.9
414	S	36	Very low	37.6	Very low	80 Å²	80	139.3 Å²	139.3	56%	0.559	75%	0.747	S	S	*	*			trans	12.3	140.9	149.6	-74.4	0	0	0	0	125.2
415	D	36.7	Very low	37.5	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	75%	0.752	S	S	*	*				32.9	123	119.8	-34.5	-56.7	0	0	0	120.3
416	E	37.7	Very low	37.5	Very low	201 Å²	201	142.1 Å²	142.1	94%	0.939	75%	0.746	S	S	*	*				-164.5	-169.5	110.9	-134	168	135.1	0	0	111.2
417	S	39.2	Very low	37.6	Very low	85 Å²	85	136.2 Å²	136.2	59%	0.594	74%	0.744	S	S	*	*			trans	-118	174.9	-160.7	59.2	0	0	0	0	116.6
418	D	39.5	Very low	37.5	Very low	130 Å²	130	129.4 Å²	129.4	70%	0.695	74%	0.739	S	S	*	*			trans	83.6	127.1	149.6	-64.1	-50.2	0	0	0	122.7
419	N	38.4	Very low	37.5	Very low	141 Å²	141	131.5 Å²	131.5	75%	0.754	74%	0.741	S	S	*	*			trans	72.8	114.6	140	-64.5	-30.7	0	0	0	123.3
420	E	38.2	Very low	37.4	Very low	162 Å²	162	136.2 Å²	136.2	76%	0.757	74%	0.744	S	S	*	*				70.1	116.5	125.6	-70.5	-115.9	66.8	0	0	121.9
421	S	36.3	Very low	37.3	Very low	92 Å²	92	136.7 Å²	136.7	64%	0.643	75%	0.747	S	S	*	*				57.4	96.2	124.6	-59.8	0	0	0	0	120.1
422	S	37.9	Very low	37.3	Very low	100 Å²	100	135 Å²	135	70%	0.699	74%	0.741	S	S	*	*				-178.3	124.4	105.4	-84.6	0	0	0	0	117
423	Q	36.3	Very low	37.4	Very low	162 Å²	162	134.7 Å²	134.7	76%	0.757	75%	0.749	S	S	*	*				62.6	131.8	128	-63.4	-173.3	75	0	0	123.5
424	L	36.3	Very low	37.3	Very low	140 Å²	140	132.2 Å²	132.2	73%	0.733	75%	0.75	S	S	*	*			trans	72.9	142.9	154.5	-59.8	161.5	0	0	0	115.8
425	L	36.1	Very low	37.2	Very low	145 Å²	145	137 Å²	137	76%	0.759	76%	0.764	S	S	*	*			cis	-148.9	128.4	39.4	-171.5	69.9	0	0	0	115.1
426	N	34.9	Very low	37.4	Very low	137 Å²	137	137.5 Å²	137.5	73%	0.733	77%	0.765	S	S	*	*			trans	30	136	148.7	-52.6	-8.6	0	0	0	123.5
427	G	42.1	Very low	37.5	Very low	83 Å²	83	133.3 Å²	133.3	86%	0.856	76%	0.755	S	S	*	*			trans	-174.5	83.1	158.4	0	0	0	0	0	112.2
428	A	35.2	Very low	37.7	Very low	96 Å²	96	134.7 Å²	134.7	79%	0.793	76%	0.762	S	S	*	*			trans	-130	143.9	-168.8	0	0	0	0	0	113.9
429	M	42	Very low	37.5	Very low	196 Å²	196	138.1 Å²	138.1	97%	0.966	77%	0.771	S	S	*	*			trans	-139.4	143.9	165.8	-72.9	-66.3	-88.4	0	0	109.3
430	K	35	Very low	37.8	Very low	161 Å²	161	141.3 Å²	141.3	70%	0.7	78%	0.778	S	S	*	*			trans	-150	121.3	-165.8	178	-138.2	171.9	-156.9	0	112.8	E432	K430-E432 WeakPolarHBondContact CE-OE2 3.38Å; K430-E432 IonicContact NZ-OE2 2.78Å; K430-E432 PolarHBondContact NZ-OE2 3.48Å
431	L	40.4	Very low	37.6	Very low	167 Å²	167	143.6 Å²	143.6	87%	0.874	79%	0.786	S	S	*	*			trans	-153.4	132.5	156.7	-68.7	177.6	0	0	0	106.1
432	E	34.1	Very low	37.8	Very low	132 Å²	132	143.8 Å²	143.8	62%	0.617	79%	0.792	S	S	*	*			cis	94.2	131	18.8	-160.2	158.2	-167.7	0	0	115.3	K430	K430-E432 WeakPolarHBondContact CE-OE2 3.38Å; K430-E432 IonicContact NZ-OE2 2.78Å; K430-E432 PolarHBondContact NZ-OE2 3.48Å
433	S	34.9	Very low	37.6	Very low	114 Å²	114	147 Å²	147	80%	0.797	79%	0.794	S	S	*	*			trans	67.2	156	-171.3	-57.8	0	0	0	0	115.2
434	S	36.9	Very low	37.5	Very low	109 Å²	109	145.3 Å²	145.3	76%	0.762	80%	0.795	S	S	*	*			cis	-171.1	167	-14.9	45	0	0	0	0	107.7
435	E	33.6	Very low	37.3	Very low	180 Å²	180	144.2 Å²	144.2	84%	0.841	79%	0.786	S	S	*	*			cis	-160.9	179.1	-28.6	180	155.9	-156.6	0	0	108.7
436	I	40.8	Very low	37.1	Very low	154 Å²	154	144.4 Å²	144.4	79%	0.79	79%	0.787	S	S	*	*			trans	-92.7	141.6	-173.6	-47.6	161.3	0	0	0	111.8
437	P	40	Very low	37.3	Very low	113 Å²	113	145.2 Å²	145.2	73%	0.734	79%	0.789	S	S	*	*			trans	-144.2	-176	133.8	43.8	-29.1	0	0	0	112.7
438	P	41.8	Very low	36.9	Very low	115 Å²	115	147.7 Å²	147.7	75%	0.747	78%	0.783	S	S	*	*				-132.5	178.2	-85.6	37.3	-17.8	0	0	0	115.2
439	K	37.3	Very low	37.1	Very low	201 Å²	201	150.6 Å²	150.6	87%	0.874	79%	0.786	S	S	*	*			trans	-67.6	144.5	173.5	-60.6	166.4	-177.8	168.5	0	111.8
440	K	43.7	Very low	36.8	Very low	209 Å²	209	147.8 Å²	147.8	91%	0.909	77%	0.774	S	S	*	*			trans	-128.4	150.9	155.3	-79.4	-170.4	175.1	-178.8	0	110.9
441	K	34.3	Very low	37	Very low	210 Å²	210	147.3 Å²	147.3	91%	0.913	78%	0.779	S	S	*	*			trans	-122.8	142.4	-178.7	-63.9	177.9	178.4	179.2	0	110.4
442	A	40	Very low	36.9	Very low	95 Å²	95	146 Å²	146	79%	0.785	77%	0.774	S	S	*	*			trans	-151.3	132.9	150.2	0	0	0	0	0	104.8
443	K	33.2	Very low	37.2	Very low	167 Å²	167	146.7 Å²	146.7	73%	0.726	78%	0.781	S	S	*	*			cis	74.9	75	18.3	-146.7	-157.4	178.7	-143.1	0	116.6	E445	K443-E445 WeakPolarHBondContact CE-OE1 3.34Å; K443-E445 IonicContact NZ-OE1 2.66Å; K443-E445 PolarHBondContact NZ-OE1 3.45Å
444	T	34.4	Very low	37.5	Very low	127 Å²	127	148.4 Å²	148.4	78%	0.779	78%	0.782	S	S	*	*			trans	-136.2	114	144.4	-41.8	0	0	0	0	102
445	E	33.6	Very low	37.5	Very low	118 Å²	118	150 Å²	150	55%	0.551	78%	0.781	S	S	*	*				52.2	128.8	78.6	-42.2	-91.6	143.9	0	0	109.7	K443	K443-E445 WeakPolarHBondContact CE-OE1 3.34Å; K443-E445 IonicContact NZ-OE1 2.66Å; K443-E445 PolarHBondContact NZ-OE1 3.45Å
446	L	31.5	Very low	37.9	Very low	148 Å²	148	147 Å²	147	78%	0.775	77%	0.771	S	S	*	*			cis	-161.7	-174.1	-4.6	-114.7	172	0	0	0	106.5
447	I	38	Very low	37.9	Very low	154 Å²	154	149.6 Å²	149.6	79%	0.79	77%	0.771	S	S	*	*			trans	91.3	102.8	175	-55.9	168.3	0	0	0	113.6
448	N	33.2	Very low	38.3	Very low	136 Å²	136	150.7 Å²	150.7	73%	0.727	77%	0.768	S	S	*	*			trans	-73.4	159.8	149.9	-46.3	-39.3	0	0	0	107.4
449	D	40.1	Very low	38.1	Very low	157 Å²	157	150.8 Å²	150.8	84%	0.84	77%	0.77	S	S	*	*				-150.6	152	116.7	-86.9	-37.2	0	0	0	107.8
450	N	35.3	Very low	38	Very low	136 Å²	136	149.2 Å²	149.2	73%	0.727	77%	0.766	S	S	*	*			trans	-91.5	171.9	165.1	-44.5	-79.4	0	0	0	107.5
451	D	39.9	Very low	37.9	Very low	151 Å²	151	145.1 Å²	145.1	81%	0.807	76%	0.764	S	S	*	*				165.9	161.8	123.2	-79.4	-6.7	0	0	0	109
452	D	39.1	Very low	38	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	75%	0.751	S	S	*	*			trans	-92.3	-178.6	-159.3	-62	-86.5	0	0	0	115
453	D	39.5	Very low	38.1	Very low	146 Å²	146	146.7 Å²	146.7	78%	0.781	76%	0.76	S	S	*	*			trans	77.8	130	149.6	-61.5	-30.5	0	0	0	124.3
454	D	40.3	Very low	38.5	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	76%	0.755	S	S	*	*			trans	82.9	154.5	134.4	-83	-27.1	0	0	0	127.2
455	D	38.5	Very low	38.7	Very low	141 Å²	141	148 Å²	148	75%	0.754	76%	0.762	S	S	*	*			trans	61.1	89.1	162.9	-84.5	-28.1	0	0	0	122.8
456	D	40.9	Very low	39.1	Very low	119 Å²	119	148.8 Å²	148.8	64%	0.636	77%	0.767	S	S	*	*				31	155.2	108.8	-163	29.4	0	0	0	121.4
457	R	42.3	Very low	39.5	Very low	207 Å²	207	146.5 Å²	146.5	78%	0.781	76%	0.764	S	S	*	*			trans	78.9	157.1	163	-49.5	-164	178.8	-175.2	6.8	118.4
458	M	47	Very low	39.5	Very low	137 Å²	137	143.8 Å²	143.8	68%	0.675	76%	0.758	S	S	*	*			cis	-157.3	163.8	-24.6	-113.9	-71.7	165.3	0	0	109.1
459	C	37.7	Very low	39.8	Very low	117 Å²	117	142.5 Å²	142.5	79%	0.791	76%	0.76	S	S	*	*			trans	-149.4	90.7	157.4	-151	0	0	0	0	112.3
460	H	36.6	Very low	39.7	Very low	167 Å²	167	143.8 Å²	143.8	77%	0.773	76%	0.758	S	S	*	*			trans	-136.3	124.3	172	-79.7	-8.8	0	0	0	109.1
461	S	40.6	Very low	39.7	Very low	124 Å²	124	141.5 Å²	141.5	87%	0.867	75%	0.753	S	S	*	*			trans	-84	141.4	-178.9	-56.5	0	0	0	0	112.7
462	E	36.9	Very low	39.5	Very low	140 Å²	140	141.1 Å²	141.1	65%	0.654	76%	0.756	S	S	*	*			trans	-49.3	163.3	-176.1	-53.3	170.7	88.4	0	0	117	K464	E462-K464 IonicContact OE1-NZ 3.67Å; E462-K464 PolarHBondContact OE1-NZ 3.38Å
463	M	41.6	Very low	39.3	Very low	198 Å²	198	138 Å²	138	98%	0.975	76%	0.757	S	S	*	*				-146.8	147.4	108.6	-107.2	-178.3	-170.2	0	0	112
464	K	42.4	Very low	39.2	Very low	143 Å²	143	139.3 Å²	139.3	62%	0.622	76%	0.758	S	S	*	*			trans	-87.5	147.8	-168	-79.6	176.8	168.9	88.6	0	114.2	E462 M466	E462-K464 IonicContact OE1-NZ 3.67Å; E462-K464 PolarHBondContact OE1-NZ 3.38Å; K464-M466 HydrophobicContact CD-SD 4.15Å
465	I	38.8	Very low	38.9	Very low	178 Å²	178	139.7 Å²	139.7	91%	0.913	76%	0.755	S	S	*	*			trans	-134.9	135.6	141.6	-53.7	179.5	0	0	0	106.2
466	M	42	Very low	38.6	Very low	134 Å²	134	137 Å²	137	66%	0.66	75%	0.747	S	S	*	*			trans	-125.5	141	-173.1	-84.3	-177.7	63.3	0	0	113.4	K464	K464-M466 HydrophobicContact CD-SD 4.15Å
467	S	38.5	Very low	38.2	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	75%	0.754	S	S	*	*			trans	68	147	144.5	-64.2	0	0	0	0	119.9
468	S	39.5	Very low	37.6	Very low	97 Å²	97	134.2 Å²	134.2	68%	0.678	75%	0.746	S	S	*	*			cis	-174.2	156.1	-14.9	51.8	0	0	0	0	110.4
469	S	39.1	Very low	36.8	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	75%	0.749	S	S	*	*			trans	69.4	154	158.1	-59.8	0	0	0	0	116.8
470	K	37.7	Very low	36.5	Very low	184 Å²	184	134.4 Å²	134.4	80%	0.8	74%	0.742	S	S	*	*			cis	-148.4	134	1.2	-135.4	173.9	-176.3	-179.7	0	111.3
471	S	35.8	Very low	36.4	Very low	89 Å²	89	133.1 Å²	133.1	62%	0.622	74%	0.737	S	S	*	*			trans	60.1	136.7	132.5	62.6	0	0	0	0	124
472	T	33.9	Very low	36.1	Very low	143 Å²	143	134.3 Å²	134.3	88%	0.877	73%	0.729	S	S	*	*			trans	61.3	132.1	143.6	53	0	0	0	0	120.7
473	G	34.7	Very low	36.2	Very low	76 Å²	76	134.1 Å²	134.1	78%	0.784	73%	0.732	S	S	*	*			trans	160.1	88.6	163.6	0	0	0	0	0	114.9
474	H	38.1	Very low	35.9	Very low	173 Å²	173	129.1 Å²	129.1	80%	0.801	71%	0.713	S	S	*	*			trans	-59.1	155.7	-177.7	-84.1	-108.2	0	0	0	117.1
475	H	34.9	Very low	35.9	Very low	157 Å²	157	129.9 Å²	129.9	73%	0.727	72%	0.716	S	S	*	*			trans	63.3	131.3	142.5	-92	-61.4	0	0	0	122.8
476	S	31.4	Very low	35.6	Very low	85 Å²	85	129.6 Å²	129.6	59%	0.594	71%	0.711	S	S	*	*			trans	67.5	153.1	133.4	-62.6	0	0	0	0	118.2
477	Q	32.3	Very low	35.2	Very low	165 Å²	165	128.1 Å²	128.1	77%	0.771	71%	0.713	S	S	*	*			cis	-154.7	-174.7	-11.5	-123.5	169.8	-35	0	0	108.6
478	T	30.4	Very low	34.9	Very low	102 Å²	102	129.6 Å²	129.6	63%	0.626	72%	0.718	S	S	*	*			trans	-1.6	148	151.5	58.3	0	0	0	0	119.5
479	N	30.8	Very low	34.7	Very low	136 Å²	136	129 Å²	129	73%	0.727	72%	0.719	S	S	*	*			cis	-168.7	-161.5	1.5	-102.3	-9	0	0	0	107.9
480	N	30.1	Very low	34.4	Very low	122 Å²	122	129.8 Å²	129.8	65%	0.652	72%	0.719	S	S	*	*			trans	7.3	148	136.2	-62.5	33.9	0	0	0	118.9
481	E	34.1	Very low	34.2	Very low	141 Å²	141	125.7 Å²	125.7	66%	0.659	71%	0.709	S	S	*	*			cis	-156.6	-157.6	14.3	-134.5	166.4	108.3	0	0	115.1
482	Q	35.4	Very low	34	Very low	149 Å²	149	129.8 Å²	129.8	70%	0.696	72%	0.719	S	S	*	*			trans	-45.8	142.5	171.6	-57.3	158.6	59.6	0	0	114.1
483	D	37.9	Very low	34.1	Very low	135 Å²	135	126.6 Å²	126.6	72%	0.722	71%	0.707	S	S	*	*				169.2	162.1	117.6	-101.4	8.8	0	0	0	112
484	V	36.7	Very low	34.2	Very low	94 Å²	94	128.5 Å²	128.5	57%	0.57	70%	0.703	S	S	*	*			cis	-169.2	-176.1	-39.8	79.5	0	0	0	0	107.5
485	K	42	Very low	34.1	Very low	158 Å²	158	126.9 Å²	126.9	69%	0.687	70%	0.7	S	S	*	*			trans	72.6	125.4	178.3	-73	128.1	-162.3	154.8	0	114.2
486	Q	32.1	Very low	34.3	Very low	173 Å²	173	126 Å²	126	81%	0.808	70%	0.701	S	S	*	*				75.3	140.7	61.1	-70.1	169.5	-25	0	0	111.7
487	S	34.5	Very low	34.7	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	71%	0.714	S	S	*	*			cis	-162.6	161.1	11.4	26.4	0	0	0	0	113.4
488	V	32.3	Very low	34.9	Very low	132 Å²	132	125.7 Å²	125.7	80%	0.8	71%	0.707	S	S	*	*			trans	33	122.2	132.5	-172	0	0	0	0	117.7
489	A	33.9	Very low	35.2	Very low	86 Å²	86	126.5 Å²	126.5	71%	0.711	71%	0.712	S	S	*	*				-166.3	148	87.2	0	0	0	0	0	110.6
490	V	33.8	Very low	35.6	Very low	123 Å²	123	128.5 Å²	128.5	75%	0.745	72%	0.717	S	S	*	*				64	127.9	66.4	168.5	0	0	0	0	111.9
491	T	33.2	Very low	35.9	Very low	98 Å²	98	125.3 Å²	125.3	60%	0.601	71%	0.712	S	S	*	*			cis	-160.9	176.6	-12.9	31	0	0	0	0	108.6
492	E	31.5	Very low	36	Very low	176 Å²	176	127.4 Å²	127.4	82%	0.822	72%	0.72	S	S	*	*			trans	60.7	162.5	143.1	-75	154.7	146.4	0	0	119.9
493	A	36.2	Very low	36	Very low	75 Å²	75	126.2 Å²	126.2	62%	0.62	72%	0.718	S	S	*	*			cis	-160.9	-172.8	-24.3	0	0	0	0	0	109.2
494	T	35.8	Very low	35.6	Very low	117 Å²	117	126.2 Å²	126.2	72%	0.718	72%	0.718	S	S	*	*			trans	20.1	125.4	147.7	50.3	0	0	0	0	118.9
495	D	38	Very low	35.4	Very low	138 Å²	138	126.9 Å²	126.9	74%	0.738	73%	0.727	S	S	*	*				-150	145	60.2	-89.4	-29.9	0	0	0	111.8
496	L	37.7	Very low	35	Very low	140 Å²	140	129 Å²	129	73%	0.733	74%	0.736	S	S	*	*				85.6	148.2	57.2	-73.3	-172.1	0	0	0	115.2
497	L	40.4	Very low	35.1	Very low	166 Å²	166	125.7 Å²	125.7	87%	0.869	73%	0.732	S	S	*	*			trans	71.9	137.7	176	-51.1	-176.6	0	0	0	116
498	A	35.3	Very low	35.3	Very low	76 Å²	76	126 Å²	126	63%	0.628	73%	0.732	S	S	*	*			cis	-154.2	155.6	-15.8	0	0	0	0	0	108.7
499	V	37.4	Very low	35.3	Very low	120 Å²	120	125.7 Å²	125.7	73%	0.727	73%	0.73	S	S	*	*				51.4	122.8	96.6	-173.1	0	0	0	0	112.5
500	E	39.3	Very low	35.3	Very low	178 Å²	178	126.2 Å²	126.2	83%	0.832	73%	0.728	S	S	*	*			cis	-151	174.3	13.8	-123.9	147.4	-144.7	0	0	108.2
501	G	36.9	Very low	35.1	Very low	54 Å²	54	128 Å²	128	56%	0.557	73%	0.729	S	S	*	*			cis	149.3	130.7	-4.7	0	0	0	0	0	112.1
502	F	36.5	Very low	35.1	Very low	186 Å²	186	130 Å²	130	82%	0.816	73%	0.734	S	S	*	*			trans	63.7	161.5	160.7	-55.2	-58.6	0	0	0	118.3
503	N	34.8	Very low	35.3	Very low	124 Å²	124	128.8 Å²	128.8	66%	0.663	73%	0.733	S	S	*	*			cis	-154.5	155.9	-21.3	-119.6	-21.8	0	0	0	113.1
504	N	30	Very low	35.3	Very low	134 Å²	134	129.1 Å²	129.1	72%	0.717	73%	0.731	S	S	*	*			trans	32.1	112.1	143.8	-73.8	-16.5	0	0	0	122.6
505	S	32.3	Very low	35.4	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	73%	0.734	S	S	*	*				105	143.6	103.9	77.2	0	0	0	0	122.3
506	K	32.9	Very low	35.4	Very low	202 Å²	202	128.3 Å²	128.3	88%	0.878	74%	0.735	S	S	*	*			trans	73	138.7	151.1	-106.8	174.8	178.3	177.6	0	120.6
507	S	34.8	Very low	35.4	Very low	104 Å²	104	127.6 Å²	127.6	73%	0.727	74%	0.736	S	S	*	*			trans	-75.9	163	168.2	59.6	0	0	0	0	111.1
508	P	38.1	Very low	35.3	Very low	109 Å²	109	125.2 Å²	125.2	71%	0.708	73%	0.728	S	S	*	*				-145.9	162.8	82.6	38.2	-20.7	0	0	0	116.8
509	V	31.7	Very low	35.6	Very low	125 Å²	125	128.9 Å²	128.9	76%	0.758	73%	0.73	S	S	*	*			trans	30.2	154.6	130.9	-167.6	0	0	0	0	120.7
510	S	34.1	Very low	35.6	Very low	96 Å²	96	128.8 Å²	128.8	67%	0.671	72%	0.722	S	S	*	*			trans	70.5	151.8	162.7	27.1	0	0	0	0	116.4
511	E	30.5	Very low	35.3	Very low	162 Å²	162	122.4 Å²	122.4	76%	0.757	70%	0.703	S	S	*	*			cis	-162.5	-177.6	-25.8	-134.1	178.5	127.3	0	0	108.6
512	L	32.4	Very low	35.1	Very low	138 Å²	138	123 Å²	123	72%	0.723	70%	0.696	S	S	*	*			trans	44.2	129.5	149.1	-68.8	164.5	0	0	0	121.8
513	L	36.9	Very low	34.9	Very low	151 Å²	151	120.8 Å²	120.8	79%	0.791	69%	0.691	S	S	*	*			trans	134.5	97.4	139.7	-69.1	176.5	0	0	0	108.8
514	S	35.5	Very low	34.6	Very low	83 Å²	83	119.8 Å²	119.8	58%	0.58	69%	0.69	S	S	*	*				49.3	102.6	69.6	82.8	0	0	0	0	110.5
515	D	38.1	Very low	34.4	Very low	146 Å²	146	119 Å²	119	78%	0.781	69%	0.69	S	S	*	*				-162.5	142.7	76.6	-83.1	-24.7	0	0	0	110.4
516	A	36.8	Very low	34.2	Very low	91 Å²	91	119.2 Å²	119.2	75%	0.752	69%	0.687	S	S	*	*				70.7	139.1	100.1	0	0	0	0	0	114.5
517	V	37.9	Very low	33.9	Very low	126 Å²	126	115.6 Å²	115.6	76%	0.764	68%	0.682	S	S	*	*			cis	-161.3	152.3	6.6	90.7	0	0	0	0	110.6
518	T	39.5	Very low	33.7	Very low	115 Å²	115	114.8 Å²	114.8	71%	0.706	68%	0.676	S	S	*	*			trans	48.2	142.8	147.9	-57.9	0	0	0	0	121.9
519	K	42.2	Very low	33.3	Very low	153 Å²	153	115.8 Å²	115.8	67%	0.665	68%	0.675	S	S	*	*			cis	-174.5	145.5	-20.3	-99.9	-172.7	-176.5	-178.7	0	106.6
520	H	35.4	Very low	33.3	Very low	119 Å²	119	115.9 Å²	115.9	55%	0.551	67%	0.672	S	S	*	*			trans	54.4	154.3	160.9	-58	-61	0	0	0	119.1	E324	E324-H520 IonicContact OE1-CE1 3.74Å; E324-H520 IonicContact OE1-CG 3.64Å; E324-H520 IonicContact OE1-ND1 2.74Å; E324-H520 PolarHBondContact OE1-ND1 2.84Å
521	G	33.4	Very low	33.2	Very low	43 Å²	43	117.3 Å²	117.3	44%	0.443	67%	0.672	S	S	.	*			trans	143.7	34.2	165.3	0	0	0	0	0	117	E324 I523	E324-G521 PolarHBondContact OE2-N 3.33Å; G521-I523 PolarHBondContact O-N 2.83Å
522	V	33.8	Very low	33.4	Very low	68 Å²	68	115.3 Å²	115.3	41%	0.412	67%	0.667	S	S	.	*			trans	-54.5	133.5	163.6	176.3	0	0	0	0	109.9	S323 E324	S323-V522 VanDerWaalsContact OG-CG1 3.23Å; S323-V522 WeakPolarHBondContact OG-CG1 3.35Å; E324-V522 HydrophobicContact CB-CB 3.94Å; E324-V522 HydrophobicContact CG-CB 4.01Å; E324-V522 HydrophobicContact CG-CG2 4.15Å; E324-V522 WeakPolarHBondContact OE2-CG2 3.41Å; E324-V522 PolarHBondContact OE2-N 3.39Å
523	I	31.2	Very low	33.3	Very low	139 Å²	139	114.1 Å²	114.1	71%	0.713	67%	0.67	S	S	*	*			trans	-141.9	153.2	133.3	-109.2	168.2	0	0	0	107.4	G521	G521-I523 PolarHBondContact O-N 2.83Å
524	T	29	Very low	33.2	Very low	103 Å²	103	114.2 Å²	114.2	63%	0.632	66%	0.664	S	S	*	*			trans	-60.5	146.9	177	53.7	0	0	0	0	112.3
525	T	26.9	Very low	33.4	Very low	116 Å²	116	120.2 Å²	120.2	71%	0.712	67%	0.674	S	S	*	*				178.2	130.3	117.9	26.3	0	0	0	0	114.4
526	T	26.2	Very low	33.5	Very low	115 Å²	115	122.3 Å²	122.3	71%	0.706	68%	0.676	S	S	*	*			trans	63.2	168.7	144.1	71.8	0	0	0	0	120.2
527	T	27.5	Very low	33.6	Very low	125 Å²	125	126.2 Å²	126.2	77%	0.767	68%	0.676	S	S	*	*			trans	73.5	142.3	150.4	-51.7	0	0	0	0	114.6
528	S	29.9	Very low	33.4	Very low	87 Å²	87	123.7 Å²	123.7	61%	0.608	66%	0.664	S	S	*	*			cis	-139.3	165.5	2.6	-150.3	0	0	0	0	113.6
529	N	30.2	Very low	33.4	Very low	130 Å²	130	124.2 Å²	124.2	70%	0.695	66%	0.658	S	S	*	*			trans	-40.1	156.2	147.5	-55.7	-74	0	0	0	113.9
530	N	31	Very low	33.4	Very low	128 Å²	128	123.8 Å²	123.8	68%	0.684	66%	0.659	S	S	*	*				152.7	113.1	121.3	-81.2	-57.4	0	0	0	110.3
531	N	32.2	Very low	33.5	Very low	126 Å²	126	125.5 Å²	125.5	67%	0.674	67%	0.667	S	S	*	*				69.7	109.4	76.2	-73.2	-42.4	0	0	0	113.8
532	N	34.8	Very low	33.8	Very low	120 Å²	120	134 Å²	134	64%	0.642	69%	0.685	S	S	*	*			trans	146.8	111.5	144.9	-84.2	-75.5	0	0	0	107.9	K534	N532-K534 HydrophobicContact CB-CD 4.37Å; N532-K534 WeakPolarHBondContact OD1-CE 3.43Å; N532-K534 PolarHBondContact OD1-NZ 3.39Å
533	S	31.9	Very low	34.1	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	70%	0.696	S	S	*	*			cis	65.5	74.6	24.4	-154.8	0	0	0	0	114.5
534	K	34.5	Very low	34.6	Very low	154 Å²	154	139.2 Å²	139.2	67%	0.67	70%	0.702	S	S	*	*			trans	-162.7	144	162.6	-88.9	121.5	179.7	169.6	0	106	N532	N532-K534 HydrophobicContact CB-CD 4.37Å; N532-K534 WeakPolarHBondContact OD1-CE 3.43Å; N532-K534 PolarHBondContact OD1-NZ 3.39Å
535	R	39.9	Very low	35.2	Very low	209 Å²	209	140.3 Å²	140.3	79%	0.789	70%	0.704	S	S	*	*			cis	-145.9	139.6	-2.7	-105.6	159.2	174.1	176.3	-4.9	106.5
536	K	39.6	Very low	36	Very low	190 Å²	190	145 Å²	145	83%	0.826	71%	0.708	S	S	*	*				56.9	141.1	98.6	-59	-167.4	-180	-173.3	0	113.8
537	K	38.8	Very low	36.9	Very low	172 Å²	172	147.9 Å²	147.9	75%	0.748	71%	0.711	S	S	*	*			cis	-164.4	152	23.7	-150.2	-165.2	167.4	-156.1	0	112
538	S	34.3	Very low	37.7	Very low	74 Å²	74	151.2 Å²	151.2	52%	0.517	72%	0.715	S	S	.	*			trans	43.8	161.8	144.3	61.8	0	0	0	0	120.9
539	E	39	Very low	37.9	Very low	126 Å²	126	155.9 Å²	155.9	59%	0.589	72%	0.724	S	S	*	*			cis	-137.8	135.5	32.2	-120.2	50.7	-114.6	0	0	109.2
540	Q	41.5	Very low	38.3	Very low	143 Å²	143	154.2 Å²	154.2	67%	0.668	72%	0.721	S	S	*	*				71.7	141.1	95.8	-70.2	-161.8	53.7	0	0	116.4
541	H	37.9	Very low	38.4	Very low	156 Å²	156	155 Å²	155	72%	0.722	72%	0.723	S	S	*	*			cis	-166	172.7	-10.6	-130.8	-13.4	0	0	0	114.1
542	R	39.8	Very low	38.5	Very low	222 Å²	222	154.2 Å²	154.2	84%	0.838	73%	0.727	S	S	*	*			trans	74.2	141.7	162.7	-70.9	179.6	178	-167.2	0.4	118.9
543	S	40.7	Very low	38.4	Very low	90 Å²	90	156.3 Å²	156.3	63%	0.629	74%	0.737	S	S	*	*			cis	-164.1	130.6	-10.1	48.2	0	0	0	0	116.4
544	R	40.9	Very low	38.5	Very low	226 Å²	226	156.2 Å²	156.2	85%	0.853	74%	0.736	S	S	*	*			trans	64.5	158.4	131	-62.2	175.8	167.8	176.9	-5.5	118.6
545	L	41.1	Very low	38.5	Very low	125 Å²	125	156 Å²	156	65%	0.654	74%	0.742	S	S	*	*			cis	-138	142.9	7.3	-78.3	85.9	0	0	0	112.5
546	R	45	Very low	38.3	Very low	214 Å²	214	152.3 Å²	152.3	81%	0.808	74%	0.738	S	S	*	*			trans	64	148	138.8	-69.6	174.4	-178.8	170.5	-2.8	119
547	K	45.1	Very low	38.1	Very low	176 Å²	176	148 Å²	148	77%	0.765	73%	0.731	S	S	*	*			cis	-144.5	132.7	3.3	-108.8	154.8	176.7	-174.8	0	106.8
548	K	43.2	Very low	38	Very low	196 Å²	196	147.9 Å²	147.9	85%	0.852	73%	0.733	S	S	*	*				60.1	133.4	99.6	-74.5	-166.9	176.5	-170.6	0	114.9
549	K	35.5	Very low	38.1	Very low	185 Å²	185	151.4 Å²	151.4	80%	0.804	74%	0.742	S	S	*	*			cis	-163.7	154.4	2.6	-156.6	-166.8	175.7	-153.5	0	111.4
550	P	38.2	Very low	38	Very low	95 Å²	95	151.9 Å²	151.9	62%	0.617	75%	0.748	S	S	*	*			trans	-118.3	-172.4	170	39.2	-27.5	0	0	0	114.5
551	I	33.3	Very low	38	Very low	145 Å²	145	152.8 Å²	152.8	74%	0.744	75%	0.752	S	S	*	*			trans	86.6	118.2	161.4	-54.8	151.1	0	0	0	119.4
552	S	34.4	Very low	38.1	Very low	108 Å²	108	151 Å²	151	76%	0.755	75%	0.747	S	S	*	*				172.3	139.4	128.7	48.7	0	0	0	0	109
553	I	31	Very low	37.9	Very low	165 Å²	165	147.4 Å²	147.4	85%	0.846	74%	0.744	S	S	*	*			cis	74.4	90.3	32	73.7	140.6	0	0	0	117.8
554	S	35.5	Very low	38	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	74%	0.739	S	S	*	*			trans	-169.5	124.8	151.7	-165.8	0	0	0	0	104.4
555	L	34	Very low	38	Very low	150 Å²	150	142.8 Å²	142.8	79%	0.785	73%	0.731	S	S	*	*				66.9	127.7	62.3	-70.4	179.3	0	0	0	114.5
556	D	35	Very low	38.1	Very low	132 Å²	132	144 Å²	144	71%	0.706	73%	0.731	S	S	*	*			trans	70.1	103	156.1	-58.4	4.5	0	0	0	121.6
557	S	35.8	Very low	38.1	Very low	98 Å²	98	142.3 Å²	142.3	69%	0.685	73%	0.729	S	S	*	*				76.5	127.4	104.2	-51.3	0	0	0	0	122.9
558	E	36.4	Very low	37.7	Very low	171 Å²	171	139.3 Å²	139.3	80%	0.799	73%	0.726	S	S	*	*			trans	76.4	143.4	147.8	-21.5	-152.6	130.9	0	0	121.3
559	E	37.4	Very low	37.7	Very low	148 Å²	148	136.8 Å²	136.8	69%	0.692	72%	0.72	S	S	*	*			trans	55.3	119.3	155.5	-39.1	-45.2	64.4	0	0	122.8
560	D	37.2	Very low	37.7	Very low	136 Å²	136	134 Å²	134	73%	0.727	71%	0.714	S	S	*	*				71.4	126.6	121.3	-65.4	-12.3	0	0	0	125.5
561	E	39.6	Very low	37.9	Very low	161 Å²	161	135.4 Å²	135.4	75%	0.752	72%	0.716	S	S	*	*				77.4	140.1	129.1	-78.1	-144.5	116.9	0	0	124.9
562	I	41.8	Very low	38.3	Very low	119 Å²	119	137.1 Å²	137.1	61%	0.61	72%	0.72	S	S	*	*			trans	81	118.4	138.3	-76.7	169.6	0	0	0	121
563	N	35.4	Very low	38.4	Very low	147 Å²	147	134.9 Å²	134.9	79%	0.786	71%	0.714	S	S	*	*			trans	69.8	155.6	148.2	-77.9	-9	0	0	0	122.4
564	S	41.6	Very low	38.8	Very low	75 Å²	75	132.9 Å²	132.9	52%	0.524	71%	0.714	S	S	.	*			cis	177.2	170.5	-31.3	59.3	0	0	0	0	111
565	E	42	Very low	38.9	Very low	144 Å²	144	132.6 Å²	132.6	67%	0.673	71%	0.713	S	S	*	*			trans	70	153.5	154.5	-68.2	-173	153.4	0	0	117.7
566	K	43.4	Very low	39.1	Very low	149 Å²	149	131.1 Å²	131.1	65%	0.648	72%	0.715	S	S	*	*			cis	-151.7	131.3	-5.1	-116.4	156.4	-173.9	149.7	0	106.8
567	K	43.5	Very low	39.3	Very low	179 Å²	179	130.2 Å²	130.2	78%	0.778	72%	0.719	S	S	*	*				70.7	137.7	94.7	-166.1	-170.3	178.9	-179.5	0	115.5
568	V	38	Very low	39.4	Very low	114 Å²	114	130.6 Å²	130.6	69%	0.691	72%	0.722	S	S	*	*				157.5	99.8	127.6	160.7	0	0	0	0	114.3
569	I	42.2	Very low	39.5	Very low	143 Å²	143	127.6 Å²	127.6	73%	0.733	72%	0.72	S	S	*	*			trans	40.2	161.2	142.3	50.3	165.8	0	0	0	123.2
570	N	36.8	Very low	39.8	Very low	127 Å²	127	126.6 Å²	126.6	68%	0.679	73%	0.726	S	S	*	*			cis	-164.9	-177.8	6.8	-107.2	1.6	0	0	0	108.5
571	L	41.7	Very low	39.9	Very low	124 Å²	124	125.5 Å²	125.5	65%	0.649	73%	0.729	S	S	*	*			cis	-169.1	153.2	-42.1	-96.2	178.3	0	0	0	111.7
572	H	40.9	Very low	40.1	Very low	181 Å²	181	123 Å²	123	84%	0.838	73%	0.727	S	S	*	*			trans	67.5	151.5	156.1	-64.8	-172	0	0	0	122.2
573	G	37.4	Very low	39.9	Very low	61 Å²	61	125 Å²	125	63%	0.629	74%	0.738	S	S	*	*			cis	163.7	149.8	-14.5	0	0	0	0	0	118
574	S	39.3	Very low	39.8	Very low	122 Å²	122	122.1 Å²	122.1	85%	0.853	73%	0.729	S	S	*	*			trans	60.4	156.6	150.4	50.2	0	0	0	0	123.8
575	S	38.4	Very low	39.6	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	75%	0.745	S	S	*	*			cis	178.2	160.3	-25.5	59.2	0	0	0	0	115.2
576	S	37.8	Very low	39.2	Very low	119 Å²	119	123.6 Å²	123.6	83%	0.832	74%	0.741	S	S	*	*			trans	74.2	159.2	157.5	84	0	0	0	0	119.3
577	S	39.7	Very low	38.7	Very low	113 Å²	113	123.2 Å²	123.2	79%	0.79	75%	0.747	S	S	*	*			cis	-153.7	-162.9	0.9	56.6	0	0	0	0	109.6
578	S	37.9	Very low	38.4	Very low	106 Å²	106	121.6 Å²	121.6	74%	0.741	75%	0.746	S	S	*	*			cis	-153	-132.9	6.7	66.3	0	0	0	0	113.9
579	S	36.8	Very low	38.3	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	75%	0.746	S	S	*	*			trans	-170.5	-161.4	-171.5	-70.7	0	0	0	0	112.3
580	P	44.9	Very low	38.1	Very low	126 Å²	126	121.2 Å²	121.2	82%	0.818	75%	0.75	S	S	*	*				-126.7	-161.6	-65	37.9	-19.4	0	0	0	115.3
581	S	38.9	Very low	38.1	Very low	113 Å²	113	121.1 Å²	121.1	79%	0.79	75%	0.754	S	S	*	*			trans	-110	-166.6	176.9	-36.2	0	0	0	0	112.6
582	P	44.1	Very low	37.7	Very low	110 Å²	110	122.9 Å²	122.9	71%	0.714	76%	0.759	S	S	*	*			cis	-151.5	-151.9	34	37.5	-9.2	0	0	0	117.4
583	L	37.3	Very low	37.3	Very low	160 Å²	160	120 Å²	120	84%	0.838	75%	0.749	S	S	*	*			trans	80.9	157.1	166.1	-53.7	-177	0	0	0	119.6
584	S	32.7	Very low	37.4	Very low	87 Å²	87	121.4 Å²	121.4	61%	0.608	75%	0.75	S	S	*	*			cis	-175.3	161.9	-27.3	59.1	0	0	0	0	112.1
585	L	37.3	Very low	37.4	Very low	163 Å²	163	124.2 Å²	124.2	85%	0.853	75%	0.746	S	S	*	*			trans	68.8	164.3	168.3	-56.6	171.2	0	0	0	116.8
586	S	33.8	Very low	37.5	Very low	86 Å²	86	123.8 Å²	123.8	60%	0.601	74%	0.743	S	S	*	*			cis	-170.8	151.3	-35.9	58.2	0	0	0	0	111.7
587	N	33.8	Very low	37.7	Very low	142 Å²	142	126 Å²	126	76%	0.759	74%	0.738	S	S	*	*			trans	76.5	130.8	155.8	-63.2	11.2	0	0	0	123.2
588	D	36	Very low	37.7	Very low	144 Å²	144	126.3 Å²	126.3	77%	0.77	73%	0.731	S	S	*	*			trans	70.6	152.9	132.8	-72.5	-56.1	0	0	0	127.2
589	S	36.4	Very low	37.7	Very low	99 Å²	99	129.3 Å²	129.3	69%	0.692	73%	0.733	S	S	*	*			trans	73.4	101.5	155.8	53	0	0	0	0	121.7
590	D	37.9	Very low	38	Very low	150 Å²	150	128.7 Å²	128.7	80%	0.802	73%	0.726	S	S	*	*				86.2	136.4	113.3	-74.6	-50.5	0	0	0	125.8
591	V	37	Very low	37.4	Very low	126 Å²	126	128.1 Å²	128.1	76%	0.764	73%	0.725	S	S	*	*			trans	80.6	149.6	140.5	165.4	0	0	0	0	120.9
592	E	34.4	Very low	37.4	Very low	161 Å²	161	127.2 Å²	127.2	75%	0.752	72%	0.719	S	S	*	*			trans	-28.4	169.3	177.5	-53.9	-167.4	136.9	0	0	119.2
593	N	32.3	Very low	37.2	Very low	119 Å²	119	129.5 Å²	129.5	64%	0.636	72%	0.72	S	S	*	*			cis	-164.3	173.5	31.1	-152.5	-51.3	0	0	0	111.7
594	S	39.8	Very low	37.1	Very low	92 Å²	92	128.5 Å²	128.5	64%	0.643	72%	0.715	S	S	*	*			trans	37.9	140.6	145.7	-81.2	0	0	0	0	120.9
595	K	38.2	Very low	37.3	Very low	180 Å²	180	131.8 Å²	131.8	78%	0.783	72%	0.718	S	S	*	*			cis	-170.4	154.9	38.5	-139.3	167.9	-175.6	167.8	0	110.6
596	S	41.7	Very low	37	Very low	95 Å²	95	130.1 Å²	130.1	66%	0.664	71%	0.706	S	S	*	*			trans	28.7	147.5	141.7	71.3	0	0	0	0	120.9
597	K	40.6	Very low	37	Very low	167 Å²	167	133.3 Å²	133.3	73%	0.726	71%	0.709	S	S	*	*			cis	-175.3	141.3	46.8	-166.2	156.3	173.9	179	0	113.6
598	D	39.4	Very low	36.8	Very low	119 Å²	119	130.8 Å²	130.8	64%	0.636	70%	0.703	S	S	*	*			trans	51.6	165.8	148.6	-64.8	-8	0	0	0	122.5
599	Q	38.2	Very low	36.8	Very low	169 Å²	169	134.8 Å²	134.8	79%	0.79	71%	0.707	S	S	*	*			cis	-161.6	-174.3	-49.7	-125.9	-159.7	78	0	0	108.2
600	P	43.2	Very low	36.5	Very low	94 Å²	94	137.4 Å²	137.4	61%	0.61	71%	0.713	S	S	*	*			trans	-134.2	-151.5	-130.1	43.5	-20.8	0	0	0	114.5
601	S	32.4	Very low	36.2	Very low	114 Å²	114	135.8 Å²	135.8	80%	0.797	71%	0.714	S	S	*	*			trans	76.3	157.5	166.5	-58.9	0	0	0	0	115
602	S	39.7	Very low	36	Very low	94 Å²	94	135.1 Å²	135.1	66%	0.657	71%	0.714	S	S	*	*			cis	-149.5	143.8	16.8	74.9	0	0	0	0	115.3
603	Q	38.8	Very low	36.4	Very low	159 Å²	159	131.8 Å²	131.8	74%	0.743	71%	0.707	S	S	*	*				70.3	127.5	125.9	-78.6	-166.3	92.6	0	0	125.1
604	L	36.6	Very low	36.5	Very low	138 Å²	138	135.2 Å²	135.2	72%	0.723	72%	0.716	S	S	*	*			trans	74.5	152.9	136.5	-61.4	173.4	0	0	0	119.8
605	K	35.1	Very low	36.3	Very low	156 Å²	156	135.7 Å²	135.7	68%	0.678	72%	0.719	S	S	*	*			cis	-168.3	138.1	-20.4	170.6	160.6	175.2	178.8	0	112
606	E	31.4	Very low	36.3	Very low	128 Å²	128	132.2 Å²	132.2	60%	0.598	72%	0.718	S	S	*	*			trans	33.3	152.2	152.9	-68.2	-175.5	125.7	0	0	125.1
607	K	33.3	Very low	36.3	Very low	153 Å²	153	132.5 Å²	132.5	67%	0.665	72%	0.716	S	S	*	*			trans	89.5	95.1	135.5	-87.8	158.9	-171.2	149	0	122.1
608	S	31	Very low	36.3	Very low	89 Å²	89	131.4 Å²	131.4	62%	0.622	72%	0.716	S	S	*	*				70.3	153.4	112.1	74.8	0	0	0	0	121.9
609	R	35.3	Very low	36.3	Very low	229 Å²	229	131.6 Å²	131.6	86%	0.864	72%	0.717	S	S	*	*			trans	81.8	120.2	177.8	-52.5	161.1	-169.8	-176.5	0.6	111.4
610	D	29.6	Very low	36.4	Very low	153 Å²	153	131.9 Å²	131.9	82%	0.818	72%	0.716	S	S	*	*			cis	86	146.6	49	-167.2	23.4	0	0	0	112.5
611	S	33.2	Very low	36.3	Very low	117 Å²	117	131.4 Å²	131.4	82%	0.818	72%	0.715	S	S	*	*			trans	74	153.3	-174.4	74.3	0	0	0	0	119.1
612	S	32.6	Very low	36.6	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	71%	0.708	S	S	*	*			trans	-105.9	-166.6	-178.7	-151.6	0	0	0	0	108.5
613	P	41.5	Very low	36.7	Very low	92 Å²	92	136.3 Å²	136.3	60%	0.597	71%	0.711	S	S	*	*			cis	-146.9	-168.1	-1.2	45.4	-25.6	0	0	0	116.8
614	K	34.7	Very low	36.7	Very low	191 Å²	191	133 Å²	133	83%	0.83	71%	0.705	S	S	*	*			trans	69.4	162.1	150.6	-76.6	171.8	-167	171.5	0	118.5
615	S	34.9	Very low	36.9	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	71%	0.707	S	S	*	*			cis	-171.7	159.8	-17	47.5	0	0	0	0	110
616	S	39.9	Very low	37.1	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	72%	0.716	S	S	*	*			cis	-138.7	-86.5	-1.7	27.6	0	0	0	0	113.4
617	T	40	Very low	37.3	Very low	100 Å²	100	137.4 Å²	137.4	61%	0.613	73%	0.725	S	S	*	*			cis	-157.8	118.4	-10.1	-59.6	0	0	0	0	110.1
618	I	42.4	Very low	38	Very low	145 Å²	145	142.1 Å²	142.1	74%	0.744	74%	0.738	S	S	*	*			trans	61.3	137.1	162.7	-72.6	173.6	0	0	0	116.7
619	N	39.1	Very low	38.1	Very low	123 Å²	123	144 Å²	144	66%	0.658	74%	0.741	S	S	*	*			cis	-164.9	-178.3	-9.2	-102.2	-15.2	0	0	0	105.6
620	K	40.1	Very low	38.2	Very low	175 Å²	175	141 Å²	141	76%	0.761	74%	0.737	S	S	*	*			cis	-163.6	159.7	-13.7	-110.5	170.9	179.2	-176.8	0	105.4
621	S	40.7	Very low	38.7	Very low	84 Å²	84	143.1 Å²	143.1	59%	0.587	74%	0.739	S	S	*	*			cis	-171.1	128.6	-34.4	55.1	0	0	0	0	112.8
622	N	39	Very low	38.7	Very low	121 Å²	121	141.7 Å²	141.7	65%	0.647	73%	0.729	S	S	*	*			trans	65.8	155.1	145.2	-66.9	-55	0	0	0	118.3
623	R	41.7	Very low	38.8	Very low	190 Å²	190	142.3 Å²	142.3	72%	0.717	72%	0.724	S	S	*	*			cis	-166.8	-176.4	1.4	-113.9	165.8	-147	170.6	7.2	106.9
624	S	39.3	Very low	38.5	Very low	89 Å²	89	145.5 Å²	145.5	62%	0.622	73%	0.731	S	S	*	*			cis	-172.2	149.3	-7	155.4	0	0	0	0	106.4
625	R	40.7	Very low	38.4	Very low	204 Å²	204	144.6 Å²	144.6	77%	0.77	73%	0.726	S	S	*	*			cis	-161	-153.4	-10.5	-97.3	170.9	171.2	155.6	-6.3	104
626	K	38.5	Very low	38.1	Very low	199 Å²	199	144.5 Å²	144.5	87%	0.865	72%	0.722	S	S	*	*			cis	-158.7	157.7	6.9	-160	179.8	-178.2	-178.9	0	108.6
627	S	36.4	Very low	37.6	Very low	111 Å²	111	145.7 Å²	145.7	78%	0.776	72%	0.72	S	S	*	*			trans	-147.5	173.5	171.8	61.3	0	0	0	0	110.5
628	R	46.5	Very low	37.2	Very low	253 Å²	253	146.7 Å²	146.7	96%	0.955	72%	0.721	S	S	*	*			trans	-149	159.9	157.8	-145.7	168.2	-171.7	162.7	3.7	111.1
629	N	33.7	Very low	36.6	Very low	128 Å²	128	146.2 Å²	146.2	68%	0.684	72%	0.72	S	S	*	*			trans	-159.4	162.4	-155.9	-167.3	7.9	0	0	0	111.5
630	Q	38.3	Very low	36.3	Very low	166 Å²	166	147.2 Å²	147.2	78%	0.776	73%	0.726	S	S	*	*			trans	66.4	157.4	169.2	-68.6	165.2	8.8	0	0	115.7
631	K	38.8	Very low	35.7	Very low	198 Å²	198	145.9 Å²	145.9	86%	0.861	73%	0.727	S	S	*	*			cis	-155.4	174.4	35.9	-164.4	168.7	178	179.1	0	113.6
632	S	34.2	Very low	35.4	Very low	86 Å²	86	149.4 Å²	149.4	60%	0.601	74%	0.738	S	S	*	*			trans	-92.1	159.6	-174.4	58.3	0	0	0	0	116
633	N	34.1	Very low	35	Very low	125 Å²	125	152 Å²	152	67%	0.668	74%	0.744	S	S	*	*				175.3	149.7	114	-90.3	-2.4	0	0	0	114.7
634	Q	36.5	Very low	34.5	Very low	159 Å²	159	151.7 Å²	151.7	74%	0.743	75%	0.753	S	S	*	*			trans	29.2	139.4	142.9	-48.1	177.4	17.6	0	0	119.2
635	K	31.3	Very low	34.3	Very low	171 Å²	171	157 Å²	157	74%	0.743	76%	0.764	S	S	*	*				176	142	51.3	-151.6	-178.8	172.8	179.3	0	111.4
636	T	29	Very low	33.9	Very low	100 Å²	100	151.9 Å²	151.9	61%	0.613	76%	0.76	S	S	*	*			trans	52.6	122.6	147.5	50.8	0	0	0	0	123.8
637	N	28.4	Very low	33.9	Very low	132 Å²	132	152.4 Å²	152.4	71%	0.706	76%	0.762	S	S	*	*				93.3	131.2	119.4	-70.9	20.2	0	0	0	123.5
638	N	32.5	Very low	33.9	Very low	122 Å²	122	155.8 Å²	155.8	65%	0.652	77%	0.766	S	S	*	*			trans	78	97.1	136.2	-64	10.3	0	0	0	121
639	N	29.5	Very low	33.5	Very low	135 Å²	135	149 Å²	149	72%	0.722	76%	0.757	S	S	*	*				60.3	150.4	108.3	-58.9	10.1	0	0	0	121.8
640	N	32.6	Very low	33.3	Very low	143 Å²	143	151.2 Å²	151.2	77%	0.765	76%	0.764	S	S	*	*			trans	76.6	110.9	167.4	-50.4	-29.5	0	0	0	114.5
641	N	28.1	Very low	33.4	Very low	148 Å²	148	149 Å²	149	79%	0.791	76%	0.761	S	S	*	*				65.6	83.6	58.3	-171.2	13	0	0	0	113.3
642	L	34.1	Very low	33.3	Very low	158 Å²	158	149 Å²	149	83%	0.827	76%	0.761	S	S	*	*			trans	-164.1	151.4	153.3	-88.1	122.9	0	0	0	108.6
643	K	30.9	Very low	33.4	Very low	175 Å²	175	149.8 Å²	149.8	76%	0.761	76%	0.764	S	S	*	*			cis	-167.3	133.6	-28.9	173.7	157.7	-178.8	167.6	0	107.4	K645	K643-K645 PolarHBondContact O-N 2.95Å
644	M	31	Very low	33.2	Very low	183 Å²	183	149.9 Å²	149.9	90%	0.901	77%	0.77	S	S	*	*			trans	-53.8	127.1	168.4	-77.2	-80.3	-87.7	0	0	110
645	K	36.1	Very low	33.2	Very low	200 Å²	200	149 Å²	149	87%	0.87	78%	0.775	S	S	*	*			trans	-130.9	82.3	-179.7	-156.7	166.5	-176	173.8	0	111.6	K643	K643-K645 PolarHBondContact O-N 2.95Å
646	S	32.2	Very low	33.3	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	78%	0.776	S	S	*	*			trans	-55.4	151.2	166.1	47.9	0	0	0	0	111.8
647	K	38.2	Very low	33.7	Very low	209 Å²	209	145.9 Å²	145.9	91%	0.909	79%	0.785	S	S	*	*			trans	-119.2	112.4	152.9	-79	-170.6	172.5	-173.8	0	107.9
648	Q	35.5	Very low	34	Very low	182 Å²	182	146.9 Å²	146.9	85%	0.85	79%	0.79	S	S	*	*			trans	-95.8	135.6	164.1	-68.1	171.3	-47.7	0	0	108.3
649	S	38.1	Very low	34.2	Very low	111 Å²	111	147.6 Å²	147.6	78%	0.776	80%	0.799	S	S	*	*			trans	167.5	145.6	153.3	53.2	0	0	0	0	109.5
650	E	30.3	Very low	34.5	Very low	175 Å²	175	146 Å²	146	82%	0.818	80%	0.798	S	S	*	*			cis	-170.7	176.8	-27.8	-152.2	-176.8	121.8	0	0	107.1
651	V	39.5	Very low	34.8	Very low	118 Å²	118	145 Å²	145	72%	0.715	80%	0.797	S	S	*	*			trans	65.7	98.6	162.4	179.9	0	0	0	0	115.7
652	K	36.5	Very low	35.3	Very low	199 Å²	199	148 Å²	148	87%	0.865	80%	0.797	S	S	*	*				104.7	164.6	75.9	-97.1	-170.1	172.3	176.1	0	112.7
653	P	36.5	Very low	35.5	Very low	103 Å²	103	146.2 Å²	146.2	67%	0.669	79%	0.788	S	S	*	*			trans	-131.6	-158.8	-136.8	41.7	-22.5	0	0	0	116.4
654	T	31	Very low	35.9	Very low	127 Å²	127	144.9 Å²	144.9	78%	0.779	79%	0.785	S	S	*	*			trans	81.3	154.8	173.3	80.4	0	0	0	0	115.1
655	T	35	Very low	36.3	Very low	140 Å²	140	144.1 Å²	144.1	86%	0.859	78%	0.777	S	S	*	*			cis	-143.6	-178.5	1.8	-37.1	0	0	0	0	109.9
656	A	34.3	Very low	36.1	Very low	91 Å²	91	145.5 Å²	145.5	75%	0.752	78%	0.777	S	S	*	*			trans	-123.8	155	-172.1	0	0	0	0	0	115.8
657	S	36.6	Very low	36.5	Very low	115 Å²	115	149.2 Å²	149.2	80%	0.804	79%	0.787	S	S	*	*			trans	176.2	167.1	157.5	52.4	0	0	0	0	111.5
658	N	35.2	Very low	36.2	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	77%	0.774	S	S	*	*				176.5	118.5	-52.4	-109.3	-6	0	0	0	109.9
659	T	37.7	Very low	36.2	Very low	138 Å²	138	142.5 Å²	142.5	85%	0.847	77%	0.774	S	S	*	*			trans	-176.5	127	151.5	25.3	0	0	0	0	108.8
660	S	35.6	Very low	36.1	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	78%	0.776	S	S	*	*				73.3	124.4	63	-155.7	0	0	0	0	111.7
661	V	38.5	Very low	36.6	Very low	123 Å²	123	141.7 Å²	141.7	75%	0.745	78%	0.776	S	S	*	*				-155.1	127.6	53.2	164.5	0	0	0	0	107.7
662	R	37.6	Very low	36.3	Very low	210 Å²	210	142.1 Å²	142.1	79%	0.792	78%	0.784	S	S	*	*				59.1	147.8	91.3	-77.1	-179.3	170.6	-178.7	0.3	115.9
663	D	39.3	Very low	36.2	Very low	121 Å²	121	135.7 Å²	135.7	65%	0.647	77%	0.774	S	S	*	*			cis	-164.2	166	2.1	-120.2	-28.6	0	0	0	113.5
664	E	38.8	Very low	36.1	Very low	148 Å²	148	138 Å²	138	69%	0.692	78%	0.78	S	S	*	*			trans	58.8	160.7	156.3	-64.4	-140.9	117.5	0	0	121
665	K	39.6	Very low	36.4	Very low	166 Å²	166	143.3 Å²	143.3	72%	0.722	79%	0.785	S	S	*	*			cis	-146.1	165.3	-2.2	-142.4	176.3	-172.1	75.3	0	111.5
666	R	32.5	Very low	36.5	Very low	230 Å²	230	144 Å²	144	87%	0.868	78%	0.778	S	S	*	*			trans	-91.7	151.3	176.7	-56.4	173.3	-177.4	165.7	-0.6	112.9
667	I	39.8	Very low	37.1	Very low	175 Å²	175	146 Å²	146	90%	0.897	78%	0.781	S	S	*	*			trans	-131.2	139.2	142.7	-61.9	-177.2	0	0	0	108
668	S	33.2	Very low	37.4	Very low	93 Å²	93	146 Å²	146	65%	0.65	78%	0.776	S	S	*	*			trans	-123.1	148.7	178.2	51.8	0	0	0	0	110.3
669	N	35.7	Very low	38.2	Very low	157 Å²	157	143.6 Å²	143.6	84%	0.84	77%	0.769	S	S	*	*			trans	161.4	115.9	162.5	-82.3	-12.2	0	0	0	104
670	D	35.2	Very low	39.2	Very low	152 Å²	152	139.8 Å²	139.8	81%	0.813	75%	0.748	S	S	*	*			cis	68.6	83.3	25.9	-153.7	9	0	0	0	114.4
671	S	41	Very low	40.9	Very low	117 Å²	117	141.5 Å²	141.5	82%	0.818	75%	0.749	S	S	*	*			trans	-167.1	146.1	154	-83.3	0	0	0	0	110.9
672	S	33.7	Very low	43.4	Very low	128 Å²	128	138.7 Å²	138.7	90%	0.895	73%	0.73	S	S	*	*			trans	-55.5	135.6	177.3	50.9	0	0	0	0	114
673	G	33.7	Very low	46	Very low	64 Å²	64	129.6 Å²	129.6	66%	0.66	70%	0.698	S	S	*	*			trans	-157	121.4	170.3	0	0	0	0	0	112.3	R675	G673-R675 PolarHBondContact O-N 3.14Å; G673-R675 VanDerWaalsContact O-N 3.1Å
674	I	34.6	Very low	48.6	Very low	152 Å²	152	124.6 Å²	124.6	78%	0.779	67%	0.672	S	S	*	*			trans	-65	109.5	173	-62.1	167.9	0	0	0	107.5	H676	I674-H676 PolarHBondContact O-N 2.77Å
675	R	37.5	Very low	51.1	Low	238 Å²	238	120.4 Å²	120.4	90%	0.898	66%	0.656	S	S	*	*			trans	-75.8	78.6	171.6	-73.1	-162.8	-67.7	-154.6	-2.1	110.1	G673 V677	G673-R675 PolarHBondContact O-N 3.14Å; G673-R675 VanDerWaalsContact O-N 3.1Å; R675-V677 PolarHBondContact O-N 3.18Å; R675-V677 VanDerWaalsContact O-N 3.11Å
676	H	37.3	Very low	53.7	Low	153 Å²	153	115.4 Å²	115.4	71%	0.708	64%	0.636	S	S	*	*			trans	-47.6	116.1	147.8	-72.8	-94.1	0	0	0	107.2	I674 T678	I674-H676 PolarHBondContact O-N 2.77Å; H676-T678 PolarHBondContact O-N 3.07Å
677	V	45.8	Very low	56.7	Low	133 Å²	133	104.5 Å²	104.5	81%	0.806	59%	0.594	S	S	*	*			trans	-61.8	111.7	163.1	176.4	0	0	0	0	105.1	R675 P679	R675-V677 PolarHBondContact O-N 3.18Å; R675-V677 VanDerWaalsContact O-N 3.11Å; V677-P679 VanDerWaalsContact O-N 3.16Å
678	T	43.8	Very low	59.2	Low	116 Å²	116	98.1 Å²	98.1	71%	0.712	56%	0.562	S	S	*	*			trans	-53.4	123.2	174.2	46.7	0	0	0	0	107.5	H676 S680	H676-T678 PolarHBondContact O-N 3.07Å; T678-S680 PolarHBondContact O-N 2.89Å
679	P	51.4	Low	62.2	Low	102 Å²	102	97.5 Å²	97.5	66%	0.662	55%	0.549	S	S	*	.			trans	-59.2	114.1	-177.6	23.7	-32.8	0	0	0	108.1	V677 N681	V677-P679 VanDerWaalsContact O-N 3.16Å; P679-N681 PolarHBondContact O-N 3.31Å; P679-N681 PolarHBondContact O-OD1 3.06Å
680	S	58.3	Low	65	Low	57 Å²	57	90.1 Å²	90.1	40%	0.399	51%	0.51	S	S	.	.			trans	-66.7	108.6	175.2	51.8	0	0	0	0	107.1	T678 D682 T685	T678-S680 PolarHBondContact O-N 2.89Å; S680-D682 PolarHBondContact O-N 3.45Å; S680-T685 VanDerWaalsContact OG-CG2 3.22Å; S680-T685 WeakPolarHBondContact OG-CG2 3.44Å
681	N	72.6	Confident	67.9	Low	136 Å²	136	83 Å²	83	73%	0.727	47%	0.472	S	S	*	.			trans	-65.7	0.9	-175.8	-67.4	-38.7	0	0	0	113.8	P679 Q686	P679-N681 PolarHBondContact O-N 3.31Å; P679-N681 PolarHBondContact O-OD1 3.06Å; N681-Q686 PolarHBondContact O-NE2 3.08Å; N681-Q686 VanDerWaalsContact O-NE2 3.15Å
682	D	89.8	Confident	70.5	Confident	65 Å²	65	83.1 Å²	83.1	35%	0.348	45%	0.454	S	S	.	.			trans	-56.1	121.9	164.7	163	41.7	0	0	0	110.9	S680 V684 T685 Q686	S680-D682 PolarHBondContact O-N 3.45Å; D682-V684 VanDerWaalsContact C-N 3.28Å; D682-V684 PolarHBondContact O-N 2.87Å; D682-V684 PolarHBondContact OD1-N 3.18Å; D682-T685 VanDerWaalsContact OD2-CB 3.24Å; D682-T685 WeakPolarHBondContact OD2-CB 3.38Å; D682-T685 PolarHBondContact OD2-N 2.82Å; D682-T685 PolarHBondContact OD2-OG1 3.32Å; D682-Q686 WeakPolarHBondContact O-CG 3.34Å; D682-Q686 PolarHBondContact O-N 3.4Å; D682-Q686 PolarHBondContact O-NE2 3.35Å
683	P	92.1	Very high	73.5	Confident	18 Å²	18	78.6 Å²	78.6	12%	0.117	42%	0.42	C	S	.	.	H	α-helix	trans	-65.1	-29.1	178.4	26.9	-34.9	0	0	0	112.6	Q686 L687 I718 V720 Q724	P683-Q686 PolarHBondContact O-N 3.23Å; P683-L687 WeakPolarHBondContact O-CB 3.3Å; P683-L687 VanDerWaalsContact O-CG 3.23Å; P683-L687 WeakPolarHBondContact O-CG 3.49Å; P683-L687 PolarHBondContact O-N 2.87Å; P683-I718 HydrophobicContact CB-CG2 3.61Å; P683-V720 HydrophobicContact CB-CG2 4.27Å; P683-Q724 VanDerWaalsContact CG-NE2 3.28Å
684	V	93.3	Very high	76.4	Confident	17 Å²	17	75.6 Å²	75.6	10%	0.103	39%	0.389	C	S	.	.	H	α-helix	trans	-68	-42.6	-178.5	-178	0	0	0	0	110.6	D682 L687 N688 Q724 E727	D682-V684 VanDerWaalsContact C-N 3.28Å; D682-V684 PolarHBondContact O-N 2.87Å; D682-V684 PolarHBondContact OD1-N 3.18Å; V684-L687 PolarHBondContact O-N 3.03Å; V684-N688 WeakPolarHBondContact O-CB 3.22Å; V684-N688 PolarHBondContact O-N 2.95Å; V684-N688 PolarHBondContact O-ND2 2.81Å; V684-Q724 HydrophobicContact CG2-CB 3.71Å; V684-Q724 HydrophobicContact CG2-CG 3.94Å; V684-E727 HydrophobicContact CG1-CB 3.94Å; V684-E727 HydrophobicContact CG2-CB 4.45Å
685	T	93.3	Very high	79.3	Confident	59 Å²	59	72.9 Å²	72.9	36%	0.362	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-39.6	173.3	-58.4	0	0	0	0	111.6	S680 D682 N688 Q689	S680-T685 VanDerWaalsContact OG-CG2 3.22Å; S680-T685 WeakPolarHBondContact OG-CG2 3.44Å; D682-T685 VanDerWaalsContact OD2-CB 3.24Å; D682-T685 WeakPolarHBondContact OD2-CB 3.38Å; D682-T685 PolarHBondContact OD2-N 2.82Å; D682-T685 PolarHBondContact OD2-OG1 3.32Å; T685-N688 PolarHBondContact O-N 3.47Å; T685-Q689 WeakPolarHBondContact O-CB 3.42Å; T685-Q689 PolarHBondContact O-N 3.26Å
686	Q	93.6	Very high	82.1	Confident	62 Å²	62	65.2 Å²	65.2	29%	0.29	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-43.4	175.9	-70.9	177.6	75.7	0	0	112.8	N681 D682 P683 Q689 C690 I718	N681-Q686 PolarHBondContact O-NE2 3.08Å; N681-Q686 VanDerWaalsContact O-NE2 3.15Å; D682-Q686 WeakPolarHBondContact O-CG 3.34Å; D682-Q686 PolarHBondContact O-N 3.4Å; D682-Q686 PolarHBondContact O-NE2 3.35Å; P683-Q686 PolarHBondContact O-N 3.23Å; Q686-Q689 PolarHBondContact O-N 3.28Å; Q686-C690 PolarHBondContact O-N 3.04Å; Q686-C690 PolarHBondContact O-SG 3.3Å; Q686-I718 HydrophobicContact CB-CD1 3.89Å
687	L	94.6	Very high	84.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-44.1	174.2	-71	169.9	0	0	0	111.3	P683 V684 Q689 C690 C691 V715 I718 V720 L725 A728 L731	P683-L687 WeakPolarHBondContact O-CB 3.3Å; P683-L687 VanDerWaalsContact O-CG 3.23Å; P683-L687 WeakPolarHBondContact O-CG 3.49Å; P683-L687 PolarHBondContact O-N 2.87Å; V684-L687 PolarHBondContact O-N 3.03Å; L687-Q689 VanDerWaalsContact C-N 3.31Å; L687-Q689 PolarHBondContact O-N 2.87Å; L687-C690 PolarHBondContact O-N 2.83Å; L687-C691 WeakPolarHBondContact O-CB 3.2Å; L687-C691 PolarHBondContact O-N 3.32Å; L687-V715 HydrophobicContact CD2-CG1 4.15Å; L687-I718 HydrophobicContact CD2-CD1 3.98Å; L687-I718 HydrophobicContact CG-CD1 4.35Å; L687-V720 HydrophobicContact CD1-CG1 3.89Å; L687-V720 HydrophobicContact CD1-CG2 3.78Å; L687-V720 HydrophobicContact CD2-CG2 4.12Å; L687-V720 HydrophobicContact CG-CG2 4.19Å; L687-L725 HydrophobicContact CD1-CD1 4.5Å; L687-A728 HydrophobicContact CB-CB 3.86Å; L687-A728 HydrophobicContact CD1-CB 3.96Å; L687-L731 HydrophobicContact CB-CD2 3.84Å; L687-L731 HydrophobicContact CD2-CD2 3.53Å; L687-L731 HydrophobicContact CG-CD2 4.23Å
688	N	93.7	Very high	87.1	Confident	41 Å²	41	53.1 Å²	53.1	22%	0.219	29%	0.287	C	S	.	.	H	α-helix	trans	-66.2	-31.4	176.5	-81.8	-69.6	0	0	0	112.8	V684 T685 R692	V684-N688 WeakPolarHBondContact O-CB 3.22Å; V684-N688 PolarHBondContact O-N 2.95Å; V684-N688 PolarHBondContact O-ND2 2.81Å; T685-N688 PolarHBondContact O-N 3.47Å; N688-R692 WeakPolarHBondContact O-CG 3.4Å; N688-R692 PolarHBondContact O-N 3.37Å; N688-R692 PolarHBondContact O-NH1 3.24Å
689	Q	94.6	Very high	89.4	Confident	81 Å²	81	51.8 Å²	51.8	38%	0.379	28%	0.275	S	S	.	.	H	α-helix	trans	-68.1	-50.9	170.6	-171.7	60.3	38.7	0	0	110.9	T685 Q686 L687 C691 R692 D693	T685-Q689 WeakPolarHBondContact O-CB 3.42Å; T685-Q689 PolarHBondContact O-N 3.26Å; Q686-Q689 PolarHBondContact O-N 3.28Å; L687-Q689 VanDerWaalsContact C-N 3.31Å; L687-Q689 PolarHBondContact O-N 2.87Å; Q689-C691 PolarHBondContact O-N 3.41Å; Q689-C691 VanDerWaalsContact O-N 3.14Å; Q689-R692 WeakPolarHBondContact O-CA 3.41Å; Q689-R692 WeakPolarHBondContact O-CB 3.34Å; Q689-R692 PolarHBondContact O-N 3.22Å; Q689-R692 VanDerWaalsContact OE1-NE 3.08Å; Q689-D693 PolarHBondContact NE2-OD1 3.38Å; Q689-D693 PolarHBondContact O-N 2.95Å
690	C	95.4	Very high	91.2	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.007	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-30.1	177.3	-59.9	0	0	0	0	112.3	Q686 L687 L694 V715	Q686-C690 PolarHBondContact O-N 3.04Å; Q686-C690 PolarHBondContact O-SG 3.3Å; L687-C690 PolarHBondContact O-N 2.83Å; C690-L694 WeakPolarHBondContact O-CB 3.47Å; C690-L694 PolarHBondContact O-N 3.05Å; C690-V715 HydrophobicContact CB-CG2 3.64Å
691	C	95.3	Very high	92.6	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.02	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-40.1	171.8	-173.9	0	0	0	0	113	L687 Q689 K695 D730 L731	L687-C691 WeakPolarHBondContact O-CB 3.2Å; L687-C691 PolarHBondContact O-N 3.32Å; Q689-C691 PolarHBondContact O-N 3.41Å; Q689-C691 VanDerWaalsContact O-N 3.14Å; C691-K695 WeakPolarHBondContact O-CB 3.35Å; C691-K695 WeakPolarHBondContact O-CD 3.35Å; C691-K695 WeakPolarHBondContact O-CG 3.47Å; C691-K695 PolarHBondContact O-N 2.96Å; C691-K695 VanDerWaalsContact O-N 3.15Å; C691-K695 WeakPolarHBondContact SG-CE 3.5Å; C691-K695 PolarHBondContact SG-NZ 3.06Å; C691-D730 VanDerWaalsContact SG-C 3.59Å; C691-L731 HydrophobicContact CB-CB 3.94Å; C691-L731 HydrophobicContact CB-CD1 3.88Å; C691-L731 HydrophobicContact CB-CG 4.43Å; C691-L731 VanDerWaalsContact SG-CA 3.6Å
692	R	95.7	Very high	93.4	Very high	120 Å²	120	54.3 Å²	54.3	45%	0.453	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-50.9	173.1	-71.4	-178.9	-72.4	-92.5	7.8	110.5	N688 Q689 L694 K695 T696	N688-R692 WeakPolarHBondContact O-CG 3.4Å; N688-R692 PolarHBondContact O-N 3.37Å; N688-R692 PolarHBondContact O-NH1 3.24Å; Q689-R692 WeakPolarHBondContact O-CA 3.41Å; Q689-R692 WeakPolarHBondContact O-CB 3.34Å; Q689-R692 PolarHBondContact O-N 3.22Å; Q689-R692 VanDerWaalsContact OE1-NE 3.08Å; R692-L694 VanDerWaalsContact C-N 3.34Å; R692-L694 PolarHBondContact O-N 3.42Å; R692-K695 WeakPolarHBondContact O-CB 3.38Å; R692-K695 PolarHBondContact O-N 3.28Å; R692-K695 VanDerWaalsContact O-N 3.12Å; R692-T696 PolarHBondContact O-N 2.95Å; R692-T696 PolarHBondContact O-OG1 2.97Å
693	D	96.1	Very high	93.6	Very high	33 Å²	33	53.9 Å²	53.9	18%	0.176	28%	0.276	C	S	.	.	H	α-helix	trans	-57	-46.6	-179.3	-52.9	-21.5	0	0	0	110.7	Q689 K695 T696 S697 L711	Q689-D693 PolarHBondContact NE2-OD1 3.38Å; Q689-D693 PolarHBondContact O-N 2.95Å; D693-K695 VanDerWaalsContact C-N 3.33Å; D693-K695 PolarHBondContact O-N 3.41Å; D693-T696 WeakPolarHBondContact CA-OG1 3.46Å; D693-T696 PolarHBondContact O-N 2.97Å; D693-T696 VanDerWaalsContact O-N 3.13Å; D693-T696 PolarHBondContact O-OG1 2.85Å; D693-S697 PolarHBondContact O-N 3.32Å; D693-S697 PolarHBondContact O-OG 3.11Å; D693-L711 HydrophobicContact CB-CD1 3.51Å; D693-L711 HydrophobicContact CB-CD2 3.64Å; D693-L711 HydrophobicContact CB-CG 4.22Å
694	L	96.3	Very high	93.7	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-68	-32.3	179.6	-178.3	62.6	0	0	0	112.4	C690 R692 L698 A708 L711 L712	C690-L694 WeakPolarHBondContact O-CB 3.47Å; C690-L694 PolarHBondContact O-N 3.05Å; R692-L694 VanDerWaalsContact C-N 3.34Å; R692-L694 PolarHBondContact O-N 3.42Å; L694-L698 HydrophobicContact CD1-CD1 3.76Å; L694-L698 HydrophobicContact CD1-CG 4.31Å; L694-L698 HydrophobicContact CG-CD1 4.2Å; L694-L698 WeakPolarHBondContact O-CG 3.45Å; L694-L698 PolarHBondContact O-N 3.05Å; L694-A708 HydrophobicContact CD1-CB 3.71Å; L694-L711 HydrophobicContact CB-CD1 4.36Å; L694-L712 HydrophobicContact CD1-CD1 4.39Å; L694-L712 HydrophobicContact CD1-CG 4.22Å; L694-L712 HydrophobicContact CD2-CD2 3.81Å; L694-L712 HydrophobicContact CD2-CG 4.17Å
695	K	95.3	Very high	93.9	Very high	94 Å²	94	58.7 Å²	58.7	41%	0.409	30%	0.297	S	S	.	.	H	α-helix	trans	-69.3	-34.5	172.4	-76.3	167.6	-178.9	168.7	0	111.5	C691 R692 D693 I699 D730	C691-K695 WeakPolarHBondContact O-CB 3.35Å; C691-K695 WeakPolarHBondContact O-CD 3.35Å; C691-K695 WeakPolarHBondContact O-CG 3.47Å; C691-K695 PolarHBondContact O-N 2.96Å; C691-K695 VanDerWaalsContact O-N 3.15Å; C691-K695 WeakPolarHBondContact SG-CE 3.5Å; C691-K695 PolarHBondContact SG-NZ 3.06Å; R692-K695 WeakPolarHBondContact O-CB 3.38Å; R692-K695 PolarHBondContact O-N 3.28Å; R692-K695 VanDerWaalsContact O-N 3.12Å; D693-K695 VanDerWaalsContact C-N 3.33Å; D693-K695 PolarHBondContact O-N 3.41Å; K695-I699 WeakPolarHBondContact O-CG1 3.29Å; K695-D730 IonicContact NZ-OD1 2.85Å; K695-D730 PolarHBondContact NZ-OD1 2.78Å
696	T	95.2	Very high	94	Very high	78 Å²	78	60.1 Å²	60.1	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-73.9	-45.3	175.1	42	0	0	0	0	112.9	R692 D693 L698 I699	R692-T696 PolarHBondContact O-N 2.95Å; R692-T696 PolarHBondContact O-OG1 2.97Å; D693-T696 WeakPolarHBondContact CA-OG1 3.46Å; D693-T696 PolarHBondContact O-N 2.97Å; D693-T696 VanDerWaalsContact O-N 3.13Å; D693-T696 PolarHBondContact O-OG1 2.85Å; T696-L698 PolarHBondContact O-N 3.13Å; T696-I699 HydrophobicContact CG2-CD1 4.27Å; T696-I699 WeakPolarHBondContact O-CG1 3.42Å; T696-I699 PolarHBondContact O-N 3.39Å; T696-I699 VanDerWaalsContact O-N 3.16Å
697	S	95	Very high	94.2	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.021	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.1	179.4	-51.1	0	0	0	0	114.2	D693 N704 E707	D693-S697 PolarHBondContact O-N 3.32Å; D693-S697 PolarHBondContact O-OG 3.11Å; S697-N704 PolarHBondContact O-N 2.69Å; S697-E707 WeakPolarHBondContact OG-CG 3.4Å; S697-E707 PolarHBondContact OG-OE2 3.43Å
698	L	94.2	Very high	94.3	Very high	28 Å²	28	60.9 Å²	60.9	15%	0.147	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	17.1	178.8	-60.8	177.5	0	0	0	113.1	L694 T696 F705 A708 Y741 V747	L694-L698 HydrophobicContact CD1-CD1 3.76Å; L694-L698 HydrophobicContact CD1-CG 4.31Å; L694-L698 HydrophobicContact CG-CD1 4.2Å; L694-L698 WeakPolarHBondContact O-CG 3.45Å; L694-L698 PolarHBondContact O-N 3.05Å; T696-L698 PolarHBondContact O-N 3.13Å; L698-F705 HydrophobicContact CD2-CD1 4.39Å; L698-A708 HydrophobicContact CD1-CB 4.4Å; L698-A708 HydrophobicContact CD2-CB 3.66Å; L698-A708 HydrophobicContact CG-CB 4Å; L698-Y741 HydrophobicContact CB-CE2 4.42Å; L698-Y741 HydrophobicContact CD2-CE1 3.98Å; L698-Y741 HydrophobicContact CD2-CE2 4.38Å; L698-V747 HydrophobicContact CD1-CG1 4.1Å; L698-V747 HydrophobicContact CD2-CG1 4.16Å; L698-V747 HydrophobicContact CD2-CG2 4.3Å
699	I	92.1	Very high	94.4	Very high	88 Å²	88	60.3 Å²	60.3	45%	0.451	31%	0.307	S	S	.	.			trans	-65.7	133.3	171.8	-69.2	174	0	0	0	109.8	K695 T696 G701 H702 E703	K695-I699 WeakPolarHBondContact O-CG1 3.29Å; T696-I699 HydrophobicContact CG2-CD1 4.27Å; T696-I699 WeakPolarHBondContact O-CG1 3.42Å; T696-I699 PolarHBondContact O-N 3.39Å; T696-I699 VanDerWaalsContact O-N 3.16Å; I699-G701 PolarHBondContact O-N 3.42Å; I699-H702 CarbonylContact O-C 3.57Å; I699-H702 PolarHBondContact O-N 3.44Å; I699-E703 PolarHBondContact O-N 3.11Å
700	K	88.9	Confident	94.5	Very high	185 Å²	185	62.2 Å²	62.2	80%	0.804	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	125.7	-178.8	-169.2	-178.4	178.8	-175.4	0	111.8	E703	K700-E703 VanDerWaalsContact CA-OE1 3.31Å; K700-E703 WeakPolarHBondContact CA-OE1 3.43Å
701	G	88.4	Confident	94.6	Very high	58 Å²	58	62.8 Å²	62.8	60%	0.598	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-3.9	-174.7	0	0	0	0	0	114.8	I699 E703	I699-G701 PolarHBondContact O-N 3.42Å; G701-E703 WeakPolarHBondContact CA-OE2 3.27Å; G701-E703 PolarHBondContact N-OE1 2.94Å; G701-E703 PolarHBondContact N-OE2 3.4Å
702	H	89.5	Confident	94.7	Very high	106 Å²	106	62.7 Å²	62.7	49%	0.491	32%	0.318	S	S	.	.	S	Bend	trans	-137.8	34.2	177.4	-58.6	78.2	0	0	0	110.2	I699 N704	I699-H702 CarbonylContact O-C 3.57Å; I699-H702 PolarHBondContact O-N 3.44Å; H702-N704 PolarHBondContact O-N 2.91Å
703	E	92.7	Very high	94.7	Very high	55 Å²	55	60.1 Å²	60.1	26%	0.257	31%	0.313	S	S	.	.			trans	-71.6	111	-173.6	-63	89.7	156.8	0	0	113.2	I699 K700 G701 F705 Y741 L743	I699-E703 PolarHBondContact O-N 3.11Å; K700-E703 VanDerWaalsContact CA-OE1 3.31Å; K700-E703 WeakPolarHBondContact CA-OE1 3.43Å; G701-E703 WeakPolarHBondContact CA-OE2 3.27Å; G701-E703 PolarHBondContact N-OE1 2.94Å; G701-E703 PolarHBondContact N-OE2 3.4Å; E703-F705 HydrophobicContact CB-CD1 4.15Å; E703-F705 HydrophobicContact CB-CE1 3.48Å; E703-F705 VanDerWaalsContact CB-CE1 3.48Å; E703-F705 HydrophobicContact CB-CZ 3.73Å; E703-F705 HydrophobicContact CG-CE1 3.98Å; E703-F705 HydrophobicContact CG-CZ 4.28Å; E703-Y741 WeakPolarHBondContact CG-OH 3.36Å; E703-L743 HydrophobicContact CG-CD1 4.25Å; E703-L743 WeakPolarHBondContact OE1-CD1 3.35Å
704	N	95.2	Very high	94.6	Very high	69 Å²	69	62.8 Å²	62.8	37%	0.369	32%	0.323	S	S	.	.			trans	-102.4	84.1	172.2	-171.5	-5.3	0	0	0	110.8	S697 H702 V706 E707 A708	S697-N704 PolarHBondContact O-N 2.69Å; H702-N704 PolarHBondContact O-N 2.91Å; N704-V706 VanDerWaalsContact C-N 3.3Å; N704-V706 PolarHBondContact O-N 3Å; N704-E707 HydrophobicContact CB-CB 4.12Å; N704-E707 WeakPolarHBondContact ND2-CB 3.23Å; N704-E707 PolarHBondContact ND2-OE2 2.83Å; N704-E707 PolarHBondContact O-N 3.05Å; N704-E707 PolarHBondContact OD1-N 3.14Å; N704-A708 WeakPolarHBondContact O-CB 3.33Å; N704-A708 PolarHBondContact O-N 2.88Å
705	F	96.4	Very high	94.6	Very high	67 Å²	67	62.8 Å²	62.8	29%	0.294	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-34.4	-177.2	-52.5	-47.1	0	0	0	113.4	L698 E703 A708 V709 Y741 L743 V747	L698-F705 HydrophobicContact CD2-CD1 4.39Å; E703-F705 HydrophobicContact CB-CD1 4.15Å; E703-F705 HydrophobicContact CB-CE1 3.48Å; E703-F705 VanDerWaalsContact CB-CE1 3.48Å; E703-F705 HydrophobicContact CB-CZ 3.73Å; E703-F705 HydrophobicContact CG-CE1 3.98Å; E703-F705 HydrophobicContact CG-CZ 4.28Å; F705-A708 PolarHBondContact O-N 2.8Å; F705-V709 WeakPolarHBondContact O-CG2 3.39Å; F705-V709 PolarHBondContact O-N 3.17Å; F705-Y741 HydrophobicContact CD1-CE1 4.18Å; F705-Y741 AromaticContact CE1-CE1 3.77Å; F705-Y741 HydrophobicContact CE1-CE1 3.77Å; F705-L743 HydrophobicContact CE1-CB 4.07Å; F705-L743 HydrophobicContact CZ-CB 3.94Å; F705-V747 HydrophobicContact CB-CG2 4.02Å; F705-V747 HydrophobicContact CD1-CG2 4.13Å; F705-V747 HydrophobicContact CG-CG2 4.48Å
706	V	96.5	Very high	94.5	Very high	89 Å²	89	62.9 Å²	62.9	54%	0.539	32%	0.321	S	S	.	.	H	α-helix	trans	-67.3	-46.9	-178.6	179.5	0	0	0	0	110.4	N704 V709 Q710	N704-V706 VanDerWaalsContact C-N 3.3Å; N704-V706 PolarHBondContact O-N 3Å; V706-V709 PolarHBondContact O-N 2.91Å; V706-Q710 WeakPolarHBondContact O-CG 3.43Å; V706-Q710 PolarHBondContact O-N 3.32Å
707	E	96.1	Very high	94.5	Very high	79 Å²	79	63.5 Å²	63.5	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-63.9	-42.5	174.1	-177.9	-179.6	-146.3	0	0	111.5	S697 N704 V709 Q710 L711	S697-E707 WeakPolarHBondContact OG-CG 3.4Å; S697-E707 PolarHBondContact OG-OE2 3.43Å; N704-E707 HydrophobicContact CB-CB 4.12Å; N704-E707 WeakPolarHBondContact ND2-CB 3.23Å; N704-E707 PolarHBondContact ND2-OE2 2.83Å; N704-E707 PolarHBondContact O-N 3.05Å; N704-E707 PolarHBondContact OD1-N 3.14Å; E707-V709 VanDerWaalsContact C-N 3.31Å; E707-V709 PolarHBondContact O-N 3.04Å; E707-Q710 CarbonylContact O-C 3.6Å; E707-Q710 PolarHBondContact O-N 3.33Å; E707-Q710 VanDerWaalsContact O-N 3.11Å; E707-L711 HydrophobicContact CG-CD1 3.88Å; E707-L711 HydrophobicContact CG-CG 4.31Å; E707-L711 WeakPolarHBondContact O-CB 3.39Å; E707-L711 VanDerWaalsContact O-CG 3.25Å; E707-L711 WeakPolarHBondContact O-CG 3.24Å; E707-L711 PolarHBondContact O-N 3.11Å
708	A	96.8	Very high	94.4	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-58.4	-40.7	175.5	0	0	0	0	0	112.7	L694 L698 N704 F705 L711 L712 V747	L694-A708 HydrophobicContact CD1-CB 3.71Å; L698-A708 HydrophobicContact CD1-CB 4.4Å; L698-A708 HydrophobicContact CD2-CB 3.66Å; L698-A708 HydrophobicContact CG-CB 4Å; N704-A708 WeakPolarHBondContact O-CB 3.33Å; N704-A708 PolarHBondContact O-N 2.88Å; F705-A708 PolarHBondContact O-N 2.8Å; A708-L711 PolarHBondContact O-N 2.84Å; A708-L712 WeakPolarHBondContact O-CD1 3.29Å; A708-L712 VanDerWaalsContact O-CG 3.28Å; A708-L712 WeakPolarHBondContact O-CG 3.24Å; A708-L712 PolarHBondContact O-N 2.9Å; A708-V747 HydrophobicContact CB-CG2 3.96Å
709	V	97.3	Very high	94.1	Very high	29 Å²	29	67.8 Å²	67.8	18%	0.176	36%	0.357	C	S	.	.	H	α-helix	trans	-67.1	-42.2	173.3	169.9	0	0	0	0	111.5	F705 V706 E707 L711 L712 N713 E746 V747 A750	F705-V709 WeakPolarHBondContact O-CG2 3.39Å; F705-V709 PolarHBondContact O-N 3.17Å; V706-V709 PolarHBondContact O-N 2.91Å; E707-V709 VanDerWaalsContact C-N 3.31Å; E707-V709 PolarHBondContact O-N 3.04Å; V709-L711 VanDerWaalsContact C-N 3.34Å; V709-L711 PolarHBondContact O-N 2.91Å; V709-L712 PolarHBondContact O-N 3.2Å; V709-N713 PolarHBondContact O-N 3.08Å; V709-N713 PolarHBondContact O-ND2 2.94Å; V709-N713 PolarHBondContact O-OD1 3.39Å; V709-E746 HydrophobicContact CG2-CB 3.91Å; V709-V747 HydrophobicContact CG2-CG2 4.04Å; V709-A750 HydrophobicContact CG1-CB 4.25Å; V709-A750 HydrophobicContact CG2-CB 4.18Å
710	Q	96.9	Very high	94	Very high	121 Å²	121	64.3 Å²	64.3	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-62.3	-38.6	175.2	-71.8	176.1	13.3	0	0	112.4	V706 E707 N713 K714	V706-Q710 WeakPolarHBondContact O-CG 3.43Å; V706-Q710 PolarHBondContact O-N 3.32Å; E707-Q710 CarbonylContact O-C 3.6Å; E707-Q710 PolarHBondContact O-N 3.33Å; E707-Q710 VanDerWaalsContact O-N 3.11Å; Q710-N713 WeakPolarHBondContact O-CB 3.41Å; Q710-N713 PolarHBondContact O-N 2.91Å; Q710-K714 WeakPolarHBondContact O-CB 3.35Å; Q710-K714 PolarHBondContact O-N 3.24Å
711	L	96.7	Very high	94.1	Very high	13 Å²	13	62 Å²	62	7%	0.068	33%	0.326	C	S	.	.	H	α-helix	trans	-68.4	-39.2	176.4	-70.8	166.8	0	0	0	112.1	D693 L694 E707 A708 V709 N713 K714 V715	D693-L711 HydrophobicContact CB-CD1 3.51Å; D693-L711 HydrophobicContact CB-CD2 3.64Å; D693-L711 HydrophobicContact CB-CG 4.22Å; L694-L711 HydrophobicContact CB-CD1 4.36Å; E707-L711 HydrophobicContact CG-CD1 3.88Å; E707-L711 HydrophobicContact CG-CG 4.31Å; E707-L711 WeakPolarHBondContact O-CB 3.39Å; E707-L711 VanDerWaalsContact O-CG 3.25Å; E707-L711 WeakPolarHBondContact O-CG 3.24Å; E707-L711 PolarHBondContact O-N 3.11Å; A708-L711 PolarHBondContact O-N 2.84Å; V709-L711 VanDerWaalsContact C-N 3.34Å; V709-L711 PolarHBondContact O-N 2.91Å; L711-N713 VanDerWaalsContact C-N 3.33Å; L711-K714 HydrophobicContact CD2-CD 4.26Å; L711-K714 WeakPolarHBondContact O-CB 3.31Å; L711-K714 PolarHBondContact O-N 2.86Å; L711-V715 WeakPolarHBondContact O-CG2 3.37Å; L711-V715 PolarHBondContact O-N 3.36Å
712	L	96.8	Very high	94.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-37.1	171.8	-72	163.5	0	0	0	111.6	L694 A708 V709 R716 I735 V747 A750 A751 T754	L694-L712 HydrophobicContact CD1-CD1 4.39Å; L694-L712 HydrophobicContact CD1-CG 4.22Å; L694-L712 HydrophobicContact CD2-CD2 3.81Å; L694-L712 HydrophobicContact CD2-CG 4.17Å; A708-L712 WeakPolarHBondContact O-CD1 3.29Å; A708-L712 VanDerWaalsContact O-CG 3.28Å; A708-L712 WeakPolarHBondContact O-CG 3.24Å; A708-L712 PolarHBondContact O-N 2.9Å; V709-L712 PolarHBondContact O-N 3.2Å; L712-R716 PolarHBondContact O-N 2.8Å; L712-I735 HydrophobicContact CD2-CD1 4.26Å; L712-I735 HydrophobicContact CD2-CG1 3.88Å; L712-V747 HydrophobicContact CD1-CG1 4.31Å; L712-A750 HydrophobicContact CB-CB 3.93Å; L712-A750 HydrophobicContact CD1-CB 3.7Å; L712-A750 HydrophobicContact CG-CB 4.45Å; L712-A751 HydrophobicContact CD1-CB 4.21Å; L712-A751 HydrophobicContact CD2-CB 4.4Å; L712-T754 PolarHBondContact O-OG1 3.08Å
713	N	95.9	Very high	94.2	Very high	66 Å²	66	54.8 Å²	54.8	35%	0.353	28%	0.278	S	S	.	.	H	α-helix	trans	-65.8	-42.3	171.8	-65	-19.3	0	0	0	111.9	V709 Q710 L711 V715 R716 S717	V709-N713 PolarHBondContact O-N 3.08Å; V709-N713 PolarHBondContact O-ND2 2.94Å; V709-N713 PolarHBondContact O-OD1 3.39Å; Q710-N713 WeakPolarHBondContact O-CB 3.41Å; Q710-N713 PolarHBondContact O-N 2.91Å; L711-N713 VanDerWaalsContact C-N 3.33Å; N713-V715 PolarHBondContact O-N 2.7Å; N713-R716 WeakPolarHBondContact O-CB 3.47Å; N713-R716 PolarHBondContact O-N 3.3Å; N713-R716 VanDerWaalsContact O-N 3.12Å; N713-R716 PolarHBondContact OD1-NH2 2.93Å; N713-S717 PolarHBondContact O-N 3.36Å
714	K	95.3	Very high	94.2	Very high	90 Å²	90	54 Å²	54	39%	0.391	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-41.3	175.8	-176.5	-177.8	174.9	-169.8	0	112	Q710 L711 R716 S717 I718	Q710-K714 WeakPolarHBondContact O-CB 3.35Å; Q710-K714 PolarHBondContact O-N 3.24Å; L711-K714 HydrophobicContact CD2-CD 4.26Å; L711-K714 WeakPolarHBondContact O-CB 3.31Å; L711-K714 PolarHBondContact O-N 2.86Å; K714-R716 VanDerWaalsContact C-N 3.26Å; K714-R716 PolarHBondContact O-N 3.11Å; K714-S717 WeakPolarHBondContact CA-OG 3.31Å; K714-S717 PolarHBondContact O-N 2.77Å; K714-S717 PolarHBondContact O-OG 3.05Å; K714-I718 WeakPolarHBondContact O-CG1 3.29Å; K714-I718 PolarHBondContact O-N 3.05Å
715	V	95.4	Very high	94	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-36.4	173.8	167.3	0	0	0	0	111.9	L687 C690 L711 N713 S717 L731 I735 T754 F758	L687-V715 HydrophobicContact CD2-CG1 4.15Å; C690-V715 HydrophobicContact CB-CG2 3.64Å; L711-V715 WeakPolarHBondContact O-CG2 3.37Å; L711-V715 PolarHBondContact O-N 3.36Å; N713-V715 PolarHBondContact O-N 2.7Å; V715-S717 VanDerWaalsContact C-N 3.32Å; V715-S717 PolarHBondContact O-N 3.25Å; V715-L731 HydrophobicContact CG1-CD2 4.02Å; V715-L731 HydrophobicContact CG2-CD1 4.29Å; V715-L731 HydrophobicContact CG2-CD2 4.03Å; V715-I735 HydrophobicContact CG1-CD1 4.29Å; V715-T754 HydrophobicContact CB-CG2 4.34Å; V715-T754 HydrophobicContact CG1-CG2 3.71Å; V715-F758 HydrophobicContact CG1-CE1 3.95Å; V715-F758 HydrophobicContact CG1-CZ 3.62Å
716	R	94.3	Very high	93.8	Very high	96 Å²	96	48.3 Å²	48.3	36%	0.362	25%	0.249	S	C	.	.	H	α-helix	trans	-73.8	-16.5	174.4	-66.5	-170.8	-74.1	161.3	-4.4	114.4	L712 N713 K714 T754 F757	L712-R716 PolarHBondContact O-N 2.8Å; N713-R716 WeakPolarHBondContact O-CB 3.47Å; N713-R716 PolarHBondContact O-N 3.3Å; N713-R716 VanDerWaalsContact O-N 3.12Å; N713-R716 PolarHBondContact OD1-NH2 2.93Å; K714-R716 VanDerWaalsContact C-N 3.26Å; K714-R716 PolarHBondContact O-N 3.11Å; R716-T754 HydrophobicContact CG-CG2 3.91Å; R716-F757 HydrophobicContact CB-CD1 4.36Å; R716-F757 HydrophobicContact CG-CB 4.3Å; R716-F757 HydrophobicContact CG-CD1 4.05Å; R716-F757 HydrophobicContact CG-CG 4.32Å
717	S	93.7	Very high	93.5	Very high	90 Å²	90	48.1 Å²	48.1	63%	0.629	24%	0.242	S	C	*	.	H	α-helix	trans	-93.5	-12.8	178.5	64.2	0	0	0	0	114.7	N713 K714 V715	N713-S717 PolarHBondContact O-N 3.36Å; K714-S717 WeakPolarHBondContact CA-OG 3.31Å; K714-S717 PolarHBondContact O-N 2.77Å; K714-S717 PolarHBondContact O-OG 3.05Å; V715-S717 VanDerWaalsContact C-N 3.32Å; V715-S717 PolarHBondContact O-N 3.25Å
718	I	92.7	Very high	93.3	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.041	22%	0.224	C	C	.	.	S	Bend	trans	-75.7	130.6	177	-58.9	162.8	0	0	0	108.6	P683 Q686 L687 K714 V720	P683-I718 HydrophobicContact CB-CG2 3.61Å; Q686-I718 HydrophobicContact CB-CD1 3.89Å; L687-I718 HydrophobicContact CD2-CD1 3.98Å; L687-I718 HydrophobicContact CG-CD1 4.35Å; K714-I718 WeakPolarHBondContact O-CG1 3.29Å; K714-I718 PolarHBondContact O-N 3.05Å; I718-V720 HydrophobicContact CB-CG2 3.99Å; I718-V720 HydrophobicContact CG2-CG2 3.61Å; I718-V720 WeakPolarHBondContact O-CG2 3.4Å; I718-V720 PolarHBondContact O-N 3.25Å
719	P	89	Confident	93	Very high	114 Å²	114	48.4 Å²	48.4	74%	0.74	24%	0.24	S	C	*	.			trans	-72.9	112.9	171.6	28.9	-32.7	0	0	0	110.1
720	V	89.2	Confident	92.7	Very high	15 Å²	15	49.6 Å²	49.6	9%	0.091	25%	0.245	C	C	.	.			trans	-133.6	133.3	-171.2	179.6	0	0	0	0	110.4	P683 L687 I718 Q724 L725	P683-V720 HydrophobicContact CB-CG2 4.27Å; L687-V720 HydrophobicContact CD1-CG1 3.89Å; L687-V720 HydrophobicContact CD1-CG2 3.78Å; L687-V720 HydrophobicContact CD2-CG2 4.12Å; L687-V720 HydrophobicContact CG-CG2 4.19Å; I718-V720 HydrophobicContact CB-CG2 3.99Å; I718-V720 HydrophobicContact CG2-CG2 3.61Å; I718-V720 WeakPolarHBondContact O-CG2 3.4Å; I718-V720 PolarHBondContact O-N 3.25Å; V720-Q724 HydrophobicContact CG1-CB 4.08Å; V720-L725 HydrophobicContact CG1-CB 3.81Å
721	R	91.1	Very high	92.6	Very high	136 Å²	136	43.8 Å²	43.8	51%	0.513	22%	0.218	S	C	.	.			trans	-95	156	167.5	-58.5	-175.3	-62.5	139.3	-10.3	111.1	P723 Q724 L725 E769	R721-P723 VanDerWaalsContact C-CD 3.48Å; R721-P723 VanDerWaalsContact C-N 3.34Å; R721-P723 VanDerWaalsContact O-N 3.16Å; R721-Q724 VanDerWaalsContact N-OE1 3.08Å; R721-Q724 WeakPolarHBondContact O-CB 3.46Å; R721-Q724 PolarHBondContact O-N 2.81Å; R721-L725 PolarHBondContact O-N 2.57Å; R721-L725 VanDerWaalsContact O-N 3.15Å; R721-E769 WeakPolarHBondContact CD-OE1 3.37Å; R721-E769 IonicContact CZ-OE1 3.81Å; R721-E769 IonicContact NE-OE1 2.72Å; R721-E769 IonicContact NH1-OE1 3.39Å; R721-E769 PolarHBondContact NH1-OE1 2.97Å
722	L	90.4	Very high	92.2	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-52.6	-40.1	-175	-168.4	70.3	0	0	0	114.6	Q724 L725 A726 Q762 T765 A773	L722-Q724 VanDerWaalsContact C-N 3.34Å; L722-Q724 PolarHBondContact O-N 3.39Å; L722-L725 PolarHBondContact O-N 3.11Å; L722-A726 PolarHBondContact O-N 3.4Å; L722-Q762 HydrophobicContact CD1-CB 4.14Å; L722-Q762 HydrophobicContact CD1-CG 4.5Å; L722-Q762 HydrophobicContact CD2-CB 4.31Å; L722-Q762 HydrophobicContact CD2-CG 3.96Å; L722-T765 HydrophobicContact CB-CG2 4.37Å; L722-T765 HydrophobicContact CD2-CG2 3.69Å; L722-A773 HydrophobicContact CD2-CB 3.89Å; L722-A773 HydrophobicContact CG-CB 3.83Å
723	P	90.4	Very high	91.9	Very high	3 Å²	3	47 Å²	47	2%	0.019	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-36.7	175.3	-24.8	35.9	0	0	0	113.9	R721 L725 A726 E727 E769 K772 L776	R721-P723 VanDerWaalsContact C-CD 3.48Å; R721-P723 VanDerWaalsContact C-N 3.34Å; R721-P723 VanDerWaalsContact O-N 3.16Å; P723-L725 VanDerWaalsContact C-N 3.34Å; P723-A726 WeakPolarHBondContact O-CB 3.47Å; P723-A726 PolarHBondContact O-N 2.89Å; P723-E727 WeakPolarHBondContact O-CG 3.38Å; P723-E727 PolarHBondContact O-N 3.19Å; P723-E769 HydrophobicContact CG-CB 4.11Å; P723-E769 HydrophobicContact CG-CG 4.31Å; P723-K772 HydrophobicContact CB-CD 4.16Å; P723-K772 HydrophobicContact CB-CG 4.32Å; P723-K772 HydrophobicContact CG-CB 4.39Å; P723-K772 HydrophobicContact CG-CD 4.26Å; P723-K772 HydrophobicContact CG-CG 4.44Å; P723-L776 HydrophobicContact CB-CD1 4.08Å
724	Q	91.9	Very high	91.8	Very high	39 Å²	39	44.3 Å²	44.3	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-71.1	-32	178.1	-66.9	167.8	-55	0	0	111.5	P683 V684 V720 R721 L722 A728	P683-Q724 VanDerWaalsContact CG-NE2 3.28Å; V684-Q724 HydrophobicContact CG2-CB 3.71Å; V684-Q724 HydrophobicContact CG2-CG 3.94Å; V720-Q724 HydrophobicContact CG1-CB 4.08Å; R721-Q724 VanDerWaalsContact N-OE1 3.08Å; R721-Q724 WeakPolarHBondContact O-CB 3.46Å; R721-Q724 PolarHBondContact O-N 2.81Å; L722-Q724 VanDerWaalsContact C-N 3.34Å; L722-Q724 PolarHBondContact O-N 3.39Å; Q724-A728 PolarHBondContact O-N 2.82Å
725	L	92.1	Very high	91.8	Very high	4 Å²	4	40 Å²	40	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-70.5	-35.5	171.3	-173.6	57.2	0	0	0	112	L687 V720 R721 L722 P723 A728 M732 F758	L687-L725 HydrophobicContact CD1-CD1 4.5Å; V720-L725 HydrophobicContact CG1-CB 3.81Å; R721-L725 PolarHBondContact O-N 2.57Å; R721-L725 VanDerWaalsContact O-N 3.15Å; L722-L725 PolarHBondContact O-N 3.11Å; P723-L725 VanDerWaalsContact C-N 3.34Å; L725-A728 CarbonylContact O-C 3.55Å; L725-A728 PolarHBondContact O-N 3.24Å; L725-M732 HydrophobicContact CD1-CE 4.28Å; L725-M732 HydrophobicContact CD2-CE 3.7Å; L725-M732 HydrophobicContact CG-CE 3.88Å; L725-F758 HydrophobicContact CD1-CD1 4.27Å; L725-F758 HydrophobicContact CD1-CD2 4.46Å; L725-F758 HydrophobicContact CD1-CE1 3.81Å; L725-F758 HydrophobicContact CD1-CE2 3.99Å; L725-F758 HydrophobicContact CD1-CZ 3.64Å; L725-F758 HydrophobicContact CD2-CB 4Å; L725-F758 HydrophobicContact CD2-CD1 3.57Å; L725-F758 HydrophobicContact CD2-CD2 4.14Å; L725-F758 HydrophobicContact CD2-CE1 3.98Å; L725-F758 HydrophobicContact CD2-CE2 4.47Å; L725-F758 HydrophobicContact CD2-CG 3.66Å; L725-F758 HydrophobicContact CD2-CZ 4.4Å
726	A	91.6	Very high	91.7	Very high	13 Å²	13	42.7 Å²	42.7	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-67.3	-37.9	174.8	0	0	0	0	0	112.7	L722 P723 A728 W729 A773 L776 I777	L722-A726 PolarHBondContact O-N 3.4Å; P723-A726 WeakPolarHBondContact O-CB 3.47Å; P723-A726 PolarHBondContact O-N 2.89Å; A726-A728 PolarHBondContact O-N 3.01Å; A726-W729 PolarHBondContact O-N 3.27Å; A726-A773 HydrophobicContact CB-CB 3.9Å; A726-L776 HydrophobicContact CB-CB 4.29Å; A726-L776 HydrophobicContact CB-CD1 4.35Å; A726-I777 HydrophobicContact CB-CD1 3.95Å; A726-I777 HydrophobicContact CB-CG1 3.95Å
727	E	91.1	Very high	91.6	Very high	85 Å²	85	43.8 Å²	43.8	40%	0.397	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-33.5	170.3	-71.7	168.3	-143.6	0	0	111.8	V684 P723 W729 L776	V684-E727 HydrophobicContact CG1-CB 3.94Å; V684-E727 HydrophobicContact CG2-CB 4.45Å; P723-E727 WeakPolarHBondContact O-CG 3.38Å; P723-E727 PolarHBondContact O-N 3.19Å; E727-W729 VanDerWaalsContact C-N 3.32Å; E727-W729 PolarHBondContact O-N 3Å; E727-L776 HydrophobicContact CG-CD1 4.01Å; E727-L776 HydrophobicContact CG-CD2 4.11Å
728	A	91.6	Very high	91.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	32.4	175.2	0	0	0	0	0	114.3	L687 Q724 L725 A726 D730 L731	L687-A728 HydrophobicContact CB-CB 3.86Å; L687-A728 HydrophobicContact CD1-CB 3.96Å; Q724-A728 PolarHBondContact O-N 2.82Å; L725-A728 CarbonylContact O-C 3.55Å; L725-A728 PolarHBondContact O-N 3.24Å; A726-A728 PolarHBondContact O-N 3.01Å; A728-D730 PolarHBondContact O-N 3.48Å; A728-L731 WeakPolarHBondContact O-CB 3.33Å; A728-L731 PolarHBondContact O-N 2.97Å
729	W	89.6	Confident	91.9	Very high	85 Å²	85	42.1 Å²	42.1	32%	0.322	20%	0.201	S	C	.	.	H	α-helix	trans	-40.4	-38.9	179	77.7	-66.8	0	0	0	115	A726 E727 L731 M732 D733 H780 I784	A726-W729 PolarHBondContact O-N 3.27Å; E727-W729 VanDerWaalsContact C-N 3.32Å; E727-W729 PolarHBondContact O-N 3Å; W729-L731 VanDerWaalsContact C-N 3.26Å; W729-L731 PolarHBondContact O-N 3.21Å; W729-M732 WeakPolarHBondContact O-CB 3.32Å; W729-M732 PolarHBondContact O-N 3.47Å; W729-M732 VanDerWaalsContact O-N 3.07Å; W729-D733 PolarHBondContact O-N 2.8Å; W729-D733 VanDerWaalsContact O-N 3.14Å; W729-H780 AromaticContact CD1-CE1 3.74Å; W729-H780 AromaticContact CD1-ND1 3.63Å; W729-H780 AromaticContact CD2-CD2 3.98Å; W729-H780 AromaticContact CD2-CE1 3.67Å; W729-H780 AromaticContact CD2-ND1 3.87Å; W729-H780 AromaticContact CD2-NE2 3.77Å; W729-H780 AromaticContact CE2-CE1 3.15Å; W729-H780 AromaticContact CE2-ND1 3.76Å; W729-H780 AromaticContact CE2-NE2 3.41Å; W729-H780 AromaticContact CG-ND1 3.87Å; W729-H780 AromaticContact CH2-NE2 3.69Å; W729-H780 AromaticContact CZ2-CE1 3.51Å; W729-H780 AromaticContact CZ2-NE2 3.39Å; W729-H780 WeakPolarHBondContact CZ2-NE2 3.46Å; W729-H780 AromaticContact NE1-CE1 3.2Å; W729-H780 PolarHBondContact NE1-CE1 3Å; W729-H780 AromaticContact NE1-ND1 3.6Å; W729-H780 AromaticContact NE1-NE2 3.95Å; W729-I784 HydrophobicContact CH2-CD1 4.28Å; W729-I784 HydrophobicContact CZ3-CD1 4.14Å
730	D	91.5	Very high	92	Very high	53 Å²	53	45.3 Å²	45.3	28%	0.283	20%	0.198	S	C	.	.	H	α-helix	trans	-58.3	-35	180	-126.1	-56.7	0	0	0	112.7	C691 K695 A728 C734	C691-D730 VanDerWaalsContact SG-C 3.59Å; K695-D730 IonicContact NZ-OD1 2.85Å; K695-D730 PolarHBondContact NZ-OD1 2.78Å; A728-D730 PolarHBondContact O-N 3.48Å; D730-C734 WeakPolarHBondContact O-CB 3.47Å; D730-C734 PolarHBondContact O-N 3.33Å; D730-C734 VanDerWaalsContact O-N 3.12Å
731	L	93.6	Very high	92.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-73.7	-38.3	176	178.7	60.7	0	0	0	111.5	L687 C691 V715 A728 W729 C734 I735	L687-L731 HydrophobicContact CB-CD2 3.84Å; L687-L731 HydrophobicContact CD2-CD2 3.53Å; L687-L731 HydrophobicContact CG-CD2 4.23Å; C691-L731 HydrophobicContact CB-CB 3.94Å; C691-L731 HydrophobicContact CB-CD1 3.88Å; C691-L731 HydrophobicContact CB-CG 4.43Å; C691-L731 VanDerWaalsContact SG-CA 3.6Å; V715-L731 HydrophobicContact CG1-CD2 4.02Å; V715-L731 HydrophobicContact CG2-CD1 4.29Å; V715-L731 HydrophobicContact CG2-CD2 4.03Å; A728-L731 WeakPolarHBondContact O-CB 3.33Å; A728-L731 PolarHBondContact O-N 2.97Å; W729-L731 VanDerWaalsContact C-N 3.26Å; W729-L731 PolarHBondContact O-N 3.21Å; L731-C734 WeakPolarHBondContact O-CB 3.4Å; L731-C734 PolarHBondContact O-N 3.05Å; L731-I735 HydrophobicContact CD1-CD1 3.84Å; L731-I735 HydrophobicContact CD1-CG1 4.3Å; L731-I735 HydrophobicContact CG-CD1 3.89Å; L731-I735 WeakPolarHBondContact O-CG1 3.2Å; L731-I735 PolarHBondContact O-N 2.78Å
732	M	90.2	Very high	92.3	Very high	24 Å²	24	45 Å²	45	12%	0.118	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-45.8	178.8	-178.1	65.7	73.5	0	0	111	L725 W729 I735 K736 F755 F758 Y1148	L725-M732 HydrophobicContact CD1-CE 4.28Å; L725-M732 HydrophobicContact CD2-CE 3.7Å; L725-M732 HydrophobicContact CG-CE 3.88Å; W729-M732 WeakPolarHBondContact O-CB 3.32Å; W729-M732 PolarHBondContact O-N 3.47Å; W729-M732 VanDerWaalsContact O-N 3.07Å; M732-I735 PolarHBondContact O-N 3.2Å; M732-K736 WeakPolarHBondContact O-CG 3.28Å; M732-K736 PolarHBondContact O-N 2.91Å; M732-F755 HydrophobicContact SD-CE2 4.48Å; M732-F758 HydrophobicContact CE-CB 4.1Å; M732-F758 HydrophobicContact CE-CD2 3.42Å; M732-F758 VanDerWaalsContact CE-CD2 3.42Å; M732-F758 HydrophobicContact CE-CE2 3.98Å; M732-F758 HydrophobicContact CE-CG 4Å; M732-F758 HydrophobicContact SD-CD2 3.65Å; M732-F758 HydrophobicContact SD-CE2 4.14Å; M732-Y1148 WeakPolarHBondContact CG-OH 3.44Å; M732-Y1148 PolarHBondContact SD-OH 2.92Å
733	D	90.2	Very high	92.4	Very high	55 Å²	55	49.7 Å²	49.7	29%	0.294	22%	0.224	S	C	.	.	H	α-helix	trans	-69.9	-32.9	175	-176.4	38.8	0	0	0	112.6	W729 K736 K737	W729-D733 PolarHBondContact O-N 2.8Å; W729-D733 VanDerWaalsContact O-N 3.14Å; D733-K736 PolarHBondContact O-N 3.18Å; D733-K737 WeakPolarHBondContact O-CD 3.36Å; D733-K737 WeakPolarHBondContact O-CG 3.4Å; D733-K737 PolarHBondContact O-N 3.27Å; D733-K737 VanDerWaalsContact O-N 3.1Å; D733-K737 VanDerWaalsContact OD1-CE 3.27Å; D733-K737 WeakPolarHBondContact OD1-CE 3.46Å; D733-K737 IonicContact OD1-NZ 2.74Å; D733-K737 WeakPolarHBondContact OD2-CE 3.27Å; D733-K737 IonicContact OD2-NZ 2.66Å; D733-K737 PolarHBondContact OD2-NZ 3.35Å
734	C	94	Very high	92.6	Very high	11 Å²	11	50.1 Å²	50.1	7%	0.074	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-46.1	169.2	-171.9	0	0	0	0	111.7	D730 L731 K737 C738	D730-C734 WeakPolarHBondContact O-CB 3.47Å; D730-C734 PolarHBondContact O-N 3.33Å; D730-C734 VanDerWaalsContact O-N 3.12Å; L731-C734 WeakPolarHBondContact O-CB 3.4Å; L731-C734 PolarHBondContact O-N 3.05Å; C734-K737 WeakPolarHBondContact O-CB 3.33Å; C734-K737 PolarHBondContact O-N 3.05Å; C734-K737 VanDerWaalsContact O-N 3.15Å; C734-C738 PolarHBondContact O-N 2.94Å; C734-C738 PolarHBondContact O-SG 2.89Å
735	I	95.3	Very high	92.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.9	-38.1	178.5	-72.2	164.2	0	0	0	111.7	L712 V715 L731 M732 K737 C738 R739 A751 T754 F755 F758	L712-I735 HydrophobicContact CD2-CD1 4.26Å; L712-I735 HydrophobicContact CD2-CG1 3.88Å; V715-I735 HydrophobicContact CG1-CD1 4.29Å; L731-I735 HydrophobicContact CD1-CD1 3.84Å; L731-I735 HydrophobicContact CD1-CG1 4.3Å; L731-I735 HydrophobicContact CG-CD1 3.89Å; L731-I735 WeakPolarHBondContact O-CG1 3.2Å; L731-I735 PolarHBondContact O-N 2.78Å; M732-I735 PolarHBondContact O-N 3.2Å; I735-K737 PolarHBondContact O-N 3Å; I735-C738 PolarHBondContact O-N 3.22Å; I735-C738 VanDerWaalsContact O-N 3.13Å; I735-R739 WeakPolarHBondContact O-CG 3.29Å; I735-R739 PolarHBondContact O-N 3.15Å; I735-A751 HydrophobicContact CG2-CB 4.46Å; I735-T754 HydrophobicContact CD1-CG2 3.74Å; I735-F755 HydrophobicContact CG2-CB 4.27Å; I735-F758 HydrophobicContact CD1-CE2 3.51Å; I735-F758 HydrophobicContact CD1-CZ 3.78Å
736	K	91.9	Very high	93	Very high	56 Å²	56	56.5 Å²	56.5	24%	0.243	26%	0.263	C	S	.	.	H	α-helix	trans	-53.5	-39.1	169	-77.4	-174.5	178.2	-173.4	0	112	M732 D733 Y1148	M732-K736 WeakPolarHBondContact O-CG 3.28Å; M732-K736 PolarHBondContact O-N 2.91Å; D733-K736 PolarHBondContact O-N 3.18Å; K736-Y1148 VanDerWaalsContact CE-OH 3.28Å; K736-Y1148 WeakPolarHBondContact CE-OH 3.12Å; K736-Y1148 VanDerWaalsContact NZ-CD1 3.35Å
737	K	93.6	Very high	93.2	Very high	120 Å²	120	55.9 Å²	55.9	52%	0.522	26%	0.258	S	S	.	.	H	α-helix	trans	-74.2	-40.7	176.9	-67.6	162.7	-168.8	167.5	0	111.6	D733 C734 I735 R739 R740 Y741	D733-K737 WeakPolarHBondContact O-CD 3.36Å; D733-K737 WeakPolarHBondContact O-CG 3.4Å; D733-K737 PolarHBondContact O-N 3.27Å; D733-K737 VanDerWaalsContact O-N 3.1Å; D733-K737 VanDerWaalsContact OD1-CE 3.27Å; D733-K737 WeakPolarHBondContact OD1-CE 3.46Å; D733-K737 IonicContact OD1-NZ 2.74Å; D733-K737 WeakPolarHBondContact OD2-CE 3.27Å; D733-K737 IonicContact OD2-NZ 2.66Å; D733-K737 PolarHBondContact OD2-NZ 3.35Å; C734-K737 WeakPolarHBondContact O-CB 3.33Å; C734-K737 PolarHBondContact O-N 3.05Å; C734-K737 VanDerWaalsContact O-N 3.15Å; I735-K737 PolarHBondContact O-N 3Å; K737-R739 VanDerWaalsContact C-N 3.32Å; K737-R739 PolarHBondContact O-N 3.23Å; K737-R740 CarbonylContact O-C 3.58Å; K737-R740 PolarHBondContact O-N 2.92Å; K737-Y741 PolarHBondContact O-N 3.3Å
738	C	95.3	Very high	93.5	Very high	5 Å²	5	56.3 Å²	56.3	3%	0.034	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-36.2	176.5	-62.9	0	0	0	0	112.8	C734 I735 R740 Y741 V747 A751	C734-C738 PolarHBondContact O-N 2.94Å; C734-C738 PolarHBondContact O-SG 2.89Å; I735-C738 PolarHBondContact O-N 3.22Å; I735-C738 VanDerWaalsContact O-N 3.13Å; C738-R740 PolarHBondContact O-N 2.86Å; C738-Y741 WeakPolarHBondContact O-CB 3.49Å; C738-Y741 PolarHBondContact O-N 3.39Å; C738-V747 HydrophobicContact CB-CG1 4.47Å; C738-A751 HydrophobicContact CB-CB 3.42Å; C738-A751 VanDerWaalsContact CB-CB 3.42Å
739	R	95.9	Very high	93.7	Very high	58 Å²	58	62.6 Å²	62.6	22%	0.219	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-18.9	171.6	-71.3	177.7	73.7	-158.4	-3.2	114.4	I735 K737 R748 A751 Q752 F755	I735-R739 WeakPolarHBondContact O-CG 3.29Å; I735-R739 PolarHBondContact O-N 3.15Å; K737-R739 VanDerWaalsContact C-N 3.32Å; K737-R739 PolarHBondContact O-N 3.23Å; R739-R748 WeakPolarHBondContact O-CG 3.33Å; R739-A751 HydrophobicContact CG-CB 4.11Å; R739-Q752 VanDerWaalsContact CZ-OE1 3.24Å; R739-F755 HydrophobicContact CG-CB 4.49Å; R739-F755 VanDerWaalsContact NH1-CZ 3.29Å
740	R	92.5	Very high	94.1	Very high	180 Å²	180	58.9 Å²	58.9	68%	0.679	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	13.3	177	-66.6	-174.9	-73.2	-125	2.6	112.8	K737 C738	K737-R740 CarbonylContact O-C 3.58Å; K737-R740 PolarHBondContact O-N 2.92Å; C738-R740 PolarHBondContact O-N 2.86Å
741	Y	93.5	Very high	94.4	Very high	38 Å²	38	56.4 Å²	56.4	15%	0.149	26%	0.259	C	S	.	.			trans	-69.5	131.1	-177.9	-166.7	-108.7	0	0	0	111.6	L698 E703 F705 K737 C738 L743 V747 R748	L698-Y741 HydrophobicContact CB-CE2 4.42Å; L698-Y741 HydrophobicContact CD2-CE1 3.98Å; L698-Y741 HydrophobicContact CD2-CE2 4.38Å; E703-Y741 WeakPolarHBondContact CG-OH 3.36Å; F705-Y741 HydrophobicContact CD1-CE1 4.18Å; F705-Y741 AromaticContact CE1-CE1 3.77Å; F705-Y741 HydrophobicContact CE1-CE1 3.77Å; K737-Y741 PolarHBondContact O-N 3.3Å; C738-Y741 WeakPolarHBondContact O-CB 3.49Å; C738-Y741 PolarHBondContact O-N 3.39Å; Y741-L743 HydrophobicContact CD1-CB 4.46Å; Y741-L743 HydrophobicContact CE1-CB 3.76Å; Y741-V747 HydrophobicContact CD1-CB 4.23Å; Y741-V747 HydrophobicContact CD1-CG1 4.04Å; Y741-V747 HydrophobicContact CG-CG1 4.45Å; Y741-R748 VanDerWaalsContact O-CZ 3.29Å; Y741-R748 PolarHBondContact O-NE 3.2Å; Y741-R748 PolarHBondContact O-NH2 3.3Å
742	K	92.3	Very high	94.5	Very high	108 Å²	108	58.9 Å²	58.9	47%	0.47	27%	0.271	S	S	.	.	S	Bend	trans	-92.3	-33.1	-169.1	-64.6	-172.4	177.3	-173.7	0	114	S744 R748 E935	K742-S744 PolarHBondContact O-N 2.93Å; K742-R748 PolarHBondContact O-NH2 3.3Å; K742-E935 IonicContact NZ-OE1 3.21Å; K742-E935 PolarHBondContact NZ-OE1 2.89Å; K742-E935 IonicContact NZ-OE2 3.77Å; K742-E935 PolarHBondContact NZ-OE2 3.01Å
743	L	92.5	Very high	94.8	Very high	107 Å²	107	60.1 Å²	60.1	56%	0.56	28%	0.28	S	S	*	.	S	Bend	trans	-77	-21.3	-169	-62.8	169.8	0	0	0	114.4	E703 F705 Y741	E703-L743 HydrophobicContact CG-CD1 4.25Å; E703-L743 WeakPolarHBondContact OE1-CD1 3.35Å; F705-L743 HydrophobicContact CE1-CB 4.07Å; F705-L743 HydrophobicContact CZ-CB 3.94Å; Y741-L743 HydrophobicContact CD1-CB 4.46Å; Y741-L743 HydrophobicContact CE1-CB 3.76Å
744	S	95.1	Very high	95.1	Very high	12 Å²	12	57.5 Å²	57.5	8%	0.084	27%	0.266	C	S	.	.			trans	-137.3	137	173.7	169.3	0	0	0	0	110.6	K742 E746 V747	K742-S744 PolarHBondContact O-N 2.93Å; S744-E746 PolarHBondContact OG-N 3.14Å; S744-V747 PolarHBondContact OG-N 3.18Å
745	S	95.4	Very high	95.1	Very high	62 Å²	62	57.1 Å²	57.1	43%	0.434	26%	0.263	S	S	.	.	H	α-helix	trans	-76.3	-39.7	168.5	42.6	0	0	0	0	111.6	V747 R748 E749	S745-V747 PolarHBondContact O-N 2.83Å; S745-R748 CarbonylContact O-C 3.58Å; S745-R748 WeakPolarHBondContact O-CA 3.21Å; S745-R748 VanDerWaalsContact O-CB 3.23Å; S745-R748 WeakPolarHBondContact O-CB 3.5Å; S745-R748 PolarHBondContact O-N 2.87Å; S745-E749 PolarHBondContact O-N 3.04Å
746	E	95.9	Very high	95.1	Very high	114 Å²	114	61.7 Å²	61.7	53%	0.533	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-46.1	-178.9	-58.7	173.8	-178	0	0	111.6	V709 S744 R748 E749 A750	V709-E746 HydrophobicContact CG2-CB 3.91Å; S744-E746 PolarHBondContact OG-N 3.14Å; E746-R748 PolarHBondContact O-N 3.3Å; E746-E749 PolarHBondContact O-N 3.34Å; E746-A750 VanDerWaalsContact O-CB 3.27Å; E746-A750 WeakPolarHBondContact O-CB 3.38Å; E746-A750 PolarHBondContact O-N 3.49Å
747	V	96.7	Very high	95.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-35.9	174	174.2	0	0	0	0	111.2	L698 F705 A708 V709 L712 C738 Y741 S744 S745 A751	L698-V747 HydrophobicContact CD1-CG1 4.1Å; L698-V747 HydrophobicContact CD2-CG1 4.16Å; L698-V747 HydrophobicContact CD2-CG2 4.3Å; F705-V747 HydrophobicContact CB-CG2 4.02Å; F705-V747 HydrophobicContact CD1-CG2 4.13Å; F705-V747 HydrophobicContact CG-CG2 4.48Å; A708-V747 HydrophobicContact CB-CG2 3.96Å; V709-V747 HydrophobicContact CG2-CG2 4.04Å; L712-V747 HydrophobicContact CD1-CG1 4.31Å; C738-V747 HydrophobicContact CB-CG1 4.47Å; Y741-V747 HydrophobicContact CD1-CB 4.23Å; Y741-V747 HydrophobicContact CD1-CG1 4.04Å; Y741-V747 HydrophobicContact CG-CG1 4.45Å; S744-V747 PolarHBondContact OG-N 3.18Å; S745-V747 PolarHBondContact O-N 2.83Å; V747-A751 WeakPolarHBondContact O-CB 3.29Å; V747-A751 PolarHBondContact O-N 3.08Å
748	R	96.7	Very high	95.1	Very high	95 Å²	95	56 Å²	56	36%	0.358	26%	0.26	S	S	.	.	H	α-helix	trans	-70.7	-40.8	179.5	-159.8	-170.3	-55.9	135.9	10.8	111.9	R739 Y741 K742 S745 E746 A751 Q752	R739-R748 WeakPolarHBondContact O-CG 3.33Å; Y741-R748 VanDerWaalsContact O-CZ 3.29Å; Y741-R748 PolarHBondContact O-NE 3.2Å; Y741-R748 PolarHBondContact O-NH2 3.3Å; K742-R748 PolarHBondContact O-NH2 3.3Å; S745-R748 CarbonylContact O-C 3.58Å; S745-R748 WeakPolarHBondContact O-CA 3.21Å; S745-R748 VanDerWaalsContact O-CB 3.23Å; S745-R748 WeakPolarHBondContact O-CB 3.5Å; S745-R748 PolarHBondContact O-N 2.87Å; E746-R748 PolarHBondContact O-N 3.3Å; R748-A751 PolarHBondContact O-N 2.94Å; R748-Q752 WeakPolarHBondContact O-CB 3.33Å; R748-Q752 PolarHBondContact O-N 2.98Å
749	E	96.7	Very high	94.9	Very high	132 Å²	132	58 Å²	58	62%	0.617	27%	0.268	S	S	*	.	H	α-helix	trans	-74.8	-39.7	179	-71.4	174.3	-162.1	0	0	111.9	S745 E746 A751 Q752 T753	S745-E749 PolarHBondContact O-N 3.04Å; E746-E749 PolarHBondContact O-N 3.34Å; E749-A751 VanDerWaalsContact C-N 3.32Å; E749-A751 PolarHBondContact O-N 2.98Å; E749-Q752 PolarHBondContact O-N 3.44Å; E749-T753 WeakPolarHBondContact O-CG2 3.42Å; E749-T753 PolarHBondContact O-N 3.41Å; E749-T753 PolarHBondContact O-OG1 2.89Å
750	A	97	Very high	94.6	Very high	7 Å²	7	57.9 Å²	57.9	6%	0.058	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-39.8	169.2	0	0	0	0	0	111.7	V709 L712 E746 T753 T754	V709-A750 HydrophobicContact CG1-CB 4.25Å; V709-A750 HydrophobicContact CG2-CB 4.18Å; L712-A750 HydrophobicContact CB-CB 3.93Å; L712-A750 HydrophobicContact CD1-CB 3.7Å; L712-A750 HydrophobicContact CG-CB 4.45Å; E746-A750 VanDerWaalsContact O-CB 3.27Å; E746-A750 WeakPolarHBondContact O-CB 3.38Å; E746-A750 PolarHBondContact O-N 3.49Å; A750-T753 WeakPolarHBondContact CA-OG1 3.34Å; A750-T753 PolarHBondContact O-OG1 3.49Å; A750-T753 VanDerWaalsContact O-OG1 3.09Å; A750-T754 WeakPolarHBondContact O-CB 3.44Å; A750-T754 PolarHBondContact O-N 2.83Å; A750-T754 PolarHBondContact O-OG1 3.3Å
751	A	97.4	Very high	94.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-70.1	-38	175	0	0	0	0	0	112.8	L712 I735 C738 R739 V747 R748 E749 T754 F755	L712-A751 HydrophobicContact CD1-CB 4.21Å; L712-A751 HydrophobicContact CD2-CB 4.4Å; I735-A751 HydrophobicContact CG2-CB 4.46Å; C738-A751 HydrophobicContact CB-CB 3.42Å; C738-A751 VanDerWaalsContact CB-CB 3.42Å; R739-A751 HydrophobicContact CG-CB 4.11Å; V747-A751 WeakPolarHBondContact O-CB 3.29Å; V747-A751 PolarHBondContact O-N 3.08Å; R748-A751 PolarHBondContact O-N 2.94Å; E749-A751 VanDerWaalsContact C-N 3.32Å; E749-A751 PolarHBondContact O-N 2.98Å; A751-T754 PolarHBondContact O-N 3.03Å; A751-F755 WeakPolarHBondContact O-CB 3.4Å; A751-F755 PolarHBondContact O-N 3.49Å
752	Q	96.5	Very high	94.2	Very high	52 Å²	52	49.3 Å²	49.3	24%	0.243	25%	0.247	C	C	.	.	H	α-helix	trans	-65.4	-42.5	176.1	178.2	60.5	40.4	0	0	111.8	R739 R748 E749 F755 Q756	R739-Q752 VanDerWaalsContact CZ-OE1 3.24Å; R748-Q752 WeakPolarHBondContact O-CB 3.33Å; R748-Q752 PolarHBondContact O-N 2.98Å; E749-Q752 PolarHBondContact O-N 3.44Å; Q752-F755 PolarHBondContact O-N 3.19Å; Q752-Q756 WeakPolarHBondContact O-CG 3.22Å; Q752-Q756 PolarHBondContact O-N 2.87Å
753	T	96.5	Very high	94.1	Very high	50 Å²	50	48.5 Å²	48.5	31%	0.307	26%	0.26	S	S	.	.	H	α-helix	trans	-71.2	-33.1	176.2	50.3	0	0	0	0	112.6	E749 A750 Q756 F757	E749-T753 WeakPolarHBondContact O-CG2 3.42Å; E749-T753 PolarHBondContact O-N 3.41Å; E749-T753 PolarHBondContact O-OG1 2.89Å; A750-T753 WeakPolarHBondContact CA-OG1 3.34Å; A750-T753 PolarHBondContact O-OG1 3.49Å; A750-T753 VanDerWaalsContact O-OG1 3.09Å; T753-Q756 PolarHBondContact O-N 3.04Å; T753-F757 PolarHBondContact O-N 3.17Å
754	T	96.2	Very high	93.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-37.9	171.8	-53.5	0	0	0	0	111.8	L712 V715 R716 I735 A750 A751 F757 F758	L712-T754 PolarHBondContact O-OG1 3.08Å; V715-T754 HydrophobicContact CB-CG2 4.34Å; V715-T754 HydrophobicContact CG1-CG2 3.71Å; R716-T754 HydrophobicContact CG-CG2 3.91Å; I735-T754 HydrophobicContact CD1-CG2 3.74Å; A750-T754 WeakPolarHBondContact O-CB 3.44Å; A750-T754 PolarHBondContact O-N 2.83Å; A750-T754 PolarHBondContact O-OG1 3.3Å; A751-T754 PolarHBondContact O-N 3.03Å; T754-F757 WeakPolarHBondContact O-CB 3.41Å; T754-F757 PolarHBondContact O-N 3.38Å; T754-F758 HydrophobicContact CG2-CE1 4.21Å; T754-F758 HydrophobicContact CG2-CE2 4.28Å; T754-F758 HydrophobicContact CG2-CZ 3.95Å; T754-F758 WeakPolarHBondContact O-CG 3.49Å; T754-F758 PolarHBondContact O-N 3.39Å; T754-F758 VanDerWaalsContact O-N 3.09Å
755	F	94.9	Very high	93.4	Very high	3 Å²	3	49.4 Å²	49.4	1%	0.013	27%	0.265	C	S	.	.	H	α-helix	trans	-65.9	-39	172.9	-172.3	-92.8	0	0	0	112.6	M732 I735 R739 A751 Q752 F758 Q759 L1147 Y1148	M732-F755 HydrophobicContact SD-CE2 4.48Å; I735-F755 HydrophobicContact CG2-CB 4.27Å; R739-F755 HydrophobicContact CG-CB 4.49Å; R739-F755 VanDerWaalsContact NH1-CZ 3.29Å; A751-F755 WeakPolarHBondContact O-CB 3.4Å; A751-F755 PolarHBondContact O-N 3.49Å; Q752-F755 PolarHBondContact O-N 3.19Å; F755-F758 WeakPolarHBondContact O-CB 3.5Å; F755-F758 PolarHBondContact O-N 2.96Å; F755-Q759 HydrophobicContact CD1-CG 4.07Å; F755-Q759 HydrophobicContact CE1-CG 3.87Å; F755-Q759 WeakPolarHBondContact O-CG 3.44Å; F755-Q759 PolarHBondContact O-N 2.81Å; F755-L1147 HydrophobicContact CZ-CD2 4.24Å; F755-Y1148 AromaticContact CE2-CE2 3.95Å; F755-Y1148 HydrophobicContact CE2-CE2 3.95Å; F755-Y1148 HydrophobicContact CZ-CD2 4.42Å; F755-Y1148 AromaticContact CZ-CE2 3.96Å; F755-Y1148 HydrophobicContact CZ-CE2 3.96Å
756	Q	93.9	Very high	93.2	Very high	96 Å²	96	50.2 Å²	50.2	45%	0.449	27%	0.267	S	S	.	.	H	α-helix	trans	-64.9	-36.8	174.1	-75.5	170.2	-21.7	0	0	112.6	Q752 T753 Q759 S760	Q752-Q756 WeakPolarHBondContact O-CG 3.22Å; Q752-Q756 PolarHBondContact O-N 2.87Å; T753-Q756 PolarHBondContact O-N 3.04Å; Q756-Q759 WeakPolarHBondContact O-CB 3.44Å; Q756-Q759 PolarHBondContact O-N 3.26Å; Q756-S760 PolarHBondContact O-N 2.94Å
757	F	93.3	Very high	92.9	Very high	55 Å²	55	53.9 Å²	53.9	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-59.3	-46.1	170	170.1	-115.3	0	0	0	111.2	R716 T753 T754 Q759 S760 L761	R716-F757 HydrophobicContact CB-CD1 4.36Å; R716-F757 HydrophobicContact CG-CB 4.3Å; R716-F757 HydrophobicContact CG-CD1 4.05Å; R716-F757 HydrophobicContact CG-CG 4.32Å; T753-F757 PolarHBondContact O-N 3.17Å; T754-F757 WeakPolarHBondContact O-CB 3.41Å; T754-F757 PolarHBondContact O-N 3.38Å; F757-Q759 PolarHBondContact O-N 2.72Å; F757-S760 PolarHBondContact O-N 3.2Å; F757-S760 VanDerWaalsContact O-N 3.09Å; F757-S760 PolarHBondContact O-OG 3.04Å; F757-L761 HydrophobicContact CD1-CD1 4.29Å; F757-L761 HydrophobicContact CE1-CD1 3.77Å; F757-L761 HydrophobicContact CE2-CD1 4.3Å; F757-L761 HydrophobicContact CE2-CD2 4.3Å; F757-L761 HydrophobicContact CE2-CG 4.23Å; F757-L761 HydrophobicContact CZ-CD1 3.78Å; F757-L761 HydrophobicContact CZ-CD2 4.35Å; F757-L761 HydrophobicContact CZ-CG 4.21Å; F757-L761 PolarHBondContact O-N 3.29Å
758	F	93.4	Very high	92.5	Very high	3 Å²	3	61.6 Å²	61.6	1%	0.013	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-37.3	174.4	-61.7	-17.2	0	0	0	113.4	V715 L725 M732 I735 T754 F755 S760 L761 Q762	V715-F758 HydrophobicContact CG1-CE1 3.95Å; V715-F758 HydrophobicContact CG1-CZ 3.62Å; L725-F758 HydrophobicContact CD1-CD1 4.27Å; L725-F758 HydrophobicContact CD1-CD2 4.46Å; L725-F758 HydrophobicContact CD1-CE1 3.81Å; L725-F758 HydrophobicContact CD1-CE2 3.99Å; L725-F758 HydrophobicContact CD1-CZ 3.64Å; L725-F758 HydrophobicContact CD2-CB 4Å; L725-F758 HydrophobicContact CD2-CD1 3.57Å; L725-F758 HydrophobicContact CD2-CD2 4.14Å; L725-F758 HydrophobicContact CD2-CE1 3.98Å; L725-F758 HydrophobicContact CD2-CE2 4.47Å; L725-F758 HydrophobicContact CD2-CG 3.66Å; L725-F758 HydrophobicContact CD2-CZ 4.4Å; M732-F758 HydrophobicContact CE-CB 4.1Å; M732-F758 HydrophobicContact CE-CD2 3.42Å; M732-F758 VanDerWaalsContact CE-CD2 3.42Å; M732-F758 HydrophobicContact CE-CE2 3.98Å; M732-F758 HydrophobicContact CE-CG 4Å; M732-F758 HydrophobicContact SD-CD2 3.65Å; M732-F758 HydrophobicContact SD-CE2 4.14Å; I735-F758 HydrophobicContact CD1-CE2 3.51Å; I735-F758 HydrophobicContact CD1-CZ 3.78Å; T754-F758 HydrophobicContact CG2-CE1 4.21Å; T754-F758 HydrophobicContact CG2-CE2 4.28Å; T754-F758 HydrophobicContact CG2-CZ 3.95Å; T754-F758 WeakPolarHBondContact O-CG 3.49Å; T754-F758 PolarHBondContact O-N 3.39Å; T754-F758 VanDerWaalsContact O-N 3.09Å; F755-F758 WeakPolarHBondContact O-CB 3.5Å; F755-F758 PolarHBondContact O-N 2.96Å; F758-S760 VanDerWaalsContact C-N 3.28Å; F758-S760 PolarHBondContact O-N 3.44Å; F758-L761 HydrophobicContact CD1-CD1 4.34Å; F758-L761 PolarHBondContact O-N 3.15Å; F758-Q762 PolarHBondContact O-N 3.17Å
759	Q	90.5	Very high	92.2	Very high	45 Å²	45	58.9 Å²	58.9	21%	0.21	31%	0.309	C	S	.	.	H	α-helix	trans	-59.1	-40.7	171.8	-70.4	177.8	-64.1	0	0	111.4	F755 Q756 F757 Q762 A763 L1147	F755-Q759 HydrophobicContact CD1-CG 4.07Å; F755-Q759 HydrophobicContact CE1-CG 3.87Å; F755-Q759 WeakPolarHBondContact O-CG 3.44Å; F755-Q759 PolarHBondContact O-N 2.81Å; Q756-Q759 WeakPolarHBondContact O-CB 3.44Å; Q756-Q759 PolarHBondContact O-N 3.26Å; F757-Q759 PolarHBondContact O-N 2.72Å; Q759-Q762 PolarHBondContact O-N 3.11Å; Q759-A763 PolarHBondContact O-N 2.97Å; Q759-L1147 HydrophobicContact CB-CD1 4.18Å; Q759-L1147 HydrophobicContact CG-CB 4.41Å; Q759-L1147 HydrophobicContact CG-CD1 3.98Å; Q759-L1147 HydrophobicContact CG-CD2 3.85Å; Q759-L1147 HydrophobicContact CG-CG 4.3Å
760	S	90.3	Very high	91.9	Very high	57 Å²	57	54.4 Å²	54.4	40%	0.399	29%	0.289	S	S	.	.	H	α-helix	trans	-68	-34	176.6	75.5	0	0	0	0	113.7	Q756 F757 F758 Q762 A763 N764	Q756-S760 PolarHBondContact O-N 2.94Å; F757-S760 PolarHBondContact O-N 3.2Å; F757-S760 VanDerWaalsContact O-N 3.09Å; F757-S760 PolarHBondContact O-OG 3.04Å; F758-S760 VanDerWaalsContact C-N 3.28Å; F758-S760 PolarHBondContact O-N 3.44Å; S760-Q762 VanDerWaalsContact C-N 3.3Å; S760-Q762 PolarHBondContact O-N 2.89Å; S760-A763 PolarHBondContact O-N 3.05Å; S760-N764 PolarHBondContact O-N 3.03Å; S760-N764 PolarHBondContact O-ND2 3.03Å; S760-N764 PolarHBondContact O-OD1 3.1Å
761	L	89.9	Confident	91.6	Very high	21 Å²	21	57.4 Å²	57.4	11%	0.11	31%	0.31	C	S	.	.	H	α-helix	trans	-69	-23.2	174.7	-70.1	178.5	0	0	0	113.8	F757 F758 N764	F757-L761 HydrophobicContact CD1-CD1 4.29Å; F757-L761 HydrophobicContact CE1-CD1 3.77Å; F757-L761 HydrophobicContact CE2-CD1 4.3Å; F757-L761 HydrophobicContact CE2-CD2 4.3Å; F757-L761 HydrophobicContact CE2-CG 4.23Å; F757-L761 HydrophobicContact CZ-CD1 3.78Å; F757-L761 HydrophobicContact CZ-CD2 4.35Å; F757-L761 HydrophobicContact CZ-CG 4.21Å; F757-L761 PolarHBondContact O-N 3.29Å; F758-L761 HydrophobicContact CD1-CD1 4.34Å; F758-L761 PolarHBondContact O-N 3.15Å; L761-N764 WeakPolarHBondContact CA-OD1 3.26Å; L761-N764 PolarHBondContact O-OD1 3.08Å
762	Q	88.1	Confident	91.3	Very high	17 Å²	17	63 Å²	63	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-87.9	-30.5	172.4	-171.1	167.3	-37.4	0	0	111.9	L722 F758 Q759 S760 N764 L1147	L722-Q762 HydrophobicContact CD1-CB 4.14Å; L722-Q762 HydrophobicContact CD1-CG 4.5Å; L722-Q762 HydrophobicContact CD2-CB 4.31Å; L722-Q762 HydrophobicContact CD2-CG 3.96Å; F758-Q762 PolarHBondContact O-N 3.17Å; Q759-Q762 PolarHBondContact O-N 3.11Å; S760-Q762 VanDerWaalsContact C-N 3.3Å; S760-Q762 PolarHBondContact O-N 2.89Å; Q762-N764 VanDerWaalsContact C-N 3.26Å; Q762-N764 PolarHBondContact O-N 2.87Å; Q762-L1147 HydrophobicContact CB-CD1 3.59Å; Q762-L1147 HydrophobicContact CG-CD1 3.87Å; Q762-L1147 PolarHBondContact NE2-O 2.86Å; Q762-L1147 VanDerWaalsContact OE1-CG 3.26Å
763	A	88.6	Confident	91	Very high	90 Å²	90	60.5 Å²	60.5	74%	0.744	32%	0.322	S	S	*	.	H	α-helix	trans	-71.1	-18.4	176	0	0	0	0	0	113.7	Q759 S760	Q759-A763 PolarHBondContact O-N 2.97Å; S760-A763 PolarHBondContact O-N 3.05Å
764	N	87.3	Confident	90.7	Very high	114 Å²	114	60.8 Å²	60.8	61%	0.61	32%	0.32	S	S	*	.	S	Bend	trans	-113	-3.2	-178	72.9	8.8	0	0	0	115.4	S760 L761 Q762	S760-N764 PolarHBondContact O-N 3.03Å; S760-N764 PolarHBondContact O-ND2 3.03Å; S760-N764 PolarHBondContact O-OD1 3.1Å; L761-N764 WeakPolarHBondContact CA-OD1 3.26Å; L761-N764 PolarHBondContact O-OD1 3.08Å; Q762-N764 VanDerWaalsContact C-N 3.26Å; Q762-N764 PolarHBondContact O-N 2.87Å
765	T	86	Confident	90.4	Very high	25 Å²	25	63.7 Å²	63.7	15%	0.153	34%	0.344	C	S	.	.	S	Bend	trans	-75.5	162.3	179.7	-162.2	0	0	0	0	112	L722 E769 L770	L722-T765 HydrophobicContact CB-CG2 4.37Å; L722-T765 HydrophobicContact CD2-CG2 3.69Å; T765-E769 WeakPolarHBondContact OG1-CB 3.47Å; T765-E769 PolarHBondContact OG1-OE2 3.44Å; T765-L770 HydrophobicContact CG2-CB 3.98Å
766	T	91	Very high	90.2	Very high	78 Å²	78	66.1 Å²	66.1	48%	0.479	36%	0.357	S	S	.	.			trans	-78	157.8	174.3	77.3	0	0	0	0	111.4	E768 E769 L770	T766-E768 PolarHBondContact O-N 3.08Å; T766-E768 PolarHBondContact OG1-N 2.9Å; T766-E769 PolarHBondContact O-N 2.97Å; T766-E769 VanDerWaalsContact O-N 3.17Å; T766-E769 PolarHBondContact OG1-N 2.83Å; T766-E769 VanDerWaalsContact OG1-N 3.16Å; T766-L770 PolarHBondContact O-N 2.85Å
767	K	89.2	Confident	89.9	Confident	191 Å²	191	62.5 Å²	62.5	83%	0.83	34%	0.341	S	S	*	.	H	α-helix	trans	-57.9	-31.2	175.1	-174.2	178.6	177.6	-176.6	0	112.7	S771	K767-S771 WeakPolarHBondContact O-CB 3.35Å; K767-S771 PolarHBondContact O-N 2.79Å
768	E	89.7	Confident	89.6	Confident	162 Å²	162	61.7 Å²	61.7	76%	0.757	34%	0.344	S	S	*	.	H	α-helix	trans	-70.6	-46.2	176.4	-173	-174.1	159.7	0	0	111.6	T766 L770 S771 K772	T766-E768 PolarHBondContact O-N 3.08Å; T766-E768 PolarHBondContact OG1-N 2.9Å; E768-L770 VanDerWaalsContact C-N 3.34Å; E768-L770 PolarHBondContact O-N 3.13Å; E768-S771 PolarHBondContact O-N 2.84Å; E768-K772 PolarHBondContact O-N 3.31Å
769	E	90.6	Very high	89.3	Confident	39 Å²	39	65.2 Å²	65.2	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-64.4	-37.7	175.6	-74.3	-169	135.7	0	0	112.5	R721 P723 T765 T766 K772 A773	R721-E769 WeakPolarHBondContact CD-OE1 3.37Å; R721-E769 IonicContact CZ-OE1 3.81Å; R721-E769 IonicContact NE-OE1 2.72Å; R721-E769 IonicContact NH1-OE1 3.39Å; R721-E769 PolarHBondContact NH1-OE1 2.97Å; P723-E769 HydrophobicContact CG-CB 4.11Å; P723-E769 HydrophobicContact CG-CG 4.31Å; T765-E769 WeakPolarHBondContact OG1-CB 3.47Å; T765-E769 PolarHBondContact OG1-OE2 3.44Å; T766-E769 PolarHBondContact O-N 2.97Å; T766-E769 VanDerWaalsContact O-N 3.17Å; T766-E769 PolarHBondContact OG1-N 2.83Å; T766-E769 VanDerWaalsContact OG1-N 3.16Å; E769-K772 PolarHBondContact O-N 3.36Å; E769-A773 WeakPolarHBondContact O-CB 3.39Å; E769-A773 PolarHBondContact O-N 2.97Å
770	L	89.9	Confident	89.1	Confident	37 Å²	37	65.3 Å²	65.3	19%	0.194	37%	0.369	C	S	.	.	H	α-helix	trans	-61.6	-47.8	173	-166.8	158.5	0	0	0	111	T765 T766 E768 K772 A773 Q774 L1151	T765-L770 HydrophobicContact CG2-CB 3.98Å; T766-L770 PolarHBondContact O-N 2.85Å; E768-L770 VanDerWaalsContact C-N 3.34Å; E768-L770 PolarHBondContact O-N 3.13Å; L770-K772 VanDerWaalsContact C-N 3.33Å; L770-K772 PolarHBondContact O-N 3.01Å; L770-A773 PolarHBondContact O-N 2.74Å; L770-Q774 WeakPolarHBondContact O-CB 3.41Å; L770-Q774 PolarHBondContact O-N 3.33Å; L770-L1151 HydrophobicContact CD2-CD2 3.74Å; L770-L1151 HydrophobicContact CG-CD2 4.06Å
771	S	89.9	Confident	88.8	Confident	70 Å²	70	64.9 Å²	64.9	49%	0.49	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-39.4	176.3	-175.3	0	0	0	0	112.2	K767 E768 Q774 A775	K767-S771 WeakPolarHBondContact O-CB 3.35Å; K767-S771 PolarHBondContact O-N 2.79Å; E768-S771 PolarHBondContact O-N 2.84Å; S771-Q774 PolarHBondContact O-N 3.16Å; S771-A775 WeakPolarHBondContact O-CB 3.42Å; S771-A775 PolarHBondContact O-N 2.72Å
772	K	90.9	Very high	88.7	Confident	117 Å²	117	69.2 Å²	69.2	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-64	-42.5	173.8	-174.5	176.5	178.6	-179.4	0	112	P723 E768 E769 L770 A775 L776	P723-K772 HydrophobicContact CB-CD 4.16Å; P723-K772 HydrophobicContact CB-CG 4.32Å; P723-K772 HydrophobicContact CG-CB 4.39Å; P723-K772 HydrophobicContact CG-CD 4.26Å; P723-K772 HydrophobicContact CG-CG 4.44Å; E768-K772 PolarHBondContact O-N 3.31Å; E769-K772 PolarHBondContact O-N 3.36Å; L770-K772 VanDerWaalsContact C-N 3.33Å; L770-K772 PolarHBondContact O-N 3.01Å; K772-A775 PolarHBondContact O-N 2.97Å; K772-L776 HydrophobicContact CG-CD1 4.2Å; K772-L776 WeakPolarHBondContact O-CD1 3.24Å; K772-L776 WeakPolarHBondContact O-CG 3.42Å; K772-L776 PolarHBondContact O-N 2.66Å
773	A	91.3	Very high	88.5	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-62.8	-46.1	176.4	0	0	0	0	0	111.8	L722 A726 E769 L770 A775 L776 I777	L722-A773 HydrophobicContact CD2-CB 3.89Å; L722-A773 HydrophobicContact CG-CB 3.83Å; A726-A773 HydrophobicContact CB-CB 3.9Å; E769-A773 WeakPolarHBondContact O-CB 3.39Å; E769-A773 PolarHBondContact O-N 2.97Å; L770-A773 PolarHBondContact O-N 2.74Å; A773-A775 PolarHBondContact O-N 3.34Å; A773-L776 PolarHBondContact O-N 2.74Å; A773-I777 WeakPolarHBondContact O-CD1 3.46Å; A773-I777 VanDerWaalsContact O-CG1 3.28Å; A773-I777 WeakPolarHBondContact O-CG1 3.41Å; A773-I777 PolarHBondContact O-N 3.16Å
774	Q	90.1	Very high	88.2	Confident	56 Å²	56	75 Å²	75	26%	0.262	39%	0.39	S	S	.	.	H	α-helix	trans	-59	-44.3	175.3	-166.6	-178.9	12.2	0	0	111.6	L770 S771 L776 I777 A778 L1151 D1152	L770-Q774 WeakPolarHBondContact O-CB 3.41Å; L770-Q774 PolarHBondContact O-N 3.33Å; S771-Q774 PolarHBondContact O-N 3.16Å; Q774-L776 PolarHBondContact O-N 3.46Å; Q774-I777 PolarHBondContact O-N 2.92Å; Q774-A778 WeakPolarHBondContact O-CB 3.46Å; Q774-A778 PolarHBondContact O-N 2.92Å; Q774-L1151 HydrophobicContact CB-CD2 3.91Å; Q774-L1151 HydrophobicContact CG-CD2 4.36Å; Q774-D1152 PolarHBondContact NE2-OD2 3.12Å
775	A	90.5	Very high	87.7	Confident	61 Å²	61	74.6 Å²	74.6	50%	0.504	38%	0.384	S	S	.	.	H	α-helix	trans	-63.5	-38.3	177.2	0	0	0	0	0	113.3	S771 K772 A773 S779	S771-A775 WeakPolarHBondContact O-CB 3.42Å; S771-A775 PolarHBondContact O-N 2.72Å; K772-A775 PolarHBondContact O-N 2.97Å; A773-A775 PolarHBondContact O-N 3.34Å; A775-S779 VanDerWaalsContact O-CB 3.32Å; A775-S779 WeakPolarHBondContact O-CB 3.44Å; A775-S779 PolarHBondContact O-N 2.83Å
776	L	89.6	Confident	87.3	Confident	54 Å²	54	77 Å²	77	28%	0.283	40%	0.402	S	S	.	.	H	α-helix	trans	-63.7	-41.4	174.1	-75	161	0	0	0	111.8	P723 A726 E727 K772 A773 Q774 S779 H780	P723-L776 HydrophobicContact CB-CD1 4.08Å; A726-L776 HydrophobicContact CB-CB 4.29Å; A726-L776 HydrophobicContact CB-CD1 4.35Å; E727-L776 HydrophobicContact CG-CD1 4.01Å; E727-L776 HydrophobicContact CG-CD2 4.11Å; K772-L776 HydrophobicContact CG-CD1 4.2Å; K772-L776 WeakPolarHBondContact O-CD1 3.24Å; K772-L776 WeakPolarHBondContact O-CG 3.42Å; K772-L776 PolarHBondContact O-N 2.66Å; A773-L776 PolarHBondContact O-N 2.74Å; Q774-L776 PolarHBondContact O-N 3.46Å; L776-S779 WeakPolarHBondContact O-CB 3.42Å; L776-S779 PolarHBondContact O-N 2.87Å; L776-H780 PolarHBondContact O-N 2.74Å
777	I	87	Confident	86.6	Confident	21 Å²	21	78 Å²	78	11%	0.108	40%	0.403	C	S	.	.	H	α-helix	trans	-72.7	-42	-178.8	-62.6	160.1	0	0	0	111	A726 A773 Q774 S779 H780 Q781 L1151 I1153	A726-I777 HydrophobicContact CB-CD1 3.95Å; A726-I777 HydrophobicContact CB-CG1 3.95Å; A773-I777 WeakPolarHBondContact O-CD1 3.46Å; A773-I777 VanDerWaalsContact O-CG1 3.28Å; A773-I777 WeakPolarHBondContact O-CG1 3.41Å; A773-I777 PolarHBondContact O-N 3.16Å; Q774-I777 PolarHBondContact O-N 2.92Å; I777-S779 VanDerWaalsContact C-N 3.31Å; I777-S779 PolarHBondContact O-N 3.22Å; I777-H780 CarbonylContact O-C 3.34Å; I777-H780 WeakPolarHBondContact O-CA 3.42Å; I777-H780 WeakPolarHBondContact O-CB 3.26Å; I777-H780 PolarHBondContact O-N 3.46Å; I777-Q781 PolarHBondContact O-N 3.46Å; I777-L1151 HydrophobicContact CD1-CD1 4.43Å; I777-I1153 HydrophobicContact CD1-CD1 3.64Å; I777-I1153 HydrophobicContact CD1-CG1 4.36Å; I777-I1153 HydrophobicContact CG2-CB 4.3Å; I777-I1153 HydrophobicContact CG2-CD1 4.08Å; I777-I1153 HydrophobicContact CG2-CG1 3.83Å; I777-I1153 HydrophobicContact CG2-CG2 3.63Å
778	A	88.8	Confident	85.8	Confident	37 Å²	37	74.3 Å²	74.3	31%	0.306	39%	0.389	S	S	.	.	H	α-helix	trans	-61.3	-39.3	172	0	0	0	0	0	111.8	Q774 H780 Q781 N782	Q774-A778 WeakPolarHBondContact O-CB 3.46Å; Q774-A778 PolarHBondContact O-N 2.92Å; A778-H780 VanDerWaalsContact C-N 3.28Å; A778-H780 PolarHBondContact O-N 3.33Å; A778-Q781 PolarHBondContact O-N 2.91Å; A778-N782 WeakPolarHBondContact O-CB 3.32Å; A778-N782 VanDerWaalsContact O-CG 3.3Å; A778-N782 PolarHBondContact O-N 2.94Å; A778-N782 PolarHBondContact O-ND2 3.31Å
779	S	86.8	Confident	84.9	Confident	77 Å²	77	71.6 Å²	71.6	54%	0.538	38%	0.38	S	S	.	.	H	α-helix	trans	-59.7	-39.7	171.6	-169.1	0	0	0	0	111.7	A775 L776 I777 R783	A775-S779 VanDerWaalsContact O-CB 3.32Å; A775-S779 WeakPolarHBondContact O-CB 3.44Å; A775-S779 PolarHBondContact O-N 2.83Å; L776-S779 WeakPolarHBondContact O-CB 3.42Å; L776-S779 PolarHBondContact O-N 2.87Å; I777-S779 VanDerWaalsContact C-N 3.31Å; I777-S779 PolarHBondContact O-N 3.22Å; S779-R783 PolarHBondContact O-N 2.72Å
780	H	84.9	Confident	83.7	Confident	47 Å²	47	72.1 Å²	72.1	22%	0.218	39%	0.387	C	S	.	.	H	α-helix	trans	-67.3	-49.1	175.1	-159.2	102.8	0	0	0	112.6	W729 L776 I777 A778 N782 R783 I784	W729-H780 AromaticContact CD1-CE1 3.74Å; W729-H780 AromaticContact CD1-ND1 3.63Å; W729-H780 AromaticContact CD2-CD2 3.98Å; W729-H780 AromaticContact CD2-CE1 3.67Å; W729-H780 AromaticContact CD2-ND1 3.87Å; W729-H780 AromaticContact CD2-NE2 3.77Å; W729-H780 AromaticContact CE2-CE1 3.15Å; W729-H780 AromaticContact CE2-ND1 3.76Å; W729-H780 AromaticContact CE2-NE2 3.41Å; W729-H780 AromaticContact CG-ND1 3.87Å; W729-H780 AromaticContact CH2-NE2 3.69Å; W729-H780 AromaticContact CZ2-CE1 3.51Å; W729-H780 AromaticContact CZ2-NE2 3.39Å; W729-H780 WeakPolarHBondContact CZ2-NE2 3.46Å; W729-H780 AromaticContact NE1-CE1 3.2Å; W729-H780 PolarHBondContact NE1-CE1 3Å; W729-H780 AromaticContact NE1-ND1 3.6Å; W729-H780 AromaticContact NE1-NE2 3.95Å; L776-H780 PolarHBondContact O-N 2.74Å; I777-H780 CarbonylContact O-C 3.34Å; I777-H780 WeakPolarHBondContact O-CA 3.42Å; I777-H780 WeakPolarHBondContact O-CB 3.26Å; I777-H780 PolarHBondContact O-N 3.46Å; A778-H780 VanDerWaalsContact C-N 3.28Å; A778-H780 PolarHBondContact O-N 3.33Å; H780-N782 VanDerWaalsContact C-N 3.26Å; H780-N782 PolarHBondContact O-N 3.13Å; H780-R783 WeakPolarHBondContact O-CB 3.49Å; H780-R783 PolarHBondContact O-N 2.94Å; H780-I784 VanDerWaalsContact CD2-CD1 3.49Å; H780-I784 WeakPolarHBondContact CD2-CD1 3.32Å; H780-I784 PolarHBondContact O-N 3.35Å
781	Q	85.7	Confident	82.6	Confident	48 Å²	48	74.6 Å²	74.6	22%	0.224	40%	0.404	C	S	.	.	H	α-helix	trans	-55.1	-43.7	175.9	-77	165.5	-43	0	0	110.8	I777 A778 R783 I784 H785 D1152 C1154	I777-Q781 PolarHBondContact O-N 3.46Å; A778-Q781 PolarHBondContact O-N 2.91Å; Q781-R783 PolarHBondContact O-N 2.79Å; Q781-I784 PolarHBondContact O-N 3.32Å; Q781-H785 PolarHBondContact O-N 2.87Å; Q781-H785 PolarHBondContact O-ND1 2.9Å; Q781-D1152 PolarHBondContact NE2-O 2.87Å; Q781-C1154 PolarHBondContact NE2-O 3.44Å
782	N	86.2	Confident	80.9	Confident	112 Å²	112	77.5 Å²	77.5	60%	0.599	41%	0.411	S	S	*	.	H	α-helix	trans	-63.4	-37.6	176.1	-75.1	-42.8	0	0	0	113	A778 H780 H785 S786	A778-N782 WeakPolarHBondContact O-CB 3.32Å; A778-N782 VanDerWaalsContact O-CG 3.3Å; A778-N782 PolarHBondContact O-N 2.94Å; A778-N782 PolarHBondContact O-ND2 3.31Å; H780-N782 VanDerWaalsContact C-N 3.26Å; H780-N782 PolarHBondContact O-N 3.13Å; N782-H785 PolarHBondContact O-N 2.95Å; N782-S786 VanDerWaalsContact O-CB 3.32Å; N782-S786 WeakPolarHBondContact O-CB 3.28Å; N782-S786 PolarHBondContact O-N 3.43Å
783	R	85.7	Confident	78.8	Confident	172 Å²	172	76.8 Å²	76.8	65%	0.649	41%	0.41	S	S	*	.	H	α-helix	trans	-63.9	-41.2	172.5	179.8	177.7	-75.5	-175.3	-2.9	111.9	S779 H780 Q781 I787	S779-R783 PolarHBondContact O-N 2.72Å; H780-R783 WeakPolarHBondContact O-CB 3.49Å; H780-R783 PolarHBondContact O-N 2.94Å; Q781-R783 PolarHBondContact O-N 2.79Å; R783-I787 HydrophobicContact CG-CD1 4.02Å; R783-I787 VanDerWaalsContact O-CG1 3.29Å; R783-I787 WeakPolarHBondContact O-CG1 3.43Å; R783-I787 PolarHBondContact O-N 3.19Å
784	I	80.8	Confident	76.8	Confident	56 Å²	56	83.5 Å²	83.5	29%	0.287	45%	0.446	S	S	.	.	H	α-helix	trans	-63	-47.9	176	-68.5	176.8	0	0	0	110.8	W729 H780 Q781 I787 Q788	W729-I784 HydrophobicContact CH2-CD1 4.28Å; W729-I784 HydrophobicContact CZ3-CD1 4.14Å; H780-I784 VanDerWaalsContact CD2-CD1 3.49Å; H780-I784 WeakPolarHBondContact CD2-CD1 3.32Å; H780-I784 PolarHBondContact O-N 3.35Å; Q781-I784 PolarHBondContact O-N 3.32Å; I784-I787 PolarHBondContact O-N 3.04Å; I784-Q788 WeakPolarHBondContact O-CG 3.27Å; I784-Q788 PolarHBondContact O-N 2.78Å
785	H	77.5	Confident	74.9	Confident	107 Å²	107	86.3 Å²	86.3	50%	0.495	47%	0.467	S	S	.	.	H	α-helix	trans	-60.3	-47.8	177.6	-73.7	88	0	0	0	111.4	Q781 N782 I787 Q788 D789	Q781-H785 PolarHBondContact O-N 2.87Å; Q781-H785 PolarHBondContact O-ND1 2.9Å; N782-H785 PolarHBondContact O-N 2.95Å; H785-I787 VanDerWaalsContact C-N 3.28Å; H785-I787 PolarHBondContact O-N 3.15Å; H785-Q788 CarbonylContact O-C 3.59Å; H785-Q788 PolarHBondContact O-N 2.98Å; H785-D789 PolarHBondContact O-N 2.94Å
786	S	77.9	Confident	72.7	Confident	76 Å²	76	87.5 Å²	87.5	53%	0.531	47%	0.472	S	S	.	.	H	α-helix	trans	-58	-37.7	177	-179.7	0	0	0	0	113.2	N782 S790	N782-S786 VanDerWaalsContact O-CB 3.32Å; N782-S786 WeakPolarHBondContact O-CB 3.28Å; N782-S786 PolarHBondContact O-N 3.43Å; S786-S790 WeakPolarHBondContact O-CB 3.38Å; S786-S790 PolarHBondContact O-N 3.27Å
787	I	77	Confident	70.3	Confident	98 Å²	98	92.1 Å²	92.1	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-46.2	173.6	-69.7	165.7	0	0	0	110.6	R783 I784 H785 S790 V791	R783-I787 HydrophobicContact CG-CD1 4.02Å; R783-I787 VanDerWaalsContact O-CG1 3.29Å; R783-I787 WeakPolarHBondContact O-CG1 3.43Å; R783-I787 PolarHBondContact O-N 3.19Å; I784-I787 PolarHBondContact O-N 3.04Å; H785-I787 VanDerWaalsContact C-N 3.28Å; H785-I787 PolarHBondContact O-N 3.15Å; I787-S790 PolarHBondContact O-N 2.91Å; I787-S790 PolarHBondContact O-OG 2.83Å; I787-V791 WeakPolarHBondContact O-CG2 3.32Å; I787-V791 PolarHBondContact O-N 3.04Å; I787-V791 VanDerWaalsContact O-N 3.08Å
788	Q	71.5	Confident	67.9	Low	114 Å²	114	96.4 Å²	96.4	53%	0.533	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-44.1	177.7	-68.7	-179.5	19.6	0	0	112.2	I784 H785 V791 M792	I784-Q788 WeakPolarHBondContact O-CG 3.27Å; I784-Q788 PolarHBondContact O-N 2.78Å; H785-Q788 CarbonylContact O-C 3.59Å; H785-Q788 PolarHBondContact O-N 2.98Å; Q788-V791 PolarHBondContact O-N 3.37Å; Q788-M792 WeakPolarHBondContact O-CG 3.37Å; Q788-M792 PolarHBondContact O-N 3.18Å
789	D	70.4	Confident	65.5	Low	104 Å²	104	102.5 Å²	102.5	56%	0.556	54%	0.544	S	S	*	.	H	α-helix	trans	-62.5	-41.8	175.4	-74.1	-33.4	0	0	0	111.5	H785 V791 M792 E793	H785-D789 PolarHBondContact O-N 2.94Å; D789-V791 VanDerWaalsContact C-N 3.27Å; D789-V791 PolarHBondContact O-N 3.19Å; D789-M792 CarbonylContact O-C 3.58Å; D789-M792 PolarHBondContact O-N 2.95Å; D789-M792 VanDerWaalsContact O-N 3.13Å; D789-E793 WeakPolarHBondContact O-CB 3.2Å; D789-E793 PolarHBondContact O-N 3.16Å
790	S	64.9	Low	63.3	Low	50 Å²	50	104.6 Å²	104.6	35%	0.35	56%	0.559	S	S	.	*	H	α-helix	trans	-62	-34.7	175.6	79.9	0	0	0	0	112.4	S786 I787 N794	S786-S790 WeakPolarHBondContact O-CB 3.38Å; S786-S790 PolarHBondContact O-N 3.27Å; I787-S790 PolarHBondContact O-N 2.91Å; I787-S790 PolarHBondContact O-OG 2.83Å; S790-N794 WeakPolarHBondContact O-CB 3.34Å; S790-N794 PolarHBondContact O-N 3.01Å; S790-N794 PolarHBondContact O-ND2 3.05Å
791	V	67	Low	61.1	Low	89 Å²	89	110 Å²	110	54%	0.539	59%	0.588	S	S	.	*	H	α-helix	trans	-73.8	-33.5	175.6	172.3	0	0	0	0	111.3	I787 Q788 D789 T795	I787-V791 WeakPolarHBondContact O-CG2 3.32Å; I787-V791 PolarHBondContact O-N 3.04Å; I787-V791 VanDerWaalsContact O-N 3.08Å; Q788-V791 PolarHBondContact O-N 3.37Å; D789-V791 VanDerWaalsContact C-N 3.27Å; D789-V791 PolarHBondContact O-N 3.19Å; V791-T795 WeakPolarHBondContact O-CG2 3.17Å; V791-T795 PolarHBondContact O-N 2.95Å; V791-T795 PolarHBondContact O-OG1 3.25Å
792	M	55.6	Low	58.8	Low	131 Å²	131	113.6 Å²	113.6	65%	0.645	62%	0.616	S	S	*	*	H	α-helix	trans	-74.4	-35.2	174.8	-71.8	-76.4	-76.9	0	0	113.1	Q788 D789 T795 S796	Q788-M792 WeakPolarHBondContact O-CG 3.37Å; Q788-M792 PolarHBondContact O-N 3.18Å; D789-M792 CarbonylContact O-C 3.58Å; D789-M792 PolarHBondContact O-N 2.95Å; D789-M792 VanDerWaalsContact O-N 3.13Å; M792-T795 WeakPolarHBondContact CA-OG1 3.3Å; M792-T795 PolarHBondContact O-N 3.48Å; M792-T795 PolarHBondContact O-OG1 3.31Å; M792-T795 VanDerWaalsContact O-OG1 3.05Å; M792-S796 PolarHBondContact O-OG 2.99Å
793	E	46.9	Very low	56.2	Low	103 Å²	103	114.3 Å²	114.3	48%	0.481	63%	0.625	S	S	.	*	H	α-helix	trans	-79.5	-38.8	179.7	-165.4	166.2	-150.4	0	0	111.8	D789 T795 S796 K797	D789-E793 WeakPolarHBondContact O-CB 3.2Å; D789-E793 PolarHBondContact O-N 3.16Å; E793-T795 PolarHBondContact O-N 2.98Å; E793-T795 VanDerWaalsContact O-N 3.16Å; E793-S796 WeakPolarHBondContact CA-OG 3.28Å; E793-S796 PolarHBondContact O-N 2.94Å; E793-S796 VanDerWaalsContact O-N 3.11Å; E793-S796 PolarHBondContact O-OG 3.06Å; E793-K797 HydrophobicContact CG-CD 4Å; E793-K797 WeakPolarHBondContact OE1-CE 3.31Å; E793-K797 IonicContact OE1-NZ 2.7Å; E793-K797 PolarHBondContact OE1-NZ 3.05Å
794	N	48.3	Very low	53.7	Low	141 Å²	141	110.8 Å²	110.8	75%	0.754	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-12.8	171.5	-73.5	-39.6	0	0	0	113.5	S790	S790-N794 WeakPolarHBondContact O-CB 3.34Å; S790-N794 PolarHBondContact O-N 3.01Å; S790-N794 PolarHBondContact O-ND2 3.05Å
795	T	50.4	Low	51.5	Low	114 Å²	114	113.2 Å²	113.2	70%	0.699	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	3.2	174	49.6	0	0	0	0	114.3	V791 M792 E793	V791-T795 WeakPolarHBondContact O-CG2 3.17Å; V791-T795 PolarHBondContact O-N 2.95Å; V791-T795 PolarHBondContact O-OG1 3.25Å; M792-T795 WeakPolarHBondContact CA-OG1 3.3Å; M792-T795 PolarHBondContact O-N 3.48Å; M792-T795 PolarHBondContact O-OG1 3.31Å; M792-T795 VanDerWaalsContact O-OG1 3.05Å; E793-T795 PolarHBondContact O-N 2.98Å; E793-T795 VanDerWaalsContact O-N 3.16Å
796	S	43.4	Very low	49.6	Very low	87 Å²	87	116.1 Å²	116.1	61%	0.608	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.1	2.9	-173.4	52.2	0	0	0	0	116.9	M792 E793	M792-S796 PolarHBondContact O-OG 2.99Å; E793-S796 WeakPolarHBondContact CA-OG 3.28Å; E793-S796 PolarHBondContact O-N 2.94Å; E793-S796 VanDerWaalsContact O-N 3.11Å; E793-S796 PolarHBondContact O-OG 3.06Å
797	K	39.6	Very low	47.9	Very low	151 Å²	151	118.1 Å²	118.1	66%	0.657	67%	0.672	S	S	*	*			trans	-115.5	57.7	-176.3	-80.1	178.6	167.5	170.2	0	116.3	E793	E793-K797 HydrophobicContact CG-CD 4Å; E793-K797 WeakPolarHBondContact OE1-CE 3.31Å; E793-K797 IonicContact OE1-NZ 2.7Å; E793-K797 PolarHBondContact OE1-NZ 3.05Å
798	T	36.5	Very low	45.9	Very low	110 Å²	110	121 Å²	121	68%	0.675	69%	0.688	S	S	*	*			trans	-143.9	66.9	165.5	63.4	0	0	0	0	114.3
799	D	38.5	Very low	44.3	Very low	165 Å²	165	123.2 Å²	123.2	88%	0.882	70%	0.704	S	S	*	*			trans	-170.9	89.8	157.3	-108	-26.9	0	0	0	112.3
800	S	39.9	Very low	42.6	Very low	122 Å²	122	126.5 Å²	126.5	85%	0.853	71%	0.713	S	S	*	*			trans	177.6	106.6	149.1	27	0	0	0	0	111.6
801	L	38.6	Very low	41.3	Very low	159 Å²	159	133 Å²	133	83%	0.832	74%	0.738	S	S	*	*			trans	-90.3	126	170.8	-153.2	80.3	0	0	0	109.5	T803	L801-T803 PolarHBondContact O-N 3.38Å
802	P	39.4	Very low	39.5	Very low	124 Å²	124	134 Å²	134	81%	0.805	75%	0.745	S	S	*	*			trans	-84.2	98.6	172.7	31.8	-31.1	0	0	0	110.4	S804	P802-S804 PolarHBondContact O-N 3.46Å
803	T	29.7	Very low	38.5	Very low	128 Å²	128	134.8 Å²	134.8	79%	0.785	75%	0.75	S	S	*	*			trans	-76.4	116.4	172.3	-55.8	0	0	0	0	110.8	L801	L801-T803 PolarHBondContact O-N 3.38Å
804	S	34.2	Very low	37.7	Very low	98 Å²	98	137.9 Å²	137.9	69%	0.685	77%	0.765	S	S	*	*			trans	-154	122.4	148	-152.4	0	0	0	0	112.1	P802	P802-S804 PolarHBondContact O-N 3.46Å
805	T	34	Very low	37.1	Very low	107 Å²	107	138.5 Å²	138.5	66%	0.656	77%	0.768	S	S	*	*			trans	28.9	117.8	140.6	58.9	0	0	0	0	119.1
806	D	37.4	Very low	36	Very low	167 Å²	167	140.4 Å²	140.4	89%	0.893	77%	0.774	S	S	*	*				-130.8	161.3	117.1	-133.1	-35.2	0	0	0	109.7
807	V	43.1	Very low	35.6	Very low	118 Å²	118	143 Å²	143	72%	0.715	79%	0.787	S	S	*	*			trans	-130.1	133	-167.1	-160.7	0	0	0	0	110.9	N809	V807-N809 PolarHBondContact O-N 2.97Å
808	D	35.5	Very low	35.2	Very low	158 Å²	158	142.6 Å²	142.6	85%	0.845	79%	0.792	S	S	*	*			trans	-50.8	126.8	173.8	-80.8	-80.1	0	0	0	112.2
809	N	37.6	Very low	35.3	Very low	161 Å²	161	142.3 Å²	142.3	86%	0.861	79%	0.794	S	S	*	*			trans	-144.1	140.8	146.3	-150.2	-1.5	0	0	0	112.1	V807	V807-N809 PolarHBondContact O-N 2.97Å
810	K	35	Very low	35.3	Very low	173 Å²	173	141.3 Å²	141.3	75%	0.752	79%	0.789	S	S	*	*			trans	-103	128.2	-172.8	-66.9	167.1	173.3	-70.7	0	110.7
811	Q	36.3	Very low	35.1	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	78%	0.783	S	S	*	*			trans	177.1	160	142.1	-97.4	153.6	50.8	0	0	109.8
812	T	28.7	Very low	35.1	Very low	110 Å²	110	138.6 Å²	138.6	68%	0.675	77%	0.772	S	S	*	*			cis	171.6	143.3	-30.7	-94.3	0	0	0	0	106.9
813	L	36	Very low	35	Very low	147 Å²	147	140.8 Å²	140.8	77%	0.77	77%	0.772	S	S	*	*			trans	71.8	136.8	-175.4	-55.5	154.7	0	0	0	113.8
814	Q	30.3	Very low	35.5	Very low	169 Å²	169	138.8 Å²	138.8	79%	0.79	76%	0.763	S	S	*	*			cis	85.3	132.2	29.5	-65.7	-169.6	-24.2	0	0	116.4
815	N	34.5	Very low	35.5	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	77%	0.768	S	S	*	*			trans	121.4	104.1	174.7	-67.5	-10.9	0	0	0	109.5
816	N	28.9	Very low	35.8	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	77%	0.768	S	S	*	*			cis	72.2	92.8	24.3	-134.8	55.3	0	0	0	114.3
817	T	34.9	Very low	35.8	Very low	142 Å²	142	138.2 Å²	138.2	87%	0.871	76%	0.761	S	S	*	*			trans	-163.9	140	147.7	18.6	0	0	0	0	113.1
818	N	31.1	Very low	35.3	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	77%	0.766	S	S	*	*			trans	-35.5	155.1	168.7	-54.4	-7.2	0	0	0	115.3
819	S	37.9	Very low	35.2	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	76%	0.759	S	S	*	*				-166.2	151.4	60	-57.2	0	0	0	0	115.9
820	N	37.3	Very low	34.9	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	76%	0.759	S	S	*	*			trans	15.9	148	137.8	-42.5	-8.3	0	0	0	118.7
821	N	35.9	Very low	34.8	Very low	139 Å²	139	135.4 Å²	135.4	74%	0.743	76%	0.76	S	S	*	*			cis	-166.5	163.1	32.9	-161.1	36.4	0	0	0	113
822	S	40.5	Very low	34.6	Very low	85 Å²	85	133.6 Å²	133.6	59%	0.594	76%	0.762	S	S	*	*			trans	59	141.2	153.4	43.2	0	0	0	0	119.4
823	E	36.6	Very low	34.7	Very low	170 Å²	170	134.9 Å²	134.9	79%	0.794	77%	0.765	S	S	*	*			cis	-154.4	152.7	7.9	-158.9	124.7	152.4	0	0	112.9
824	S	38.8	Very low	34.5	Very low	86 Å²	86	134.5 Å²	134.5	60%	0.601	77%	0.769	S	S	*	*			trans	49	103.7	147.4	-70.5	0	0	0	0	121
825	T	35.9	Very low	34.6	Very low	129 Å²	129	133.3 Å²	133.3	79%	0.791	77%	0.768	S	S	*	*				99.6	142.4	80.9	55.5	0	0	0	0	113.3
826	S	39.2	Very low	34.5	Very low	94 Å²	94	132 Å²	132	66%	0.657	77%	0.766	S	S	*	*			cis	-152.4	147.9	6.2	39.8	0	0	0	0	114
827	N	37.7	Very low	34.4	Very low	138 Å²	138	131.2 Å²	131.2	74%	0.738	77%	0.766	S	S	*	*			trans	54.5	113	141.2	-54.2	-10.1	0	0	0	119.2
828	H	33	Very low	34.2	Very low	181 Å²	181	130.6 Å²	130.6	84%	0.838	76%	0.763	S	S	*	*				56.6	99.8	85.2	-82.3	-79.3	0	0	0	112.7
829	A	33.1	Very low	34.2	Very low	83 Å²	83	129.1 Å²	129.1	69%	0.686	76%	0.759	S	S	*	*				77.1	124.4	54.8	0	0	0	0	0	115
830	T	31.7	Very low	33.9	Very low	141 Å²	141	132.4 Å²	132.4	87%	0.865	77%	0.767	S	S	*	*			trans	-158.8	157.7	137.6	2.6	0	0	0	0	110
831	D	31.6	Very low	33.7	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	76%	0.759	S	S	*	*			trans	-74.2	150.2	-170.9	-42.1	-95.8	0	0	0	113.6
832	T	32.1	Very low	33.8	Very low	148 Å²	148	130.1 Å²	130.1	91%	0.908	76%	0.758	S	S	*	*				-158.4	157.1	121.5	-1.1	0	0	0	0	112.8
833	N	32.2	Very low	33.7	Very low	138 Å²	138	132.4 Å²	132.4	74%	0.738	76%	0.759	S	S	*	*			trans	-114.2	127	-173.5	172.7	13.6	0	0	0	110.2
834	T	31.3	Very low	34.3	Very low	139 Å²	139	128.6 Å²	128.6	85%	0.853	75%	0.75	S	S	*	*			trans	-151.8	152.9	163.3	13.1	0	0	0	0	112.1
835	N	32.9	Very low	34.9	Very low	144 Å²	144	131.1 Å²	131.1	77%	0.77	75%	0.752	S	S	*	*			trans	-89.2	151.2	-169.6	-77.5	-44.8	0	0	0	115.1
836	T	30.9	Very low	35.5	Very low	126 Å²	126	131.6 Å²	131.6	77%	0.773	75%	0.75	S	S	*	*			trans	-6.4	135.3	154.5	46.2	0	0	0	0	119.7
837	T	27.3	Very low	36.6	Very low	137 Å²	137	133.4 Å²	133.4	84%	0.84	75%	0.751	S	S	*	*				-169.2	106.7	114	-72.1	0	0	0	0	110.2
838	T	31.7	Very low	38.3	Very low	130 Å²	130	130.1 Å²	130.1	80%	0.798	74%	0.736	S	S	*	*			trans	-154.2	131.7	169.2	1.3	0	0	0	0	111.8
839	T	30.4	Very low	40.5	Very low	111 Å²	111	124 Å²	124	68%	0.681	72%	0.716	S	S	*	*			trans	31	109.7	153.2	-41.7	0	0	0	0	119.5
840	I	32.8	Very low	42.8	Very low	173 Å²	173	124.2 Å²	124.2	89%	0.887	71%	0.706	S	S	*	*			trans	-96.9	90.2	163.7	-57.5	176.4	0	0	0	109.6
841	T	32.4	Very low	45.3	Very low	97 Å²	97	122.9 Å²	122.9	60%	0.595	69%	0.693	S	S	*	*			trans	-142.8	162.8	155.2	52.6	0	0	0	0	106.6
842	N	37.2	Very low	47.9	Very low	137 Å²	137	121.8 Å²	121.8	73%	0.733	68%	0.683	S	S	*	*			trans	74.8	141.8	-175.2	-43.2	14.8	0	0	0	112.5
843	E	38.5	Very low	50.6	Low	132 Å²	132	117.6 Å²	117.6	62%	0.617	66%	0.664	S	S	*	*			cis	-151.3	162	-24.5	-98.4	-42.3	96.6	0	0	106.4	E845	E843-E845 VanDerWaalsContact C-N 3.31Å; E843-E845 HydrophobicContact CB-CG 4.39Å; E843-E845 PolarHBondContact O-N 3.3Å
844	P	49.8	Very low	53.4	Low	91 Å²	91	115.9 Å²	115.9	59%	0.591	65%	0.65	S	S	*	*	S	Bend	trans	-77.8	-10.8	-175.4	32	-34.3	0	0	0	114.6	N846 L847	P844-N846 VanDerWaalsContact C-N 3.31Å; P844-N846 PolarHBondContact O-N 2.83Å; P844-N846 VanDerWaalsContact O-N 3.14Å; P844-L847 PolarHBondContact O-N 3.4Å
845	E	50.5	Low	56.5	Low	139 Å²	139	113.2 Å²	113.2	65%	0.65	63%	0.633	S	S	*	*	H	α-helix	trans	-60.1	-30.6	-161.7	-60	-178.6	140.8	0	0	115.4	E843 L847 T848 A849	E843-E845 VanDerWaalsContact C-N 3.31Å; E843-E845 HydrophobicContact CB-CG 4.39Å; E843-E845 PolarHBondContact O-N 3.3Å; E845-L847 VanDerWaalsContact C-N 3.25Å; E845-L847 PolarHBondContact O-N 3Å; E845-T848 WeakPolarHBondContact CA-OG1 3.46Å; E845-T848 PolarHBondContact O-N 3.38Å; E845-T848 PolarHBondContact O-OG1 2.99Å; E845-A849 PolarHBondContact O-N 2.9Å
846	N	50.2	Low	59.4	Low	139 Å²	139	111.3 Å²	111.3	74%	0.743	62%	0.623	S	S	*	*	H	α-helix	trans	-73.8	-16	-174.7	-153.6	12.4	0	0	0	113.2	P844	P844-N846 VanDerWaalsContact C-N 3.31Å; P844-N846 PolarHBondContact O-N 2.83Å; P844-N846 VanDerWaalsContact O-N 3.14Å
847	L	60.5	Low	62.3	Low	132 Å²	132	109 Å²	109	69%	0.691	61%	0.606	S	S	*	*	H	α-helix	trans	-86.7	-28.5	171.3	-76.5	167.5	0	0	0	112.3	P844 E845 L851	P844-L847 PolarHBondContact O-N 3.4Å; E845-L847 VanDerWaalsContact C-N 3.25Å; E845-L847 PolarHBondContact O-N 3Å; L847-L851 WeakPolarHBondContact O-CG 3.44Å; L847-L851 PolarHBondContact O-N 3.24Å
848	T	74	Confident	65.4	Low	69 Å²	69	105.7 Å²	105.7	42%	0.423	59%	0.585	S	S	.	*	H	α-helix	trans	-69.1	-46.7	174	3.1	0	0	0	0	110.9	E845 D850 L851 E852	E845-T848 WeakPolarHBondContact CA-OG1 3.46Å; E845-T848 PolarHBondContact O-N 3.38Å; E845-T848 PolarHBondContact O-OG1 2.99Å; T848-D850 VanDerWaalsContact C-N 3.33Å; T848-D850 PolarHBondContact O-N 3.14Å; T848-L851 CarbonylContact O-C 3.52Å; T848-L851 WeakPolarHBondContact O-CA 3.21Å; T848-L851 WeakPolarHBondContact O-CB 3.43Å; T848-L851 PolarHBondContact O-N 3.03Å; T848-E852 WeakPolarHBondContact O-CG 3.3Å; T848-E852 PolarHBondContact O-N 2.84Å
849	A	80.3	Confident	68.3	Low	51 Å²	51	103.7 Å²	103.7	42%	0.421	57%	0.569	S	S	.	*	H	α-helix	trans	-58.9	-41.5	179.7	0	0	0	0	0	113.1	E845 L851 E852 A853	E845-A849 PolarHBondContact O-N 2.9Å; A849-L851 VanDerWaalsContact C-N 3.26Å; A849-L851 PolarHBondContact O-N 3.18Å; A849-E852 PolarHBondContact O-N 3.16Å; A849-A853 WeakPolarHBondContact O-CB 3.32Å; A849-A853 PolarHBondContact O-N 2.83Å
850	D	80.4	Confident	71.3	Confident	89 Å²	89	101.8 Å²	101.8	48%	0.476	56%	0.56	S	S	.	*	H	α-helix	trans	-75.2	-11.7	176.9	-174.8	45.3	0	0	0	113.1	T848 K854	T848-D850 VanDerWaalsContact C-N 3.33Å; T848-D850 PolarHBondContact O-N 3.14Å; D850-K854 WeakPolarHBondContact O-CD 3.34Å; D850-K854 WeakPolarHBondContact O-CG 3.35Å; D850-K854 PolarHBondContact O-NZ 3.07Å; D850-K854 IonicContact OD1-NZ 2.71Å; D850-K854 PolarHBondContact OD1-NZ 2.88Å; D850-K854 IonicContact OD2-NZ 2.6Å; D850-K854 PolarHBondContact OD2-NZ 3.18Å
851	L	85.3	Confident	74	Confident	112 Å²	112	100.2 Å²	100.2	59%	0.586	54%	0.543	S	S	*	.	H	α-helix	trans	-89	-43.8	167.2	-75.8	169	0	0	0	111.6	L847 T848 A849 A853 K854 V855	L847-L851 WeakPolarHBondContact O-CG 3.44Å; L847-L851 PolarHBondContact O-N 3.24Å; T848-L851 CarbonylContact O-C 3.52Å; T848-L851 WeakPolarHBondContact O-CA 3.21Å; T848-L851 WeakPolarHBondContact O-CB 3.43Å; T848-L851 PolarHBondContact O-N 3.03Å; A849-L851 VanDerWaalsContact C-N 3.26Å; A849-L851 PolarHBondContact O-N 3.18Å; L851-A853 PolarHBondContact O-N 3.41Å; L851-K854 PolarHBondContact O-N 3.41Å; L851-K854 VanDerWaalsContact O-N 3.08Å; L851-V855 PolarHBondContact O-N 3.31Å
852	E	84.8	Confident	76.9	Confident	123 Å²	123	99.7 Å²	99.7	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-60.2	-45.3	177.3	-72.9	173.8	169.9	0	0	111.3	T848 A849 K854 V855 D856	T848-E852 WeakPolarHBondContact O-CG 3.3Å; T848-E852 PolarHBondContact O-N 2.84Å; A849-E852 PolarHBondContact O-N 3.16Å; E852-K854 PolarHBondContact O-N 3.42Å; E852-V855 WeakPolarHBondContact O-CB 3.32Å; E852-V855 PolarHBondContact O-N 2.83Å; E852-D856 PolarHBondContact O-N 3.4Å
853	A	89.8	Confident	79.4	Confident	60 Å²	60	101.7 Å²	101.7	50%	0.496	53%	0.533	S	S	.	.	H	α-helix	trans	-58.6	-31.2	174.4	0	0	0	0	0	113.4	A849 L851 D857	A849-A853 WeakPolarHBondContact O-CB 3.32Å; A849-A853 PolarHBondContact O-N 2.83Å; L851-A853 PolarHBondContact O-N 3.41Å; A853-D857 PolarHBondContact O-N 3.16Å; A853-D857 VanDerWaalsContact O-N 3.16Å
854	K	91.6	Very high	81.9	Confident	102 Å²	102	97.2 Å²	97.2	44%	0.443	52%	0.519	S	S	.	.	H	α-helix	trans	-80.3	-30.9	175.7	-66.6	-176.8	-170.5	96.4	0	112.4	D850 L851 E852 V858	D850-K854 WeakPolarHBondContact O-CD 3.34Å; D850-K854 WeakPolarHBondContact O-CG 3.35Å; D850-K854 PolarHBondContact O-NZ 3.07Å; D850-K854 IonicContact OD1-NZ 2.71Å; D850-K854 PolarHBondContact OD1-NZ 2.88Å; D850-K854 IonicContact OD2-NZ 2.6Å; D850-K854 PolarHBondContact OD2-NZ 3.18Å; L851-K854 PolarHBondContact O-N 3.41Å; L851-K854 VanDerWaalsContact O-N 3.08Å; E852-K854 PolarHBondContact O-N 3.42Å; K854-V858 VanDerWaalsContact O-CG2 3.29Å; K854-V858 WeakPolarHBondContact O-CG2 3.29Å; K854-V858 PolarHBondContact O-N 3.28Å; K854-V858 VanDerWaalsContact O-N 3.12Å
855	V	95.4	Very high	83.7	Confident	83 Å²	83	96.1 Å²	96.1	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-66	-46.1	170.5	170.5	0	0	0	0	110.2	L851 E852 D857 V858 L859	L851-V855 PolarHBondContact O-N 3.31Å; E852-V855 WeakPolarHBondContact O-CB 3.32Å; E852-V855 PolarHBondContact O-N 2.83Å; V855-D857 PolarHBondContact O-N 2.99Å; V855-V858 PolarHBondContact O-N 3.09Å; V855-L859 HydrophobicContact CG1-CD1 3.81Å; V855-L859 HydrophobicContact CG1-CG 4.28Å; V855-L859 WeakPolarHBondContact O-CB 3.49Å; V855-L859 WeakPolarHBondContact O-CG 3.25Å; V855-L859 PolarHBondContact O-N 2.84Å
856	D	93.4	Very high	85.5	Confident	104 Å²	104	95.1 Å²	95.1	56%	0.556	51%	0.506	S	S	*	.	H	α-helix	trans	-65.7	-37.5	179	-91.6	-6.6	0	0	0	113.2	E852 L859 S860	E852-D856 PolarHBondContact O-N 3.4Å; D856-L859 PolarHBondContact O-N 3.04Å; D856-S860 WeakPolarHBondContact O-CB 3.41Å; D856-S860 PolarHBondContact O-N 3.06Å; D856-S860 PolarHBondContact O-OG 3.43Å
857	D	92.1	Very high	87.2	Confident	78 Å²	78	95 Å²	95	42%	0.417	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-38	171.4	167	61.9	0	0	0	112.1	A853 V855 R861	A853-D857 PolarHBondContact O-N 3.16Å; A853-D857 VanDerWaalsContact O-N 3.16Å; V855-D857 PolarHBondContact O-N 2.99Å; D857-R861 WeakPolarHBondContact O-CB 3.4Å; D857-R861 VanDerWaalsContact O-CG 3.28Å; D857-R861 WeakPolarHBondContact O-CG 3.5Å; D857-R861 PolarHBondContact O-N 3.39Å; D857-R861 PolarHBondContact O-NE 2.93Å; D857-R861 IonicContact OD1-NE 2.78Å; D857-R861 PolarHBondContact OD1-NE 3.06Å; D857-R861 IonicContact OD2-CZ 3.62Å; D857-R861 IonicContact OD2-NE 2.72Å; D857-R861 PolarHBondContact OD2-NE 2.91Å; D857-R861 IonicContact OD2-NH2 2.83Å; D857-R861 PolarHBondContact OD2-NH2 3.47Å
858	V	92.5	Very high	88.3	Confident	68 Å²	68	96.9 Å²	96.9	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-65.6	-46.2	173.1	168.5	0	0	0	0	111.5	K854 V855 S860 R861 I862	K854-V858 VanDerWaalsContact O-CG2 3.29Å; K854-V858 WeakPolarHBondContact O-CG2 3.29Å; K854-V858 PolarHBondContact O-N 3.28Å; K854-V858 VanDerWaalsContact O-N 3.12Å; V855-V858 PolarHBondContact O-N 3.09Å; V858-S860 VanDerWaalsContact C-N 3.33Å; V858-S860 PolarHBondContact O-N 3.15Å; V858-R861 PolarHBondContact O-N 3.26Å; V858-I862 HydrophobicContact CG1-CD1 3.96Å; V858-I862 WeakPolarHBondContact O-CG1 3.45Å; V858-I862 PolarHBondContact O-N 3.4Å
859	L	93.5	Very high	88.9	Confident	87 Å²	87	99.3 Å²	99.3	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-39.6	176.9	-71.5	172.3	0	0	0	111.9	V855 D856 I862 R863	V855-L859 HydrophobicContact CG1-CD1 3.81Å; V855-L859 HydrophobicContact CG1-CG 4.28Å; V855-L859 WeakPolarHBondContact O-CB 3.49Å; V855-L859 WeakPolarHBondContact O-CG 3.25Å; V855-L859 PolarHBondContact O-N 2.84Å; D856-L859 PolarHBondContact O-N 3.04Å; L859-I862 PolarHBondContact O-N 2.7Å; L859-R863 WeakPolarHBondContact O-CB 3.42Å; L859-R863 PolarHBondContact O-N 3.16Å
860	S	92.6	Very high	89.2	Confident	71 Å²	71	99.6 Å²	99.6	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-42.2	174.4	-63	0	0	0	0	111.6	D856 V858 R863 A864	D856-S860 WeakPolarHBondContact O-CB 3.41Å; D856-S860 PolarHBondContact O-N 3.06Å; D856-S860 PolarHBondContact O-OG 3.43Å; V858-S860 VanDerWaalsContact C-N 3.33Å; V858-S860 PolarHBondContact O-N 3.15Å; S860-R863 PolarHBondContact O-N 2.62Å; S860-A864 VanDerWaalsContact O-CB 3.27Å; S860-A864 WeakPolarHBondContact O-CB 3.49Å; S860-A864 PolarHBondContact O-N 3Å
861	R	89.9	Confident	89.1	Confident	141 Å²	141	97.9 Å²	97.9	53%	0.532	51%	0.507	S	S	.	.	H	α-helix	trans	-68	-32.3	175.7	-74	-175.9	-76.1	142.6	-2.4	113	D857 V858 T865	D857-R861 WeakPolarHBondContact O-CB 3.4Å; D857-R861 VanDerWaalsContact O-CG 3.28Å; D857-R861 WeakPolarHBondContact O-CG 3.5Å; D857-R861 PolarHBondContact O-N 3.39Å; D857-R861 PolarHBondContact O-NE 2.93Å; D857-R861 IonicContact OD1-NE 2.78Å; D857-R861 PolarHBondContact OD1-NE 3.06Å; D857-R861 IonicContact OD2-CZ 3.62Å; D857-R861 IonicContact OD2-NE 2.72Å; D857-R861 PolarHBondContact OD2-NE 2.91Å; D857-R861 IonicContact OD2-NH2 2.83Å; D857-R861 PolarHBondContact OD2-NH2 3.47Å; V858-R861 PolarHBondContact O-N 3.26Å; R861-T865 WeakPolarHBondContact O-CB 3.34Å; R861-T865 PolarHBondContact O-N 3.29Å; R861-T865 PolarHBondContact O-OG1 2.96Å
862	I	92	Very high	88.8	Confident	86 Å²	86	95.1 Å²	95.1	44%	0.441	50%	0.501	S	S	.	.	H	α-helix	trans	-66.4	-54.3	171.6	-69.1	164.6	0	0	0	110	V858 L859 A864 T865 E866	V858-I862 HydrophobicContact CG1-CD1 3.96Å; V858-I862 WeakPolarHBondContact O-CG1 3.45Å; V858-I862 PolarHBondContact O-N 3.4Å; L859-I862 PolarHBondContact O-N 2.7Å; I862-A864 PolarHBondContact O-N 3.25Å; I862-T865 WeakPolarHBondContact O-CA 3.25Å; I862-T865 WeakPolarHBondContact O-CB 3.07Å; I862-T865 PolarHBondContact O-N 3.32Å; I862-E866 PolarHBondContact O-N 2.87Å
863	R	91.3	Very high	88.4	Confident	179 Å²	179	92.2 Å²	92.2	68%	0.675	50%	0.497	S	S	*	.	H	α-helix	trans	-57.7	-44.9	-179.3	-167.4	-175.9	-61.9	172.2	3.8	112.2	L859 S860 T865 E866 E867	L859-R863 WeakPolarHBondContact O-CB 3.42Å; L859-R863 PolarHBondContact O-N 3.16Å; S860-R863 PolarHBondContact O-N 2.62Å; R863-T865 PolarHBondContact O-N 2.96Å; R863-T865 VanDerWaalsContact O-N 3.15Å; R863-E866 PolarHBondContact O-N 3.08Å; R863-E867 WeakPolarHBondContact O-CB 3.46Å; R863-E867 PolarHBondContact O-N 3.07Å
864	A	89.5	Confident	87.6	Confident	38 Å²	38	94.3 Å²	94.3	31%	0.314	50%	0.504	S	S	.	.	H	α-helix	trans	-71.3	-1.8	175.5	0	0	0	0	0	114.2	S860 I862 R868	S860-A864 VanDerWaalsContact O-CB 3.27Å; S860-A864 WeakPolarHBondContact O-CB 3.49Å; S860-A864 PolarHBondContact O-N 3Å; I862-A864 PolarHBondContact O-N 3.25Å; A864-R868 PolarHBondContact O-NE 3.07Å; A864-R868 PolarHBondContact O-NH2 3.03Å
865	T	88.5	Confident	86.2	Confident	67 Å²	67	94 Å²	94	41%	0.411	51%	0.514	S	S	.	.	H	α-helix	trans	-100.8	-41.5	170	-57.9	0	0	0	0	110.5	R861 I862 R863 R868 M869	R861-T865 WeakPolarHBondContact O-CB 3.34Å; R861-T865 PolarHBondContact O-N 3.29Å; R861-T865 PolarHBondContact O-OG1 2.96Å; I862-T865 WeakPolarHBondContact O-CA 3.25Å; I862-T865 WeakPolarHBondContact O-CB 3.07Å; I862-T865 PolarHBondContact O-N 3.32Å; R863-T865 PolarHBondContact O-N 2.96Å; R863-T865 VanDerWaalsContact O-N 3.15Å; T865-R868 PolarHBondContact O-N 3.48Å; T865-M869 HydrophobicContact CG2-CE 4.36Å; T865-M869 WeakPolarHBondContact O-CG 3.22Å; T865-M869 PolarHBondContact O-N 2.92Å
866	E	87.5	Confident	84.5	Confident	118 Å²	118	94.9 Å²	94.9	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-59.7	-46.6	170.8	-68.1	-176.8	124.1	0	0	112	I862 R863 R868 M869 A870	I862-E866 PolarHBondContact O-N 2.87Å; R863-E866 PolarHBondContact O-N 3.08Å; E866-R868 VanDerWaalsContact C-N 3.27Å; E866-R868 PolarHBondContact O-N 3.18Å; E866-M869 HydrophobicContact CG-CE 4.32Å; E866-M869 CarbonylContact O-C 3.6Å; E866-M869 WeakPolarHBondContact O-CA 3.5Å; E866-M869 PolarHBondContact O-N 3.02Å; E866-A870 PolarHBondContact O-N 3.4Å
867	E	87.1	Confident	82.6	Confident	137 Å²	137	95.6 Å²	95.6	64%	0.64	53%	0.533	S	S	*	.	H	α-helix	trans	-57.9	-39.7	177	-174.8	179	-168.3	0	0	111.9	R863 A870 A871	R863-E867 WeakPolarHBondContact O-CB 3.46Å; R863-E867 PolarHBondContact O-N 3.07Å; E867-A870 PolarHBondContact O-N 3.22Å; E867-A871 VanDerWaalsContact O-CB 3.3Å; E867-A871 WeakPolarHBondContact O-CB 3.47Å; E867-A871 PolarHBondContact O-N 2.85Å
868	R	83.7	Confident	80.4	Confident	172 Å²	172	102.7 Å²	102.7	65%	0.649	55%	0.554	S	S	*	*	H	α-helix	trans	-69.9	-32.4	174.6	-87.1	-177.6	-73.4	-176.7	-4.8	113.2	A864 T865 E866 A872	A864-R868 PolarHBondContact O-NE 3.07Å; A864-R868 PolarHBondContact O-NH2 3.03Å; T865-R868 PolarHBondContact O-N 3.48Å; E866-R868 VanDerWaalsContact C-N 3.27Å; E866-R868 PolarHBondContact O-N 3.18Å; R868-A872 WeakPolarHBondContact O-CB 3.31Å; R868-A872 PolarHBondContact O-N 2.81Å; R868-A872 VanDerWaalsContact O-N 3.08Å
869	M	86.6	Confident	78.1	Confident	120 Å²	120	105 Å²	105	59%	0.591	57%	0.573	S	S	*	*	H	α-helix	trans	-71.4	-40.5	173.2	-69.3	-173.2	-63.1	0	0	111.5	T865 E866 A872 A873	T865-M869 HydrophobicContact CG2-CE 4.36Å; T865-M869 WeakPolarHBondContact O-CG 3.22Å; T865-M869 PolarHBondContact O-N 2.92Å; E866-M869 HydrophobicContact CG-CE 4.32Å; E866-M869 CarbonylContact O-C 3.6Å; E866-M869 WeakPolarHBondContact O-CA 3.5Å; E866-M869 PolarHBondContact O-N 3.02Å; M869-A872 PolarHBondContact O-N 3.32Å; M869-A873 PolarHBondContact O-N 3.49Å
870	A	85	Confident	75.6	Confident	57 Å²	57	108.4 Å²	108.4	47%	0.471	59%	0.591	S	S	.	*	H	α-helix	trans	-63.4	-46.3	174	0	0	0	0	0	111.9	E866 E867 A872 A873 V874	E866-A870 PolarHBondContact O-N 3.4Å; E867-A870 PolarHBondContact O-N 3.22Å; A870-A872 VanDerWaalsContact C-N 3.3Å; A870-A872 PolarHBondContact O-N 3.16Å; A870-A873 PolarHBondContact O-N 3.11Å; A870-V874 WeakPolarHBondContact O-CG2 3.35Å; A870-V874 PolarHBondContact O-N 3.25Å
871	A	78.6	Confident	73.5	Confident	53 Å²	53	111.8 Å²	111.8	44%	0.438	61%	0.61	S	S	.	*	H	α-helix	trans	-61	-37.6	175.5	0	0	0	0	0	112.4	E867 S875	E867-A871 VanDerWaalsContact O-CB 3.3Å; E867-A871 WeakPolarHBondContact O-CB 3.47Å; E867-A871 PolarHBondContact O-N 2.85Å; A871-S875 VanDerWaalsContact O-CB 3.29Å; A871-S875 WeakPolarHBondContact O-CB 3.34Å; A871-S875 PolarHBondContact O-N 2.6Å; A871-S875 PolarHBondContact O-OG 3Å
872	A	78.9	Confident	71.2	Confident	54 Å²	54	110.8 Å²	110.8	45%	0.446	62%	0.621	S	S	.	*	H	α-helix	trans	-68.6	-37.8	175.5	0	0	0	0	0	112.3	R868 M869 A870 S875 S876	R868-A872 WeakPolarHBondContact O-CB 3.31Å; R868-A872 PolarHBondContact O-N 2.81Å; R868-A872 VanDerWaalsContact O-N 3.08Å; M869-A872 PolarHBondContact O-N 3.32Å; A870-A872 VanDerWaalsContact C-N 3.3Å; A870-A872 PolarHBondContact O-N 3.16Å; A872-S875 PolarHBondContact O-N 3.3Å; A872-S876 PolarHBondContact O-N 3.02Å; A872-S876 PolarHBondContact O-OG 2.98Å
873	A	77.3	Confident	68.5	Low	61 Å²	61	115.8 Å²	115.8	50%	0.504	64%	0.636	S	S	.	*	H	α-helix	trans	-64.2	-49.5	174.5	0	0	0	0	0	111.6	M869 A870 S875 S876	M869-A873 PolarHBondContact O-N 3.49Å; A870-A873 PolarHBondContact O-N 3.11Å; A873-S875 VanDerWaalsContact C-N 3.31Å; A873-S875 PolarHBondContact O-N 2.87Å; A873-S876 WeakPolarHBondContact O-CB 3.23Å; A873-S876 PolarHBondContact O-N 3.44Å
874	V	73.5	Confident	66.1	Low	104 Å²	104	114.8 Å²	114.8	63%	0.63	64%	0.636	S	S	*	*	H	α-helix	trans	-64	-34.2	177.2	175.6	0	0	0	0	112.2	A870 S876 T877	A870-V874 WeakPolarHBondContact O-CG2 3.35Å; A870-V874 PolarHBondContact O-N 3.25Å; V874-S876 PolarHBondContact O-N 2.8Å; V874-T877 PolarHBondContact O-OG1 3.33Å
875	S	62.4	Low	63.6	Low	95 Å²	95	117.5 Å²	117.5	66%	0.664	65%	0.653	S	S	*	*	H	α-helix	trans	-69.5	-16.5	173.6	-58.2	0	0	0	0	113.3	A871 A872 A873	A871-S875 VanDerWaalsContact O-CB 3.29Å; A871-S875 WeakPolarHBondContact O-CB 3.34Å; A871-S875 PolarHBondContact O-N 2.6Å; A871-S875 PolarHBondContact O-OG 3Å; A872-S875 PolarHBondContact O-N 3.3Å; A873-S875 VanDerWaalsContact C-N 3.31Å; A873-S875 PolarHBondContact O-N 2.87Å
876	S	59	Low	61.3	Low	103 Å²	103	121.7 Å²	121.7	72%	0.72	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-3.1	-178.2	-58.6	0	0	0	0	113.8	A872 A873 V874	A872-S876 PolarHBondContact O-N 3.02Å; A872-S876 PolarHBondContact O-OG 2.98Å; A873-S876 WeakPolarHBondContact O-CB 3.23Å; A873-S876 PolarHBondContact O-N 3.44Å; V874-S876 PolarHBondContact O-N 2.8Å
877	T	53.9	Low	59	Low	119 Å²	119	120.2 Å²	120.2	73%	0.73	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	24	-174.5	64.7	0	0	0	0	113.6	V874	V874-T877 PolarHBondContact O-OG1 3.33Å
878	R	44.6	Very low	56.6	Low	226 Å²	226	120.9 Å²	120.9	85%	0.853	68%	0.682	S	S	*	*			trans	-144.5	61.7	-166.7	-154	-178.5	-174.4	-157.9	0.2	116.4
879	S	44.9	Very low	54.4	Low	116 Å²	116	120.9 Å²	120.9	81%	0.811	69%	0.689	S	S	*	*			trans	-156.9	109.5	158.3	60.4	0	0	0	0	112.3
880	D	40.8	Very low	52	Low	159 Å²	159	120.3 Å²	120.3	85%	0.85	69%	0.692	S	S	*	*			trans	-149.6	112.8	164	-124.2	-29.4	0	0	0	110
881	T	48.2	Very low	49.9	Very low	143 Å²	143	124.1 Å²	124.1	88%	0.877	71%	0.71	S	S	*	*			trans	-178.4	138.3	154	12.2	0	0	0	0	109.1
882	P	42.5	Very low	47.7	Very low	119 Å²	119	129.8 Å²	129.8	77%	0.773	73%	0.733	S	S	*	*			trans	-119.3	167.8	-163.5	42	-32.8	0	0	0	116.5
883	Y	34.4	Very low	45.8	Very low	191 Å²	191	133 Å²	133	75%	0.749	75%	0.752	S	S	*	*				117.9	135.8	127.3	-158.2	-135.9	0	0	0	119.1
884	K	40.8	Very low	43.8	Very low	159 Å²	159	136 Å²	136	69%	0.691	77%	0.769	S	S	*	*			trans	67	143.5	166.4	-84.7	176.1	175.9	171.6	0	117.8
885	S	38	Very low	42	Very low	94 Å²	94	138.5 Å²	138.5	66%	0.657	78%	0.777	S	S	*	*			cis	-165.8	170.5	-10.6	-144	0	0	0	0	113.1
886	I	39.4	Very low	40.7	Very low	155 Å²	155	145.7 Å²	145.7	80%	0.795	79%	0.79	S	S	*	*			trans	78.7	106	152	-67.4	157.5	0	0	0	120.1
887	S	38.9	Very low	39.8	Very low	87 Å²	87	145.5 Å²	145.5	61%	0.608	79%	0.788	S	S	*	*				71.8	107.5	129	-171.1	0	0	0	0	123.8
888	N	36.8	Very low	39.3	Very low	152 Å²	152	146.1 Å²	146.1	81%	0.813	79%	0.792	S	S	*	*				51.4	118	127.4	-49.2	-16.5	0	0	0	121.7
889	H	39	Very low	38.8	Very low	171 Å²	171	139.3 Å²	139.3	79%	0.792	79%	0.792	S	S	*	*				-166.9	122.2	101	-176.7	-86.4	0	0	0	114.1
890	V	34.6	Very low	38.6	Very low	109 Å²	109	135.8 Å²	135.8	66%	0.661	77%	0.774	S	S	*	*			trans	-5.8	122.1	158.4	-170.2	0	0	0	0	118.9
891	T	40.8	Very low	39.1	Very low	137 Å²	137	138.7 Å²	138.7	84%	0.84	77%	0.774	S	S	*	*				-172.6	137.8	113.7	20.5	0	0	0	0	112
892	N	32.5	Very low	39.2	Very low	172 Å²	172	137.8 Å²	137.8	92%	0.92	77%	0.768	S	S	*	*			trans	-95.4	136.4	-179.2	-84.6	-42.3	0	0	0	112.4
893	S	38.6	Very low	39.6	Very low	121 Å²	121	138.9 Å²	138.9	85%	0.846	77%	0.766	S	S	*	*			trans	-152.7	118.9	144.2	56.3	0	0	0	0	114.7
894	S	35.9	Very low	40.6	Very low	123 Å²	123	138.4 Å²	138.4	86%	0.86	76%	0.762	S	S	*	*			trans	45.4	105.2	155.1	-138	0	0	0	0	121.4
895	I	36	Very low	41	Very low	157 Å²	157	134.1 Å²	134.1	81%	0.805	76%	0.757	S	S	*	*			trans	-75.9	142.3	162	-64.3	157.2	0	0	0	110.6
896	R	35	Very low	41.8	Very low	247 Å²	247	133.8 Å²	133.8	93%	0.932	76%	0.755	S	S	*	*			trans	-143.3	59.2	158.2	-151.7	172.1	-160.2	-93.8	-2	114.7	T898	R896-T898 PolarHBondContact O-N 3.05Å
897	S	40.8	Very low	42.5	Very low	98 Å²	98	129.2 Å²	129.2	69%	0.685	74%	0.74	S	S	*	*			trans	-83.4	111.7	177.2	-169.7	0	0	0	0	113.3	G899	S897-G899 VanDerWaalsContact C-N 3.29Å; S897-G899 PolarHBondContact O-N 2.8Å
898	T	42.4	Very low	43.4	Very low	132 Å²	132	129.6 Å²	129.6	81%	0.81	74%	0.738	S	S	*	*			trans	41.1	23.5	133.8	-34.9	0	0	0	0	121.4	R896 G900	R896-T898 PolarHBondContact O-N 3.05Å; T898-G900 PolarHBondContact O-N 3.34Å
899	G	34.8	Very low	44.3	Very low	83 Å²	83	125.3 Å²	125.3	86%	0.856	72%	0.724	S	S	*	*			trans	-74.9	84.8	171.9	0	0	0	0	0	113.7	S897	S897-G899 VanDerWaalsContact C-N 3.29Å; S897-G899 PolarHBondContact O-N 2.8Å
900	G	41.2	Very low	45.1	Very low	43 Å²	43	120 Å²	120	44%	0.443	71%	0.71	S	S	.	*			trans	-168.1	4.7	-178.1	0	0	0	0	0	120.2	T898 R904	T898-G900 PolarHBondContact O-N 3.34Å; G900-R904 PolarHBondContact O-NH2 2.73Å; G900-R904 VanDerWaalsContact O-NH2 3.1Å
901	R	49.8	Very low	45.9	Very low	220 Å²	220	117.6 Å²	117.6	83%	0.83	70%	0.701	S	S	*	*	S	Bend	trans	-108.5	-35.9	-176.1	-154.3	167.3	-74.1	-158.5	-0.8	114.2	I903	R901-I903 PolarHBondContact O-N 3.08Å
902	T	51.3	Low	46.5	Very low	124 Å²	124	116 Å²	116	76%	0.761	69%	0.691	S	S	*	*	H	α-helix	trans	-69.6	-31.4	-172.5	-22.6	0	0	0	0	115	R904 A905	T902-R904 VanDerWaalsContact C-N 3.29Å; T902-R904 PolarHBondContact O-N 2.93Å; T902-A905 PolarHBondContact O-N 3.21Å
903	I	50.5	Low	47.5	Very low	141 Å²	141	112 Å²	112	72%	0.723	68%	0.682	S	S	*	*	H	α-helix	trans	-66	-29.6	-172.7	-60.6	174.2	0	0	0	112.4	R901 A907	R901-I903 PolarHBondContact O-N 3.08Å; I903-A907 WeakPolarHBondContact O-CB 3.38Å; I903-A907 PolarHBondContact O-N 3.49Å
904	R	55.3	Low	48	Very low	181 Å²	181	112 Å²	112	68%	0.683	67%	0.669	S	S	*	*	H	α-helix	trans	-74.5	-35.1	-178.1	-88.3	174.8	-78.4	-153.2	-6.9	113.7	G900 T902 A907 V908	G900-R904 PolarHBondContact O-NH2 2.73Å; G900-R904 VanDerWaalsContact O-NH2 3.1Å; T902-R904 VanDerWaalsContact C-N 3.29Å; T902-R904 PolarHBondContact O-N 2.93Å; R904-A907 PolarHBondContact O-N 2.72Å; R904-V908 WeakPolarHBondContact O-CG2 3.33Å; R904-V908 PolarHBondContact O-N 2.96Å
905	A	50.4	Low	48.5	Very low	70 Å²	70	114.1 Å²	114.1	58%	0.579	67%	0.667	S	S	*	*	H	α-helix	trans	-62.9	-46.1	178.9	0	0	0	0	0	111.6	T902 A907 V908 A909	T902-A905 PolarHBondContact O-N 3.21Å; A905-A907 PolarHBondContact O-N 3.32Å; A905-V908 PolarHBondContact O-N 3Å; A905-A909 WeakPolarHBondContact O-CB 3.21Å; A905-A909 PolarHBondContact O-N 3.39Å
906	S	53.3	Low	49	Very low	87 Å²	87	114.3 Å²	114.3	61%	0.608	66%	0.664	S	S	*	*	H	α-helix	trans	-62.5	-42.2	175.3	179.6	0	0	0	0	112.4	A910	S906-A910 VanDerWaalsContact O-CB 3.25Å; S906-A910 WeakPolarHBondContact O-CB 3.38Å; S906-A910 PolarHBondContact O-N 3.43Å
907	A	53.9	Low	49.6	Very low	58 Å²	58	106.4 Å²	106.4	48%	0.479	64%	0.64	S	S	.	*	H	α-helix	trans	-67.4	-35.3	178.9	0	0	0	0	0	113.4	I903 R904 A905 A911	I903-A907 WeakPolarHBondContact O-CB 3.38Å; I903-A907 PolarHBondContact O-N 3.49Å; R904-A907 PolarHBondContact O-N 2.72Å; A905-A907 PolarHBondContact O-N 3.32Å; A907-A911 WeakPolarHBondContact O-CB 3.42Å; A907-A911 PolarHBondContact O-N 2.92Å
908	V	59	Low	50.3	Low	96 Å²	96	109 Å²	109	58%	0.582	64%	0.641	S	S	*	*	H	α-helix	trans	-70.4	-48.4	174.8	170.1	0	0	0	0	110.6	R904 A905 A910 A911 T912	R904-V908 WeakPolarHBondContact O-CG2 3.33Å; R904-V908 PolarHBondContact O-N 2.96Å; A905-V908 PolarHBondContact O-N 3Å; V908-A910 VanDerWaalsContact C-N 3.28Å; V908-A910 PolarHBondContact O-N 3.44Å; V908-A911 WeakPolarHBondContact O-CA 3.45Å; V908-A911 WeakPolarHBondContact O-CB 3.47Å; V908-A911 PolarHBondContact O-N 3.33Å; V908-T912 PolarHBondContact O-N 3.27Å; V908-T912 PolarHBondContact O-OG1 3.47Å
909	A	56.3	Low	50.9	Low	61 Å²	61	110.1 Å²	110.1	50%	0.504	64%	0.638	S	S	.	*	H	α-helix	trans	-58.3	-39.9	175.9	0	0	0	0	0	112.3	A905 A911 A913	A905-A909 WeakPolarHBondContact O-CB 3.21Å; A905-A909 PolarHBondContact O-N 3.39Å; A909-A911 VanDerWaalsContact C-N 3.32Å; A909-A911 PolarHBondContact O-N 3.4Å; A909-A913 VanDerWaalsContact O-CB 3.26Å; A909-A913 WeakPolarHBondContact O-CB 3.44Å; A909-A913 PolarHBondContact O-N 2.91Å
910	A	54.7	Low	52.3	Low	61 Å²	61	111.8 Å²	111.8	50%	0.504	63%	0.627	S	S	.	*	H	α-helix	trans	-70.6	-23	174.9	0	0	0	0	0	114	S906 V908	S906-A910 VanDerWaalsContact O-CB 3.25Å; S906-A910 WeakPolarHBondContact O-CB 3.38Å; S906-A910 PolarHBondContact O-N 3.43Å; V908-A910 VanDerWaalsContact C-N 3.28Å; V908-A910 PolarHBondContact O-N 3.44Å
911	A	51.2	Low	53.3	Low	58 Å²	58	116.7 Å²	116.7	48%	0.479	64%	0.638	S	S	.	*	H	α-helix	trans	-76.7	-48	172	0	0	0	0	0	110.9	A907 V908 A909 A913 H914	A907-A911 WeakPolarHBondContact O-CB 3.42Å; A907-A911 PolarHBondContact O-N 2.92Å; V908-A911 WeakPolarHBondContact O-CA 3.45Å; V908-A911 WeakPolarHBondContact O-CB 3.47Å; V908-A911 PolarHBondContact O-N 3.33Å; A909-A911 VanDerWaalsContact C-N 3.32Å; A909-A911 PolarHBondContact O-N 3.4Å; A911-A913 VanDerWaalsContact C-N 3.3Å; A911-A913 PolarHBondContact O-N 3.23Å; A911-H914 PolarHBondContact O-N 3.5Å
912	T	54.9	Low	54	Low	102 Å²	102	111.8 Å²	111.8	63%	0.626	63%	0.625	S	S	*	*	H	α-helix	trans	-57.1	-43.9	174.7	-50.6	0	0	0	0	111.2	V908 H914 M915	V908-T912 PolarHBondContact O-N 3.27Å; V908-T912 PolarHBondContact O-OG1 3.47Å; T912-H914 PolarHBondContact O-N 2.79Å; T912-M915 PolarHBondContact O-N 3.02Å
913	A	52.2	Low	55	Low	88 Å²	88	108.5 Å²	108.5	73%	0.727	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-2.1	177.9	0	0	0	0	0	115.2	A909 A911	A909-A913 VanDerWaalsContact O-CB 3.26Å; A909-A913 WeakPolarHBondContact O-CB 3.44Å; A909-A913 PolarHBondContact O-N 2.91Å; A911-A913 VanDerWaalsContact C-N 3.3Å; A911-A913 PolarHBondContact O-N 3.23Å
914	H	50.3	Low	55.9	Low	122 Å²	122	104.8 Å²	104.8	57%	0.565	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	11.9	177.4	-155.1	-39.1	0	0	0	112.8	A911 T912	A911-H914 PolarHBondContact O-N 3.5Å; T912-H914 PolarHBondContact O-N 2.79Å
915	M	46.1	Very low	56.5	Low	167 Å²	167	101.9 Å²	101.9	82%	0.823	59%	0.586	S	S	*	*	S	Bend	trans	-90.4	-3.1	175.7	-70.9	-173.3	58.1	0	0	114.8	T912	T912-M915 PolarHBondContact O-N 3.02Å
916	H	46.4	Very low	57.7	Low	161 Å²	161	101.4 Å²	101.4	75%	0.745	58%	0.579	S	S	*	*			trans	-97.5	49.9	170.6	-104.4	-84.4	0	0	0	112.4	E918	H916-E918 VanDerWaalsContact C-N 3.28Å; H916-E918 IonicContact CE1-OE1 2.7Å; H916-E918 IonicContact CG-OE1 2.62Å; H916-E918 IonicContact ND1-OE1 2.87Å; H916-E918 PolarHBondContact ND1-OE1 3.48Å; H916-E918 PolarHBondContact O-N 2.93Å
917	D	47.8	Very low	58.7	Low	81 Å²	81	104.6 Å²	104.6	43%	0.433	58%	0.577	S	S	.	*			trans	-85.6	76.6	167.2	-146.9	47.7	0	0	0	106.5	R248 E919	R248-D917 IonicContact CZ-OD2 3.12Å; R248-D917 IonicContact NH1-OD2 3.25Å; R248-D917 PolarHBondContact NH1-OD2 2.71Å; R248-D917 VanDerWaalsContact NH1-OD2 3.11Å; R248-D917 IonicContact NH2-OD2 2.96Å; R248-D917 PolarHBondContact NH2-OD2 2.92Å; D917-E919 PolarHBondContact O-N 2.89Å
918	E	55.6	Low	60	Low	152 Å²	152	106.3 Å²	106.3	71%	0.71	58%	0.582	S	S	*	*			trans	-35.8	120.2	-173	-49.7	-82.8	102.4	0	0	113.1	H916	H916-E918 VanDerWaalsContact C-N 3.28Å; H916-E918 IonicContact CE1-OE1 2.7Å; H916-E918 IonicContact CG-OE1 2.62Å; H916-E918 IonicContact ND1-OE1 2.87Å; H916-E918 PolarHBondContact ND1-OE1 3.48Å; H916-E918 PolarHBondContact O-N 2.93Å
919	E	53.4	Low	61	Low	157 Å²	157	108.5 Å²	108.5	73%	0.734	59%	0.586	S	S	*	*			trans	-84.7	116.7	170.2	-66.8	-148	137.1	0	0	109.5	D917 E921	D917-E919 PolarHBondContact O-N 2.89Å; E919-E921 PolarHBondContact O-N 3.03Å
920	D	65.1	Low	61.7	Low	117 Å²	117	110.5 Å²	110.5	63%	0.626	59%	0.585	S	S	*	*			trans	-48.2	126	178.6	-70.2	-60.6	0	0	0	111.5	E922 S923 V924	D920-E922 PolarHBondContact O-N 3.05Å; D920-S923 WeakPolarHBondContact O-CA 3.43Å; D920-S923 WeakPolarHBondContact O-CB 3.37Å; D920-S923 PolarHBondContact O-N 3.14Å; D920-V924 PolarHBondContact O-N 2.76Å
921	E	63	Low	62.7	Low	147 Å²	147	110.8 Å²	110.8	69%	0.687	58%	0.58	S	S	*	*	H	α-helix	trans	-46.6	-39	175	-73	-66.6	163.2	0	0	112.7	E919 S923 V924 M925	E919-E921 PolarHBondContact O-N 3.03Å; E921-S923 VanDerWaalsContact C-N 3.28Å; E921-S923 PolarHBondContact O-N 3.27Å; E921-V924 PolarHBondContact O-N 2.78Å; E921-V924 VanDerWaalsContact O-N 3.17Å; E921-M925 WeakPolarHBondContact O-CB 3.46Å; E921-M925 WeakPolarHBondContact O-CG 3.29Å; E921-M925 PolarHBondContact O-N 2.8Å
922	E	63.4	Low	63.8	Low	117 Å²	117	110.4 Å²	110.4	55%	0.547	58%	0.577	S	S	.	*	H	α-helix	trans	-61.2	-33.5	176.7	-167.7	-169.3	-113.3	0	0	112.9	R252 D920 S926	R252-E922 IonicContact CZ-OE2 3.68Å; R252-E922 VanDerWaalsContact CZ-OE2 3.23Å; R252-E922 IonicContact NH1-OE2 3.32Å; R252-E922 PolarHBondContact NH1-OE2 2.82Å; R252-E922 IonicContact NH2-OE2 3.43Å; R252-E922 PolarHBondContact NH2-OE2 3.3Å; D920-E922 PolarHBondContact O-N 3.05Å; E922-S926 WeakPolarHBondContact O-CB 3.42Å; E922-S926 PolarHBondContact O-N 3.4Å
923	S	71.9	Confident	64.7	Low	55 Å²	55	109 Å²	109	39%	0.385	58%	0.575	S	S	.	*	H	α-helix	trans	-71.8	-38.8	175.4	-173.9	0	0	0	0	111.5	D920 E921 R927	D920-S923 WeakPolarHBondContact O-CA 3.43Å; D920-S923 WeakPolarHBondContact O-CB 3.37Å; D920-S923 PolarHBondContact O-N 3.14Å; E921-S923 VanDerWaalsContact C-N 3.28Å; E921-S923 PolarHBondContact O-N 3.27Å; S923-R927 WeakPolarHBondContact O-CB 3.38Å; S923-R927 PolarHBondContact O-N 3.26Å
924	V	69.7	Low	65.6	Low	62 Å²	62	113.5 Å²	113.5	38%	0.376	58%	0.575	S	S	.	*	H	α-helix	trans	-68.2	-49.9	175.1	-175.2	0	0	0	0	110.1	D920 E921 S926 R927 V928	D920-V924 PolarHBondContact O-N 2.76Å; E921-V924 PolarHBondContact O-N 2.78Å; E921-V924 VanDerWaalsContact O-N 3.17Å; V924-S926 PolarHBondContact O-N 3Å; V924-R927 WeakPolarHBondContact O-CA 3.01Å; V924-R927 WeakPolarHBondContact O-CB 3.45Å; V924-R927 PolarHBondContact O-N 3.21Å; V924-V928 WeakPolarHBondContact O-CG2 3.33Å; V924-V928 PolarHBondContact O-N 3.3Å
925	M	68.6	Low	66.4	Low	120 Å²	120	112.2 Å²	112.2	59%	0.591	57%	0.569	S	S	*	*	H	α-helix	trans	-57.5	-46.3	175	-72.1	-173.1	70.3	0	0	112.2	E921 R927 V928 E929	E921-M925 WeakPolarHBondContact O-CB 3.46Å; E921-M925 WeakPolarHBondContact O-CG 3.29Å; E921-M925 PolarHBondContact O-N 2.8Å; M925-R927 PolarHBondContact O-N 2.94Å; M925-V928 PolarHBondContact O-N 3.45Å; M925-E929 WeakPolarHBondContact O-CB 3.43Å; M925-E929 PolarHBondContact O-N 3.02Å
926	S	74.9	Confident	67.2	Low	61 Å²	61	108.1 Å²	108.1	43%	0.427	56%	0.562	S	S	.	*	H	α-helix	trans	-62.4	-32.1	176	-175.8	0	0	0	0	112	E922 V924 Q930	E922-S926 WeakPolarHBondContact O-CB 3.42Å; E922-S926 PolarHBondContact O-N 3.4Å; V924-S926 PolarHBondContact O-N 3Å; S926-Q930 WeakPolarHBondContact O-CB 3.35Å; S926-Q930 PolarHBondContact O-N 3.06Å
927	R	75.3	Confident	67.7	Low	153 Å²	153	103.6 Å²	103.6	58%	0.577	56%	0.559	S	S	*	*	H	α-helix	trans	-71.4	-40.7	174.6	-169.9	61.6	177.4	149.6	8.4	112.1	S923 V924 M925 V931	S923-R927 WeakPolarHBondContact O-CB 3.38Å; S923-R927 PolarHBondContact O-N 3.26Å; V924-R927 WeakPolarHBondContact O-CA 3.01Å; V924-R927 WeakPolarHBondContact O-CB 3.45Å; V924-R927 PolarHBondContact O-N 3.21Å; M925-R927 PolarHBondContact O-N 2.94Å; R927-V931 WeakPolarHBondContact O-CG2 3.14Å; R927-V931 PolarHBondContact O-N 3.24Å; R927-V931 VanDerWaalsContact O-N 3.13Å
928	V	79.5	Confident	67.9	Low	95 Å²	95	103.9 Å²	103.9	58%	0.576	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-47.3	175.2	172.1	0	0	0	0	110.9	V924 M925 Q930 V931 A932	V924-V928 WeakPolarHBondContact O-CG2 3.33Å; V924-V928 PolarHBondContact O-N 3.3Å; M925-V928 PolarHBondContact O-N 3.45Å; V928-Q930 VanDerWaalsContact C-N 3.33Å; V928-Q930 PolarHBondContact O-N 3.29Å; V928-V931 PolarHBondContact O-N 3.3Å; V928-V931 VanDerWaalsContact O-N 3.11Å; V928-A932 WeakPolarHBondContact O-CB 3.25Å; V928-A932 PolarHBondContact O-N 3.17Å
929	E	81.5	Confident	67.5	Low	142 Å²	142	102.1 Å²	102.1	66%	0.664	56%	0.561	S	S	*	*	H	α-helix	trans	-61.3	-40.1	176.3	-174.7	175.2	-148.3	0	0	111.7	M925 V931 A932 A933	M925-E929 WeakPolarHBondContact O-CB 3.43Å; M925-E929 PolarHBondContact O-N 3.02Å; E929-V931 VanDerWaalsContact C-N 3.29Å; E929-V931 PolarHBondContact O-N 2.95Å; E929-A932 PolarHBondContact O-N 2.88Å; E929-A933 VanDerWaalsContact O-CB 3.28Å; E929-A933 WeakPolarHBondContact O-CB 3.17Å; E929-A933 PolarHBondContact O-N 2.97Å
930	Q	70.4	Confident	67.1	Low	102 Å²	102	101.8 Å²	101.8	48%	0.477	57%	0.565	S	S	.	*	H	α-helix	trans	-68.2	-24.5	175.7	-176.1	167.3	103.1	0	0	113.8	S926 V928	S926-Q930 WeakPolarHBondContact O-CB 3.35Å; S926-Q930 PolarHBondContact O-N 3.06Å; V928-Q930 VanDerWaalsContact C-N 3.33Å; V928-Q930 PolarHBondContact O-N 3.29Å
931	V	75	Confident	65.9	Low	67 Å²	67	106.6 Å²	106.6	41%	0.406	58%	0.576	S	S	.	*	H	α-helix	trans	-78.7	-48.8	169.4	170.7	0	0	0	0	109.9	R927 V928 E929 A933 Y934 E935	R927-V931 WeakPolarHBondContact O-CG2 3.14Å; R927-V931 PolarHBondContact O-N 3.24Å; R927-V931 VanDerWaalsContact O-N 3.13Å; V928-V931 PolarHBondContact O-N 3.3Å; V928-V931 VanDerWaalsContact O-N 3.11Å; E929-V931 VanDerWaalsContact C-N 3.29Å; E929-V931 PolarHBondContact O-N 2.95Å; V931-A933 VanDerWaalsContact C-N 3.32Å; V931-A933 PolarHBondContact O-N 2.86Å; V931-Y934 WeakPolarHBondContact O-CA 3.2Å; V931-Y934 WeakPolarHBondContact O-CB 3.45Å; V931-Y934 PolarHBondContact O-N 3.08Å; V931-E935 HydrophobicContact CG1-CG 4.3Å; V931-E935 PolarHBondContact O-N 3.19Å
932	A	75.1	Confident	64.8	Low	51 Å²	51	105 Å²	105	42%	0.421	58%	0.581	S	S	.	*	H	α-helix	trans	-57.6	-41.9	179.4	0	0	0	0	0	112.5	V928 E929 Y934 E935 A936	V928-A932 WeakPolarHBondContact O-CB 3.25Å; V928-A932 PolarHBondContact O-N 3.17Å; E929-A932 PolarHBondContact O-N 2.88Å; A932-Y934 VanDerWaalsContact C-N 3.28Å; A932-Y934 PolarHBondContact O-N 2.89Å; A932-E935 PolarHBondContact O-N 2.91Å; A932-A936 WeakPolarHBondContact O-CB 3.46Å; A932-A936 PolarHBondContact O-N 3.4Å
933	A	73.9	Confident	63.5	Low	71 Å²	71	107.1 Å²	107.1	59%	0.587	60%	0.596	S	S	*	*	H	α-helix	trans	-67.1	-25.7	175.7	0	0	0	0	0	113.5	E929 V931 G937	E929-A933 VanDerWaalsContact O-CB 3.28Å; E929-A933 WeakPolarHBondContact O-CB 3.17Å; E929-A933 PolarHBondContact O-N 2.97Å; V931-A933 VanDerWaalsContact C-N 3.32Å; V931-A933 PolarHBondContact O-N 2.86Å; A933-G937 PolarHBondContact O-N 3.34Å
934	Y	71.4	Confident	61.9	Low	184 Å²	184	109.1 Å²	109.1	72%	0.722	61%	0.61	S	S	*	*	H	α-helix	trans	-81.1	-38.5	175.9	-151.3	-107	0	0	0	111.5	V931 A932 G937 S938	V931-Y934 WeakPolarHBondContact O-CA 3.2Å; V931-Y934 WeakPolarHBondContact O-CB 3.45Å; V931-Y934 PolarHBondContact O-N 3.08Å; A932-Y934 VanDerWaalsContact C-N 3.28Å; A932-Y934 PolarHBondContact O-N 2.89Å; Y934-G937 PolarHBondContact O-N 3.01Å; Y934-S938 PolarHBondContact O-OG 2.98Å
935	E	67.1	Low	60.5	Low	94 Å²	94	110.8 Å²	110.8	44%	0.439	63%	0.631	S	S	.	*	H	α-helix	trans	-71.5	-38.1	175	-64.1	-165.4	109.1	0	0	112.4	K742 V931 A932 G937 S938	K742-E935 IonicContact NZ-OE1 3.21Å; K742-E935 PolarHBondContact NZ-OE1 2.89Å; K742-E935 IonicContact NZ-OE2 3.77Å; K742-E935 PolarHBondContact NZ-OE2 3.01Å; V931-E935 HydrophobicContact CG1-CG 4.3Å; V931-E935 PolarHBondContact O-N 3.19Å; A932-E935 PolarHBondContact O-N 2.91Å; E935-G937 VanDerWaalsContact C-N 3.26Å; E935-G937 PolarHBondContact O-N 3.43Å; E935-S938 PolarHBondContact O-N 3.45Å; E935-S938 VanDerWaalsContact O-N 3.16Å
936	A	62.8	Low	59.2	Low	81 Å²	81	110.3 Å²	110.3	67%	0.669	64%	0.639	S	S	*	*	H	α-helix	trans	-67.8	-24.2	174.4	0	0	0	0	0	113.1	A932 S938	A932-A936 WeakPolarHBondContact O-CB 3.46Å; A932-A936 PolarHBondContact O-N 3.4Å; A936-S938 VanDerWaalsContact C-N 3.27Å; A936-S938 PolarHBondContact O-N 3.47Å
937	G	57.2	Low	57.6	Low	67 Å²	67	115 Å²	115	69%	0.691	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	4.7	172.7	0	0	0	0	0	114.7	A933 Y934 E935	A933-G937 PolarHBondContact O-N 3.34Å; Y934-G937 PolarHBondContact O-N 3.01Å; E935-G937 VanDerWaalsContact C-N 3.26Å; E935-G937 PolarHBondContact O-N 3.43Å
938	S	52	Low	56.1	Low	86 Å²	86	111 Å²	111	60%	0.601	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	3.7	-170.1	-60.4	0	0	0	0	114.5	Y934 E935 A936	Y934-S938 PolarHBondContact O-OG 2.98Å; E935-S938 PolarHBondContact O-N 3.45Å; E935-S938 VanDerWaalsContact O-N 3.16Å; A936-S938 VanDerWaalsContact C-N 3.27Å; A936-S938 PolarHBondContact O-N 3.47Å
939	I	47	Very low	54.8	Low	115 Å²	115	111.9 Å²	111.9	59%	0.59	68%	0.675	S	S	*	*	S	Bend	trans	-140.7	83.6	-178.1	-50.2	177.5	0	0	0	109.5
940	D	44.9	Very low	54.1	Low	151 Å²	151	110.4 Å²	110.4	81%	0.807	68%	0.678	S	S	*	*			trans	-177.2	102.4	159	-100.5	-27	0	0	0	108.8
941	Y	39.2	Very low	53.9	Low	217 Å²	217	111.1 Å²	111.1	85%	0.851	69%	0.691	S	S	*	*			trans	173.5	84	155.1	-88.8	-55.8	0	0	0	110
942	S	40.4	Very low	53.8	Low	115 Å²	115	113.4 Å²	113.4	80%	0.804	71%	0.708	S	S	*	*			trans	-157.9	70.1	173.1	56.9	0	0	0	0	113.3
943	N	36.6	Very low	53.6	Low	160 Å²	160	116.5 Å²	116.5	86%	0.856	72%	0.723	S	S	*	*			trans	177.7	153.7	158.8	-97	-19.2	0	0	0	108.5
944	S	38.5	Very low	53.5	Low	98 Å²	98	118.7 Å²	118.7	69%	0.685	73%	0.731	S	S	*	*			cis	-167.8	157.7	-24.1	47.3	0	0	0	0	110.2
945	A	38.5	Very low	53.5	Low	97 Å²	97	115.3 Å²	115.3	80%	0.802	73%	0.732	S	S	*	*			trans	71.3	147.7	165.1	0	0	0	0	0	120.6
946	S	41.2	Very low	53.7	Low	109 Å²	109	116.3 Å²	116.3	76%	0.762	75%	0.747	S	S	*	*			trans	67	133.6	162.4	-156.6	0	0	0	0	119.1
947	L	43.2	Very low	54.1	Low	161 Å²	161	117.9 Å²	117.9	84%	0.843	75%	0.75	S	S	*	*			cis	-154.4	142.8	-22	-114.5	175.4	0	0	0	106.5
948	G	43.1	Very low	54.4	Low	69 Å²	69	120 Å²	120	71%	0.711	75%	0.751	S	S	*	*			trans	164.4	80	-178.2	0	0	0	0	0	112.9
949	S	51.6	Low	54.2	Low	112 Å²	112	121.6 Å²	121.6	78%	0.783	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-65.5	127	-175.4	-54.2	0	0	0	0	112
950	P	66.8	Low	54.1	Low	112 Å²	112	124 Å²	124	73%	0.727	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66	152.8	166.5	29.9	-34.1	0	0	0	110.1
951	P	67.5	Low	53.9	Low	117 Å²	117	120.5 Å²	120.5	76%	0.76	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-63	148.1	177.7	27.2	-34.8	0	0	0	111.2
952	P	71.4	Confident	54.1	Low	115 Å²	115	119.4 Å²	119.4	75%	0.747	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-63.7	148.7	178.3	27.7	-35	0	0	0	111.3
953	P	71.8	Confident	54	Low	115 Å²	115	118.9 Å²	118.9	75%	0.747	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-63.3	147.5	174.4	28.3	-34.8	0	0	0	110.7
954	P	71.9	Confident	54.1	Low	117 Å²	117	116.9 Å²	116.9	76%	0.76	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-63.1	145.4	175.4	27.9	-34.7	0	0	0	110.7
955	P	71.8	Confident	54.3	Low	114 Å²	114	118.6 Å²	118.6	74%	0.74	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-63.9	148.6	177.1	27.8	-34.8	0	0	0	111
956	P	70.4	Confident	54.6	Low	115 Å²	115	117 Å²	117	75%	0.747	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-62.1	145.6	174	27.5	-34.5	0	0	0	110.5
957	P	70.5	Confident	54.9	Low	114 Å²	114	117.9 Å²	117.9	74%	0.74	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-62.9	142.2	178.4	26.9	-34.4	0	0	0	110.8	S959	P957-S959 PolarHBondContact O-N 3.28Å
958	P	65.1	Low	54.8	Low	110 Å²	110	114.5 Å²	114.5	71%	0.714	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-63.6	137.5	-178.6	26.6	-34.5	0	0	0	111.1	L960	P958-L960 PolarHBondContact O-N 3.45Å
959	S	46	Very low	54.8	Low	121 Å²	121	117.1 Å²	117.1	85%	0.846	75%	0.748	S	S	*	*			trans	-71.5	85.6	-179.5	-49.9	0	0	0	0	111.3	P957 S961	P957-S959 PolarHBondContact O-N 3.28Å; S959-S961 PolarHBondContact O-N 3.09Å
960	L	46.7	Very low	54	Low	165 Å²	165	119.7 Å²	119.7	86%	0.864	75%	0.748	S	S	*	*			trans	-68.6	99.8	171.1	-65.9	-178.1	0	0	0	109.8	P958	P958-L960 PolarHBondContact O-N 3.45Å
961	S	39.8	Very low	52.8	Low	78 Å²	78	121.2 Å²	121.2	55%	0.545	75%	0.749	S	S	.	*			trans	-77.6	177.3	164.5	48.8	0	0	0	0	111	S959	S959-S961 PolarHBondContact O-N 3.09Å
962	F	42.7	Very low	51.2	Low	194 Å²	194	124 Å²	124	85%	0.851	75%	0.752	S	S	*	*			trans	73	136.2	-177.8	-43.9	-71.8	0	0	0	114.8
963	S	39.9	Very low	49.6	Very low	104 Å²	104	122 Å²	122	73%	0.727	74%	0.744	S	S	*	*			cis	-171	139.7	-11	48.5	0	0	0	0	111.7
964	S	38.4	Very low	48.1	Very low	118 Å²	118	125.3 Å²	125.3	83%	0.825	75%	0.747	S	S	*	*			trans	63.1	152.4	159.8	-119.9	0	0	0	0	117.3
965	V	41.8	Very low	46.7	Very low	134 Å²	134	125.9 Å²	125.9	81%	0.812	75%	0.749	S	S	*	*			cis	-136.1	146.8	12.3	-167.2	0	0	0	0	109.4
966	G	45.3	Very low	45.3	Very low	64 Å²	64	125.9 Å²	125.9	66%	0.66	75%	0.751	S	S	*	*			trans	-96.7	-143.8	170.8	0	0	0	0	0	112.5
967	P	47.8	Very low	44.1	Very low	126 Å²	126	126.1 Å²	126.1	82%	0.818	75%	0.753	S	S	*	*			cis	-111.8	-164.9	-12	42.5	-28.7	0	0	0	110.5
968	S	41.1	Very low	42.7	Very low	90 Å²	90	125.4 Å²	125.4	63%	0.629	75%	0.751	S	S	*	*			cis	-171	159.7	28.9	-116.9	0	0	0	0	106.7
969	D	42	Very low	42.2	Very low	125 Å²	125	125 Å²	125	67%	0.668	75%	0.746	S	S	*	*			cis	-140.5	140.1	0.8	-72.3	-51.9	0	0	0	107.3
970	Q	35.8	Very low	42.8	Very low	165 Å²	165	125.8 Å²	125.8	77%	0.771	74%	0.741	S	S	*	*				50.2	131.5	83.5	-61.8	-171.3	97.2	0	0	114.1
971	L	40.7	Very low	43.4	Very low	144 Å²	144	127 Å²	127	75%	0.754	74%	0.742	S	S	*	*			cis	-140.2	141.8	26.2	-64.4	159.5	0	0	0	109.8
972	E	34.3	Very low	45	Very low	177 Å²	177	127.2 Å²	127.2	83%	0.827	74%	0.736	S	S	*	*				59.5	136.6	77.7	-84.2	-138.9	114.6	0	0	116.1
973	A	39	Very low	46.8	Very low	71 Å²	71	123 Å²	123	59%	0.587	72%	0.723	S	S	*	*			cis	-164.4	-175.2	8.4	0	0	0	0	0	114.3
974	K	40.2	Very low	48.8	Very low	186 Å²	186	121.3 Å²	121.3	81%	0.809	71%	0.705	S	S	*	*			trans	100.4	79.6	153	-52.9	-162.8	-179.8	-173.7	0	122
975	T	40.5	Very low	51	Low	128 Å²	128	119.8 Å²	119.8	79%	0.785	69%	0.688	S	S	*	*				47	129.6	118.6	57.1	0	0	0	0	123
976	S	42.6	Very low	53.1	Low	114 Å²	114	116.1 Å²	116.1	80%	0.797	67%	0.668	S	S	*	*			trans	144	160.1	139.4	-61.1	0	0	0	0	111.3
977	P	45.6	Very low	54.9	Low	121 Å²	121	120.1 Å²	120.1	79%	0.786	66%	0.663	S	S	*	*				-105.1	167.7	-110	12.3	11.3	0	0	0	114.7
978	S	40.5	Very low	56.4	Low	98 Å²	98	117.7 Å²	117.7	69%	0.685	64%	0.643	S	S	*	*			trans	-74.4	157	175.1	115.3	0	0	0	0	112.3	D980	S978-D980 WeakPolarHBondContact CB-OD2 3.24Å; S978-D980 PolarHBondContact OG-OD2 3.23Å
979	V	56.1	Low	58.3	Low	103 Å²	103	119.6 Å²	119.6	62%	0.624	64%	0.641	S	S	*	*			trans	-118.9	19.6	-170.6	-65.4	0	0	0	0	112.8	H981	V979-H981 PolarHBondContact O-N 2.72Å; V979-H981 VanDerWaalsContact O-N 3.11Å
980	D	58.6	Low	60.3	Low	137 Å²	137	118.4 Å²	118.4	73%	0.733	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	8	-163.9	-56.6	-64.6	0	0	0	114.9	S978	S978-D980 WeakPolarHBondContact CB-OD2 3.24Å; S978-D980 PolarHBondContact OG-OD2 3.23Å
981	H	58	Low	62.3	Low	191 Å²	191	118.1 Å²	118.1	88%	0.884	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.1	46.9	178.1	-162.1	42.4	0	0	0	112.9	V979	V979-H981 PolarHBondContact O-N 2.72Å; V979-H981 VanDerWaalsContact O-N 3.11Å
982	L	75	Confident	64.1	Low	82 Å²	82	117.2 Å²	117.2	43%	0.429	62%	0.624	S	S	.	*			trans	-110	134	165.4	-69.5	176.5	0	0	0	110.6	L990	L982-L990 HydrophobicContact CD1-CD2 4.36Å
983	D	79.9	Confident	66	Low	106 Å²	106	112.3 Å²	112.3	57%	0.567	61%	0.61	S	S	*	*			trans	-59.5	158.1	172.3	172.5	56.2	0	0	0	112.1	D985 S986 R987	D983-D985 VanDerWaalsContact C-N 3.33Å; D983-D985 PolarHBondContact O-N 2.86Å; D983-D985 PolarHBondContact OD2-N 2.83Å; D983-D985 VanDerWaalsContact OD2-N 3.08Å; D983-S986 WeakPolarHBondContact O-CB 3.47Å; D983-S986 PolarHBondContact O-N 2.87Å; D983-R987 WeakPolarHBondContact O-CB 3.34Å; D983-R987 PolarHBondContact O-N 3.5Å
984	L	81.4	Confident	67.3	Low	68 Å²	68	112.1 Å²	112.1	36%	0.356	61%	0.608	S	S	.	*	H	α-helix	trans	-58.7	-42.4	-177.1	-174.9	61.5	0	0	0	112.2	R987 I988	L984-R987 PolarHBondContact O-N 3.11Å; L984-I988 HydrophobicContact CD1-CD1 4.21Å; L984-I988 HydrophobicContact CD1-CG1 4.46Å; L984-I988 HydrophobicContact CG-CD1 3.89Å; L984-I988 WeakPolarHBondContact O-CB 3.31Å; L984-I988 VanDerWaalsContact O-CG1 3.27Å; L984-I988 WeakPolarHBondContact O-CG1 3.39Å; L984-I988 PolarHBondContact O-N 3.21Å
985	D	84.5	Confident	68.1	Low	86 Å²	86	106.8 Å²	106.8	46%	0.46	60%	0.599	S	S	.	*	H	α-helix	trans	-70.3	-37.8	178.7	-99.6	12	0	0	0	111.6	D983 R987 I988 Q989	D983-D985 VanDerWaalsContact C-N 3.33Å; D983-D985 PolarHBondContact O-N 2.86Å; D983-D985 PolarHBondContact OD2-N 2.83Å; D983-D985 VanDerWaalsContact OD2-N 3.08Å; D985-R987 VanDerWaalsContact C-N 3.28Å; D985-R987 PolarHBondContact O-N 3.01Å; D985-I988 PolarHBondContact O-N 3.35Å; D985-Q989 WeakPolarHBondContact O-CB 3.4Å; D985-Q989 WeakPolarHBondContact O-CG 3.37Å; D985-Q989 PolarHBondContact O-N 3.12Å
986	S	87.1	Confident	68.4	Low	57 Å²	57	105.6 Å²	105.6	40%	0.399	60%	0.596	S	S	.	*	H	α-helix	trans	-61.5	-38.6	172	-66.5	0	0	0	0	111.8	D983 L990	D983-S986 WeakPolarHBondContact O-CB 3.47Å; D983-S986 PolarHBondContact O-N 2.87Å; S986-L990 WeakPolarHBondContact O-CB 3.38Å; S986-L990 PolarHBondContact O-N 3.11Å
987	R	81.8	Confident	68.6	Low	148 Å²	148	104.6 Å²	104.6	56%	0.558	59%	0.589	S	S	*	*	H	α-helix	trans	-74.4	-32.2	177.9	-163.9	172.2	65.6	-160.4	-1.4	112.5	D983 L984 D985 F991	D983-R987 WeakPolarHBondContact O-CB 3.34Å; D983-R987 PolarHBondContact O-N 3.5Å; L984-R987 PolarHBondContact O-N 3.11Å; D985-R987 VanDerWaalsContact C-N 3.28Å; D985-R987 PolarHBondContact O-N 3.01Å; R987-F991 WeakPolarHBondContact O-CB 3.44Å; R987-F991 PolarHBondContact O-N 2.84Å
988	I	80.3	Confident	68.5	Low	75 Å²	75	107.9 Å²	107.9	39%	0.385	59%	0.594	S	S	.	*	H	α-helix	trans	-70.1	-44.9	171.7	-72.2	167.1	0	0	0	110.4	L984 D985 L990 F991 M992	L984-I988 HydrophobicContact CD1-CD1 4.21Å; L984-I988 HydrophobicContact CD1-CG1 4.46Å; L984-I988 HydrophobicContact CG-CD1 3.89Å; L984-I988 WeakPolarHBondContact O-CB 3.31Å; L984-I988 VanDerWaalsContact O-CG1 3.27Å; L984-I988 WeakPolarHBondContact O-CG1 3.39Å; L984-I988 PolarHBondContact O-N 3.21Å; D985-I988 PolarHBondContact O-N 3.35Å; I988-L990 PolarHBondContact O-N 2.98Å; I988-F991 PolarHBondContact O-N 3.16Å; I988-M992 HydrophobicContact CG2-CG 4.33Å; I988-M992 HydrophobicContact CG2-SD 3.86Å; I988-M992 WeakPolarHBondContact O-CB 3.46Å; I988-M992 WeakPolarHBondContact O-CG 3.34Å; I988-M992 PolarHBondContact O-N 3.35Å
989	Q	81.4	Confident	68.4	Low	129 Å²	129	113.2 Å²	113.2	60%	0.603	61%	0.605	S	S	*	*	H	α-helix	trans	-58.7	-46.8	173.4	-75	-173.3	21.5	0	0	111	D985 F991 M992 S993	D985-Q989 WeakPolarHBondContact O-CB 3.4Å; D985-Q989 WeakPolarHBondContact O-CG 3.37Å; D985-Q989 PolarHBondContact O-N 3.12Å; Q989-F991 VanDerWaalsContact C-N 3.32Å; Q989-F991 PolarHBondContact O-N 3.48Å; Q989-M992 PolarHBondContact O-N 3.12Å; Q989-S993 WeakPolarHBondContact O-CB 3.4Å; Q989-S993 PolarHBondContact O-N 2.98Å; Q989-S993 PolarHBondContact O-OG 2.94Å
990	L	82.2	Confident	67.4	Low	100 Å²	100	113.5 Å²	113.5	52%	0.524	61%	0.611	S	S	.	*	H	α-helix	trans	-59.7	-41.2	175.8	-174.5	62.7	0	0	0	112.1	L982 S986 I988 A994	L982-L990 HydrophobicContact CD1-CD2 4.36Å; S986-L990 WeakPolarHBondContact O-CB 3.38Å; S986-L990 PolarHBondContact O-N 3.11Å; I988-L990 PolarHBondContact O-N 2.98Å; L990-A994 VanDerWaalsContact O-CB 3.27Å; L990-A994 WeakPolarHBondContact O-CB 3.34Å; L990-A994 PolarHBondContact O-N 2.86Å
991	F	79.1	Confident	66.4	Low	159 Å²	159	113.2 Å²	113.2	70%	0.697	61%	0.614	S	S	*	*	H	α-helix	trans	-66.5	-41.4	176.4	-171.8	-100	0	0	0	112.6	R987 I988 Q989 A995	R987-F991 WeakPolarHBondContact O-CB 3.44Å; R987-F991 PolarHBondContact O-N 2.84Å; I988-F991 PolarHBondContact O-N 3.16Å; Q989-F991 VanDerWaalsContact C-N 3.32Å; Q989-F991 PolarHBondContact O-N 3.48Å; F991-A995 VanDerWaalsContact O-CB 3.23Å; F991-A995 WeakPolarHBondContact O-CB 3.39Å; F991-A995 PolarHBondContact O-N 2.85Å
992	M	77.6	Confident	65.2	Low	125 Å²	125	115.3 Å²	115.3	62%	0.616	61%	0.614	S	S	*	*	H	α-helix	trans	-68.6	-40.5	176.4	-71.5	179.1	66.2	0	0	112.2	I988 Q989 A995 S996	I988-M992 HydrophobicContact CG2-CG 4.33Å; I988-M992 HydrophobicContact CG2-SD 3.86Å; I988-M992 WeakPolarHBondContact O-CB 3.46Å; I988-M992 WeakPolarHBondContact O-CG 3.34Å; I988-M992 PolarHBondContact O-N 3.35Å; Q989-M992 PolarHBondContact O-N 3.12Å; M992-A995 PolarHBondContact O-N 3.43Å; M992-S996 PolarHBondContact O-N 3.06Å
993	S	74.8	Confident	63.5	Low	74 Å²	74	116.1 Å²	116.1	52%	0.517	63%	0.627	S	S	.	*	H	α-helix	trans	-64.3	-43.9	174.3	-63	0	0	0	0	111.5	Q989 S996	Q989-S993 WeakPolarHBondContact O-CB 3.4Å; Q989-S993 PolarHBondContact O-N 2.98Å; Q989-S993 PolarHBondContact O-OG 2.94Å; S993-S996 PolarHBondContact O-N 3.49Å
994	A	66.6	Low	61.3	Low	67 Å²	67	116.1 Å²	116.1	55%	0.554	64%	0.635	S	S	*	*	H	α-helix	trans	-63.4	-43.2	174.1	0	0	0	0	0	112.1	L990 S996 S997	L990-A994 VanDerWaalsContact O-CB 3.27Å; L990-A994 WeakPolarHBondContact O-CB 3.34Å; L990-A994 PolarHBondContact O-N 2.86Å; A994-S996 PolarHBondContact O-N 3.4Å; A994-S997 PolarHBondContact O-N 2.89Å; A994-S997 VanDerWaalsContact O-N 3.11Å
995	A	56.5	Low	59.1	Low	75 Å²	75	120.7 Å²	120.7	62%	0.62	66%	0.66	S	S	*	*	H	α-helix	trans	-64.2	-22.3	176.7	0	0	0	0	0	113.5	F991 M992 S997	F991-A995 VanDerWaalsContact O-CB 3.23Å; F991-A995 WeakPolarHBondContact O-CB 3.39Å; F991-A995 PolarHBondContact O-N 2.85Å; M992-A995 PolarHBondContact O-N 3.43Å; A995-S997 VanDerWaalsContact C-N 3.3Å
996	S	47.1	Very low	57	Low	103 Å²	103	122 Å²	122	72%	0.72	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-6.1	175	-166.7	0	0	0	0	114.2	M992 S993 A994	M992-S996 PolarHBondContact O-N 3.06Å; S993-S996 PolarHBondContact O-N 3.49Å; A994-S996 PolarHBondContact O-N 3.4Å
997	S	45.8	Very low	54.7	Low	93 Å²	93	126.7 Å²	126.7	65%	0.65	70%	0.696	S	S	*	*	S	Bend	trans	-118.8	43.1	-173	-66.6	0	0	0	0	114.6	A994 A995	A994-S997 PolarHBondContact O-N 2.89Å; A994-S997 VanDerWaalsContact O-N 3.11Å; A995-S997 VanDerWaalsContact C-N 3.3Å
998	Q	43.9	Very low	52.9	Low	189 Å²	189	124.8 Å²	124.8	88%	0.883	70%	0.703	S	S	*	*			trans	-159.4	94.1	160.8	-119.2	162	74.3	0	0	114
999	K	38.1	Very low	50.7	Low	211 Å²	211	127.3 Å²	127.3	92%	0.917	72%	0.722	S	S	*	*			trans	-152.2	123.9	159.4	-157.1	170.3	-174.2	176.6	0	114.9
1000	S	35.6	Very low	48.7	Very low	109 Å²	109	128 Å²	128	76%	0.762	73%	0.728	S	S	*	*			trans	79.1	158.4	163.4	-151.6	0	0	0	0	118.2
1001	V	37.4	Very low	46.6	Very low	131 Å²	131	128.3 Å²	128.3	79%	0.794	74%	0.739	S	S	*	*			trans	68.9	116.1	179.6	-170.5	0	0	0	0	113.2
1002	R	33.3	Very low	44.6	Very low	234 Å²	234	127.4 Å²	127.4	88%	0.883	75%	0.746	S	S	*	*			cis	-152.9	150.7	6.8	-147.8	175.4	-178.7	165.9	-1.9	111.6
1003	S	38.2	Very low	42.7	Very low	100 Å²	100	124.7 Å²	124.7	70%	0.699	75%	0.75	S	S	*	*			trans	-72.6	156.9	161.3	-58.9	0	0	0	0	111.7
1004	S	34.5	Very low	41.1	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	77%	0.765	S	S	*	*			trans	50.5	120.7	155.3	61.6	0	0	0	0	119.1
1005	N	35.4	Very low	39.9	Very low	164 Å²	164	132.1 Å²	132.1	88%	0.877	77%	0.773	S	S	*	*				-148.9	141.7	124.8	-116.7	-1.3	0	0	0	111.4
1006	S	40.6	Very low	38.8	Very low	112 Å²	112	135.9 Å²	135.9	78%	0.783	78%	0.778	S	S	*	*			trans	-77.1	157.1	171	40.7	0	0	0	0	111.2
1007	N	37.8	Very low	38.4	Very low	157 Å²	157	138.3 Å²	138.3	84%	0.84	78%	0.78	S	S	*	*			trans	-89.1	172	-176.4	-117.3	-22.7	0	0	0	111.6
1008	P	43.9	Very low	38	Very low	108 Å²	108	140.1 Å²	140.1	70%	0.701	79%	0.787	S	S	*	*				-120	-169.6	-121.8	42.9	-30.4	0	0	0	112.8
1009	V	35.4	Very low	37.8	Very low	128 Å²	128	136.8 Å²	136.8	78%	0.776	78%	0.782	S	S	*	*			trans	-157.8	117.7	157.8	123.2	0	0	0	0	114.3
1010	I	38	Very low	37.9	Very low	144 Å²	144	136.3 Å²	136.3	74%	0.738	78%	0.78	S	S	*	*			trans	63.9	137.9	139.2	-63.1	169.9	0	0	0	122.7
1011	S	38.4	Very low	37.8	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	78%	0.778	S	S	*	*			trans	71.8	153.4	157.9	-76.5	0	0	0	0	120.6
1012	V	37.1	Very low	37.8	Very low	139 Å²	139	138 Å²	138	84%	0.842	78%	0.782	S	S	*	*			cis	178.1	137.7	-42.6	134.8	0	0	0	0	107
1013	G	38	Very low	37.9	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	77%	0.765	S	S	*	*			trans	100.6	140.8	174.4	0	0	0	0	0	113.3
1014	K	41.4	Very low	38	Very low	191 Å²	191	133.9 Å²	133.9	83%	0.83	77%	0.77	S	S	*	*			cis	170.1	156.5	-12.9	-119	177.3	-174.4	-172	0	103.6
1015	S	40.9	Very low	38	Very low	106 Å²	106	136.2 Å²	136.2	74%	0.741	77%	0.769	S	S	*	*			trans	62.7	149.8	166	38.8	0	0	0	0	118.4
1016	E	34	Very low	38	Very low	154 Å²	154	134.9 Å²	134.9	72%	0.72	76%	0.76	S	S	*	*			cis	-174.1	161	-15.5	173.7	157.4	167.8	0	0	110.7
1017	M	39	Very low	37.8	Very low	155 Å²	155	135.8 Å²	135.8	76%	0.764	75%	0.752	S	S	*	*			trans	64.9	165.6	166.7	-78.8	164.3	-174.9	0	0	119.3
1018	T	36.3	Very low	37.9	Very low	130 Å²	130	135.4 Å²	135.4	80%	0.798	75%	0.745	S	S	*	*				-163.4	158.8	-74	23.1	0	0	0	0	110.3
1019	P	40.4	Very low	37.5	Very low	120 Å²	120	136.2 Å²	136.2	78%	0.779	74%	0.744	S	S	*	*			trans	-101.7	164.9	-172.4	38.9	-35.5	0	0	0	116.4
1020	K	39.6	Very low	37.6	Very low	201 Å²	201	134.4 Å²	134.4	87%	0.874	74%	0.736	S	S	*	*			trans	-138.6	139.6	153.5	-72	-178.2	176.1	179.5	0	107.1
1021	A	35	Very low	37.5	Very low	87 Å²	87	133.4 Å²	133.4	72%	0.719	74%	0.738	S	S	*	*			cis	88.1	133.1	27.1	0	0	0	0	0	114.9
1022	Q	36.1	Very low	37.1	Very low	189 Å²	189	132.9 Å²	132.9	88%	0.883	73%	0.734	S	S	*	*			trans	69.7	149.2	172.5	-67.7	175.5	-24.5	0	0	115.7
1023	S	36	Very low	37.1	Very low	75 Å²	75	133.4 Å²	133.4	52%	0.524	73%	0.73	S	S	.	*			cis	-168.2	169.3	-8	-121.1	0	0	0	0	112.5
1024	H	40.9	Very low	36.9	Very low	171 Å²	171	135.4 Å²	135.4	79%	0.792	73%	0.729	S	S	*	*			trans	53.4	120.4	145.4	-57.6	-33.7	0	0	0	119.7
1025	H	33.7	Very low	36.5	Very low	156 Å²	156	131.2 Å²	131.2	72%	0.722	72%	0.724	S	S	*	*				107.3	168.6	71.9	-177	46.3	0	0	0	110.1
1026	I	36.2	Very low	36.2	Very low	135 Å²	135	131.1 Å²	131.1	69%	0.692	72%	0.723	S	S	*	*			trans	70	137.4	173.2	-53.2	-175.8	0	0	0	114.9
1027	Q	35.5	Very low	36.1	Very low	132 Å²	132	129.8 Å²	129.8	62%	0.617	73%	0.726	S	S	*	*			cis	-176.5	166.3	-32.9	-132.5	179.9	-3.3	0	0	107.9
1028	Q	40.8	Very low	36	Very low	148 Å²	148	126.9 Å²	126.9	69%	0.692	72%	0.721	S	S	*	*			trans	66.3	154.8	150.2	-73.3	177	45.8	0	0	117.6
1029	N	34.2	Very low	36.1	Very low	126 Å²	126	126.4 Å²	126.4	67%	0.674	72%	0.722	S	S	*	*			cis	-155.4	166	-15.2	-136.3	-7.3	0	0	0	110.2
1030	S	38.4	Very low	35.9	Very low	89 Å²	89	124.7 Å²	124.7	62%	0.622	71%	0.714	S	S	*	*			trans	60.5	142.9	144.8	-60	0	0	0	0	119.9
1031	T	35.6	Very low	35.8	Very low	124 Å²	124	119.5 Å²	119.5	76%	0.761	70%	0.703	S	S	*	*			cis	-154.5	168.2	1.1	-0.7	0	0	0	0	111.9
1032	S	31.1	Very low	35.8	Very low	94 Å²	94	121.3 Å²	121.3	66%	0.657	71%	0.705	S	S	*	*			trans	-37.3	169.1	158.4	57.4	0	0	0	0	116
1033	I	36.1	Very low	35.8	Very low	151 Å²	151	117.1 Å²	117.1	77%	0.774	70%	0.696	S	S	*	*				-150.4	143.7	74.3	-81.6	175.2	0	0	0	113.4
1034	T	34	Very low	35.8	Very low	109 Å²	109	118.1 Å²	118.1	67%	0.669	70%	0.703	S	S	*	*			trans	-36.8	143.2	168.1	51.6	0	0	0	0	115.5
1035	S	32.6	Very low	35.4	Very low	103 Å²	103	115.5 Å²	115.5	72%	0.72	70%	0.704	S	S	*	*				64.4	101.8	50.5	82.3	0	0	0	0	116.3
1036	S	33.8	Very low	35.4	Very low	105 Å²	105	114.4 Å²	114.4	73%	0.734	71%	0.708	S	S	*	*			trans	176.8	153.7	145.8	54.4	0	0	0	0	113.2
1037	T	34	Very low	35.3	Very low	126 Å²	126	115.2 Å²	115.2	77%	0.773	71%	0.713	S	S	*	*			trans	56.9	150.6	144.6	48.4	0	0	0	0	121.9
1038	S	36.6	Very low	35.3	Very low	94 Å²	94	114.3 Å²	114.3	66%	0.657	72%	0.719	S	S	*	*			cis	176.9	146.9	-28.9	47.4	0	0	0	0	109.5
1039	S	38.4	Very low	34.8	Very low	119 Å²	119	112.5 Å²	112.5	83%	0.832	72%	0.723	S	S	*	*			trans	58.9	162.9	171.5	44.3	0	0	0	0	115.8
1040	S	35.8	Very low	34.9	Very low	85 Å²	85	112.9 Å²	112.9	59%	0.594	73%	0.73	S	S	*	*			cis	-145.3	140.5	1.4	40.3	0	0	0	0	107.2
1041	S	37.9	Very low	34.5	Very low	92 Å²	92	113.4 Å²	113.4	64%	0.643	73%	0.733	S	S	*	*				53.7	141.4	65.1	74.8	0	0	0	0	114.8
1042	T	33.8	Very low	34.5	Very low	125 Å²	125	115.4 Å²	115.4	77%	0.767	74%	0.739	S	S	*	*			cis	-96.2	-136.6	-1.7	44	0	0	0	0	110.5
1043	S	37.3	Very low	34.6	Very low	100 Å²	100	115.2 Å²	115.2	70%	0.699	74%	0.738	S	S	*	*			cis	-167.3	173.1	-6.5	11	0	0	0	0	109.2
1044	S	34.6	Very low	34.5	Very low	97 Å²	97	113.4 Å²	113.4	68%	0.678	74%	0.738	S	S	*	*				173.5	163.9	-59	50.8	0	0	0	0	110
1045	S	33.8	Very low	34.8	Very low	116 Å²	116	113.6 Å²	113.6	81%	0.811	74%	0.744	S	S	*	*			trans	75.8	145.9	174.3	83.2	0	0	0	0	116.2
1046	T	33.8	Very low	35.6	Very low	132 Å²	132	112.2 Å²	112.2	81%	0.81	73%	0.734	S	S	*	*			cis	-135.7	151.4	6.5	-45.7	0	0	0	0	112.9
1047	L	33.3	Very low	36.7	Very low	152 Å²	152	114 Å²	114	80%	0.796	74%	0.735	S	S	*	*			trans	-62.7	173.4	167.6	-75	171	0	0	0	112.3
1048	P	35.6	Very low	38.1	Very low	114 Å²	114	113.5 Å²	113.5	74%	0.74	73%	0.727	S	S	*	*			cis	-142	173.9	26.2	43.2	-24	0	0	0	119
1049	S	31.3	Very low	39.5	Very low	110 Å²	110	113.2 Å²	113.2	77%	0.769	72%	0.723	S	S	*	*			trans	-72.5	131.2	165.6	52.5	0	0	0	0	112.8
1050	T	35.5	Very low	41	Very low	134 Å²	134	111.8 Å²	111.8	82%	0.822	71%	0.709	S	S	*	*			trans	-133.2	146.5	154.2	47.8	0	0	0	0	110.3
1051	S	30.5	Very low	42.4	Very low	99 Å²	99	112.3 Å²	112.3	69%	0.692	71%	0.705	S	S	*	*			trans	-76.6	176.6	175.9	51	0	0	0	0	112.1
1052	L	34.4	Very low	44.3	Very low	166 Å²	166	113.7 Å²	113.7	87%	0.869	70%	0.704	S	S	*	*			trans	73.1	153.5	174.1	-46.8	172.2	0	0	0	113.7
1053	S	34	Very low	46.3	Very low	91 Å²	91	110.5 Å²	110.5	64%	0.636	69%	0.69	S	S	*	*			cis	-159.2	172.5	-27.3	-175.1	0	0	0	0	108.5	S1055	S1053-S1055 PolarHBondContact O-N 3.35Å; S1053-S1055 PolarHBondContact O-OG 2.84Å
1054	S	32.9	Very low	48.2	Very low	112 Å²	112	112.2 Å²	112.2	78%	0.783	69%	0.685	S	S	*	*			trans	-39.2	119.8	179.2	56.4	0	0	0	0	114.8
1055	S	42	Very low	50.4	Low	113 Å²	113	116.6 Å²	116.6	79%	0.79	69%	0.687	S	S	*	*			trans	-139.2	70.1	178.7	-74.4	0	0	0	0	114.4	S1053	S1053-S1055 PolarHBondContact O-N 3.35Å; S1053-S1055 PolarHBondContact O-OG 2.84Å
1056	S	48.7	Very low	52.8	Low	75 Å²	75	117 Å²	117	52%	0.524	67%	0.674	S	S	.	*				35.6	115.1	127.3	-170.2	0	0	0	0	119.3	L1058 P1059	S1056-L1058 PolarHBondContact O-N 2.95Å; S1056-L1058 VanDerWaalsContact O-N 3.09Å; S1056-L1058 VanDerWaalsContact OG-CB 3.29Å; S1056-L1058 WeakPolarHBondContact OG-CB 3.4Å; S1056-L1058 WeakPolarHBondContact OG-CD1 3.31Å; S1056-L1058 WeakPolarHBondContact OG-CG 3.44Å; S1056-L1058 PolarHBondContact OG-N 2.92Å; S1056-P1059 WeakPolarHBondContact O-CD 3.18Å
1057	L	56.1	Low	55	Low	141 Å²	141	114.8 Å²	114.8	74%	0.738	66%	0.66	S	S	*	*	S	Bend	trans	-67.5	-0.7	167.7	-77.2	167.6	0	0	0	114.7	L1061	L1057-L1061 HydrophobicContact CB-CD1 4.43Å; L1057-L1061 PolarHBondContact O-N 2.98Å
1058	L	63.5	Low	57	Low	117 Å²	117	112.5 Å²	112.5	61%	0.613	65%	0.647	S	S	*	*	H	α-helix	trans	-62.9	-38.1	-173.6	-64.6	176.6	0	0	0	115.1	S1056 V1060 L1061 L1062	S1056-L1058 PolarHBondContact O-N 2.95Å; S1056-L1058 VanDerWaalsContact O-N 3.09Å; S1056-L1058 VanDerWaalsContact OG-CB 3.29Å; S1056-L1058 WeakPolarHBondContact OG-CB 3.4Å; S1056-L1058 WeakPolarHBondContact OG-CD1 3.31Å; S1056-L1058 WeakPolarHBondContact OG-CG 3.44Å; S1056-L1058 PolarHBondContact OG-N 2.92Å; L1058-V1060 PolarHBondContact O-N 2.88Å; L1058-L1061 PolarHBondContact O-N 3.1Å; L1058-L1062 WeakPolarHBondContact O-CB 3.4Å; L1058-L1062 PolarHBondContact O-N 3.07Å
1059	P	66.1	Low	59.1	Low	88 Å²	88	109.6 Å²	109.6	57%	0.571	63%	0.633	S	S	*	*	H	α-helix	trans	-61.7	-42.8	-178.8	-24.8	35.9	0	0	0	113.1	S1056 L1062 A1063	S1056-P1059 WeakPolarHBondContact O-CD 3.18Å; P1059-L1062 PolarHBondContact O-N 3.31Å; P1059-A1063 WeakPolarHBondContact O-CB 3.13Å; P1059-A1063 PolarHBondContact O-N 2.8Å
1060	V	69.7	Low	61.5	Low	89 Å²	89	108 Å²	108	54%	0.539	62%	0.616	S	S	.	*	H	α-helix	trans	-69.1	-38.6	179.1	-178.5	0	0	0	0	111.2	L1058 K1064	L1058-V1060 PolarHBondContact O-N 2.88Å; V1060-K1064 WeakPolarHBondContact O-CB 3.49Å; V1060-K1064 WeakPolarHBondContact O-CG 3.2Å; V1060-K1064 PolarHBondContact O-N 3.03Å
1061	L	65.7	Low	63.4	Low	96 Å²	96	109 Å²	109	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-70.3	-33.8	174.8	-71.9	172.9	0	0	0	112.6	L1057 L1058 R1065	L1057-L1061 HydrophobicContact CB-CD1 4.43Å; L1057-L1061 PolarHBondContact O-N 2.98Å; L1058-L1061 PolarHBondContact O-N 3.1Å; L1061-R1065 WeakPolarHBondContact O-CB 3.44Å; L1061-R1065 WeakPolarHBondContact O-CG 3.07Å; L1061-R1065 PolarHBondContact O-N 3.36Å
1062	L	78.7	Confident	65.4	Low	121 Å²	121	109.8 Å²	109.8	63%	0.634	61%	0.605	S	S	*	*	H	α-helix	trans	-71.4	-41.9	176.1	-174.2	60.6	0	0	0	111.2	L1058 P1059 R1065 K1066	L1058-L1062 WeakPolarHBondContact O-CB 3.4Å; L1058-L1062 PolarHBondContact O-N 3.07Å; P1059-L1062 PolarHBondContact O-N 3.31Å; L1062-R1065 PolarHBondContact O-N 2.86Å; L1062-K1066 PolarHBondContact O-N 3.32Å
1063	A	75.2	Confident	67.2	Low	57 Å²	57	104.9 Å²	104.9	47%	0.471	59%	0.588	S	S	.	*	H	α-helix	trans	-59.7	-47.6	172	0	0	0	0	0	111.6	P1059 R1065 K1066 V1067	P1059-A1063 WeakPolarHBondContact O-CB 3.13Å; P1059-A1063 PolarHBondContact O-N 2.8Å; A1063-R1065 PolarHBondContact O-N 3.02Å; A1063-K1066 PolarHBondContact O-N 2.86Å; A1063-V1067 WeakPolarHBondContact O-CG2 3.48Å; A1063-V1067 PolarHBondContact O-N 3.08Å
1064	K	77.4	Confident	68.9	Low	136 Å²	136	103.5 Å²	103.5	59%	0.591	58%	0.582	S	S	*	*	H	α-helix	trans	-61	-41.8	174.1	-75.6	-179.5	176.8	-179.9	0	112.2	V1060 I1068	V1060-K1064 WeakPolarHBondContact O-CB 3.49Å; V1060-K1064 WeakPolarHBondContact O-CG 3.2Å; V1060-K1064 PolarHBondContact O-N 3.03Å; K1064-I1068 WeakPolarHBondContact O-CD1 3.43Å; K1064-I1068 VanDerWaalsContact O-CG1 3.3Å; K1064-I1068 WeakPolarHBondContact O-CG1 3.32Å; K1064-I1068 PolarHBondContact O-N 3.2Å; K1064-I1068 VanDerWaalsContact O-N 3.14Å
1065	R	79.9	Confident	70.3	Confident	189 Å²	189	103.2 Å²	103.2	71%	0.713	58%	0.575	S	S	*	*	H	α-helix	trans	-61.7	-41.3	173.5	-86.9	-179	167.4	162.5	-2.2	112.4	L1061 L1062 A1063 I1068 A1069	L1061-R1065 WeakPolarHBondContact O-CB 3.44Å; L1061-R1065 WeakPolarHBondContact O-CG 3.07Å; L1061-R1065 PolarHBondContact O-N 3.36Å; L1062-R1065 PolarHBondContact O-N 2.86Å; A1063-R1065 PolarHBondContact O-N 3.02Å; R1065-I1068 PolarHBondContact O-N 3.45Å; R1065-A1069 WeakPolarHBondContact O-CB 3.3Å; R1065-A1069 PolarHBondContact O-N 3.23Å
1066	K	84.1	Confident	71.3	Confident	124 Å²	124	106.8 Å²	106.8	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-63.6	-47.9	178.1	-163	-163.5	179.5	-56.6	0	111.4	L1062 A1063 I1068 A1069 D1070	L1062-K1066 PolarHBondContact O-N 3.32Å; A1063-K1066 PolarHBondContact O-N 2.86Å; K1066-I1068 VanDerWaalsContact C-N 3.26Å; K1066-I1068 PolarHBondContact O-N 3.27Å; K1066-A1069 PolarHBondContact O-N 2.78Å; K1066-A1069 VanDerWaalsContact O-N 3.07Å; K1066-D1070 IonicContact NZ-OD1 2.79Å; K1066-D1070 PolarHBondContact NZ-OD1 2.55Å; K1066-D1070 IonicContact NZ-OD2 2.66Å; K1066-D1070 PolarHBondContact NZ-OD2 2.66Å; K1066-D1070 WeakPolarHBondContact O-CB 3.43Å; K1066-D1070 PolarHBondContact O-N 2.77Å
1067	V	80.7	Confident	71.8	Confident	87 Å²	87	107.4 Å²	107.4	53%	0.527	59%	0.587	S	S	.	*	H	α-helix	trans	-60.4	-35.3	177.9	174.3	0	0	0	0	112.2	A1063 K1071	A1063-V1067 WeakPolarHBondContact O-CG2 3.48Å; A1063-V1067 PolarHBondContact O-N 3.08Å; V1067-K1071 PolarHBondContact O-N 3.18Å
1068	I	75.8	Confident	71.6	Confident	103 Å²	103	105.2 Å²	105.2	53%	0.528	58%	0.583	S	S	.	*	H	α-helix	trans	-70.8	-42.5	173.9	-67.3	166.1	0	0	0	111.1	K1064 R1065 K1066 K1071 L1072	K1064-I1068 WeakPolarHBondContact O-CD1 3.43Å; K1064-I1068 VanDerWaalsContact O-CG1 3.3Å; K1064-I1068 WeakPolarHBondContact O-CG1 3.32Å; K1064-I1068 PolarHBondContact O-N 3.2Å; K1064-I1068 VanDerWaalsContact O-N 3.14Å; R1065-I1068 PolarHBondContact O-N 3.45Å; K1066-I1068 VanDerWaalsContact C-N 3.26Å; K1066-I1068 PolarHBondContact O-N 3.27Å; I1068-K1071 PolarHBondContact O-N 3.01Å; I1068-L1072 HydrophobicContact CG2-CD1 3.97Å; I1068-L1072 HydrophobicContact CG2-CG 4.5Å; I1068-L1072 WeakPolarHBondContact O-CB 3.29Å; I1068-L1072 WeakPolarHBondContact O-CG 3.44Å; I1068-L1072 PolarHBondContact O-N 2.79Å
1069	A	79	Confident	70.7	Confident	53 Å²	53	103.1 Å²	103.1	44%	0.438	59%	0.589	S	S	.	*	H	α-helix	trans	-64.2	-44.7	177.4	0	0	0	0	0	112.2	R1065 K1066 K1071 L1072 A1073	R1065-A1069 WeakPolarHBondContact O-CB 3.3Å; R1065-A1069 PolarHBondContact O-N 3.23Å; K1066-A1069 PolarHBondContact O-N 2.78Å; K1066-A1069 VanDerWaalsContact O-N 3.07Å; A1069-K1071 VanDerWaalsContact C-N 3.34Å; A1069-K1071 PolarHBondContact O-N 3.32Å; A1069-L1072 PolarHBondContact O-N 2.81Å; A1069-A1073 WeakPolarHBondContact O-CB 3.36Å; A1069-A1073 PolarHBondContact O-N 3.1Å
1070	D	80.8	Confident	69.5	Low	78 Å²	78	104.6 Å²	104.6	42%	0.417	60%	0.602	S	S	.	*	H	α-helix	trans	-60.5	-42.8	176.7	-63.2	-24.5	0	0	0	110.7	K1066 A1073 A1074	K1066-D1070 IonicContact NZ-OD1 2.79Å; K1066-D1070 PolarHBondContact NZ-OD1 2.55Å; K1066-D1070 IonicContact NZ-OD2 2.66Å; K1066-D1070 PolarHBondContact NZ-OD2 2.66Å; K1066-D1070 WeakPolarHBondContact O-CB 3.43Å; K1066-D1070 PolarHBondContact O-N 2.77Å; D1070-A1073 PolarHBondContact O-N 3.07Å; D1070-A1074 WeakPolarHBondContact O-CB 3.49Å; D1070-A1074 PolarHBondContact O-N 2.95Å
1071	K	75.6	Confident	68.1	Low	153 Å²	153	106 Å²	106	67%	0.665	61%	0.613	S	S	*	*	H	α-helix	trans	-65.1	-40.6	174.1	-83.4	-171.8	172	-176.1	0	113.2	V1067 I1068 A1069 A1074 V1075	V1067-K1071 PolarHBondContact O-N 3.18Å; I1068-K1071 PolarHBondContact O-N 3.01Å; A1069-K1071 VanDerWaalsContact C-N 3.34Å; A1069-K1071 PolarHBondContact O-N 3.32Å; K1071-A1074 PolarHBondContact O-N 3.01Å; K1071-V1075 WeakPolarHBondContact O-CG2 2.99Å; K1071-V1075 PolarHBondContact O-N 3.11Å; K1071-V1075 VanDerWaalsContact O-N 3.09Å
1072	L	72.8	Confident	66.9	Low	117 Å²	117	109.8 Å²	109.8	61%	0.613	63%	0.632	S	S	*	*	H	α-helix	trans	-68.9	-34.6	177	-73.3	171.7	0	0	0	112.2	I1068 A1069 K1076	I1068-L1072 HydrophobicContact CG2-CD1 3.97Å; I1068-L1072 HydrophobicContact CG2-CG 4.5Å; I1068-L1072 WeakPolarHBondContact O-CB 3.29Å; I1068-L1072 WeakPolarHBondContact O-CG 3.44Å; I1068-L1072 PolarHBondContact O-N 2.79Å; A1069-L1072 PolarHBondContact O-N 2.81Å; L1072-K1076 VanDerWaalsContact O-CB 3.31Å; L1072-K1076 WeakPolarHBondContact O-CB 3.33Å; L1072-K1076 PolarHBondContact O-N 3.48Å
1073	A	73.4	Confident	65	Low	62 Å²	62	113.8 Å²	113.8	51%	0.512	64%	0.644	S	S	.	*	H	α-helix	trans	-65.2	-46.1	173.1	0	0	0	0	0	111.5	A1069 D1070 V1075 K1076 A1077	A1069-A1073 WeakPolarHBondContact O-CB 3.36Å; A1069-A1073 PolarHBondContact O-N 3.1Å; D1070-A1073 PolarHBondContact O-N 3.07Å; A1073-V1075 PolarHBondContact O-N 3.03Å; A1073-K1076 PolarHBondContact O-N 3.18Å; A1073-A1077 PolarHBondContact O-N 3.15Å
1074	A	68.4	Low	63.1	Low	63 Å²	63	116.2 Å²	116.2	52%	0.521	66%	0.658	S	S	.	*	H	α-helix	trans	-58.7	-47.7	176.8	0	0	0	0	0	112.4	D1070 K1071 K1076 A1077 S1078	D1070-A1074 WeakPolarHBondContact O-CB 3.49Å; D1070-A1074 PolarHBondContact O-N 2.95Å; K1071-A1074 PolarHBondContact O-N 3.01Å; A1074-K1076 VanDerWaalsContact C-N 3.28Å; A1074-K1076 PolarHBondContact O-N 3.49Å; A1074-A1077 PolarHBondContact O-N 2.78Å; A1074-S1078 PolarHBondContact O-N 2.89Å
1075	V	62.3	Low	61.2	Low	105 Å²	105	116 Å²	116	64%	0.636	67%	0.672	S	S	*	*	H	α-helix	trans	-64.9	-31.1	177.4	172.7	0	0	0	0	112.2	K1071 A1073 S1078	K1071-V1075 WeakPolarHBondContact O-CG2 2.99Å; K1071-V1075 PolarHBondContact O-N 3.11Å; K1071-V1075 VanDerWaalsContact O-N 3.09Å; A1073-V1075 PolarHBondContact O-N 3.03Å; V1075-S1078 PolarHBondContact O-OG 2.96Å
1076	K	62.5	Low	59.1	Low	189 Å²	189	115.7 Å²	115.7	82%	0.822	68%	0.678	S	S	*	*	H	α-helix	trans	-79.2	-17.5	177.3	-165.6	167.2	-177.6	178.8	0	113.7	L1072 A1073 A1074	L1072-K1076 VanDerWaalsContact O-CB 3.31Å; L1072-K1076 WeakPolarHBondContact O-CB 3.33Å; L1072-K1076 PolarHBondContact O-N 3.48Å; A1073-K1076 PolarHBondContact O-N 3.18Å; A1074-K1076 VanDerWaalsContact C-N 3.28Å; A1074-K1076 PolarHBondContact O-N 3.49Å
1077	A	59.1	Low	57.4	Low	88 Å²	88	114.9 Å²	114.9	73%	0.727	69%	0.685	S	S	*	*	H	α-helix	trans	-78.7	-26.8	171.7	0	0	0	0	0	112.8	A1073 A1074 G1079	A1073-A1077 PolarHBondContact O-N 3.15Å; A1074-A1077 PolarHBondContact O-N 2.78Å; A1077-G1079 PolarHBondContact O-N 3.14Å
1078	S	52.9	Low	55.3	Low	95 Å²	95	116.7 Å²	116.7	66%	0.664	70%	0.696	S	S	*	*	S	Bend	trans	-97.2	67.2	-175.7	61.8	0	0	0	0	113.4	A1074 V1075	A1074-S1078 PolarHBondContact O-N 2.89Å; V1075-S1078 PolarHBondContact O-OG 2.96Å
1079	G	43.7	Very low	53.5	Low	72 Å²	72	118 Å²	118	74%	0.742	71%	0.71	S	S	*	*			trans	-168.6	95.4	177	0	0	0	0	0	115.3	A1077	A1077-G1079 PolarHBondContact O-N 3.14Å
1080	S	40.9	Very low	51.6	Low	120 Å²	120	120.5 Å²	120.5	84%	0.839	72%	0.724	S	S	*	*			trans	-132.8	142.3	172.9	-165.4	0	0	0	0	110.8
1081	P	40.7	Very low	50	Low	117 Å²	117	122.4 Å²	122.4	76%	0.76	74%	0.74	S	S	*	*			trans	-108.7	141.6	-159.3	38.4	-31.7	0	0	0	115.5
1082	I	40.5	Very low	48.4	Very low	177 Å²	177	122.7 Å²	122.7	91%	0.908	75%	0.748	S	S	*	*			trans	-128.3	156.6	169.6	-60.8	-176.1	0	0	0	110.4
1083	K	40.2	Very low	47.1	Very low	205 Å²	205	123 Å²	123	89%	0.891	76%	0.757	S	S	*	*			trans	-99.4	172.9	-154.3	-60.3	170.2	-176.3	170.6	0	114.5
1084	S	34.3	Very low	45.5	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	77%	0.766	S	S	*	*			trans	-99.3	145.6	-173.7	54.9	0	0	0	0	115.3
1085	C	37.2	Very low	44.4	Very low	131 Å²	131	126.8 Å²	126.8	89%	0.885	77%	0.774	S	S	*	*			trans	-142	164.8	161.4	-81.3	0	0	0	0	112
1086	H	36.3	Very low	43.3	Very low	182 Å²	182	128.2 Å²	128.2	84%	0.843	78%	0.782	S	S	*	*			trans	-162.3	174.7	-171.9	-87.2	-53.1	0	0	0	107.8
1087	P	48.5	Very low	42	Very low	107 Å²	107	123.4 Å²	123.4	70%	0.695	77%	0.773	S	S	*	*			cis	-138.3	-161.5	-31	31.8	-8.1	0	0	0	114
1088	V	37.3	Very low	41	Very low	126 Å²	126	125.7 Å²	125.7	76%	0.764	77%	0.773	S	S	*	*			trans	80.6	117.6	155.9	-145.3	0	0	0	0	121.2
1089	T	38	Very low	40.4	Very low	131 Å²	131	127.9 Å²	127.9	80%	0.804	78%	0.777	S	S	*	*				164.3	146.3	111.7	-58.1	0	0	0	0	113.3
1090	S	37.9	Very low	40.1	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	78%	0.776	S	S	*	*			trans	-86.4	-165.2	-172.2	-21.4	0	0	0	0	114.8
1091	P	46.7	Very low	39.9	Very low	117 Å²	117	132.5 Å²	132.5	76%	0.76	77%	0.77	S	S	*	*			cis	-137.7	175	-33.2	35	-14.9	0	0	0	116.4
1092	L	42	Very low	39.7	Very low	160 Å²	160	134.2 Å²	134.2	84%	0.838	77%	0.773	S	S	*	*			trans	23.3	148	139.7	-135	47.5	0	0	0	121.3
1093	P	45.4	Very low	39.3	Very low	123 Å²	123	132.3 Å²	132.3	80%	0.799	76%	0.764	S	S	*	*			cis	-152.2	-173.4	40.4	44.7	-22.1	0	0	0	120.6
1094	S	40.2	Very low	39.3	Very low	100 Å²	100	130.6 Å²	130.6	70%	0.699	76%	0.763	S	S	*	*			trans	-116.4	167.3	172.9	57.9	0	0	0	0	111.8
1095	P	45.5	Very low	39.3	Very low	105 Å²	105	131.3 Å²	131.3	68%	0.682	76%	0.763	S	S	*	*				-162	172.8	103	40.9	-20.7	0	0	0	119.2
1096	T	39	Very low	39.5	Very low	134 Å²	134	133.9 Å²	133.9	82%	0.822	76%	0.761	S	S	*	*			trans	62.3	155.7	148.9	47.9	0	0	0	0	121.6
1097	S	36.5	Very low	39.6	Very low	89 Å²	89	134.2 Å²	134.2	62%	0.622	76%	0.76	S	S	*	*			cis	-177.1	176.8	-18.4	-179	0	0	0	0	111
1098	N	38.1	Very low	39.3	Very low	136 Å²	136	137.5 Å²	137.5	73%	0.727	77%	0.771	S	S	*	*			trans	106.4	85.5	152.2	-52.7	-13.9	0	0	0	121.4
1099	N	39	Very low	39.4	Very low	141 Å²	141	136.4 Å²	136.4	75%	0.754	77%	0.769	S	S	*	*				61.7	136.1	112.4	-65.7	20.1	0	0	0	126.1
1100	N	37	Very low	39.4	Very low	133 Å²	133	135.6 Å²	135.6	71%	0.711	77%	0.769	S	S	*	*			trans	84.3	96.2	142.3	-67.8	25.6	0	0	0	123.8
1101	E	36.6	Very low	39.6	Very low	155 Å²	155	135.3 Å²	135.3	72%	0.724	77%	0.767	S	S	*	*				50.6	121.8	103.8	-160	-172.8	175.9	0	0	122.1
1102	L	36.7	Very low	39.3	Very low	154 Å²	154	136.8 Å²	136.8	81%	0.806	77%	0.767	S	S	*	*				-179.6	166.2	116.1	-97.4	171.6	0	0	0	114.9
1103	N	33.8	Very low	39.1	Very low	136 Å²	136	136.2 Å²	136.2	73%	0.727	76%	0.763	S	S	*	*			trans	-86.1	166.6	-175.7	-74.2	-70.7	0	0	0	114.8
1104	I	38.3	Very low	38.7	Very low	170 Å²	170	135.9 Å²	135.9	87%	0.872	76%	0.759	S	S	*	*				-177.7	164.7	119.4	-93	158	0	0	0	111.8
1105	V	36.1	Very low	38.7	Very low	123 Å²	123	136.9 Å²	136.9	75%	0.745	76%	0.761	S	S	*	*			trans	-129.1	139.1	-165.4	172.4	0	0	0	0	112.3
1106	E	40.6	Very low	38.5	Very low	184 Å²	184	137.2 Å²	137.2	86%	0.86	76%	0.763	S	S	*	*			trans	-165.5	125.8	147.3	-107.2	166.3	-178.2	0	0	108.6
1107	K	39	Very low	38.5	Very low	189 Å²	189	139.1 Å²	139.1	82%	0.822	77%	0.766	S	S	*	*				66.6	112.3	66.9	-96.4	-171.8	178.3	-179.7	0	115.8
1108	L	40.8	Very low	38.2	Very low	177 Å²	177	141 Å²	141	93%	0.927	77%	0.774	S	S	*	*				-172.6	172.3	121.6	-98.9	166.5	0	0	0	111
1109	S	39.4	Very low	38.1	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	78%	0.775	S	S	*	*			trans	-126	175.6	-157.3	-51	0	0	0	0	115.2
1110	S	39.7	Very low	37.8	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	77%	0.772	S	S	*	*			trans	90.6	149.8	167.6	-38.6	0	0	0	0	115.3
1111	S	40.5	Very low	37.8	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	78%	0.777	S	S	*	*			cis	-178.1	157.8	-15.4	-92.1	0	0	0	0	108.7
1112	I	40.3	Very low	37.5	Very low	147 Å²	147	137.5 Å²	137.5	75%	0.754	78%	0.779	S	S	*	*			cis	-155.7	-173.9	-20.6	-78.2	149.6	0	0	0	104.2
1113	I	38.1	Very low	37.5	Very low	149 Å²	149	136.7 Å²	136.7	76%	0.764	78%	0.781	S	S	*	*			trans	96.6	99.6	159.3	-52.3	-176.3	0	0	0	118.3
1114	T	37.5	Very low	37.6	Very low	115 Å²	115	135.3 Å²	135.3	71%	0.706	78%	0.778	S	S	*	*				53.4	94.1	127.8	-43	0	0	0	0	122.3
1115	T	39.6	Very low	37.4	Very low	121 Å²	121	134 Å²	134	74%	0.742	77%	0.771	S	S	*	*				23.1	162.6	119.8	68.9	0	0	0	0	122.8
1116	P	42.1	Very low	37.4	Very low	113 Å²	113	136.9 Å²	136.9	73%	0.734	78%	0.776	S	S	*	*				-142.6	134.6	-55.2	39.1	-20.8	0	0	0	114.7
1117	I	38.2	Very low	37.2	Very low	173 Å²	173	133.8 Å²	133.8	89%	0.887	77%	0.769	S	S	*	*			trans	-138.3	147	168.4	-63.7	-174.8	0	0	0	112.8
1118	T	30.9	Very low	37.5	Very low	128 Å²	128	130.5 Å²	130.5	79%	0.785	77%	0.768	S	S	*	*			trans	-53.4	129.5	-173.7	-45.1	0	0	0	0	119.4
1119	T	36.9	Very low	37.5	Very low	123 Å²	123	128.1 Å²	128.1	76%	0.755	76%	0.763	S	S	*	*			trans	-155.6	118	156	46.5	0	0	0	0	108.8
1120	T	31.6	Very low	37.2	Very low	110 Å²	110	130.8 Å²	130.8	68%	0.675	77%	0.768	S	S	*	*				69.6	143.3	75.8	61.6	0	0	0	0	117.3
1121	T	36.9	Very low	37.1	Very low	133 Å²	133	133.4 Å²	133.4	82%	0.816	77%	0.772	S	S	*	*			trans	73.7	139.1	179.2	69.7	0	0	0	0	115.8
1122	T	31.2	Very low	36.8	Very low	127 Å²	127	133.8 Å²	133.8	78%	0.779	77%	0.771	S	S	*	*			cis	107	98.3	18.5	-62.5	0	0	0	0	112.4
1123	T	36.9	Very low	36.9	Very low	136 Å²	136	136 Å²	136	83%	0.834	78%	0.775	S	S	*	*			trans	-176.9	149.1	163.4	-78.5	0	0	0	0	107.1
1124	T	35.6	Very low	36.8	Very low	108 Å²	108	140.4 Å²	140.4	66%	0.663	78%	0.782	S	S	*	*			cis	169.7	115	-32.8	-85	0	0	0	0	105.2
1125	I	33.1	Very low	36.7	Very low	143 Å²	143	142.7 Å²	142.7	73%	0.733	79%	0.789	S	S	*	*			trans	55.5	116.4	156.4	-57.3	167.4	0	0	0	119.4
1126	H	37.2	Very low	36.6	Very low	182 Å²	182	144.9 Å²	144.9	84%	0.843	80%	0.796	S	S	*	*				-155.7	140.5	120.3	-131.4	-87.2	0	0	0	112.8
1127	T	36.8	Very low	36.3	Very low	119 Å²	119	146.5 Å²	146.5	73%	0.73	80%	0.804	S	S	*	*			trans	-136.5	133	-178.4	49.8	0	0	0	0	112.3
1128	P	45.3	Very low	36.4	Very low	121 Å²	121	143 Å²	143	79%	0.786	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-93	162.6	160.9	27	-15.1	0	0	0	112.3
1129	P	40.8	Very low	37.1	Very low	127 Å²	127	146.2 Å²	146.2	83%	0.825	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-95.2	158.5	-156	35.8	-37.3	0	0	0	116.6
1130	L	32.5	Very low	37.2	Very low	159 Å²	159	148.5 Å²	148.5	83%	0.832	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-68.5	149.1	167.2	-78.6	79.6	0	0	0	112
1131	L	38	Very low	37.6	Very low	168 Å²	168	148.3 Å²	148.3	88%	0.88	81%	0.809	S	S	*	*			trans	-134	119.2	158.1	-136.2	166.2	0	0	0	109.6
1132	T	33.8	Very low	37.9	Very low	108 Å²	108	146.2 Å²	146.2	66%	0.663	80%	0.8	S	S	*	*			trans	-91.3	145.6	-164.7	53.5	0	0	0	0	113.7
1133	K	41.7	Very low	38.8	Very low	194 Å²	194	147.7 Å²	147.7	84%	0.843	80%	0.795	S	S	*	*			trans	-162.8	107.4	150.6	-107.4	144.9	-168.9	170.5	0	114
1134	R	36.2	Very low	39.5	Very low	241 Å²	241	144.4 Å²	144.4	91%	0.909	77%	0.773	S	S	*	*			trans	49.9	105.9	153.1	-66.1	-174.8	172.2	174	-2.3	118.9
1135	L	35.9	Very low	40.4	Very low	163 Å²	163	145.4 Å²	145.4	85%	0.853	77%	0.77	S	S	*	*			trans	-61.9	149	154.9	-75.4	66.6	0	0	0	110.9
1136	N	38.1	Very low	41.4	Very low	166 Å²	166	144.4 Å²	144.4	89%	0.888	76%	0.762	S	S	*	*			trans	-123	155.5	142.7	-101.3	-8.2	0	0	0	107.6	A1138	N1136-A1138 PolarHBondContact O-N 2.94Å
1137	T	34.5	Very low	42	Very low	147 Å²	147	136.3 Å²	136.3	90%	0.902	73%	0.725	S	S	*	*			trans	-83.7	114.6	-166.3	51.1	0	0	0	0	113.4
1138	A	39.9	Very low	42.7	Very low	100 Å²	100	132.2 Å²	132.2	83%	0.826	70%	0.696	S	S	*	*			trans	-108.9	154	161.2	0	0	0	0	0	110.2	N1136	N1136-A1138 PolarHBondContact O-N 2.94Å
1139	K	46.4	Very low	43.2	Very low	195 Å²	195	132.7 Å²	132.7	85%	0.848	69%	0.692	S	S	*	*			trans	-99.9	113.3	-173.1	-175.9	-178.1	177.6	-171.6	0	109.3
1140	M	37.9	Very low	43.5	Very low	171 Å²	171	131.7 Å²	131.7	84%	0.842	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-52.8	135.8	-179.4	-68.9	-69.3	-66	0	0	111.9
1141	P	41.2	Very low	44.3	Very low	107 Å²	107	124.5 Å²	124.5	70%	0.695	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-68.1	170.1	169.8	29.9	-34.4	0	0	0	111.7
1142	S	43.2	Very low	44.5	Very low	89 Å²	89	121.8 Å²	121.8	62%	0.622	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-77.7	154.4	177.4	-162.8	0	0	0	0	111.4	D1144	S1142-D1144 WeakPolarHBondContact CB-OD2 3.16Å; S1142-D1144 PolarHBondContact O-N 3.31Å; S1142-D1144 PolarHBondContact OG-OD2 3.43Å
1143	K	49	Very low	45.1	Very low	158 Å²	158	118.4 Å²	118.4	69%	0.687	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	28.7	-175.6	-62.5	-168.4	165.5	-146.5	0	114.6
1144	D	51.9	Low	44.8	Very low	66 Å²	66	117.7 Å²	117.7	35%	0.353	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102	-7.6	-169	-63.6	-76.5	0	0	0	113.2	S1142	S1142-D1144 WeakPolarHBondContact CB-OD2 3.16Å; S1142-D1144 PolarHBondContact O-N 3.31Å; S1142-D1144 PolarHBondContact OG-OD2 3.43Å
1145	E	55.9	Low	45.2	Very low	129 Å²	129	111.6 Å²	111.6	60%	0.603	61%	0.609	S	S	*	*	S	Bend	trans	-120.8	-6.2	-172.7	-54.6	-162.8	138.8	0	0	114.3	L1147 Y1148	E1145-L1147 PolarHBondContact O-N 3.46Å; E1145-Y1148 PolarHBondContact O-N 3.37Å
1146	E	53.8	Low	45.7	Very low	122 Å²	122	108.8 Å²	108.8	57%	0.57	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-13	178.3	-64.8	178.5	162.7	0	0	114.6
1147	L	49	Very low	46.1	Very low	13 Å²	13	105.7 Å²	105.7	7%	0.068	58%	0.58	C	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	-31.1	174.3	-160.8	76.2	0	0	0	113.3	F755 Q759 Q762 E1145	F755-L1147 HydrophobicContact CZ-CD2 4.24Å; Q759-L1147 HydrophobicContact CB-CD1 4.18Å; Q759-L1147 HydrophobicContact CG-CB 4.41Å; Q759-L1147 HydrophobicContact CG-CD1 3.98Å; Q759-L1147 HydrophobicContact CG-CD2 3.85Å; Q759-L1147 HydrophobicContact CG-CG 4.3Å; Q762-L1147 HydrophobicContact CB-CD1 3.59Å; Q762-L1147 HydrophobicContact CG-CD1 3.87Å; Q762-L1147 PolarHBondContact NE2-O 2.86Å; Q762-L1147 VanDerWaalsContact OE1-CG 3.26Å; E1145-L1147 PolarHBondContact O-N 3.46Å
1148	Y	51.6	Low	46.8	Very low	32 Å²	32	103.2 Å²	103.2	13%	0.125	56%	0.561	C	S	.	*	T	Hydrogen-bonded Turn	trans	-93.6	-39.1	-170.3	-86	-88.2	0	0	0	112.3	M732 K736 F755 E1145 L1150 L1151 D1152 I1153	M732-Y1148 WeakPolarHBondContact CG-OH 3.44Å; M732-Y1148 PolarHBondContact SD-OH 2.92Å; K736-Y1148 VanDerWaalsContact CE-OH 3.28Å; K736-Y1148 WeakPolarHBondContact CE-OH 3.12Å; K736-Y1148 VanDerWaalsContact NZ-CD1 3.35Å; F755-Y1148 AromaticContact CE2-CE2 3.95Å; F755-Y1148 HydrophobicContact CE2-CE2 3.95Å; F755-Y1148 HydrophobicContact CZ-CD2 4.42Å; F755-Y1148 AromaticContact CZ-CE2 3.96Å; F755-Y1148 HydrophobicContact CZ-CE2 3.96Å; E1145-Y1148 PolarHBondContact O-N 3.37Å; Y1148-L1150 PolarHBondContact O-N 3.5Å; Y1148-L1150 VanDerWaalsContact O-N 3.1Å; Y1148-L1151 PolarHBondContact O-N 3.28Å; Y1148-L1151 VanDerWaalsContact O-N 3.1Å; Y1148-D1152 PolarHBondContact O-N 2.59Å; Y1148-I1153 HydrophobicContact CD1-CB 3.81Å; Y1148-I1153 HydrophobicContact CD1-CD1 4.04Å; Y1148-I1153 HydrophobicContact CD1-CG1 4.3Å; Y1148-I1153 HydrophobicContact CE1-CB 3.94Å; Y1148-I1153 HydrophobicContact CE1-CD1 3.62Å; Y1148-I1153 HydrophobicContact CE1-CG1 4.3Å; Y1148-I1153 HydrophobicContact CE1-CG2 4.38Å
1149	D	57	Low	47.2	Very low	131 Å²	131	103.4 Å²	103.4	70%	0.701	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.5	171.4	-58.3	-25.4	0	0	0	113
1150	L	45.1	Very low	47.3	Very low	106 Å²	106	97.3 Å²	97.3	56%	0.555	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	2	179.5	-162.4	61	0	0	0	113.6	Y1148	Y1148-L1150 PolarHBondContact O-N 3.5Å; Y1148-L1150 VanDerWaalsContact O-N 3.1Å
1151	L	50.1	Low	47.9	Very low	8 Å²	8	92.1 Å²	92.1	4%	0.042	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	8.6	178.3	-74.1	177.9	0	0	0	114.1	L770 Q774 I777 Y1148 I1153	L770-L1151 HydrophobicContact CD2-CD2 3.74Å; L770-L1151 HydrophobicContact CG-CD2 4.06Å; Q774-L1151 HydrophobicContact CB-CD2 3.91Å; Q774-L1151 HydrophobicContact CG-CD2 4.36Å; I777-L1151 HydrophobicContact CD1-CD1 4.43Å; Y1148-L1151 PolarHBondContact O-N 3.28Å; Y1148-L1151 VanDerWaalsContact O-N 3.1Å; L1151-I1153 VanDerWaalsContact C-N 3.27Å; L1151-I1153 HydrophobicContact CB-CD1 3.65Å; L1151-I1153 HydrophobicContact CB-CG1 3.6Å; L1151-I1153 HydrophobicContact CD1-CD1 4Å; L1151-I1153 VanDerWaalsContact O-CG1 3.24Å; L1151-I1153 WeakPolarHBondContact O-CG1 3.09Å; L1151-I1153 PolarHBondContact O-N 3.31Å
1152	D	43.2	Very low	48.5	Very low	111 Å²	111	90.9 Å²	90.9	59%	0.594	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	31.1	179.7	-60.8	-52.4	0	0	0	115.3	Q774 Q781 Y1148 C1154	Q774-D1152 PolarHBondContact NE2-OD2 3.12Å; Q781-D1152 PolarHBondContact NE2-O 2.87Å; Y1148-D1152 PolarHBondContact O-N 2.59Å; D1152-C1154 PolarHBondContact O-N 2.66Å
1153	I	46.2	Very low	48.9	Very low	37 Å²	37	91.1 Å²	91.1	19%	0.19	48%	0.475	C	S	.	.			trans	-98.3	67.5	-174	-25.7	166.4	0	0	0	112.5	I777 Y1148 L1151	I777-I1153 HydrophobicContact CD1-CD1 3.64Å; I777-I1153 HydrophobicContact CD1-CG1 4.36Å; I777-I1153 HydrophobicContact CG2-CB 4.3Å; I777-I1153 HydrophobicContact CG2-CD1 4.08Å; I777-I1153 HydrophobicContact CG2-CG1 3.83Å; I777-I1153 HydrophobicContact CG2-CG2 3.63Å; Y1148-I1153 HydrophobicContact CD1-CB 3.81Å; Y1148-I1153 HydrophobicContact CD1-CD1 4.04Å; Y1148-I1153 HydrophobicContact CD1-CG1 4.3Å; Y1148-I1153 HydrophobicContact CE1-CB 3.94Å; Y1148-I1153 HydrophobicContact CE1-CD1 3.62Å; Y1148-I1153 HydrophobicContact CE1-CG1 4.3Å; Y1148-I1153 HydrophobicContact CE1-CG2 4.38Å; L1151-I1153 VanDerWaalsContact C-N 3.27Å; L1151-I1153 HydrophobicContact CB-CD1 3.65Å; L1151-I1153 HydrophobicContact CB-CG1 3.6Å; L1151-I1153 HydrophobicContact CD1-CD1 4Å; L1151-I1153 VanDerWaalsContact O-CG1 3.24Å; L1151-I1153 WeakPolarHBondContact O-CG1 3.09Å; L1151-I1153 PolarHBondContact O-N 3.31Å
1154	C	34	Very low	48.9	Very low	180 Å²	180	85 Å²	85	100%	1.216	46%	0.456	S	S	*	.			trans	-75.4	0	159.1	-66.9	0	0	0	0	111.1	Q781 D1152	Q781-C1154 PolarHBondContact NE2-O 3.44Å; D1152-C1154 PolarHBondContact O-N 2.66Å

Retrieved 1,154 of 1,154 residues in 635.2 ms (Link to these results)

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