A0A3Q0KNX7_SCHMA Loading...

DNAj-related

AlphaFold DB , UniProt , Accession A0A3Q0KNX7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 949 aa.

						>A0A3Q0KNX7_SCHMA|A0A3Q0KNX7
MPGDRFEFDESGDTFLCFLTAFYTLVLIPLTYFCWPSLEFKESYEQSKRKCMCQPCQLKRHHIKSSTPLKRLKKIMIKAAFVAGWGIFFLLVYKLTLIEPDNSGFDPFLVLGLDKDASPKDIRSAYKKLSLLNHPDKGGDPKRFIQISKAYNALTNEESRKNWEEYGNPDGPGAAHFGIALPKWMVQKENFYLVIGAYILLFMMILPISVGVWWYNTMKFSNNNVLLDTIRYFCGAFMRSPYMAMPRIIKVLSTAYEFNPNYNKEIICRPSDNTELPPLIMQIPFFTIFKKAIVGSPYSVKARALIYAHLERLELPANTLHVDRQYIIKHSPRLIDEMINSLLYVLAVAMDEANSRHKTPQHLATIENCMHLIPMLVQALTDNASPLLQLPHITQTQLRHMATKQRNIKSVRQLINLPDDKRRALLRSLSDEQYRDILTVSSSMPYLELSYRCEVLDEDEDDSSIWPFSMVTVTVVLKRKPLLDPNAVSSAMNANGHTTNTNTITTNSGTTNSPTTLPDSSYFDRGQTMQLDWNAYNNNDSLNSKLYPIADIHGTETLKSLNYDDFLGSGGGGGDEDKGFDNVGNSMKSSKKTTPPVWDKSKRKKGVRKSKSRKQQQQQQRNSLLGSEKVNQSEINPTDEIDSEQEDSDSVVGIDKIPDHVGFTNSSVPSDISIKEKDESVQPNHIDGGQVQRKTTTDTFVESSLPSSLSTNKSSSSRKPMKPHSKLSSMMDSKTHCTHVVHCPYFPVEKFEGWWIYLADRKTRQLITKPIYIATLQTEEELQLRFVAPPIPGQYLYVLSVRSDSYMDCDFTECIRFTVRPLPERIVEILKEQEEAASDDDDDSSDTSSTDTEDDDEVEAEETGNDVVIDNEEDPDIEVLSQEECTQASIGIVEQSKKCDNDLSSNKNNIDNQGERDGYGVDDDDDDEQNVCGHIAQLSSISDNKCLFG
					

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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	41	Very low	68.6	Low	201 Å²	201	111.5 Å²	111.5	99%	0.99	58%	0.578	S	S	*	*				0	145.1	0	-70.7	-64.9	-171.5	0	0	107.1	G3	M1-G3 PolarHBondContact O-N 3.34Å
2	P	45	Very low	69.8	Low	112 Å²	112	103.9 Å²	103.9	73%	0.727	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-75.9	4.2	179.8	30.6	-35	0	0	0	114.5	D4	P2-D4 VanDerWaalsContact C-N 3.33Å; P2-D4 PolarHBondContact O-N 3.48Å
3	G	51.6	Low	71	Confident	52 Å²	52	100.7 Å²	100.7	54%	0.536	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-71.6	-20.6	-178.2	0	0	0	0	0	115	M1 R5	M1-G3 PolarHBondContact O-N 3.34Å; G3-R5 PolarHBondContact O-N 2.99Å
4	D	58.7	Low	72.1	Confident	147 Å²	147	99.1 Å²	99.1	79%	0.786	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-79.5	15.1	-172.8	-47.4	-42.8	0	0	0	113.5	P2	P2-D4 VanDerWaalsContact C-N 3.33Å; P2-D4 PolarHBondContact O-N 3.48Å
5	R	68.5	Low	73.2	Confident	197 Å²	197	96.2 Å²	96.2	74%	0.743	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-89.9	-19.9	179.8	-71.1	-168.8	179.8	-169.3	2	114.6	G3	G3-R5 PolarHBondContact O-N 2.99Å
6	F	77.8	Confident	74.3	Confident	111 Å²	111	91.9 Å²	91.9	49%	0.487	49%	0.485	S	S	.	.			trans	-130.8	130.3	-175.1	-66.2	-66.9	0	0	0	111	F177 I179	F6-F177 WeakPolarHBondContact CA-O 3.4Å; F6-F177 HydrophobicContact CD1-CB 3.95Å; F6-F177 HydrophobicContact CE1-CB 4.08Å; F6-I179 HydrophobicContact CB-CD1 3.67Å; F6-I179 HydrophobicContact CB-CG1 4.01Å; F6-I179 HydrophobicContact CD1-CD1 3.77Å; F6-I179 HydrophobicContact CD1-CG1 3.88Å; F6-I179 HydrophobicContact CD2-CD1 4.08Å; F6-I179 HydrophobicContact CE1-CD1 4.42Å; F6-I179 HydrophobicContact CG-CD1 3.58Å; F6-I179 HydrophobicContact CG-CG1 4.09Å
7	E	80.8	Confident	75.1	Confident	111 Å²	111	90.2 Å²	90.2	52%	0.519	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	115.3	179.4	-168.4	151.4	-153.3	0	0	109.9	H176 F177 G178 I179	E7-H176 IonicContact OE2-ND1 3.47Å; E7-F177 PolarHBondContact N-O 2.86Å; E7-F177 VanDerWaalsContact N-O 3.12Å; E7-G178 CarbonylContact O-C 3.52Å; E7-G178 VanDerWaalsContact O-CA 3.27Å; E7-G178 WeakPolarHBondContact O-CA 3.34Å; E7-I179 PolarHBondContact O-N 3.5Å
8	F	84.6	Confident	76	Confident	50 Å²	50	91.5 Å²	91.5	22%	0.219	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	140.3	179.3	-70.1	-82.7	0	0	0	111.1	E10 I179 L181 K183 V186	F8-E10 PolarHBondContact O-N 3.23Å; F8-I179 HydrophobicContact CD1-CB 4.28Å; F8-I179 HydrophobicContact CD1-CG2 4.43Å; F8-I179 HydrophobicContact CE1-CB 4.24Å; F8-I179 HydrophobicContact CE1-CD1 4.28Å; F8-I179 HydrophobicContact CE1-CG2 4.21Å; F8-I179 HydrophobicContact CZ-CD1 4.36Å; F8-L181 HydrophobicContact CD1-CB 4.13Å; F8-L181 HydrophobicContact CE1-CB 4.37Å; F8-K183 HydrophobicContact CB-CB 4.06Å; F8-K183 HydrophobicContact CB-CG 4.18Å; F8-V186 HydrophobicContact CD1-CG2 4.01Å; F8-V186 HydrophobicContact CE1-CG2 3.79Å; F8-V186 HydrophobicContact CE2-CG1 4.25Å; F8-V186 HydrophobicContact CE2-CG2 4.48Å; F8-V186 HydrophobicContact CG-CG2 4.45Å; F8-V186 HydrophobicContact CZ-CG1 4.36Å; F8-V186 HydrophobicContact CZ-CG2 4.04Å
9	D	84	Confident	76.8	Confident	16 Å²	16	89.7 Å²	89.7	9%	0.086	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	115.1	-178	-172.3	-0.8	0	0	0	112.3	S11 G12 D13 T14 F15 I179 L181 K183	D9-S11 PolarHBondContact OD1-N 3.34Å; D9-S11 PolarHBondContact OD1-OG 3.08Å; D9-G12 VanDerWaalsContact CG-N 3.3Å; D9-G12 PolarHBondContact OD1-N 3.39Å; D9-G12 WeakPolarHBondContact OD2-CA 3.4Å; D9-G12 PolarHBondContact OD2-N 3.02Å; D9-D13 PolarHBondContact OD2-N 2.94Å; D9-T14 VanDerWaalsContact OD2-CA 3.32Å; D9-T14 WeakPolarHBondContact OD2-CA 3.42Å; D9-T14 WeakPolarHBondContact OD2-CB 3.31Å; D9-T14 PolarHBondContact OD2-N 2.81Å; D9-F15 PolarHBondContact OD2-N 3.34Å; D9-I179 PolarHBondContact N-O 3.47Å; D9-L181 PolarHBondContact N-O 3.49Å; D9-K183 WeakPolarHBondContact O-CB 3.23Å; D9-K183 PolarHBondContact O-N 3.43Å
10	E	81.8	Confident	77.6	Confident	147 Å²	147	85.9 Å²	85.9	69%	0.687	45%	0.453	S	S	*	.	S	Bend	trans	-83.2	-33.6	-179.7	-62.2	-142.6	130.2	0	0	113.2	F8 K183	F8-E10 PolarHBondContact O-N 3.23Å; E10-K183 HydrophobicContact CG-CD 3.81Å; E10-K183 WeakPolarHBondContact OE1-CD 3.47Å; E10-K183 WeakPolarHBondContact OE1-CE 3.29Å; E10-K183 IonicContact OE1-NZ 3.9Å; E10-K183 PolarHBondContact OE1-NZ 3.1Å
11	S	80.8	Confident	78.3	Confident	83 Å²	83	84.5 Å²	84.5	58%	0.58	46%	0.455	S	S	*	.	S	Bend	trans	-89.6	-31	-179.1	67.2	0	0	0	0	112.4	D9 D13	D9-S11 PolarHBondContact OD1-N 3.34Å; D9-S11 PolarHBondContact OD1-OG 3.08Å; S11-D13 WeakPolarHBondContact CB-OD2 3.36Å; S11-D13 WeakPolarHBondContact OG-CB 3.29Å; S11-D13 PolarHBondContact OG-N 3.25Å; S11-D13 PolarHBondContact OG-OD2 3.22Å
12	G	83.2	Confident	80.8	Confident	20 Å²	20	80.5 Å²	80.5	21%	0.206	43%	0.432	C	S	.	.	S	Bend	trans	90.5	1.8	-175.1	0	0	0	0	0	113.9	D9 F15 L16	D9-G12 VanDerWaalsContact CG-N 3.3Å; D9-G12 PolarHBondContact OD1-N 3.39Å; D9-G12 WeakPolarHBondContact OD2-CA 3.4Å; D9-G12 PolarHBondContact OD2-N 3.02Å; G12-F15 PolarHBondContact O-N 2.91Å; G12-L16 PolarHBondContact O-N 2.65Å
13	D	84.8	Confident	83.1	Confident	62 Å²	62	77.9 Å²	77.9	33%	0.332	41%	0.408	S	S	.	.	H	α-helix	trans	-69.4	-39.5	-179.2	-63.7	-42.8	0	0	0	111.7	D9 S11 L16 C17 I98	D9-D13 PolarHBondContact OD2-N 2.94Å; S11-D13 WeakPolarHBondContact CB-OD2 3.36Å; S11-D13 WeakPolarHBondContact OG-CB 3.29Å; S11-D13 PolarHBondContact OG-N 3.25Å; S11-D13 PolarHBondContact OG-OD2 3.22Å; D13-L16 PolarHBondContact O-N 3.33Å; D13-C17 PolarHBondContact O-N 3.05Å; D13-C17 PolarHBondContact O-SG 3.14Å; D13-C17 VanDerWaalsContact O-SG 3.42Å; D13-I98 HydrophobicContact CB-CD1 3.88Å; D13-I98 HydrophobicContact CB-CG1 4.43Å; D13-I98 HydrophobicContact CB-CG2 4.1Å; D13-I98 WeakPolarHBondContact OD1-CG1 3.31Å
14	T	86.5	Confident	85	Confident	79 Å²	79	77.2 Å²	77.2	49%	0.485	39%	0.393	S	S	.	.	H	α-helix	trans	-69	-38.9	177.8	-40.6	0	0	0	0	110.4	D9 L16 C17 F18 A180	D9-T14 VanDerWaalsContact OD2-CA 3.32Å; D9-T14 WeakPolarHBondContact OD2-CA 3.42Å; D9-T14 WeakPolarHBondContact OD2-CB 3.31Å; D9-T14 PolarHBondContact OD2-N 2.81Å; T14-L16 VanDerWaalsContact C-N 3.32Å; T14-C17 WeakPolarHBondContact O-CB 3.32Å; T14-C17 PolarHBondContact O-N 3.43Å; T14-F18 PolarHBondContact O-N 2.98Å; T14-A180 HydrophobicContact CG2-CB 3.7Å
15	F	89.2	Confident	86.7	Confident	55 Å²	55	76 Å²	76	24%	0.241	39%	0.387	C	S	.	.	H	α-helix	trans	-62.5	-37.8	170.5	175.3	-115.2	0	0	0	112	D9 G12 F18 L19 A180 P182	D9-F15 PolarHBondContact OD2-N 3.34Å; G12-F15 PolarHBondContact O-N 2.91Å; F15-F18 PolarHBondContact O-N 3.16Å; F15-L19 HydrophobicContact CE1-CD2 4.07Å; F15-L19 HydrophobicContact CZ-CB 4.48Å; F15-L19 HydrophobicContact CZ-CD2 4.16Å; F15-L19 WeakPolarHBondContact O-CB 3.3Å; F15-L19 PolarHBondContact O-N 3.23Å; F15-A180 VanDerWaalsContact CA-O 3.3Å; F15-A180 WeakPolarHBondContact CA-O 3.34Å; F15-A180 VanDerWaalsContact CB-O 3.31Å; F15-A180 WeakPolarHBondContact CB-O 3.46Å; F15-A180 WeakPolarHBondContact CD2-O 3.45Å; F15-P182 HydrophobicContact CB-CG 3.75Å; F15-P182 HydrophobicContact CD1-CG 3.4Å; F15-P182 HydrophobicContact CD2-CG 4.02Å; F15-P182 HydrophobicContact CE1-CG 3.93Å; F15-P182 HydrophobicContact CE2-CG 4.48Å; F15-P182 HydrophobicContact CG-CG 3.44Å; F15-P182 VanDerWaalsContact CG-CG 3.44Å; F15-P182 HydrophobicContact CZ-CG 4.44Å
16	L	89.9	Confident	87.8	Confident	27 Å²	27	69.3 Å²	69.3	14%	0.141	37%	0.367	C	S	.	.	H	α-helix	trans	-68.1	-38.5	176.7	-168.2	68.9	0	0	0	111.9	G12 D13 T14 T20 L91 K94 L95 I98	G12-L16 PolarHBondContact O-N 2.65Å; D13-L16 PolarHBondContact O-N 3.33Å; T14-L16 VanDerWaalsContact C-N 3.32Å; L16-T20 WeakPolarHBondContact O-CB 3.48Å; L16-T20 WeakPolarHBondContact O-CG2 3.31Å; L16-T20 PolarHBondContact O-N 3.3Å; L16-T20 PolarHBondContact O-OG1 3.38Å; L16-L91 HydrophobicContact CD1-CD2 3.78Å; L16-K94 HydrophobicContact CD2-CB 3.6Å; L16-L95 HydrophobicContact CB-CD1 4.17Å; L16-L95 HydrophobicContact CD2-CB 4.42Å; L16-L95 HydrophobicContact CD2-CD1 3.93Å; L16-L95 HydrophobicContact CG-CD1 3.82Å; L16-I98 HydrophobicContact CD2-CD1 4.25Å
17	C	89.2	Confident	88.4	Confident	63 Å²	63	64.5 Å²	64.5	43%	0.426	35%	0.346	S	S	.	.	H	α-helix	trans	-58	-47	169.1	-70.4	0	0	0	0	111.8	D13 T14 T20 A21	D13-C17 PolarHBondContact O-N 3.05Å; D13-C17 PolarHBondContact O-SG 3.14Å; D13-C17 VanDerWaalsContact O-SG 3.42Å; T14-C17 WeakPolarHBondContact O-CB 3.32Å; T14-C17 PolarHBondContact O-N 3.43Å; C17-T20 PolarHBondContact O-OG1 2.88Å; C17-A21 WeakPolarHBondContact O-CB 3.25Å; C17-A21 PolarHBondContact O-N 2.78Å; C17-A21 VanDerWaalsContact O-N 3.14Å
18	F	91.1	Very high	88.9	Confident	114 Å²	114	63.7 Å²	63.7	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-65.8	-46.7	178.2	176	-100.7	0	0	0	112.3	T14 F15 T20 A21 F22 A180	T14-F18 PolarHBondContact O-N 2.98Å; F15-F18 PolarHBondContact O-N 3.16Å; F18-T20 PolarHBondContact O-N 2.79Å; F18-A21 PolarHBondContact O-N 3.36Å; F18-F22 WeakPolarHBondContact O-CB 3.45Å; F18-F22 PolarHBondContact O-N 2.95Å; F18-A180 HydrophobicContact CB-CB 4.08Å
19	L	91.4	Very high	89.1	Confident	58 Å²	58	64 Å²	64	30%	0.304	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-42	-179.3	-179.6	62.5	0	0	0	111.5	F15 Y23 L91	F15-L19 HydrophobicContact CE1-CD2 4.07Å; F15-L19 HydrophobicContact CZ-CB 4.48Å; F15-L19 HydrophobicContact CZ-CD2 4.16Å; F15-L19 WeakPolarHBondContact O-CB 3.3Å; F15-L19 PolarHBondContact O-N 3.23Å; L19-Y23 WeakPolarHBondContact O-CB 3.46Å; L19-Y23 PolarHBondContact O-N 2.86Å; L19-L91 HydrophobicContact CD2-CD2 4.19Å
20	T	91.8	Very high	89.3	Confident	12 Å²	12	67.3 Å²	67.3	7%	0.074	37%	0.369	C	S	.	.	H	α-helix	trans	-63.8	-44.6	175.2	44.3	0	0	0	0	111.8	L16 C17 F18 Y23 T24 L91	L16-T20 WeakPolarHBondContact O-CB 3.48Å; L16-T20 WeakPolarHBondContact O-CG2 3.31Å; L16-T20 PolarHBondContact O-N 3.3Å; L16-T20 PolarHBondContact O-OG1 3.38Å; C17-T20 PolarHBondContact O-OG1 2.88Å; F18-T20 PolarHBondContact O-N 2.79Å; T20-Y23 PolarHBondContact O-N 3.23Å; T20-T24 PolarHBondContact O-N 3.44Å; T20-T24 PolarHBondContact O-OG1 3.26Å; T20-L91 HydrophobicContact CG2-CB 3.57Å
21	A	92.4	Very high	89.6	Confident	58 Å²	58	61.4 Å²	61.4	48%	0.479	34%	0.343	S	S	.	.	H	α-helix	trans	-67.1	-39.1	179.3	0	0	0	0	0	113.6	C17 F18 T24 L25	C17-A21 WeakPolarHBondContact O-CB 3.25Å; C17-A21 PolarHBondContact O-N 2.78Å; C17-A21 VanDerWaalsContact O-N 3.14Å; F18-A21 PolarHBondContact O-N 3.36Å; A21-T24 PolarHBondContact O-OG1 3.4Å; A21-L25 WeakPolarHBondContact O-CB 3.21Å; A21-L25 PolarHBondContact O-N 2.92Å
22	F	92.9	Very high	89.8	Confident	116 Å²	116	66.3 Å²	66.3	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-68.7	-39.9	173	-174.7	-99.4	0	0	0	111.3	F18 T24 L25 V26	F18-F22 WeakPolarHBondContact O-CB 3.45Å; F18-F22 PolarHBondContact O-N 2.95Å; F22-T24 PolarHBondContact O-N 3.1Å; F22-L25 PolarHBondContact O-N 3.34Å; F22-V26 HydrophobicContact CD1-CG2 4.34Å; F22-V26 HydrophobicContact CE1-CG2 3.9Å; F22-V26 HydrophobicContact CZ-CG2 4Å; F22-V26 WeakPolarHBondContact O-CG2 3.49Å; F22-V26 PolarHBondContact O-N 3.44Å; F22-V26 VanDerWaalsContact O-N 3.1Å
23	Y	93.5	Very high	89.7	Confident	57 Å²	57	73 Å²	73	22%	0.224	37%	0.374	C	S	.	.	H	α-helix	trans	-67.1	-35.5	-179.9	-166.6	-109.4	0	0	0	113	L19 T20 V26 L27 G84 I87 F88 L91	L19-Y23 WeakPolarHBondContact O-CB 3.46Å; L19-Y23 PolarHBondContact O-N 2.86Å; T20-Y23 PolarHBondContact O-N 3.23Å; Y23-V26 PolarHBondContact O-N 2.98Å; Y23-L27 HydrophobicContact CD1-CD2 4.46Å; Y23-L27 HydrophobicContact CE1-CD2 3.98Å; Y23-L27 WeakPolarHBondContact O-CB 3.31Å; Y23-L27 PolarHBondContact O-N 3.41Å; Y23-G84 WeakPolarHBondContact CE1-O 3.28Å; Y23-G84 WeakPolarHBondContact OH-CA 3.3Å; Y23-G84 PolarHBondContact OH-O 3.2Å; Y23-I87 HydrophobicContact CE1-CB 4.44Å; Y23-I87 HydrophobicContact CE1-CG2 4.11Å; Y23-F88 HydrophobicContact CD1-CB 4.15Å; Y23-F88 HydrophobicContact CD1-CD2 4.43Å; Y23-F88 HydrophobicContact CE1-CB 3.93Å; Y23-L91 HydrophobicContact CD1-CD1 4.25Å; Y23-L91 HydrophobicContact CG-CD1 4.47Å
24	T	92.2	Very high	89.4	Confident	38 Å²	38	73.2 Å²	73.2	23%	0.233	38%	0.38	C	S	.	.	H	α-helix	trans	-67.8	-42.3	172.5	49.5	0	0	0	0	112.4	T20 A21 F22 V26 L27 I28 F88	T20-T24 PolarHBondContact O-N 3.44Å; T20-T24 PolarHBondContact O-OG1 3.26Å; A21-T24 PolarHBondContact O-OG1 3.4Å; F22-T24 PolarHBondContact O-N 3.1Å; T24-V26 PolarHBondContact O-N 3.06Å; T24-L27 PolarHBondContact O-N 3Å; T24-I28 WeakPolarHBondContact O-CB 3.12Å; T24-I28 WeakPolarHBondContact O-CG1 3.25Å; T24-I28 PolarHBondContact O-N 2.88Å; T24-F88 HydrophobicContact CG2-CD2 3.75Å; T24-F88 HydrophobicContact CG2-CE2 3.13Å; T24-F88 HydrophobicContact CG2-CZ 3.73Å
25	L	93.6	Very high	88.9	Confident	123 Å²	123	76 Å²	76	64%	0.644	38%	0.381	S	S	*	.	H	α-helix	trans	-59.4	-33.1	177.4	-171.8	151.7	0	0	0	111.9	A21 F22 P29	A21-L25 WeakPolarHBondContact O-CB 3.21Å; A21-L25 PolarHBondContact O-N 2.92Å; F22-L25 PolarHBondContact O-N 3.34Å; L25-P29 WeakPolarHBondContact O-CD 3.13Å; L25-P29 VanDerWaalsContact O-CG 3.24Å; L25-P29 WeakPolarHBondContact O-CG 3.49Å
26	V	91.7	Very high	87.7	Confident	55 Å²	55	74.9 Å²	74.9	33%	0.333	38%	0.38	S	S	.	.	H	α-helix	trans	-83.9	-46.1	174.3	173.8	0	0	0	0	112.3	F22 Y23 T24 L30	F22-V26 HydrophobicContact CD1-CG2 4.34Å; F22-V26 HydrophobicContact CE1-CG2 3.9Å; F22-V26 HydrophobicContact CZ-CG2 4Å; F22-V26 WeakPolarHBondContact O-CG2 3.49Å; F22-V26 PolarHBondContact O-N 3.44Å; F22-V26 VanDerWaalsContact O-N 3.1Å; Y23-V26 PolarHBondContact O-N 2.98Å; T24-V26 PolarHBondContact O-N 3.06Å; V26-L30 HydrophobicContact CG1-CD1 3.6Å; V26-L30 HydrophobicContact CG1-CG 4.35Å; V26-L30 WeakPolarHBondContact O-CB 3.49Å; V26-L30 VanDerWaalsContact O-CG 3.24Å; V26-L30 WeakPolarHBondContact O-CG 3.26Å; V26-L30 PolarHBondContact O-N 3.28Å
27	L	92.1	Very high	86.2	Confident	10 Å²	10	77.3 Å²	77.3	5%	0.052	40%	0.399	C	S	.	.	H	α-helix	trans	-66	-42.5	-174.1	-178.9	63.4	0	0	0	112.5	Y23 T24 L30 T31 F81 W85 F88	Y23-L27 HydrophobicContact CD1-CD2 4.46Å; Y23-L27 HydrophobicContact CE1-CD2 3.98Å; Y23-L27 WeakPolarHBondContact O-CB 3.31Å; Y23-L27 PolarHBondContact O-N 3.41Å; T24-L27 PolarHBondContact O-N 3Å; L27-L30 PolarHBondContact O-N 3.36Å; L27-T31 HydrophobicContact CD1-CG2 3.87Å; L27-T31 HydrophobicContact CG-CG2 4.18Å; L27-T31 WeakPolarHBondContact O-CG2 3.27Å; L27-T31 PolarHBondContact O-N 3.14Å; L27-T31 PolarHBondContact O-OG1 3.11Å; L27-F81 HydrophobicContact CD1-CD1 4.25Å; L27-W85 HydrophobicContact CD2-CD2 3.86Å; L27-W85 HydrophobicContact CD2-CE3 4.02Å; L27-W85 HydrophobicContact CD2-CG 4.3Å; L27-W85 HydrophobicContact CD2-CH2 4.41Å; L27-W85 HydrophobicContact CD2-CZ2 4.28Å; L27-W85 HydrophobicContact CD2-CZ3 4.3Å; L27-W85 HydrophobicContact CG-CZ2 4.36Å; L27-F88 HydrophobicContact CD2-CB 3.9Å; L27-F88 HydrophobicContact CD2-CG 4.39Å
28	I	89.8	Confident	84.5	Confident	94 Å²	94	81.8 Å²	81.8	48%	0.482	42%	0.418	S	S	.	.	H	α-helix	trans	-65.2	-53.7	-174	-66.2	169.1	0	0	0	111.2	T24 L30 T31 Y32 W85	T24-I28 WeakPolarHBondContact O-CB 3.12Å; T24-I28 WeakPolarHBondContact O-CG1 3.25Å; T24-I28 PolarHBondContact O-N 2.88Å; I28-L30 PolarHBondContact O-N 3.04Å; I28-T31 PolarHBondContact O-N 3.13Å; I28-T31 PolarHBondContact O-OG1 3.37Å; I28-Y32 PolarHBondContact O-N 2.81Å; I28-W85 HydrophobicContact CG1-CH2 4.41Å
29	P	90.2	Very high	82.8	Confident	58 Å²	58	83.1 Å²	83.1	38%	0.377	43%	0.425	S	S	.	.	H	α-helix	trans	-61.4	-40.8	175.3	-23.6	35.7	0	0	0	113.1	L25 T31 Y32 F33	L25-P29 WeakPolarHBondContact O-CD 3.13Å; L25-P29 VanDerWaalsContact O-CG 3.24Å; L25-P29 WeakPolarHBondContact O-CG 3.49Å; P29-T31 VanDerWaalsContact C-N 3.3Å; P29-T31 PolarHBondContact O-N 3.06Å; P29-Y32 PolarHBondContact O-N 3.22Å; P29-Y32 VanDerWaalsContact O-N 3.14Å; P29-F33 HydrophobicContact CB-CD2 4.31Å; P29-F33 HydrophobicContact CB-CE2 4.35Å; P29-F33 WeakPolarHBondContact O-CD2 3.43Å; P29-F33 PolarHBondContact O-N 3.24Å
30	L	87.4	Confident	80.7	Confident	85 Å²	85	87.7 Å²	87.7	45%	0.445	44%	0.443	S	S	.	.	H	α-helix	trans	-59.9	-41.2	175.5	-74.9	179	0	0	0	111.6	V26 L27 I28 C34 F81	V26-L30 HydrophobicContact CG1-CD1 3.6Å; V26-L30 HydrophobicContact CG1-CG 4.35Å; V26-L30 WeakPolarHBondContact O-CB 3.49Å; V26-L30 VanDerWaalsContact O-CG 3.24Å; V26-L30 WeakPolarHBondContact O-CG 3.26Å; V26-L30 PolarHBondContact O-N 3.28Å; L27-L30 PolarHBondContact O-N 3.36Å; I28-L30 PolarHBondContact O-N 3.04Å; L30-C34 VanDerWaalsContact O-CB 3.26Å; L30-C34 WeakPolarHBondContact O-CB 3.44Å; L30-C34 PolarHBondContact O-N 3.3Å; L30-F81 HydrophobicContact CB-CE1 3.95Å; L30-F81 HydrophobicContact CB-CZ 4.19Å; L30-F81 VanDerWaalsContact O-CZ 3.25Å; L30-F81 WeakPolarHBondContact O-CZ 3.38Å
31	T	88.1	Confident	78.8	Confident	22 Å²	22	96.2 Å²	96.2	14%	0.135	48%	0.479	C	S	.	.	H	α-helix	trans	-65.2	-42.8	174.2	62.8	0	0	0	0	111.3	L27 I28 P29 F33 W35 F81 W85	L27-T31 HydrophobicContact CD1-CG2 3.87Å; L27-T31 HydrophobicContact CG-CG2 4.18Å; L27-T31 WeakPolarHBondContact O-CG2 3.27Å; L27-T31 PolarHBondContact O-N 3.14Å; L27-T31 PolarHBondContact O-OG1 3.11Å; I28-T31 PolarHBondContact O-N 3.13Å; I28-T31 PolarHBondContact O-OG1 3.37Å; P29-T31 VanDerWaalsContact C-N 3.3Å; P29-T31 PolarHBondContact O-N 3.06Å; T31-F33 PolarHBondContact O-N 3.41Å; T31-W35 WeakPolarHBondContact O-CB 3.39Å; T31-W35 PolarHBondContact O-N 2.98Å; T31-F81 HydrophobicContact CG2-CD1 3.42Å; T31-F81 VanDerWaalsContact CG2-CD1 3.42Å; T31-F81 HydrophobicContact CG2-CE1 3.64Å; T31-F81 HydrophobicContact CG2-CG 4.26Å; T31-W85 HydrophobicContact CG2-CZ2 4.13Å; T31-W85 VanDerWaalsContact CG2-NE1 3.29Å
32	Y	85.3	Confident	76.9	Confident	186 Å²	186	97.9 Å²	97.9	73%	0.729	48%	0.477	S	S	*	.	H	α-helix	trans	-61.2	-47.5	178.9	-177.1	-100.3	0	0	0	112.8	I28 P29	I28-Y32 PolarHBondContact O-N 2.81Å; P29-Y32 PolarHBondContact O-N 3.22Å; P29-Y32 VanDerWaalsContact O-N 3.14Å
33	F	80.7	Confident	75.1	Confident	161 Å²	161	95.2 Å²	95.2	71%	0.706	47%	0.473	S	S	*	.	H	α-helix	trans	-83.2	-27.4	-175.6	-68.9	-63.8	0	0	0	114.7	P29 T31	P29-F33 HydrophobicContact CB-CD2 4.31Å; P29-F33 HydrophobicContact CB-CE2 4.35Å; P29-F33 WeakPolarHBondContact O-CD2 3.43Å; P29-F33 PolarHBondContact O-N 3.24Å; T31-F33 PolarHBondContact O-N 3.41Å
34	C	79	Confident	73.1	Confident	67 Å²	67	101 Å²	101	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-113.7	-0.5	-175.8	-67.8	0	0	0	0	114.6	L30 P36 F81	L30-C34 VanDerWaalsContact O-CB 3.26Å; L30-C34 WeakPolarHBondContact O-CB 3.44Å; L30-C34 PolarHBondContact O-N 3.3Å; C34-P36 WeakPolarHBondContact O-CD 3.46Å; C34-F81 HydrophobicContact CB-CE2 3.75Å; C34-F81 HydrophobicContact CB-CZ 3.72Å
35	W	75	Confident	71.4	Confident	138 Å²	138	102.9 Å²	102.9	52%	0.523	50%	0.502	S	S	.	.	S	Bend	trans	-63.7	124.5	164.3	-168.5	-93.5	0	0	0	108.4	T31 S37 F81	T31-W35 WeakPolarHBondContact O-CB 3.39Å; T31-W35 PolarHBondContact O-N 2.98Å; W35-S37 PolarHBondContact O-N 2.84Å; W35-F81 HydrophobicContact CZ3-CB 4.42Å
36	P	64.9	Low	69.8	Low	31 Å²	31	98.9 Å²	98.9	20%	0.201	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-65.7	117.5	-177.8	25.2	-32	0	0	0	109.1	C34 K78	C34-P36 WeakPolarHBondContact O-CD 3.46Å; P36-K78 HydrophobicContact CG-CD 4.35Å; P36-K78 HydrophobicContact CG-CG 4.13Å
37	S	58.9	Low	68.4	Low	78 Å²	78	98.3 Å²	98.3	55%	0.545	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-46.1	144.9	171.7	-173.7	0	0	0	0	110.2	W35 E39	W35-S37 PolarHBondContact O-N 2.84Å; S37-E39 PolarHBondContact O-N 3.06Å
38	L	53.7	Low	67	Low	157 Å²	157	102.1 Å²	102.1	82%	0.822	49%	0.494	S	S	*	.			trans	-62.8	107.5	-171.5	-155.6	79.9	0	0	0	108.7	F40	L38-F40 PolarHBondContact O-N 2.77Å
39	E	54.8	Low	66.1	Low	142 Å²	142	102.4 Å²	102.4	66%	0.664	49%	0.489	S	S	*	.			trans	-55.3	103.6	-178.7	-74.6	-175.6	171.4	0	0	109.3	S37 K41 K74	S37-E39 PolarHBondContact O-N 3.06Å; E39-K41 PolarHBondContact O-N 3.03Å; E39-K41 VanDerWaalsContact O-N 3.12Å; E39-K74 IonicContact OE1-NZ 2.71Å; E39-K74 PolarHBondContact OE1-NZ 2.78Å
40	F	47.1	Very low	65.7	Low	154 Å²	154	103 Å²	103	68%	0.675	49%	0.486	S	S	*	.			trans	-64.2	119.5	-173.5	-147.8	-82.4	0	0	0	108.1	L38 E42	L38-F40 PolarHBondContact O-N 2.77Å; F40-E42 PolarHBondContact O-N 2.78Å
41	K	51.4	Low	65.8	Low	191 Å²	191	99.4 Å²	99.4	83%	0.83	47%	0.468	S	S	*	.			trans	-68.1	109.1	-172.3	-171	176.3	-179.9	-178.7	0	108.7	E39 S43	E39-K41 PolarHBondContact O-N 3.03Å; E39-K41 VanDerWaalsContact O-N 3.12Å; K41-S43 PolarHBondContact O-N 2.71Å
42	E	53.6	Low	65.8	Low	92 Å²	92	101.6 Å²	101.6	43%	0.43	48%	0.477	S	S	.	.			trans	-38.9	119.6	-176	177.4	161.6	-84.7	0	0	112	F40 Q46 K50	F40-E42 PolarHBondContact O-N 2.78Å; E42-Q46 HydrophobicContact CG-CB 4.13Å; E42-K50 IonicContact OE1-NZ 2.86Å; E42-K50 PolarHBondContact OE1-NZ 3.29Å; E42-K50 IonicContact OE2-NZ 3.3Å; E42-K50 PolarHBondContact OE2-NZ 2.93Å
43	S	53.7	Low	66	Low	60 Å²	60	93.1 Å²	93.1	42%	0.42	45%	0.445	S	S	.	.			trans	-68.9	148.7	-171.1	-178.5	0	0	0	0	111.2	K41 E45 Q46 S47	K41-S43 PolarHBondContact O-N 2.71Å; S43-E45 PolarHBondContact O-N 2.69Å; S43-Q46 WeakPolarHBondContact O-CA 3.33Å; S43-Q46 WeakPolarHBondContact O-CB 3.32Å; S43-Q46 PolarHBondContact O-N 3.25Å; S43-S47 PolarHBondContact O-N 3.46Å
44	Y	52.2	Low	66.6	Low	178 Å²	178	92 Å²	92	70%	0.698	44%	0.442	S	S	*	.	H	α-helix	trans	-53.4	-41.9	179	178.9	-104.1	0	0	0	112	Q46 S47 K48	Y44-Q46 PolarHBondContact O-N 3.46Å; Y44-S47 WeakPolarHBondContact O-CB 3.35Å; Y44-S47 PolarHBondContact O-N 3.24Å; Y44-S47 PolarHBondContact O-OG 3.05Å; Y44-K48 PolarHBondContact O-N 2.97Å; Y44-K48 VanDerWaalsContact O-N 3.09Å
45	E	55.7	Low	67.2	Low	79 Å²	79	90.1 Å²	90.1	37%	0.369	43%	0.429	S	S	.	.	H	α-helix	trans	-68.4	-31.6	176.9	-73.3	-63.1	131.3	0	0	113.3	S43 S47 K48 R49	S43-E45 PolarHBondContact O-N 2.69Å; E45-S47 VanDerWaalsContact C-N 3.31Å; E45-K48 PolarHBondContact O-N 3.29Å; E45-K48 WeakPolarHBondContact OE1-CD 3.32Å; E45-K48 IonicContact OE1-NZ 3.79Å; E45-K48 PolarHBondContact OE1-NZ 2.87Å; E45-K48 WeakPolarHBondContact OE2-CD 3.38Å; E45-K48 IonicContact OE2-NZ 2.83Å; E45-K48 PolarHBondContact OE2-NZ 3.44Å; E45-K48 VanDerWaalsContact OE2-NZ 3.16Å; E45-R49 WeakPolarHBondContact O-CG 3.44Å; E45-R49 PolarHBondContact O-N 3.15Å
46	Q	61.8	Low	68	Low	39 Å²	39	84.3 Å²	84.3	18%	0.182	41%	0.409	C	S	.	.	H	α-helix	trans	-67	-34.9	172	-68.1	170.5	-28.2	0	0	111	E42 S43 Y44 A535	E42-Q46 HydrophobicContact CG-CB 4.13Å; S43-Q46 WeakPolarHBondContact O-CA 3.33Å; S43-Q46 WeakPolarHBondContact O-CB 3.32Å; S43-Q46 PolarHBondContact O-N 3.25Å; Y44-Q46 PolarHBondContact O-N 3.46Å; Q46-A535 PolarHBondContact NE2-O 2.8Å
47	S	60.3	Low	69.3	Low	42 Å²	42	88 Å²	88	29%	0.294	42%	0.423	S	S	.	.	H	α-helix	trans	-67.9	-38.1	176	84.1	0	0	0	0	112.6	S43 Y44 E45 R49 K50 M52	S43-S47 PolarHBondContact O-N 3.46Å; Y44-S47 WeakPolarHBondContact O-CB 3.35Å; Y44-S47 PolarHBondContact O-N 3.24Å; Y44-S47 PolarHBondContact O-OG 3.05Å; E45-S47 VanDerWaalsContact C-N 3.31Å; S47-R49 VanDerWaalsContact C-N 3.32Å; S47-R49 PolarHBondContact O-N 2.95Å; S47-K50 PolarHBondContact O-N 3.1Å; S47-M52 WeakPolarHBondContact O-CE 3.37Å
48	K	64.1	Low	70.8	Confident	90 Å²	90	89.2 Å²	89.2	39%	0.391	42%	0.423	S	S	.	.	H	α-helix	trans	-68.1	-27	-179.4	-172.5	-171.3	-177.6	-172.7	0	113.4	Y44 E45 K50	Y44-K48 PolarHBondContact O-N 2.97Å; Y44-K48 VanDerWaalsContact O-N 3.09Å; E45-K48 PolarHBondContact O-N 3.29Å; E45-K48 WeakPolarHBondContact OE1-CD 3.32Å; E45-K48 IonicContact OE1-NZ 3.79Å; E45-K48 PolarHBondContact OE1-NZ 2.87Å; E45-K48 WeakPolarHBondContact OE2-CD 3.38Å; E45-K48 IonicContact OE2-NZ 2.83Å; E45-K48 PolarHBondContact OE2-NZ 3.44Å; E45-K48 VanDerWaalsContact OE2-NZ 3.16Å; K48-K50 VanDerWaalsContact C-N 3.32Å
49	R	70.4	Confident	72.6	Confident	101 Å²	101	83 Å²	83	38%	0.381	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	12.7	177.9	-63.9	175.3	-173.1	-154.8	6.1	114	E45 S47 T439 Y536	E45-R49 WeakPolarHBondContact O-CG 3.44Å; E45-R49 PolarHBondContact O-N 3.15Å; S47-R49 VanDerWaalsContact C-N 3.32Å; S47-R49 PolarHBondContact O-N 2.95Å; R49-T439 WeakPolarHBondContact O-CG2 3.5Å; R49-Y536 VanDerWaalsContact CB-OH 3.29Å; R49-Y536 WeakPolarHBondContact CB-OH 3.13Å; R49-Y536 WeakPolarHBondContact CD-OH 3.41Å; R49-Y536 VanDerWaalsContact NH1-CE2 3.33Å
50	K	82.6	Confident	74.2	Confident	70 Å²	70	79.3 Å²	79.3	30%	0.304	37%	0.37	S	S	.	.	S	Bend	trans	-99.5	135.8	175.5	-64.2	180	-177.6	-172.3	0	110.9	E42 S47 K48 M52	E42-K50 IonicContact OE1-NZ 2.86Å; E42-K50 PolarHBondContact OE1-NZ 3.29Å; E42-K50 IonicContact OE2-NZ 3.3Å; E42-K50 PolarHBondContact OE2-NZ 2.93Å; S47-K50 PolarHBondContact O-N 3.1Å; K48-K50 VanDerWaalsContact C-N 3.32Å; K50-M52 HydrophobicContact CB-CE 4.2Å; K50-M52 WeakPolarHBondContact O-CE 3.25Å
51	C	88.2	Confident	76.2	Confident	10 Å²	10	78.5 Å²	78.5	7%	0.068	37%	0.368	C	S	.	.			trans	-57.2	137.8	171	-178.7	0	0	0	0	111.2	C56 R60 P391 V440	C51-C56 HydrophobicContact CB-CB 4.48Å; C51-R60 VanDerWaalsContact O-CZ 3.3Å; C51-R60 PolarHBondContact O-NH1 3.3Å; C51-R60 PolarHBondContact O-NH2 3.3Å; C51-P391 VanDerWaalsContact SG-CB 3.58Å; C51-V440 HydrophobicContact CB-CG2 3.83Å
52	M	88.8	Confident	77.8	Confident	68 Å²	68	72.5 Å²	72.5	34%	0.335	34%	0.343	S	S	.	.			trans	-107.4	8.8	-177.8	-62.6	-55.4	175.5	0	0	114.5	S47 K50 Q57 R60 D436	S47-M52 WeakPolarHBondContact O-CE 3.37Å; K50-M52 HydrophobicContact CB-CE 4.2Å; K50-M52 WeakPolarHBondContact O-CE 3.25Å; M52-Q57 PolarHBondContact O-NE2 2.99Å; M52-R60 PolarHBondContact SD-NH1 2.96Å; M52-D436 VanDerWaalsContact N-CG 3.3Å; M52-D436 PolarHBondContact N-OD1 3.03Å; M52-D436 PolarHBondContact N-OD2 2.92Å
53	C	90.2	Very high	79.3	Confident	7 Å²	7	69.6 Å²	69.6	5%	0.047	33%	0.329	C	S	.	.	S	Bend	trans	-58.5	148.7	172.9	78.2	0	0	0	0	112.8	C56 Q57 P391 H392 D436	C53-C56 PolarHBondContact O-N 3.08Å; C53-Q57 PolarHBondContact O-N 3.44Å; C53-P391 HydrophobicContact CB-CB 4.06Å; C53-H392 WeakPolarHBondContact CB-CE1 3.32Å; C53-D436 PolarHBondContact N-OD2 3.21Å
54	Q	91.9	Very high	80.8	Confident	138 Å²	138	73.7 Å²	73.7	65%	0.645	34%	0.34	S	S	*	.	H	α-helix	trans	-52.8	-46.7	-176.8	175.2	-149	8.8	0	0	113.1	C56 Q57 L58	Q54-C56 VanDerWaalsContact C-N 3.34Å; Q54-C56 PolarHBondContact O-N 3.47Å; Q54-Q57 WeakPolarHBondContact O-CB 3.48Å; Q54-Q57 PolarHBondContact O-N 2.86Å; Q54-Q57 VanDerWaalsContact O-N 3.08Å; Q54-L58 HydrophobicContact CG-CD1 3.99Å; Q54-L58 HydrophobicContact CG-CG 4.33Å; Q54-L58 WeakPolarHBondContact O-CG 3.42Å; Q54-L58 PolarHBondContact O-N 2.98Å
55	P	91.9	Very high	82.3	Confident	28 Å²	28	68.3 Å²	68.3	18%	0.182	33%	0.328	C	S	.	.	H	α-helix	trans	-55.7	-44	174.6	-29	37.2	0	0	0	113.7	Q57 L58 K59 P744 Y745	P55-Q57 VanDerWaalsContact C-N 3.34Å; P55-Q57 PolarHBondContact O-N 2.83Å; P55-L58 PolarHBondContact O-N 3.39Å; P55-K59 WeakPolarHBondContact O-CB 3.48Å; P55-K59 PolarHBondContact O-N 2.72Å; P55-P744 HydrophobicContact CB-CB 3.63Å; P55-Y745 HydrophobicContact CB-CE1 4.3Å; P55-Y745 HydrophobicContact CG-CE1 4.37Å
56	C	91.7	Very high	83.2	Confident	15 Å²	15	68.1 Å²	68.1	10%	0.101	34%	0.335	C	S	.	.	H	α-helix	trans	-67.7	-30.6	175.8	-78.9	0	0	0	0	112.9	C51 C53 Q54 R60 H742	C51-C56 HydrophobicContact CB-CB 4.48Å; C53-C56 PolarHBondContact O-N 3.08Å; Q54-C56 VanDerWaalsContact C-N 3.34Å; Q54-C56 PolarHBondContact O-N 3.47Å; C56-R60 WeakPolarHBondContact O-CB 3.41Å; C56-R60 WeakPolarHBondContact O-CG 3.42Å; C56-R60 PolarHBondContact O-N 3.19Å; C56-R60 PolarHBondContact O-NE 3.09Å; C56-H742 PolarHBondContact SG-NE2 3.38Å; C56-H742 VanDerWaalsContact SG-NE2 3.36Å
57	Q	91.3	Very high	83.6	Confident	108 Å²	108	67.9 Å²	67.9	51%	0.505	34%	0.337	S	S	.	.	H	α-helix	trans	-67.8	-48.6	170.4	-63.7	-172.2	26.2	0	0	111.5	M52 C53 Q54 P55 K59 R60 H61	M52-Q57 PolarHBondContact O-NE2 2.99Å; C53-Q57 PolarHBondContact O-N 3.44Å; Q54-Q57 WeakPolarHBondContact O-CB 3.48Å; Q54-Q57 PolarHBondContact O-N 2.86Å; Q54-Q57 VanDerWaalsContact O-N 3.08Å; P55-Q57 VanDerWaalsContact C-N 3.34Å; P55-Q57 PolarHBondContact O-N 2.83Å; Q57-K59 PolarHBondContact O-N 3.12Å; Q57-R60 PolarHBondContact O-N 3.37Å; Q57-H61 PolarHBondContact O-N 3.26Å
58	L	91	Very high	84.1	Confident	104 Å²	104	69.6 Å²	69.6	55%	0.545	35%	0.347	S	S	.	.	H	α-helix	trans	-59.4	-46.5	178.6	-70.4	172.1	0	0	0	111.9	Q54 P55 R60 H61 H62	Q54-L58 HydrophobicContact CG-CD1 3.99Å; Q54-L58 HydrophobicContact CG-CG 4.33Å; Q54-L58 WeakPolarHBondContact O-CG 3.42Å; Q54-L58 PolarHBondContact O-N 2.98Å; P55-L58 PolarHBondContact O-N 3.39Å; L58-R60 PolarHBondContact O-N 2.87Å; L58-H61 PolarHBondContact O-N 2.87Å; L58-H62 WeakPolarHBondContact O-CB 3.31Å; L58-H62 PolarHBondContact O-N 3.16Å
59	K	91.4	Very high	84.5	Confident	28 Å²	28	71.9 Å²	71.9	12%	0.122	36%	0.363	C	S	.	.	H	α-helix	trans	-58.3	-46.8	174.9	174.2	167.7	176.2	159.5	0	112.2	P55 Q57 H61 H62 I63 C743 P744 F746 V748	P55-K59 WeakPolarHBondContact O-CB 3.48Å; P55-K59 PolarHBondContact O-N 2.72Å; Q57-K59 PolarHBondContact O-N 3.12Å; K59-H61 VanDerWaalsContact C-N 3.34Å; K59-H61 PolarHBondContact O-N 3.06Å; K59-H62 PolarHBondContact O-N 3.12Å; K59-I63 HydrophobicContact CD-CD1 4.4Å; K59-I63 HydrophobicContact CG-CD1 3.67Å; K59-I63 HydrophobicContact CG-CG1 4.49Å; K59-I63 WeakPolarHBondContact O-CG1 3.4Å; K59-I63 PolarHBondContact O-N 3.06Å; K59-C743 WeakPolarHBondContact CD-O 3.38Å; K59-C743 PolarHBondContact NZ-O 3.25Å; K59-C743 PolarHBondContact NZ-SG 3.49Å; K59-P744 WeakPolarHBondContact CD-O 3.37Å; K59-F746 WeakPolarHBondContact CD-O 3.46Å; K59-F746 WeakPolarHBondContact CE-O 3.29Å; K59-F746 PolarHBondContact NZ-O 2.86Å; K59-V748 VanDerWaalsContact CE-O 3.27Å; K59-V748 WeakPolarHBondContact CE-O 3.12Å; K59-V748 PolarHBondContact NZ-O 3.4Å
60	R	89	Confident	84.5	Confident	64 Å²	64	72 Å²	72	24%	0.242	37%	0.366	C	S	.	.	H	α-helix	trans	-64.6	-36.1	176.9	-76.6	176.1	-66.7	-176.3	-6	112.5	C51 M52 C56 Q57 L58 K64	C51-R60 VanDerWaalsContact O-CZ 3.3Å; C51-R60 PolarHBondContact O-NH1 3.3Å; C51-R60 PolarHBondContact O-NH2 3.3Å; M52-R60 PolarHBondContact SD-NH1 2.96Å; C56-R60 WeakPolarHBondContact O-CB 3.41Å; C56-R60 WeakPolarHBondContact O-CG 3.42Å; C56-R60 PolarHBondContact O-N 3.19Å; C56-R60 PolarHBondContact O-NE 3.09Å; Q57-R60 PolarHBondContact O-N 3.37Å; L58-R60 PolarHBondContact O-N 2.87Å; R60-K64 WeakPolarHBondContact O-CB 3.43Å; R60-K64 VanDerWaalsContact O-CG 3.27Å; R60-K64 WeakPolarHBondContact O-CG 3.24Å; R60-K64 PolarHBondContact O-N 2.84Å; R60-K64 VanDerWaalsContact O-N 3.1Å
61	H	88.4	Confident	84.1	Confident	137 Å²	137	76.8 Å²	76.8	63%	0.634	38%	0.382	S	S	*	.	H	α-helix	trans	-65.1	-48	173.2	-173.6	-88.4	0	0	0	110.8	Q57 L58 K59 I63 K64 S65	Q57-H61 PolarHBondContact O-N 3.26Å; L58-H61 PolarHBondContact O-N 2.87Å; K59-H61 VanDerWaalsContact C-N 3.34Å; K59-H61 PolarHBondContact O-N 3.06Å; H61-I63 PolarHBondContact O-N 3.16Å; H61-K64 PolarHBondContact O-N 2.9Å; H61-S65 PolarHBondContact O-N 3.39Å; H61-S65 PolarHBondContact O-OG 3.13Å; H61-S65 VanDerWaalsContact O-OG 3.1Å
62	H	86.6	Confident	83.8	Confident	65 Å²	65	81 Å²	81	30%	0.301	40%	0.403	S	S	.	.	H	α-helix	trans	-56.5	-51	178.6	-172.7	-109.3	0	0	0	112.3	L58 K59 K64 S65 S66 Q325	L58-H62 WeakPolarHBondContact O-CB 3.31Å; L58-H62 PolarHBondContact O-N 3.16Å; K59-H62 PolarHBondContact O-N 3.12Å; H62-K64 VanDerWaalsContact C-N 3.35Å; H62-K64 PolarHBondContact O-N 3.45Å; H62-S65 WeakPolarHBondContact CA-OG 3.43Å; H62-S65 CarbonylContact O-C 3.6Å; H62-S65 PolarHBondContact O-N 2.97Å; H62-S65 VanDerWaalsContact O-N 3.13Å; H62-S65 PolarHBondContact O-OG 2.89Å; H62-S66 PolarHBondContact O-N 3.11Å; H62-S66 PolarHBondContact O-OG 3.4Å; H62-Q325 PolarHBondContact CE1-NE2 3.24Å; H62-Q325 PolarHBondContact CE1-OE1 2.91Å; H62-Q325 PolarHBondContact NE2-NE2 3.26Å; H62-Q325 PolarHBondContact NE2-OE1 2.93Å
63	I	84.8	Confident	83.4	Confident	30 Å²	30	84.8 Å²	84.8	15%	0.154	42%	0.418	C	S	.	.	H	α-helix	trans	-60.3	-42.2	177	-67.3	162.1	0	0	0	111.2	K59 H61 S65 S66 T67 E749	K59-I63 HydrophobicContact CD-CD1 4.4Å; K59-I63 HydrophobicContact CG-CD1 3.67Å; K59-I63 HydrophobicContact CG-CG1 4.49Å; K59-I63 WeakPolarHBondContact O-CG1 3.4Å; K59-I63 PolarHBondContact O-N 3.06Å; H61-I63 PolarHBondContact O-N 3.16Å; I63-S65 PolarHBondContact O-N 2.7Å; I63-S66 PolarHBondContact O-N 3.46Å; I63-S66 PolarHBondContact O-OG 3.23Å; I63-S66 VanDerWaalsContact O-OG 3.12Å; I63-T67 WeakPolarHBondContact O-CG2 3.17Å; I63-E749 HydrophobicContact CD1-CG 3.81Å
64	K	84.8	Confident	82.9	Confident	147 Å²	147	86.9 Å²	86.9	64%	0.639	43%	0.426	S	S	*	.	H	α-helix	trans	-62.2	-43.8	174.6	-74.2	176.8	-179.3	-172.7	0	111.3	R60 H61 H62 S66 T67	R60-K64 WeakPolarHBondContact O-CB 3.43Å; R60-K64 VanDerWaalsContact O-CG 3.27Å; R60-K64 WeakPolarHBondContact O-CG 3.24Å; R60-K64 PolarHBondContact O-N 2.84Å; R60-K64 VanDerWaalsContact O-N 3.1Å; H61-K64 PolarHBondContact O-N 2.9Å; H62-K64 VanDerWaalsContact C-N 3.35Å; H62-K64 PolarHBondContact O-N 3.45Å; K64-S66 VanDerWaalsContact C-N 3.35Å; K64-S66 PolarHBondContact O-N 3.18Å; K64-T67 PolarHBondContact O-N 3.26Å; K64-T67 PolarHBondContact O-OG1 2.88Å
65	S	83	Confident	82.6	Confident	64 Å²	64	85.3 Å²	85.3	45%	0.448	42%	0.421	S	S	.	.	H	α-helix	trans	-72.2	-17.8	179.2	59.4	0	0	0	0	115.4	H61 H62 I63 P68	H61-S65 PolarHBondContact O-N 3.39Å; H61-S65 PolarHBondContact O-OG 3.13Å; H61-S65 VanDerWaalsContact O-OG 3.1Å; H62-S65 WeakPolarHBondContact CA-OG 3.43Å; H62-S65 CarbonylContact O-C 3.6Å; H62-S65 PolarHBondContact O-N 2.97Å; H62-S65 VanDerWaalsContact O-N 3.13Å; H62-S65 PolarHBondContact O-OG 2.89Å; I63-S65 PolarHBondContact O-N 2.7Å; S65-P68 WeakPolarHBondContact O-CD 3.3Å
66	S	74.7	Confident	82.3	Confident	75 Å²	75	89.7 Å²	89.7	52%	0.524	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-1.5	175.9	66.8	0	0	0	0	114	H62 I63 K64	H62-S66 PolarHBondContact O-N 3.11Å; H62-S66 PolarHBondContact O-OG 3.4Å; I63-S66 PolarHBondContact O-N 3.46Å; I63-S66 PolarHBondContact O-OG 3.23Å; I63-S66 VanDerWaalsContact O-OG 3.12Å; K64-S66 VanDerWaalsContact C-N 3.35Å; K64-S66 PolarHBondContact O-N 3.18Å
67	T	70	Confident	82	Confident	35 Å²	35	91.9 Å²	91.9	22%	0.215	45%	0.451	C	S	.	.			trans	-94.1	6.9	177	63.9	0	0	0	0	118.5	I63 K64 L69 K70 R71	I63-T67 WeakPolarHBondContact O-CG2 3.17Å; K64-T67 PolarHBondContact O-N 3.26Å; K64-T67 PolarHBondContact O-OG1 2.88Å; T67-L69 VanDerWaalsContact C-N 3.26Å; T67-L69 PolarHBondContact O-N 3.27Å; T67-K70 HydrophobicContact CG2-CD 4.33Å; T67-K70 WeakPolarHBondContact O-CA 3.49Å; T67-K70 WeakPolarHBondContact O-CB 3.49Å; T67-K70 PolarHBondContact O-N 2.82Å; T67-R71 PolarHBondContact O-N 2.78Å
68	P	71.7	Confident	81.7	Confident	77 Å²	77	91.6 Å²	91.6	50%	0.5	45%	0.448	S	S	.	.	H	α-helix	trans	-64.8	-30.3	-175.3	27.4	-34.3	0	0	0	112.3	S65 R71 L72	S65-P68 WeakPolarHBondContact O-CD 3.3Å; P68-R71 PolarHBondContact O-N 3.4Å; P68-L72 WeakPolarHBondContact O-CB 3.5Å; P68-L72 PolarHBondContact O-N 3.21Å
69	L	71.6	Confident	81.6	Confident	139 Å²	139	89.1 Å²	89.1	73%	0.728	44%	0.442	S	S	*	.	H	α-helix	trans	-66.9	-37.8	171.2	-70.2	171	0	0	0	112.5	T67 L72 K73	T67-L69 VanDerWaalsContact C-N 3.26Å; T67-L69 PolarHBondContact O-N 3.27Å; L69-L72 PolarHBondContact O-N 3.03Å; L69-K73 WeakPolarHBondContact O-CB 3.48Å; L69-K73 PolarHBondContact O-N 3.26Å
70	K	70.5	Confident	81.4	Confident	104 Å²	104	90.8 Å²	90.8	45%	0.452	46%	0.462	S	S	.	.	H	α-helix	trans	-63.7	-42.2	171.8	-67.6	-165.5	179.8	-172.7	0	110.6	T67 K73 K74	T67-K70 HydrophobicContact CG2-CD 4.33Å; T67-K70 WeakPolarHBondContact O-CA 3.49Å; T67-K70 WeakPolarHBondContact O-CB 3.49Å; T67-K70 PolarHBondContact O-N 2.82Å; K70-K73 PolarHBondContact O-N 3.45Å; K70-K74 PolarHBondContact O-N 3.06Å
71	R	74.5	Confident	81.4	Confident	170 Å²	170	88.9 Å²	88.9	64%	0.642	46%	0.455	S	S	*	.	H	α-helix	trans	-63.9	-46.3	175.8	-70.4	-177.9	171.5	-161.7	-6.9	112	T67 P68 K73 K74 I75	T67-R71 PolarHBondContact O-N 2.78Å; P68-R71 PolarHBondContact O-N 3.4Å; R71-K73 PolarHBondContact O-N 2.9Å; R71-K74 PolarHBondContact O-N 3.22Å; R71-I75 WeakPolarHBondContact O-CG1 3.42Å; R71-I75 PolarHBondContact O-N 3.05Å
72	L	82.9	Confident	81.5	Confident	98 Å²	98	87.2 Å²	87.2	51%	0.513	45%	0.454	S	S	.	.	H	α-helix	trans	-61.4	-43.7	176	-173.9	64.1	0	0	0	111	P68 L69 K74 I75 M76	P68-L72 WeakPolarHBondContact O-CB 3.5Å; P68-L72 PolarHBondContact O-N 3.21Å; L69-L72 PolarHBondContact O-N 3.03Å; L72-K74 PolarHBondContact O-N 3.09Å; L72-I75 PolarHBondContact O-N 3.38Å; L72-M76 HydrophobicContact CD1-CG 4.42Å; L72-M76 HydrophobicContact CG-CG 4.39Å; L72-M76 WeakPolarHBondContact O-CB 3.31Å; L72-M76 VanDerWaalsContact O-CG 3.3Å; L72-M76 WeakPolarHBondContact O-CG 3.4Å; L72-M76 PolarHBondContact O-N 3.39Å
73	K	79.8	Confident	81.8	Confident	147 Å²	147	86.8 Å²	86.8	64%	0.639	46%	0.462	S	S	*	.	H	α-helix	trans	-59.4	-44.4	173.8	-171.5	172.2	-178.4	175.8	0	111.8	L69 K70 R71 I75 M76 I77	L69-K73 WeakPolarHBondContact O-CB 3.48Å; L69-K73 PolarHBondContact O-N 3.26Å; K70-K73 PolarHBondContact O-N 3.45Å; R71-K73 PolarHBondContact O-N 2.9Å; K73-I75 PolarHBondContact O-N 3.22Å; K73-M76 PolarHBondContact O-N 3.29Å; K73-I77 HydrophobicContact CG-CD1 3.92Å; K73-I77 WeakPolarHBondContact O-CB 3.24Å; K73-I77 VanDerWaalsContact O-CG1 3.26Å; K73-I77 WeakPolarHBondContact O-CG1 3.25Å; K73-I77 PolarHBondContact O-N 3.42Å
74	K	79.9	Confident	82.2	Confident	51 Å²	51	85.7 Å²	85.7	22%	0.222	46%	0.458	C	S	.	.	H	α-helix	trans	-61.7	-40.1	173.9	-74.3	-167.2	179.6	-167	0	112.8	E39 K70 R71 L72 K78	E39-K74 IonicContact OE1-NZ 2.71Å; E39-K74 PolarHBondContact OE1-NZ 2.78Å; K70-K74 PolarHBondContact O-N 3.06Å; R71-K74 PolarHBondContact O-N 3.22Å; L72-K74 PolarHBondContact O-N 3.09Å; K74-K78 WeakPolarHBondContact O-CG 3.46Å; K74-K78 PolarHBondContact O-N 3.06Å
75	I	84.5	Confident	82.6	Confident	106 Å²	106	82.3 Å²	82.3	54%	0.544	44%	0.441	S	S	.	.	H	α-helix	trans	-66.7	-44.8	176.8	-69	163.9	0	0	0	110.8	R71 L72 K73 I77 K78 A79	R71-I75 WeakPolarHBondContact O-CG1 3.42Å; R71-I75 PolarHBondContact O-N 3.05Å; L72-I75 PolarHBondContact O-N 3.38Å; K73-I75 PolarHBondContact O-N 3.22Å; I75-I77 PolarHBondContact O-N 2.98Å; I75-K78 PolarHBondContact O-N 3.16Å; I75-A79 WeakPolarHBondContact O-CB 3.31Å; I75-A79 PolarHBondContact O-N 3.04Å
76	M	86.1	Confident	83.2	Confident	119 Å²	119	81.2 Å²	81.2	59%	0.586	44%	0.44	S	S	*	.	H	α-helix	trans	-63.8	-38.7	177.1	-69.7	-60.3	-65.6	0	0	112.2	L72 K73 A79 A80	L72-M76 HydrophobicContact CD1-CG 4.42Å; L72-M76 HydrophobicContact CG-CG 4.39Å; L72-M76 WeakPolarHBondContact O-CB 3.31Å; L72-M76 VanDerWaalsContact O-CG 3.3Å; L72-M76 WeakPolarHBondContact O-CG 3.4Å; L72-M76 PolarHBondContact O-N 3.39Å; K73-M76 PolarHBondContact O-N 3.29Å; M76-A79 PolarHBondContact O-N 3.4Å; M76-A80 WeakPolarHBondContact O-CB 3.42Å; M76-A80 PolarHBondContact O-N 3.5Å
77	I	84.7	Confident	84.1	Confident	62 Å²	62	81.6 Å²	81.6	32%	0.318	44%	0.435	S	S	.	.	H	α-helix	trans	-64.3	-45.7	173.6	-70.3	165.5	0	0	0	110.7	K73 I75 A79 A80 F81	K73-I77 HydrophobicContact CG-CD1 3.92Å; K73-I77 WeakPolarHBondContact O-CB 3.24Å; K73-I77 VanDerWaalsContact O-CG1 3.26Å; K73-I77 WeakPolarHBondContact O-CG1 3.25Å; K73-I77 PolarHBondContact O-N 3.42Å; I75-I77 PolarHBondContact O-N 2.98Å; I77-A79 VanDerWaalsContact C-N 3.35Å; I77-A79 PolarHBondContact O-N 2.84Å; I77-A80 PolarHBondContact O-N 3.28Å; I77-F81 HydrophobicContact CG2-CD2 3.85Å; I77-F81 HydrophobicContact CG2-CE2 3.65Å; I77-F81 VanDerWaalsContact O-CD2 3.29Å; I77-F81 WeakPolarHBondContact O-CD2 3.43Å; I77-F81 PolarHBondContact O-N 3.04Å
78	K	85.5	Confident	85.2	Confident	101 Å²	101	81.7 Å²	81.7	44%	0.439	43%	0.433	S	S	.	.	H	α-helix	trans	-59.8	-43.5	173.9	-75.1	-174.8	176.9	-168.5	0	112	P36 K74 I75 F81 V82	P36-K78 HydrophobicContact CG-CD 4.35Å; P36-K78 HydrophobicContact CG-CG 4.13Å; K74-K78 WeakPolarHBondContact O-CG 3.46Å; K74-K78 PolarHBondContact O-N 3.06Å; I75-K78 PolarHBondContact O-N 3.16Å; K78-F81 PolarHBondContact O-N 3.39Å; K78-V82 WeakPolarHBondContact O-CG2 3.26Å; K78-V82 PolarHBondContact O-N 3.4Å
79	A	88.5	Confident	86.3	Confident	52 Å²	52	84 Å²	84	43%	0.43	44%	0.435	S	S	.	.	H	α-helix	trans	-64.8	-39.6	177.5	0	0	0	0	0	112.2	I75 M76 I77 V82 A83	I75-A79 WeakPolarHBondContact O-CB 3.31Å; I75-A79 PolarHBondContact O-N 3.04Å; M76-A79 PolarHBondContact O-N 3.4Å; I77-A79 VanDerWaalsContact C-N 3.35Å; I77-A79 PolarHBondContact O-N 2.84Å; A79-V82 PolarHBondContact O-N 3.02Å; A79-A83 WeakPolarHBondContact O-CB 3.42Å; A79-A83 PolarHBondContact O-N 2.96Å
80	A	88.7	Confident	87.3	Confident	64 Å²	64	82.3 Å²	82.3	53%	0.529	43%	0.426	S	S	.	.	H	α-helix	trans	-62.9	-40.3	174.2	0	0	0	0	0	111.9	M76 I77 A83 G84	M76-A80 WeakPolarHBondContact O-CB 3.42Å; M76-A80 PolarHBondContact O-N 3.5Å; I77-A80 PolarHBondContact O-N 3.28Å; A80-A83 PolarHBondContact O-N 3.1Å; A80-G84 PolarHBondContact O-N 2.98Å
81	F	89.1	Confident	88.3	Confident	23 Å²	23	78.5 Å²	78.5	10%	0.101	41%	0.411	C	S	.	.	H	α-helix	trans	-68	-41	173.3	-78.1	-57.5	0	0	0	113.2	L27 L30 T31 C34 W35 I77 K78 A83 G84 W85	L27-F81 HydrophobicContact CD1-CD1 4.25Å; L30-F81 HydrophobicContact CB-CE1 3.95Å; L30-F81 HydrophobicContact CB-CZ 4.19Å; L30-F81 VanDerWaalsContact O-CZ 3.25Å; L30-F81 WeakPolarHBondContact O-CZ 3.38Å; T31-F81 HydrophobicContact CG2-CD1 3.42Å; T31-F81 VanDerWaalsContact CG2-CD1 3.42Å; T31-F81 HydrophobicContact CG2-CE1 3.64Å; T31-F81 HydrophobicContact CG2-CG 4.26Å; C34-F81 HydrophobicContact CB-CE2 3.75Å; C34-F81 HydrophobicContact CB-CZ 3.72Å; W35-F81 HydrophobicContact CZ3-CB 4.42Å; I77-F81 HydrophobicContact CG2-CD2 3.85Å; I77-F81 HydrophobicContact CG2-CE2 3.65Å; I77-F81 VanDerWaalsContact O-CD2 3.29Å; I77-F81 WeakPolarHBondContact O-CD2 3.43Å; I77-F81 PolarHBondContact O-N 3.04Å; K78-F81 PolarHBondContact O-N 3.39Å; F81-A83 VanDerWaalsContact C-N 3.33Å; F81-A83 PolarHBondContact O-N 3.38Å; F81-G84 PolarHBondContact O-N 3.5Å; F81-W85 VanDerWaalsContact O-CD1 3.23Å; F81-W85 PolarHBondContact O-N 2.99Å
82	V	90.4	Very high	89.1	Confident	102 Å²	102	72.7 Å²	72.7	62%	0.618	39%	0.394	S	S	*	.	H	α-helix	trans	-61.7	-42.1	174.4	171	0	0	0	0	111.1	K78 A79 G86	K78-V82 WeakPolarHBondContact O-CG2 3.26Å; K78-V82 PolarHBondContact O-N 3.4Å; A79-V82 PolarHBondContact O-N 3.02Å; V82-G86 PolarHBondContact O-N 3.35Å
83	A	92.6	Very high	89.5	Confident	57 Å²	57	74.8 Å²	74.8	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-65	-40.8	174.1	0	0	0	0	0	112.2	A79 A80 F81 G86 I87	A79-A83 WeakPolarHBondContact O-CB 3.42Å; A79-A83 PolarHBondContact O-N 2.96Å; A80-A83 PolarHBondContact O-N 3.1Å; F81-A83 VanDerWaalsContact C-N 3.33Å; F81-A83 PolarHBondContact O-N 3.38Å; A83-G86 CarbonylContact O-C 3.56Å; A83-G86 WeakPolarHBondContact O-CA 3.42Å; A83-G86 PolarHBondContact O-N 3.06Å; A83-I87 WeakPolarHBondContact O-CG1 3.29Å; A83-I87 PolarHBondContact O-N 2.89Å
84	G	92.4	Very high	90.1	Very high	6 Å²	6	73.2 Å²	73.2	6%	0.062	39%	0.389	C	S	.	.	H	α-helix	trans	-64.5	-44.4	177.5	0	0	0	0	0	113.2	Y23 A80 F81 G86 I87 F88	Y23-G84 WeakPolarHBondContact CE1-O 3.28Å; Y23-G84 WeakPolarHBondContact OH-CA 3.3Å; Y23-G84 PolarHBondContact OH-O 3.2Å; A80-G84 PolarHBondContact O-N 2.98Å; F81-G84 PolarHBondContact O-N 3.5Å; G84-G86 VanDerWaalsContact C-N 3.32Å; G84-G86 PolarHBondContact O-N 2.65Å; G84-I87 PolarHBondContact O-N 3.48Å; G84-F88 PolarHBondContact O-N 2.63Å
85	W	94.2	Very high	90.5	Very high	77 Å²	77	73.4 Å²	73.4	29%	0.292	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-37.4	170.5	-78.8	106.3	0	0	0	112	L27 I28 T31 F81 I87 F88 F89	L27-W85 HydrophobicContact CD2-CD2 3.86Å; L27-W85 HydrophobicContact CD2-CE3 4.02Å; L27-W85 HydrophobicContact CD2-CG 4.3Å; L27-W85 HydrophobicContact CD2-CH2 4.41Å; L27-W85 HydrophobicContact CD2-CZ2 4.28Å; L27-W85 HydrophobicContact CD2-CZ3 4.3Å; L27-W85 HydrophobicContact CG-CZ2 4.36Å; I28-W85 HydrophobicContact CG1-CH2 4.41Å; T31-W85 HydrophobicContact CG2-CZ2 4.13Å; T31-W85 VanDerWaalsContact CG2-NE1 3.29Å; F81-W85 VanDerWaalsContact O-CD1 3.23Å; F81-W85 PolarHBondContact O-N 2.99Å; W85-I87 PolarHBondContact O-N 2.86Å; W85-F88 HydrophobicContact CE3-CB 4.49Å; W85-F88 AromaticContact CE3-CD1 3.66Å; W85-F88 HydrophobicContact CE3-CD1 3.66Å; W85-F88 HydrophobicContact CE3-CE1 4.36Å; W85-F88 HydrophobicContact CE3-CG 4.4Å; W85-F88 AromaticContact CZ3-CD1 3.63Å; W85-F88 HydrophobicContact CZ3-CD1 3.63Å; W85-F88 AromaticContact CZ3-CE1 3.89Å; W85-F88 HydrophobicContact CZ3-CE1 3.89Å; W85-F88 HydrophobicContact CZ3-CG 4.48Å; W85-F88 WeakPolarHBondContact O-CB 3.41Å; W85-F88 PolarHBondContact O-N 2.83Å; W85-F89 HydrophobicContact CB-CE2 4.24Å; W85-F89 HydrophobicContact CE3-CE2 4.2Å; W85-F89 HydrophobicContact CE3-CZ 4.12Å; W85-F89 WeakPolarHBondContact O-CD2 3.5Å; W85-F89 PolarHBondContact O-N 3.04Å
86	G	94.6	Very high	90.6	Very high	40 Å²	40	73.2 Å²	73.2	41%	0.412	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-42.3	171.9	0	0	0	0	0	113.3	V82 A83 G84 L90	V82-G86 PolarHBondContact O-N 3.35Å; A83-G86 CarbonylContact O-C 3.56Å; A83-G86 WeakPolarHBondContact O-CA 3.42Å; A83-G86 PolarHBondContact O-N 3.06Å; G84-G86 VanDerWaalsContact C-N 3.32Å; G84-G86 PolarHBondContact O-N 2.65Å; G86-L90 WeakPolarHBondContact O-CB 3.36Å; G86-L90 PolarHBondContact O-N 3.3Å
87	I	93.5	Very high	90.7	Very high	84 Å²	84	72.1 Å²	72.1	43%	0.431	39%	0.392	S	S	.	.	H	α-helix	trans	-65.3	-43.3	173.5	-69.4	164.1	0	0	0	110.6	Y23 A83 G84 W85 F89 L90 L91	Y23-I87 HydrophobicContact CE1-CB 4.44Å; Y23-I87 HydrophobicContact CE1-CG2 4.11Å; A83-I87 WeakPolarHBondContact O-CG1 3.29Å; A83-I87 PolarHBondContact O-N 2.89Å; G84-I87 PolarHBondContact O-N 3.48Å; W85-I87 PolarHBondContact O-N 2.86Å; I87-F89 PolarHBondContact O-N 2.66Å; I87-L90 WeakPolarHBondContact O-CB 3.1Å; I87-L90 PolarHBondContact O-N 3.48Å; I87-L91 HydrophobicContact CG2-CD1 3.89Å; I87-L91 HydrophobicContact CG2-CG 4.25Å; I87-L91 WeakPolarHBondContact O-CG 3.27Å; I87-L91 PolarHBondContact O-N 2.84Å
88	F	93.7	Very high	90.6	Very high	36 Å²	36	71.6 Å²	71.6	16%	0.158	39%	0.39	C	S	.	.	H	α-helix	trans	-57.2	-50.4	175.7	173.4	-114.6	0	0	0	111.9	Y23 T24 L27 G84 W85 L90 L91 V92	Y23-F88 HydrophobicContact CD1-CB 4.15Å; Y23-F88 HydrophobicContact CD1-CD2 4.43Å; Y23-F88 HydrophobicContact CE1-CB 3.93Å; T24-F88 HydrophobicContact CG2-CD2 3.75Å; T24-F88 HydrophobicContact CG2-CE2 3.13Å; T24-F88 HydrophobicContact CG2-CZ 3.73Å; L27-F88 HydrophobicContact CD2-CB 3.9Å; L27-F88 HydrophobicContact CD2-CG 4.39Å; G84-F88 PolarHBondContact O-N 2.63Å; W85-F88 HydrophobicContact CE3-CB 4.49Å; W85-F88 AromaticContact CE3-CD1 3.66Å; W85-F88 HydrophobicContact CE3-CD1 3.66Å; W85-F88 HydrophobicContact CE3-CE1 4.36Å; W85-F88 HydrophobicContact CE3-CG 4.4Å; W85-F88 AromaticContact CZ3-CD1 3.63Å; W85-F88 HydrophobicContact CZ3-CD1 3.63Å; W85-F88 AromaticContact CZ3-CE1 3.89Å; W85-F88 HydrophobicContact CZ3-CE1 3.89Å; W85-F88 HydrophobicContact CZ3-CG 4.48Å; W85-F88 WeakPolarHBondContact O-CB 3.41Å; W85-F88 PolarHBondContact O-N 2.83Å; F88-L90 VanDerWaalsContact C-N 3.29Å; F88-L90 PolarHBondContact O-N 2.88Å; F88-L91 PolarHBondContact O-N 3.04Å; F88-V92 HydrophobicContact CD2-CG2 3.9Å; F88-V92 HydrophobicContact CE1-CG2 4.1Å; F88-V92 HydrophobicContact CE2-CG2 3.33Å; F88-V92 HydrophobicContact CG-CG2 4.47Å; F88-V92 HydrophobicContact CZ-CG2 3.48Å; F88-V92 VanDerWaalsContact CZ-CG2 3.48Å; F88-V92 WeakPolarHBondContact O-CG2 3.49Å; F88-V92 PolarHBondContact O-N 3.36Å
89	F	93.9	Very high	90.1	Very high	127 Å²	127	75 Å²	75	56%	0.557	41%	0.407	S	S	*	.	H	α-helix	trans	-64.2	-32.4	178.2	-67	-56.5	0	0	0	112.8	W85 I87 Y93	W85-F89 HydrophobicContact CB-CE2 4.24Å; W85-F89 HydrophobicContact CE3-CE2 4.2Å; W85-F89 HydrophobicContact CE3-CZ 4.12Å; W85-F89 WeakPolarHBondContact O-CD2 3.5Å; W85-F89 PolarHBondContact O-N 3.04Å; I87-F89 PolarHBondContact O-N 2.66Å; F89-Y93 VanDerWaalsContact O-CB 3.23Å; F89-Y93 WeakPolarHBondContact O-CB 3.48Å; F89-Y93 PolarHBondContact O-N 3.08Å
90	L	93	Very high	89	Confident	102 Å²	102	78.2 Å²	78.2	53%	0.534	42%	0.424	S	S	.	.	H	α-helix	trans	-66	-45.6	172.9	-171.3	161.4	0	0	0	111.6	G86 I87 F88 Y93 K94	G86-L90 WeakPolarHBondContact O-CB 3.36Å; G86-L90 PolarHBondContact O-N 3.3Å; I87-L90 WeakPolarHBondContact O-CB 3.1Å; I87-L90 PolarHBondContact O-N 3.48Å; F88-L90 VanDerWaalsContact C-N 3.29Å; F88-L90 PolarHBondContact O-N 2.88Å; L90-Y93 PolarHBondContact O-N 2.9Å; L90-K94 HydrophobicContact CD2-CG 4.26Å; L90-K94 PolarHBondContact O-N 3.29Å
91	L	91.8	Very high	87.7	Confident	24 Å²	24	82.7 Å²	82.7	13%	0.126	44%	0.439	C	S	.	.	H	α-helix	trans	-65.7	-41.6	178.1	-66.2	170.7	0	0	0	111.6	L16 L19 T20 Y23 I87 F88 K94 L95	L16-L91 HydrophobicContact CD1-CD2 3.78Å; L19-L91 HydrophobicContact CD2-CD2 4.19Å; T20-L91 HydrophobicContact CG2-CB 3.57Å; Y23-L91 HydrophobicContact CD1-CD1 4.25Å; Y23-L91 HydrophobicContact CG-CD1 4.47Å; I87-L91 HydrophobicContact CG2-CD1 3.89Å; I87-L91 HydrophobicContact CG2-CG 4.25Å; I87-L91 WeakPolarHBondContact O-CG 3.27Å; I87-L91 PolarHBondContact O-N 2.84Å; F88-L91 PolarHBondContact O-N 3.04Å; L91-K94 WeakPolarHBondContact O-CB 3.37Å; L91-K94 PolarHBondContact O-N 2.94Å; L91-L95 PolarHBondContact O-N 2.85Å
92	V	91.6	Very high	85.9	Confident	49 Å²	49	88.4 Å²	88.4	30%	0.297	47%	0.47	S	S	.	.	H	α-helix	trans	-64.6	-42	173.5	172	0	0	0	0	111.5	F88 K94 L95 T96	F88-V92 HydrophobicContact CD2-CG2 3.9Å; F88-V92 HydrophobicContact CE1-CG2 4.1Å; F88-V92 HydrophobicContact CE2-CG2 3.33Å; F88-V92 HydrophobicContact CG-CG2 4.47Å; F88-V92 HydrophobicContact CZ-CG2 3.48Å; F88-V92 VanDerWaalsContact CZ-CG2 3.48Å; F88-V92 WeakPolarHBondContact O-CG2 3.49Å; F88-V92 PolarHBondContact O-N 3.36Å; V92-K94 VanDerWaalsContact C-N 3.3Å; V92-K94 PolarHBondContact O-N 3.06Å; V92-L95 WeakPolarHBondContact O-CA 3.37Å; V92-L95 VanDerWaalsContact O-CB 3.24Å; V92-L95 WeakPolarHBondContact O-CB 3.49Å; V92-L95 PolarHBondContact O-N 2.78Å; V92-L95 VanDerWaalsContact O-N 3.07Å; V92-T96 PolarHBondContact O-N 3.39Å
93	Y	91.8	Very high	84.4	Confident	142 Å²	142	89.1 Å²	89.1	56%	0.557	48%	0.48	S	S	*	.	H	α-helix	trans	-60.4	-41.2	174.4	172.1	-113.2	0	0	0	111.7	F89 L90 L95 T96 L97	F89-Y93 VanDerWaalsContact O-CB 3.23Å; F89-Y93 WeakPolarHBondContact O-CB 3.48Å; F89-Y93 PolarHBondContact O-N 3.08Å; L90-Y93 PolarHBondContact O-N 2.9Å; Y93-L95 VanDerWaalsContact C-N 3.32Å; Y93-L95 PolarHBondContact O-N 3.28Å; Y93-T96 WeakPolarHBondContact CA-OG1 3.01Å; Y93-T96 PolarHBondContact O-N 3.12Å; Y93-T96 PolarHBondContact O-OG1 3.34Å; Y93-L97 HydrophobicContact CD1-CD1 4.39Å; Y93-L97 HydrophobicContact CE1-CD1 3.83Å; Y93-L97 HydrophobicContact CE2-CD1 4.39Å; Y93-L97 HydrophobicContact CE2-CD2 4.49Å; Y93-L97 HydrophobicContact CE2-CG 4.43Å; Y93-L97 PolarHBondContact O-N 2.55Å
94	K	91	Very high	83.1	Confident	114 Å²	114	89.2 Å²	89.2	50%	0.496	49%	0.486	S	S	.	.	H	α-helix	trans	-61.9	-38.8	172	-78.6	-72.7	-176.2	179.9	0	112.4	L16 L90 L91 V92 T96 L97	L16-K94 HydrophobicContact CD2-CB 3.6Å; L90-K94 HydrophobicContact CD2-CG 4.26Å; L90-K94 PolarHBondContact O-N 3.29Å; L91-K94 WeakPolarHBondContact O-CB 3.37Å; L91-K94 PolarHBondContact O-N 2.94Å; V92-K94 VanDerWaalsContact C-N 3.3Å; V92-K94 PolarHBondContact O-N 3.06Å; K94-T96 VanDerWaalsContact C-N 3.31Å; K94-T96 PolarHBondContact O-N 2.93Å; K94-L97 HydrophobicContact CD-CD1 4.42Å; K94-L97 PolarHBondContact O-N 3.48Å; K94-L97 VanDerWaalsContact O-N 3.17Å
95	L	88.9	Confident	82.4	Confident	55 Å²	55	91.1 Å²	91.1	29%	0.288	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-38.6	174.3	-148.8	76.1	0	0	0	112.1	L16 L91 V92 Y93 L97 I98	L16-L95 HydrophobicContact CB-CD1 4.17Å; L16-L95 HydrophobicContact CD2-CB 4.42Å; L16-L95 HydrophobicContact CD2-CD1 3.93Å; L16-L95 HydrophobicContact CG-CD1 3.82Å; L91-L95 PolarHBondContact O-N 2.85Å; V92-L95 WeakPolarHBondContact O-CA 3.37Å; V92-L95 VanDerWaalsContact O-CB 3.24Å; V92-L95 WeakPolarHBondContact O-CB 3.49Å; V92-L95 PolarHBondContact O-N 2.78Å; V92-L95 VanDerWaalsContact O-N 3.07Å; Y93-L95 VanDerWaalsContact C-N 3.32Å; Y93-L95 PolarHBondContact O-N 3.28Å; L95-L97 PolarHBondContact O-N 2.83Å; L95-I98 HydrophobicContact CD1-CD1 3.94Å; L95-I98 HydrophobicContact CG-CD1 4.37Å; L95-I98 WeakPolarHBondContact O-CG1 3.33Å; L95-I98 PolarHBondContact O-N 3.3Å
96	T	87.4	Confident	81.9	Confident	102 Å²	102	88.7 Å²	88.7	63%	0.626	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-3	177.1	57.9	0	0	0	0	115.1	V92 Y93 K94	V92-T96 PolarHBondContact O-N 3.39Å; Y93-T96 WeakPolarHBondContact CA-OG1 3.01Å; Y93-T96 PolarHBondContact O-N 3.12Å; Y93-T96 PolarHBondContact O-OG1 3.34Å; K94-T96 VanDerWaalsContact C-N 3.31Å; K94-T96 PolarHBondContact O-N 2.93Å
97	L	87.4	Confident	81.5	Confident	95 Å²	95	86.8 Å²	86.8	50%	0.497	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-1.5	174.7	-68.5	171.6	0	0	0	113.2	Y93 K94 L95	Y93-L97 HydrophobicContact CD1-CD1 4.39Å; Y93-L97 HydrophobicContact CE1-CD1 3.83Å; Y93-L97 HydrophobicContact CE2-CD1 4.39Å; Y93-L97 HydrophobicContact CE2-CD2 4.49Å; Y93-L97 HydrophobicContact CE2-CG 4.43Å; Y93-L97 PolarHBondContact O-N 2.55Å; K94-L97 HydrophobicContact CD-CD1 4.42Å; K94-L97 PolarHBondContact O-N 3.48Å; K94-L97 VanDerWaalsContact O-N 3.17Å; L95-L97 PolarHBondContact O-N 2.83Å
98	I	82.3	Confident	81.3	Confident	52 Å²	52	83.4 Å²	83.4	27%	0.267	45%	0.448	S	S	.	.			trans	-79.3	120.3	178.1	-56.6	171	0	0	0	108.4	D13 L16 L95	D13-I98 HydrophobicContact CB-CD1 3.88Å; D13-I98 HydrophobicContact CB-CG1 4.43Å; D13-I98 HydrophobicContact CB-CG2 4.1Å; D13-I98 WeakPolarHBondContact OD1-CG1 3.31Å; L16-I98 HydrophobicContact CD2-CD1 4.25Å; L95-I98 HydrophobicContact CD1-CD1 3.94Å; L95-I98 HydrophobicContact CG-CD1 4.37Å; L95-I98 WeakPolarHBondContact O-CG1 3.33Å; L95-I98 PolarHBondContact O-N 3.3Å
99	E	75.1	Confident	81.1	Confident	173 Å²	173	87.6 Å²	87.6	81%	0.808	47%	0.471	S	S	*	.			trans	-74.4	129	171.6	-65.1	-171.9	172.7	0	0	109.2	D101	E99-D101 PolarHBondContact O-N 3.46Å
100	P	66.1	Low	80.8	Confident	119 Å²	119	82.3 Å²	82.3	77%	0.773	45%	0.45	S	S	*	.			trans	-72.6	101.7	-177.3	28.3	-33.8	0	0	0	110.3	N102	P100-N102 PolarHBondContact O-N 2.8Å
101	D	60	Low	80.6	Confident	157 Å²	157	77.7 Å²	77.7	84%	0.84	43%	0.425	S	S	*	.			trans	-65.3	104.7	-179	-149.2	3	0	0	0	109.8	E99 S103	E99-D101 PolarHBondContact O-N 3.46Å; D101-S103 PolarHBondContact O-N 2.94Å
102	N	53.2	Low	80.4	Confident	144 Å²	144	79.8 Å²	79.8	77%	0.77	45%	0.453	S	S	*	.			trans	-83.6	66.6	-159.8	-157.1	7.2	0	0	0	110.9	P100 G104	P100-N102 PolarHBondContact O-N 2.8Å; N102-G104 PolarHBondContact O-N 3.12Å
103	S	57.5	Low	80.4	Confident	116 Å²	116	79.5 Å²	79.5	81%	0.811	45%	0.45	S	S	*	.			trans	-71.4	-6	-166.6	53.9	0	0	0	0	115.4	D101 F105	D101-S103 PolarHBondContact O-N 2.94Å; S103-F105 PolarHBondContact O-N 3.38Å
104	G	65.7	Low	80.1	Confident	59 Å²	59	78.5 Å²	78.5	61%	0.608	45%	0.454	S	S	*	.			trans	-68.3	111.7	172.6	0	0	0	0	0	112.2	N102 D106	N102-G104 PolarHBondContact O-N 3.12Å; G104-D106 PolarHBondContact O-N 2.91Å
105	F	77.4	Confident	79.8	Confident	47 Å²	47	79.3 Å²	79.3	21%	0.206	46%	0.457	C	S	.	.			trans	-74.2	94.8	177.9	-177	-99.6	0	0	0	111.6	S103 P107 V110 K149 A150 A153 W163 P169	S103-F105 PolarHBondContact O-N 3.38Å; F105-P107 HydrophobicContact CD1-CG 4.3Å; F105-P107 HydrophobicContact CE1-CG 3.9Å; F105-P107 WeakPolarHBondContact O-CD 3.29Å; F105-V110 HydrophobicContact CE2-CG2 4.18Å; F105-K149 HydrophobicContact CE1-CD 4.24Å; F105-K149 HydrophobicContact CE1-CG 3.99Å; F105-K149 HydrophobicContact CE2-CB 4.43Å; F105-K149 HydrophobicContact CE2-CD 4.22Å; F105-K149 HydrophobicContact CE2-CG 4.31Å; F105-K149 HydrophobicContact CZ-CB 3.88Å; F105-K149 HydrophobicContact CZ-CD 3.94Å; F105-K149 HydrophobicContact CZ-CG 3.62Å; F105-A150 HydrophobicContact CZ-CB 4Å; F105-A153 HydrophobicContact CE1-CB 4.41Å; F105-W163 PolarHBondContact O-NE1 2.95Å; F105-P169 HydrophobicContact CD1-CG 4.16Å; F105-P169 HydrophobicContact CE1-CG 3.86Å
106	D	84.9	Confident	79.6	Confident	25 Å²	25	84.2 Å²	84.2	13%	0.134	48%	0.484	C	S	.	.			trans	-97	110.4	171.4	-173.3	-37.6	0	0	0	110.7	G104 F108 L109 V110 K115	G104-D106 PolarHBondContact O-N 2.91Å; D106-F108 VanDerWaalsContact C-N 3.27Å; D106-F108 PolarHBondContact O-N 3.37Å; D106-F108 WeakPolarHBondContact OD1-CA 3.5Å; D106-F108 VanDerWaalsContact OD1-CB 3.3Å; D106-F108 WeakPolarHBondContact OD1-CB 3.17Å; D106-F108 PolarHBondContact OD1-N 3.21Å; D106-L109 HydrophobicContact CB-CB 4.05Å; D106-L109 HydrophobicContact CB-CD1 3.94Å; D106-L109 HydrophobicContact CB-CG 4.06Å; D106-L109 PolarHBondContact O-N 3.03Å; D106-L109 PolarHBondContact OD1-N 2.87Å; D106-L109 VanDerWaalsContact OD1-N 3.12Å; D106-V110 WeakPolarHBondContact O-CG2 3.45Å; D106-V110 PolarHBondContact O-N 2.68Å; D106-K115 IonicContact OD2-NZ 3.89Å
107	P	86.4	Confident	79.6	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	46%	0.463	C	S	.	.	H	α-helix	trans	-60.6	-31.6	178.6	-24.5	34.1	0	0	0	114.3	F105 L111 A150 A153 L154 W163	F105-P107 HydrophobicContact CD1-CG 4.3Å; F105-P107 HydrophobicContact CE1-CG 3.9Å; F105-P107 WeakPolarHBondContact O-CD 3.29Å; P107-L111 WeakPolarHBondContact O-CB 3.5Å; P107-L111 WeakPolarHBondContact O-CG 3.21Å; P107-L111 PolarHBondContact O-N 3.34Å; P107-A150 HydrophobicContact CB-CB 3.96Å; P107-A153 HydrophobicContact CB-CB 4.21Å; P107-A153 HydrophobicContact CG-CB 3.71Å; P107-L154 HydrophobicContact CB-CD1 3.94Å; P107-L154 HydrophobicContact CB-CD2 3.87Å; P107-L154 HydrophobicContact CB-CG 3.65Å; P107-L154 HydrophobicContact CG-CD2 4.24Å; P107-L154 HydrophobicContact CG-CG 4.43Å; P107-W163 HydrophobicContact CG-CD2 4.13Å; P107-W163 HydrophobicContact CG-CG 4.24Å; P107-W163 HydrophobicContact CG-CZ2 4.44Å
108	F	89.4	Confident	79.6	Confident	13 Å²	13	77.9 Å²	77.9	6%	0.057	45%	0.453	C	S	.	.	H	α-helix	trans	-72.4	-44.2	-179.7	-63.2	-87.1	0	0	0	110.3	D106 V110 L111 G112 L113 D114 K115 L154 W163	D106-F108 VanDerWaalsContact C-N 3.27Å; D106-F108 PolarHBondContact O-N 3.37Å; D106-F108 WeakPolarHBondContact OD1-CA 3.5Å; D106-F108 VanDerWaalsContact OD1-CB 3.3Å; D106-F108 WeakPolarHBondContact OD1-CB 3.17Å; D106-F108 PolarHBondContact OD1-N 3.21Å; F108-V110 VanDerWaalsContact C-N 3.34Å; F108-V110 PolarHBondContact O-N 3.38Å; F108-L111 CarbonylContact O-C 3.55Å; F108-L111 PolarHBondContact O-N 2.92Å; F108-G112 PolarHBondContact O-N 2.9Å; F108-L113 HydrophobicContact CD1-CB 4.42Å; F108-L113 PolarHBondContact O-N 3.34Å; F108-D114 WeakPolarHBondContact CD1-O 3.37Å; F108-K115 HydrophobicContact CD2-CG 4.36Å; F108-K115 WeakPolarHBondContact CE1-O 3.23Å; F108-K115 HydrophobicContact CG-CG 4.41Å; F108-L154 HydrophobicContact CD1-CD1 3.89Å; F108-L154 HydrophobicContact CD2-CD1 4.44Å; F108-L154 HydrophobicContact CD2-CD2 4.25Å; F108-L154 HydrophobicContact CE1-CD1 3.78Å; F108-L154 HydrophobicContact CE1-CD2 4.26Å; F108-L154 HydrophobicContact CE2-CD1 4.34Å; F108-L154 HydrophobicContact CE2-CD2 3.61Å; F108-L154 HydrophobicContact CG-CD1 4.24Å; F108-L154 HydrophobicContact CZ-CD1 4.02Å; F108-L154 HydrophobicContact CZ-CD2 3.62Å; F108-L154 HydrophobicContact CZ-CG 4.49Å; F108-W163 AromaticContact CD2-CH2 3.92Å; F108-W163 HydrophobicContact CD2-CH2 3.92Å; F108-W163 HydrophobicContact CD2-CZ3 4.46Å; F108-W163 AromaticContact CE2-CH2 3.68Å; F108-W163 HydrophobicContact CE2-CH2 3.68Å; F108-W163 AromaticContact CE2-CZ3 3.79Å; F108-W163 HydrophobicContact CE2-CZ3 3.79Å
109	L	87.5	Confident	79.8	Confident	124 Å²	124	79.7 Å²	79.7	65%	0.649	47%	0.468	S	S	*	.	H	α-helix	trans	-63.6	-37.2	172.7	-68.9	178.2	0	0	0	112.4	D106 L111 G112	D106-L109 HydrophobicContact CB-CB 4.05Å; D106-L109 HydrophobicContact CB-CD1 3.94Å; D106-L109 HydrophobicContact CB-CG 4.06Å; D106-L109 PolarHBondContact O-N 3.03Å; D106-L109 PolarHBondContact OD1-N 2.87Å; D106-L109 VanDerWaalsContact OD1-N 3.12Å; L109-L111 VanDerWaalsContact C-N 3.34Å; L109-G112 PolarHBondContact O-N 2.92Å
110	V	88	Confident	80.5	Confident	16 Å²	16	79.5 Å²	79.5	10%	0.097	47%	0.465	C	S	.	.	H	α-helix	trans	-66.1	-35.7	175.6	171.7	0	0	0	0	112.2	F105 D106 F108 Q146 I147 A150	F105-V110 HydrophobicContact CE2-CG2 4.18Å; D106-V110 WeakPolarHBondContact O-CG2 3.45Å; D106-V110 PolarHBondContact O-N 2.68Å; F108-V110 VanDerWaalsContact C-N 3.34Å; F108-V110 PolarHBondContact O-N 3.38Å; V110-Q146 HydrophobicContact CG1-CB 4.1Å; V110-I147 HydrophobicContact CG1-CG1 4.45Å; V110-A150 HydrophobicContact CB-CB 3.81Å; V110-A150 HydrophobicContact CG1-CB 3.57Å
111	L	90	Very high	81.7	Confident	5 Å²	5	77.3 Å²	77.3	3%	0.026	45%	0.447	C	S	.	.	H	α-helix	trans	-87.9	-8.5	177.4	-68.8	172.4	0	0	0	114.4	P107 F108 L109 L113 I122 A125 L129 I147 A150 L154	P107-L111 WeakPolarHBondContact O-CB 3.5Å; P107-L111 WeakPolarHBondContact O-CG 3.21Å; P107-L111 PolarHBondContact O-N 3.34Å; F108-L111 CarbonylContact O-C 3.55Å; F108-L111 PolarHBondContact O-N 2.92Å; L109-L111 VanDerWaalsContact C-N 3.34Å; L111-L113 HydrophobicContact CB-CD1 4.15Å; L111-L113 HydrophobicContact CB-CG 4.3Å; L111-I122 HydrophobicContact CD1-CG2 4.26Å; L111-A125 HydrophobicContact CB-CB 4.43Å; L111-L129 HydrophobicContact CD2-CD1 4.13Å; L111-L129 WeakPolarHBondContact O-CD1 3.48Å; L111-I147 HydrophobicContact CD2-CG2 4.22Å; L111-A150 HydrophobicContact CD1-CB 4.32Å; L111-A150 HydrophobicContact CG-CB 4.01Å; L111-L154 HydrophobicContact CD1-CD1 3.97Å
112	G	87.5	Confident	83.1	Confident	69 Å²	69	70.2 Å²	70.2	71%	0.711	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	41.4	-176.4	0	0	0	0	0	113	F108 L109	F108-G112 PolarHBondContact O-N 2.9Å; L109-G112 PolarHBondContact O-N 2.92Å
113	L	90.2	Very high	84.9	Confident	42 Å²	42	70.6 Å²	70.6	22%	0.22	40%	0.399	C	S	.	.			trans	-121.1	159.1	-178.7	-71.9	175.8	0	0	0	111.5	F108 L111 A117 D121 I122 A125	F108-L113 HydrophobicContact CD1-CB 4.42Å; F108-L113 PolarHBondContact O-N 3.34Å; L111-L113 HydrophobicContact CB-CD1 4.15Å; L111-L113 HydrophobicContact CB-CG 4.3Å; L113-A117 HydrophobicContact CB-CB 3.89Å; L113-A117 HydrophobicContact CD1-CB 4.06Å; L113-A117 HydrophobicContact CD2-CB 4.12Å; L113-A117 HydrophobicContact CG-CB 4.26Å; L113-D121 HydrophobicContact CD2-CB 4.23Å; L113-I122 HydrophobicContact CD1-CB 4.29Å; L113-I122 HydrophobicContact CD1-CG1 3.8Å; L113-A125 HydrophobicContact CD1-CB 3.76Å; L113-A125 HydrophobicContact CD2-CB 4.13Å; L113-A125 HydrophobicContact CG-CB 3.93Å
114	D	86.9	Confident	86.5	Confident	121 Å²	121	68.7 Å²	68.7	65%	0.647	39%	0.386	S	S	*	.			trans	-81.6	160.1	168.1	-151.8	-22.1	0	0	0	110.7	F108 D116 A117	F108-D114 WeakPolarHBondContact CD1-O 3.37Å; D114-D116 PolarHBondContact O-N 3.03Å; D114-A117 WeakPolarHBondContact O-CB 3.39Å; D114-A117 PolarHBondContact O-N 3.39Å
115	K	84	Confident	87.7	Confident	131 Å²	131	66.4 Å²	66.4	57%	0.57	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.8	-174.9	-60.2	-168.3	176.5	-165.6	0	113	D106 F108 A117	D106-K115 IonicContact OD2-NZ 3.89Å; F108-K115 HydrophobicContact CD2-CG 4.36Å; F108-K115 WeakPolarHBondContact CE1-O 3.23Å; F108-K115 HydrophobicContact CG-CG 4.41Å; K115-A117 VanDerWaalsContact C-N 3.32Å
116	D	84.8	Confident	88.5	Confident	159 Å²	159	66.9 Å²	66.9	85%	0.85	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	7.8	175.1	-65.2	-28	0	0	0	113.8	D114 S118	D114-D116 PolarHBondContact O-N 3.03Å; D116-S118 PolarHBondContact O-N 2.9Å
117	A	86.9	Confident	88.8	Confident	21 Å²	21	72.4 Å²	72.4	17%	0.174	39%	0.385	C	S	.	.			trans	-61.6	134.7	-176.3	0	0	0	0	0	113.1	L113 D114 K115 D121	L113-A117 HydrophobicContact CB-CB 3.89Å; L113-A117 HydrophobicContact CD1-CB 4.06Å; L113-A117 HydrophobicContact CD2-CB 4.12Å; L113-A117 HydrophobicContact CG-CB 4.26Å; D114-A117 WeakPolarHBondContact O-CB 3.39Å; D114-A117 PolarHBondContact O-N 3.39Å; K115-A117 VanDerWaalsContact C-N 3.32Å; A117-D121 HydrophobicContact CB-CB 4.37Å
118	S	87.9	Confident	89.1	Confident	43 Å²	43	80.1 Å²	80.1	30%	0.301	42%	0.419	S	S	.	.			trans	-71.5	158.7	-175.4	88.5	0	0	0	0	112	D116 K120 D121 I122	D116-S118 PolarHBondContact O-N 2.9Å; S118-K120 PolarHBondContact O-N 3.23Å; S118-K120 PolarHBondContact OG-N 2.72Å; S118-D121 WeakPolarHBondContact CB-OD2 3.28Å; S118-D121 PolarHBondContact N-OD2 2.98Å; S118-D121 VanDerWaalsContact N-OD2 3.16Å; S118-D121 PolarHBondContact O-N 3.46Å; S118-D121 PolarHBondContact OG-N 3.22Å; S118-D121 PolarHBondContact OG-OD2 2.99Å; S118-I122 PolarHBondContact O-N 3.34Å
119	P	87.4	Confident	89.2	Confident	89 Å²	89	81.5 Å²	81.5	58%	0.578	43%	0.426	S	S	*	.	H	α-helix	trans	-62.1	-11.2	174.4	24.9	-35.2	0	0	0	114.1	R123	P119-R123 VanDerWaalsContact O-CD 3.28Å; P119-R123 WeakPolarHBondContact O-CD 3.12Å; P119-R123 VanDerWaalsContact O-CG 3.26Å; P119-R123 WeakPolarHBondContact O-CG 3.27Å
120	K	88.5	Confident	89.3	Confident	169 Å²	169	76.4 Å²	76.4	74%	0.735	40%	0.401	S	S	*	.	H	α-helix	trans	-79.3	-39.5	168.8	-63.3	176.5	-178.8	172.5	0	111.3	S118 R123 S124	S118-K120 PolarHBondContact O-N 3.23Å; S118-K120 PolarHBondContact OG-N 2.72Å; K120-R123 PolarHBondContact O-N 2.97Å; K120-S124 WeakPolarHBondContact O-CB 3.29Å; K120-S124 PolarHBondContact O-N 3.02Å
121	D	91	Very high	89.3	Confident	74 Å²	74	80 Å²	80	40%	0.396	42%	0.419	S	S	.	.	H	α-helix	trans	-72.9	-40.2	-178	-53	-52.9	0	0	0	110.8	L113 A117 S118 R123 S124 A125	L113-D121 HydrophobicContact CD2-CB 4.23Å; A117-D121 HydrophobicContact CB-CB 4.37Å; S118-D121 WeakPolarHBondContact CB-OD2 3.28Å; S118-D121 PolarHBondContact N-OD2 2.98Å; S118-D121 VanDerWaalsContact N-OD2 3.16Å; S118-D121 PolarHBondContact O-N 3.46Å; S118-D121 PolarHBondContact OG-N 3.22Å; S118-D121 PolarHBondContact OG-OD2 2.99Å; D121-R123 VanDerWaalsContact C-N 3.33Å; D121-R123 PolarHBondContact O-N 2.9Å; D121-S124 WeakPolarHBondContact O-CB 3.37Å; D121-S124 PolarHBondContact O-N 3.34Å; D121-S124 VanDerWaalsContact O-N 3.08Å; D121-A125 WeakPolarHBondContact O-CB 3.48Å; D121-A125 PolarHBondContact O-N 3.25Å
122	I	91.2	Very high	89.3	Confident	7 Å²	7	85.7 Å²	85.7	4%	0.036	45%	0.449	C	S	.	.	H	α-helix	trans	-54.5	-47	170.9	-66.5	162.5	0	0	0	111.2	L111 L113 S118 Y126 Y151 L154 T155	L111-I122 HydrophobicContact CD1-CG2 4.26Å; L113-I122 HydrophobicContact CD1-CB 4.29Å; L113-I122 HydrophobicContact CD1-CG1 3.8Å; S118-I122 PolarHBondContact O-N 3.34Å; I122-Y126 WeakPolarHBondContact O-CB 3.4Å; I122-Y126 PolarHBondContact O-N 2.96Å; I122-Y151 HydrophobicContact CG2-CD2 4.09Å; I122-Y151 HydrophobicContact CG2-CE2 4.36Å; I122-L154 HydrophobicContact CD1-CB 4.17Å; I122-L154 HydrophobicContact CD1-CD1 4.04Å; I122-L154 HydrophobicContact CG1-CD1 4.1Å; I122-L154 HydrophobicContact CG2-CB 4.07Å; I122-L154 HydrophobicContact CG2-CD1 4.35Å; I122-T155 HydrophobicContact CG2-CG2 3.99Å
123	R	90.6	Very high	89.3	Confident	152 Å²	152	83.5 Å²	83.5	57%	0.574	42%	0.421	S	S	*	.	H	α-helix	trans	-67.9	-34.8	176.2	-68.7	172.1	-174.1	-174.5	2.8	112.7	P119 K120 D121 K127 Y151	P119-R123 VanDerWaalsContact O-CD 3.28Å; P119-R123 WeakPolarHBondContact O-CD 3.12Å; P119-R123 VanDerWaalsContact O-CG 3.26Å; P119-R123 WeakPolarHBondContact O-CG 3.27Å; K120-R123 PolarHBondContact O-N 2.97Å; D121-R123 VanDerWaalsContact C-N 3.33Å; D121-R123 PolarHBondContact O-N 2.9Å; R123-K127 VanDerWaalsContact O-CB 3.29Å; R123-K127 WeakPolarHBondContact O-CB 3.46Å; R123-K127 PolarHBondContact O-N 2.85Å; R123-Y151 HydrophobicContact CG-CE2 3.99Å
124	S	90.6	Very high	89.1	Confident	76 Å²	76	84.9 Å²	84.9	53%	0.531	43%	0.426	S	S	.	.	H	α-helix	trans	-68.9	-48.8	177.6	-168.3	0	0	0	0	111.9	K120 D121 K127 K128	K120-S124 WeakPolarHBondContact O-CB 3.29Å; K120-S124 PolarHBondContact O-N 3.02Å; D121-S124 WeakPolarHBondContact O-CB 3.37Å; D121-S124 PolarHBondContact O-N 3.34Å; D121-S124 VanDerWaalsContact O-N 3.08Å; S124-K127 PolarHBondContact O-N 3.19Å; S124-K128 WeakPolarHBondContact O-CB 3.23Å; S124-K128 PolarHBondContact O-N 3.47Å
125	A	91.8	Very high	89.1	Confident	12 Å²	12	82.4 Å²	82.4	10%	0.099	42%	0.417	C	S	.	.	H	α-helix	trans	-61.6	-48.2	176.4	0	0	0	0	0	111.3	L111 L113 D121 K127 K128 L129	L111-A125 HydrophobicContact CB-CB 4.43Å; L113-A125 HydrophobicContact CD1-CB 3.76Å; L113-A125 HydrophobicContact CD2-CB 4.13Å; L113-A125 HydrophobicContact CG-CB 3.93Å; D121-A125 WeakPolarHBondContact O-CB 3.48Å; D121-A125 PolarHBondContact O-N 3.25Å; A125-K127 PolarHBondContact O-N 3.44Å; A125-K128 PolarHBondContact O-N 2.92Å; A125-L129 WeakPolarHBondContact O-CB 3.42Å; A125-L129 WeakPolarHBondContact O-CG 3.1Å; A125-L129 PolarHBondContact O-N 3.34Å
126	Y	93	Very high	89.3	Confident	57 Å²	57	83.1 Å²	83.1	22%	0.224	43%	0.427	C	S	.	.	H	α-helix	trans	-57	-46.9	174.1	173.9	-110.6	0	0	0	111.9	I122 K128 L129 S130 I147 Y151	I122-Y126 WeakPolarHBondContact O-CB 3.4Å; I122-Y126 PolarHBondContact O-N 2.96Å; Y126-K128 VanDerWaalsContact C-N 3.33Å; Y126-K128 PolarHBondContact O-N 2.71Å; Y126-L129 PolarHBondContact O-N 2.85Å; Y126-S130 WeakPolarHBondContact O-CB 3.38Å; Y126-S130 PolarHBondContact O-N 3.1Å; Y126-S130 PolarHBondContact O-OG 3.32Å; Y126-I147 HydrophobicContact CD2-CG2 3.66Å; Y126-I147 HydrophobicContact CE2-CG2 3.98Å; Y126-Y151 AromaticContact CD1-CD1 3.97Å; Y126-Y151 HydrophobicContact CD1-CD1 3.97Å; Y126-Y151 AromaticContact CD1-CD2 3.71Å; Y126-Y151 HydrophobicContact CD1-CD2 3.71Å; Y126-Y151 HydrophobicContact CD1-CE1 4.11Å; Y126-Y151 AromaticContact CD1-CE2 3.84Å; Y126-Y151 HydrophobicContact CD1-CE2 3.84Å; Y126-Y151 AromaticContact CD1-CG 3.76Å; Y126-Y151 HydrophobicContact CD1-CG 3.76Å; Y126-Y151 HydrophobicContact CD2-CD1 4.24Å; Y126-Y151 HydrophobicContact CD2-CD2 4.03Å; Y126-Y151 AromaticContact CD2-CG 3.62Å; Y126-Y151 HydrophobicContact CD2-CG 3.62Å; Y126-Y151 AromaticContact CE1-CD1 3.98Å; Y126-Y151 HydrophobicContact CE1-CD1 3.98Å; Y126-Y151 HydrophobicContact CE1-CE1 4.13Å; Y126-Y151 HydrophobicContact CE1-CG 4.19Å; Y126-Y151 HydrophobicContact CE2-CD1 4.27Å; Y126-Y151 HydrophobicContact CE2-CG 4.07Å; Y126-Y151 HydrophobicContact CG-CD1 4.1Å; Y126-Y151 AromaticContact CG-CD2 3.4Å; Y126-Y151 HydrophobicContact CG-CD2 3.4Å; Y126-Y151 VanDerWaalsContact CG-CD2 3.4Å; Y126-Y151 AromaticContact CG-CE2 3.99Å; Y126-Y151 HydrophobicContact CG-CE2 3.99Å; Y126-Y151 AromaticContact CG-CG 3.45Å; Y126-Y151 HydrophobicContact CG-CG 3.45Å; Y126-Y151 VanDerWaalsContact CG-CG 3.45Å
127	K	91.5	Very high	89.2	Confident	141 Å²	141	81.9 Å²	81.9	61%	0.613	41%	0.414	S	S	*	.	H	α-helix	trans	-61.2	-39.6	177.4	-174.5	176.9	-179.8	-179.7	0	112.4	R123 S124 A125 S130 L131	R123-K127 VanDerWaalsContact O-CB 3.29Å; R123-K127 WeakPolarHBondContact O-CB 3.46Å; R123-K127 PolarHBondContact O-N 2.85Å; S124-K127 PolarHBondContact O-N 3.19Å; A125-K127 PolarHBondContact O-N 3.44Å; K127-S130 PolarHBondContact O-OG 3.15Å; K127-L131 HydrophobicContact CG-CD1 4.19Å; K127-L131 VanDerWaalsContact O-CB 3.32Å; K127-L131 WeakPolarHBondContact O-CB 3.47Å; K127-L131 WeakPolarHBondContact O-CD1 3.4Å; K127-L131 VanDerWaalsContact O-CG 3.23Å; K127-L131 WeakPolarHBondContact O-CG 3.47Å; K127-L131 PolarHBondContact O-N 3.18Å
128	K	92.3	Very high	88.9	Confident	162 Å²	162	84.5 Å²	84.5	70%	0.704	44%	0.443	S	S	*	.	H	α-helix	trans	-67.2	-47.1	177.1	-173.6	-177	178.5	-172.3	0	112	S124 A125 Y126 L132	S124-K128 WeakPolarHBondContact O-CB 3.23Å; S124-K128 PolarHBondContact O-N 3.47Å; A125-K128 PolarHBondContact O-N 2.92Å; Y126-K128 VanDerWaalsContact C-N 3.33Å; Y126-K128 PolarHBondContact O-N 2.71Å; K128-L132 PolarHBondContact O-N 3.02Å
129	L	91.6	Very high	88.6	Confident	41 Å²	41	83.1 Å²	83.1	22%	0.215	44%	0.435	C	S	.	.	H	α-helix	trans	-75.8	-39.4	-175.6	-70.9	173.1	0	0	0	112.8	L111 A125 Y126 L132 N133 I147	L111-L129 HydrophobicContact CD2-CD1 4.13Å; L111-L129 WeakPolarHBondContact O-CD1 3.48Å; A125-L129 WeakPolarHBondContact O-CB 3.42Å; A125-L129 WeakPolarHBondContact O-CG 3.1Å; A125-L129 PolarHBondContact O-N 3.34Å; Y126-L129 PolarHBondContact O-N 2.85Å; L129-L132 PolarHBondContact O-N 3.44Å; L129-N133 WeakPolarHBondContact O-CB 3.36Å; L129-N133 PolarHBondContact O-N 2.99Å; L129-N133 PolarHBondContact O-ND2 3.13Å; L129-I147 HydrophobicContact CB-CD1 3.86Å; L129-I147 HydrophobicContact CB-CG1 4.21Å; L129-I147 HydrophobicContact CB-CG2 3.97Å
130	S	90.2	Very high	88.5	Confident	17 Å²	17	84.1 Å²	84.1	12%	0.119	44%	0.436	C	S	.	.	H	α-helix	trans	-64.8	-38.6	174.2	57.9	0	0	0	0	112.1	Y126 K127 L132 H134	Y126-S130 WeakPolarHBondContact O-CB 3.38Å; Y126-S130 PolarHBondContact O-N 3.1Å; Y126-S130 PolarHBondContact O-OG 3.32Å; K127-S130 PolarHBondContact O-OG 3.15Å; S130-L132 VanDerWaalsContact C-N 3.27Å; S130-L132 PolarHBondContact O-N 2.88Å; S130-H134 WeakPolarHBondContact O-CB 3.49Å; S130-H134 PolarHBondContact O-N 3.24Å; S130-H134 VanDerWaalsContact O-N 3.1Å
131	L	88.3	Confident	88.4	Confident	93 Å²	93	79.7 Å²	79.7	49%	0.487	42%	0.424	S	S	.	.	H	α-helix	trans	-65	-28.6	174.1	-81.1	171.9	0	0	0	113.6	K127	K127-L131 HydrophobicContact CG-CD1 4.19Å; K127-L131 VanDerWaalsContact O-CB 3.32Å; K127-L131 WeakPolarHBondContact O-CB 3.47Å; K127-L131 WeakPolarHBondContact O-CD1 3.4Å; K127-L131 VanDerWaalsContact O-CG 3.23Å; K127-L131 WeakPolarHBondContact O-CG 3.47Å; K127-L131 PolarHBondContact O-N 3.18Å
132	L	88.5	Confident	88.2	Confident	124 Å²	124	84.4 Å²	84.4	65%	0.649	44%	0.441	S	S	*	.	H	α-helix	trans	-84.1	-39.9	178.9	-176.8	67.2	0	0	0	112.4	K128 L129 S130	K128-L132 PolarHBondContact O-N 3.02Å; L129-L132 PolarHBondContact O-N 3.44Å; S130-L132 VanDerWaalsContact C-N 3.27Å; S130-L132 PolarHBondContact O-N 2.88Å
133	N	87.5	Confident	87.9	Confident	22 Å²	22	88.6 Å²	88.6	12%	0.118	46%	0.457	C	S	.	.	H	α-helix	trans	-97.8	7.8	-173.7	-66	-96.3	0	0	0	113.3	L129 G139 R143 F144 I147	L129-N133 WeakPolarHBondContact O-CB 3.36Å; L129-N133 PolarHBondContact O-N 2.99Å; L129-N133 PolarHBondContact O-ND2 3.13Å; N133-G139 CarbonylContact O-C 3.49Å; N133-R143 WeakPolarHBondContact OD1-CG 3.46Å; N133-F144 HydrophobicContact CB-CB 4.4Å; N133-F144 HydrophobicContact CB-CD2 4.44Å; N133-F144 WeakPolarHBondContact O-CB 3.47Å; N133-I147 HydrophobicContact CB-CD1 3.8Å; N133-I147 WeakPolarHBondContact ND2-CD1 3.35Å
134	H	86.6	Confident	87.9	Confident	72 Å²	72	83.4 Å²	83.4	33%	0.333	44%	0.438	S	S	.	.			trans	-63	131.2	-177.4	-158	-96.5	0	0	0	111.2	S130 D136 K137 G139 F144	S130-H134 WeakPolarHBondContact O-CB 3.49Å; S130-H134 PolarHBondContact O-N 3.24Å; S130-H134 VanDerWaalsContact O-N 3.1Å; H134-D136 VanDerWaalsContact C-N 3.31Å; H134-D136 WeakPolarHBondContact ND1-CB 3.27Å; H134-D136 PolarHBondContact ND1-N 2.94Å; H134-D136 PolarHBondContact O-N 3.16Å; H134-K137 HydrophobicContact CB-CB 4.41Å; H134-K137 HydrophobicContact CB-CD 4.34Å; H134-K137 HydrophobicContact CB-CG 4.29Å; H134-K137 WeakPolarHBondContact O-CA 3.44Å; H134-K137 PolarHBondContact O-N 2.88Å; H134-G139 PolarHBondContact O-N 2.82Å; H134-G139 VanDerWaalsContact O-N 3.11Å; H134-F144 HydrophobicContact CB-CE2 4.44Å; H134-F144 AromaticContact CD2-CE2 3.61Å; H134-F144 AromaticContact CD2-CZ 3.79Å
135	P	86.2	Confident	87.8	Confident	69 Å²	69	85.3 Å²	85.3	45%	0.448	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-62	-36.9	-175.9	22.2	-33	0	0	0	112.8	K137 G138	P135-K137 PolarHBondContact O-N 3.28Å; P135-G138 PolarHBondContact O-N 3.08Å
136	D	88.7	Confident	87.6	Confident	146 Å²	146	88.7 Å²	88.7	78%	0.781	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-60.3	-13	173.5	-164.9	52.6	0	0	0	114	H134	H134-D136 VanDerWaalsContact C-N 3.31Å; H134-D136 WeakPolarHBondContact ND1-CB 3.27Å; H134-D136 PolarHBondContact ND1-N 2.94Å; H134-D136 PolarHBondContact O-N 3.16Å
137	K	82.6	Confident	87.6	Confident	133 Å²	133	86 Å²	86	58%	0.578	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-112.4	11.1	178.6	-60.8	-175.1	-179.9	-178.3	0	113.2	H134 P135	H134-K137 HydrophobicContact CB-CB 4.41Å; H134-K137 HydrophobicContact CB-CD 4.34Å; H134-K137 HydrophobicContact CB-CG 4.29Å; H134-K137 WeakPolarHBondContact O-CA 3.44Å; H134-K137 PolarHBondContact O-N 2.88Å; P135-K137 PolarHBondContact O-N 3.28Å
138	G	80.8	Confident	87.5	Confident	76 Å²	76	80.5 Å²	80.5	78%	0.784	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	18.8	-177	0	0	0	0	0	114.5	P135	P135-G138 PolarHBondContact O-N 3.08Å
139	G	81.3	Confident	87.4	Confident	14 Å²	14	75.6 Å²	75.6	14%	0.144	40%	0.402	C	S	.	.			trans	-84.4	156.2	173.7	0	0	0	0	0	113.4	N133 H134 P141	N133-G139 CarbonylContact O-C 3.49Å; H134-G139 PolarHBondContact O-N 2.82Å; H134-G139 VanDerWaalsContact O-N 3.11Å; G139-P141 WeakPolarHBondContact O-CD 3.31Å
140	D	85.7	Confident	87.4	Confident	110 Å²	110	73.6 Å²	73.6	59%	0.588	39%	0.392	S	S	*	.			trans	-65.1	118	-175.6	-82.6	-49.1	0	0	0	112.8	K142 R143 F144	D140-K142 VanDerWaalsContact C-N 3.3Å; D140-K142 PolarHBondContact O-N 2.91Å; D140-R143 HydrophobicContact CB-CB 3.79Å; D140-R143 PolarHBondContact O-N 3.15Å; D140-R143 VanDerWaalsContact O-N 3.08Å; D140-F144 PolarHBondContact O-N 2.69Å
141	P	86.9	Confident	87.5	Confident	76 Å²	76	75.2 Å²	75.2	49%	0.494	40%	0.396	S	S	.	.	H	α-helix	trans	-64.5	-34.9	-178.8	25.1	-33.6	0	0	0	112.2	G139 R143 F144 I145	G139-P141 WeakPolarHBondContact O-CD 3.31Å; P141-R143 PolarHBondContact O-N 3.2Å; P141-F144 PolarHBondContact O-N 2.81Å; P141-I145 WeakPolarHBondContact O-CD1 3.37Å; P141-I145 VanDerWaalsContact O-CG1 3.27Å; P141-I145 WeakPolarHBondContact O-CG1 3.29Å; P141-I145 PolarHBondContact O-N 3.22Å
142	K	86.5	Confident	87.6	Confident	173 Å²	173	75 Å²	75	75%	0.752	40%	0.395	S	S	*	.	H	α-helix	trans	-60.9	-43.7	173.4	-69.2	-171.6	178.3	-174.4	0	111.5	D140 I145 Q146	D140-K142 VanDerWaalsContact C-N 3.3Å; D140-K142 PolarHBondContact O-N 2.91Å; K142-I145 PolarHBondContact O-N 3.16Å; K142-Q146 WeakPolarHBondContact O-CG 3.4Å; K142-Q146 PolarHBondContact O-N 2.98Å; K142-Q146 VanDerWaalsContact O-N 3.13Å
143	R	85.3	Confident	87.7	Confident	95 Å²	95	69 Å²	69	36%	0.358	36%	0.364	S	S	.	.	H	α-helix	trans	-72.4	-37	-179.4	-166.7	57.1	176.1	178.1	0.3	111.3	N133 D140 P141 I145 Q146 I147	N133-R143 WeakPolarHBondContact OD1-CG 3.46Å; D140-R143 HydrophobicContact CB-CB 3.79Å; D140-R143 PolarHBondContact O-N 3.15Å; D140-R143 VanDerWaalsContact O-N 3.08Å; P141-R143 PolarHBondContact O-N 3.2Å; R143-I145 PolarHBondContact O-N 2.87Å; R143-Q146 PolarHBondContact O-N 2.77Å; R143-I147 HydrophobicContact CG-CD1 3.95Å; R143-I147 WeakPolarHBondContact O-CB 3.43Å; R143-I147 WeakPolarHBondContact O-CD1 3.39Å; R143-I147 VanDerWaalsContact O-CG1 3.25Å; R143-I147 WeakPolarHBondContact O-CG1 3.28Å; R143-I147 PolarHBondContact O-N 3.26Å
144	F	90.2	Very high	87.8	Confident	43 Å²	43	68.5 Å²	68.5	19%	0.189	36%	0.361	C	S	.	.	H	α-helix	trans	-57.3	-46.8	171.4	-170.6	-97.2	0	0	0	112.1	N133 H134 D140 P141 Q146 I147 S148	N133-F144 HydrophobicContact CB-CB 4.4Å; N133-F144 HydrophobicContact CB-CD2 4.44Å; N133-F144 WeakPolarHBondContact O-CB 3.47Å; H134-F144 HydrophobicContact CB-CE2 4.44Å; H134-F144 AromaticContact CD2-CE2 3.61Å; H134-F144 AromaticContact CD2-CZ 3.79Å; D140-F144 PolarHBondContact O-N 2.69Å; P141-F144 PolarHBondContact O-N 2.81Å; F144-Q146 PolarHBondContact O-N 3.1Å; F144-I147 PolarHBondContact O-N 3.01Å; F144-S148 PolarHBondContact O-N 3.41Å; F144-S148 PolarHBondContact O-OG 2.98Å
145	I	88.2	Confident	87.8	Confident	115 Å²	115	67.8 Å²	67.8	59%	0.59	36%	0.362	S	S	*	.	H	α-helix	trans	-60.4	-44.4	176.2	-68.3	162.3	0	0	0	111.2	P141 K142 R143 S148 K149	P141-I145 WeakPolarHBondContact O-CD1 3.37Å; P141-I145 VanDerWaalsContact O-CG1 3.27Å; P141-I145 WeakPolarHBondContact O-CG1 3.29Å; P141-I145 PolarHBondContact O-N 3.22Å; K142-I145 PolarHBondContact O-N 3.16Å; R143-I145 PolarHBondContact O-N 2.87Å; I145-S148 PolarHBondContact O-N 3.38Å; I145-K149 WeakPolarHBondContact O-CB 3.44Å; I145-K149 PolarHBondContact O-N 3.31Å
146	Q	88.5	Confident	88	Confident	84 Å²	84	68.2 Å²	68.2	39%	0.393	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-46.5	174.7	-71.9	175.9	-13.3	0	0	112.1	V110 K142 R143 F144 S148 K149 A150	V110-Q146 HydrophobicContact CG1-CB 4.1Å; K142-Q146 WeakPolarHBondContact O-CG 3.4Å; K142-Q146 PolarHBondContact O-N 2.98Å; K142-Q146 VanDerWaalsContact O-N 3.13Å; R143-Q146 PolarHBondContact O-N 2.77Å; F144-Q146 PolarHBondContact O-N 3.1Å; Q146-S148 VanDerWaalsContact C-N 3.33Å; Q146-S148 PolarHBondContact O-N 3.32Å; Q146-K149 PolarHBondContact O-N 3.3Å; Q146-A150 WeakPolarHBondContact O-CB 3.34Å; Q146-A150 PolarHBondContact O-N 3.41Å
147	I	91.2	Very high	87.8	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-60.7	-41.6	178.1	-70.7	157.2	0	0	0	111.2	V110 L111 Y126 L129 N133 R143 F144 Y151	V110-I147 HydrophobicContact CG1-CG1 4.45Å; L111-I147 HydrophobicContact CD2-CG2 4.22Å; Y126-I147 HydrophobicContact CD2-CG2 3.66Å; Y126-I147 HydrophobicContact CE2-CG2 3.98Å; L129-I147 HydrophobicContact CB-CD1 3.86Å; L129-I147 HydrophobicContact CB-CG1 4.21Å; L129-I147 HydrophobicContact CB-CG2 3.97Å; N133-I147 HydrophobicContact CB-CD1 3.8Å; N133-I147 WeakPolarHBondContact ND2-CD1 3.35Å; R143-I147 HydrophobicContact CG-CD1 3.95Å; R143-I147 WeakPolarHBondContact O-CB 3.43Å; R143-I147 WeakPolarHBondContact O-CD1 3.39Å; R143-I147 VanDerWaalsContact O-CG1 3.25Å; R143-I147 WeakPolarHBondContact O-CG1 3.28Å; R143-I147 PolarHBondContact O-N 3.26Å; F144-I147 PolarHBondContact O-N 3.01Å; I147-Y151 WeakPolarHBondContact O-CB 3.43Å; I147-Y151 PolarHBondContact O-N 2.89Å
148	S	90.8	Very high	88.2	Confident	25 Å²	25	68.6 Å²	68.6	18%	0.175	36%	0.36	C	S	.	.	H	α-helix	trans	-68.3	-43	175.5	-64.4	0	0	0	0	112.5	F144 I145 Q146 A150 Y151 N152	F144-S148 PolarHBondContact O-N 3.41Å; F144-S148 PolarHBondContact O-OG 2.98Å; I145-S148 PolarHBondContact O-N 3.38Å; Q146-S148 VanDerWaalsContact C-N 3.33Å; Q146-S148 PolarHBondContact O-N 3.32Å; S148-A150 VanDerWaalsContact C-N 3.31Å; S148-A150 PolarHBondContact O-N 3.09Å; S148-Y151 PolarHBondContact O-N 2.86Å; S148-N152 WeakPolarHBondContact O-CB 3.49Å; S148-N152 PolarHBondContact O-N 3.29Å; S148-N152 PolarHBondContact O-OD1 2.92Å
149	K	90.3	Very high	88.4	Confident	58 Å²	58	65.6 Å²	65.6	25%	0.252	33%	0.326	S	S	.	.	H	α-helix	trans	-61.2	-41	174.6	-173.3	175.1	172	173.5	0	111	F105 I145 Q146 N152 A153 N168 P169 D170	F105-K149 HydrophobicContact CE1-CD 4.24Å; F105-K149 HydrophobicContact CE1-CG 3.99Å; F105-K149 HydrophobicContact CE2-CB 4.43Å; F105-K149 HydrophobicContact CE2-CD 4.22Å; F105-K149 HydrophobicContact CE2-CG 4.31Å; F105-K149 HydrophobicContact CZ-CB 3.88Å; F105-K149 HydrophobicContact CZ-CD 3.94Å; F105-K149 HydrophobicContact CZ-CG 3.62Å; I145-K149 WeakPolarHBondContact O-CB 3.44Å; I145-K149 PolarHBondContact O-N 3.31Å; Q146-K149 PolarHBondContact O-N 3.3Å; K149-N152 PolarHBondContact O-N 3.32Å; K149-A153 VanDerWaalsContact O-CB 3.3Å; K149-A153 WeakPolarHBondContact O-CB 3.42Å; K149-A153 PolarHBondContact O-N 2.99Å; K149-N168 PolarHBondContact NZ-OD1 3.23Å; K149-P169 HydrophobicContact CD-CG 4.39Å; K149-P169 HydrophobicContact CG-CG 4.14Å; K149-D170 VanDerWaalsContact CE-OD1 3.28Å; K149-D170 WeakPolarHBondContact CE-OD1 3.46Å; K149-D170 WeakPolarHBondContact CE-OD2 3.29Å; K149-D170 VanDerWaalsContact NZ-CG 3.34Å; K149-D170 IonicContact NZ-OD1 2.69Å; K149-D170 PolarHBondContact NZ-OD1 2.66Å; K149-D170 IonicContact NZ-OD2 2.75Å; K149-D170 PolarHBondContact NZ-OD2 3.11Å
150	A	90.9	Very high	88.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-68.8	-40.7	179	0	0	0	0	0	112.6	F105 P107 V110 L111 Q146 S148 A153 L154	F105-A150 HydrophobicContact CZ-CB 4Å; P107-A150 HydrophobicContact CB-CB 3.96Å; V110-A150 HydrophobicContact CB-CB 3.81Å; V110-A150 HydrophobicContact CG1-CB 3.57Å; L111-A150 HydrophobicContact CD1-CB 4.32Å; L111-A150 HydrophobicContact CG-CB 4.01Å; Q146-A150 WeakPolarHBondContact O-CB 3.34Å; Q146-A150 PolarHBondContact O-N 3.41Å; S148-A150 VanDerWaalsContact C-N 3.31Å; S148-A150 PolarHBondContact O-N 3.09Å; A150-A153 PolarHBondContact O-N 3.47Å; A150-L154 PolarHBondContact O-N 3.26Å
151	Y	92.4	Very high	88.8	Confident	50 Å²	50	69.9 Å²	69.9	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-44.3	173.4	177.3	-102.7	0	0	0	112	I122 R123 Y126 I147 S148 L154 T155	I122-Y151 HydrophobicContact CG2-CD2 4.09Å; I122-Y151 HydrophobicContact CG2-CE2 4.36Å; R123-Y151 HydrophobicContact CG-CE2 3.99Å; Y126-Y151 AromaticContact CD1-CD1 3.97Å; Y126-Y151 HydrophobicContact CD1-CD1 3.97Å; Y126-Y151 AromaticContact CD1-CD2 3.71Å; Y126-Y151 HydrophobicContact CD1-CD2 3.71Å; Y126-Y151 HydrophobicContact CD1-CE1 4.11Å; Y126-Y151 AromaticContact CD1-CE2 3.84Å; Y126-Y151 HydrophobicContact CD1-CE2 3.84Å; Y126-Y151 AromaticContact CD1-CG 3.76Å; Y126-Y151 HydrophobicContact CD1-CG 3.76Å; Y126-Y151 HydrophobicContact CD2-CD1 4.24Å; Y126-Y151 HydrophobicContact CD2-CD2 4.03Å; Y126-Y151 AromaticContact CD2-CG 3.62Å; Y126-Y151 HydrophobicContact CD2-CG 3.62Å; Y126-Y151 AromaticContact CE1-CD1 3.98Å; Y126-Y151 HydrophobicContact CE1-CD1 3.98Å; Y126-Y151 HydrophobicContact CE1-CE1 4.13Å; Y126-Y151 HydrophobicContact CE1-CG 4.19Å; Y126-Y151 HydrophobicContact CE2-CD1 4.27Å; Y126-Y151 HydrophobicContact CE2-CG 4.07Å; Y126-Y151 HydrophobicContact CG-CD1 4.1Å; Y126-Y151 AromaticContact CG-CD2 3.4Å; Y126-Y151 HydrophobicContact CG-CD2 3.4Å; Y126-Y151 VanDerWaalsContact CG-CD2 3.4Å; Y126-Y151 AromaticContact CG-CE2 3.99Å; Y126-Y151 HydrophobicContact CG-CE2 3.99Å; Y126-Y151 AromaticContact CG-CG 3.45Å; Y126-Y151 HydrophobicContact CG-CG 3.45Å; Y126-Y151 VanDerWaalsContact CG-CG 3.45Å; I147-Y151 WeakPolarHBondContact O-CB 3.43Å; I147-Y151 PolarHBondContact O-N 2.89Å; S148-Y151 PolarHBondContact O-N 2.86Å; Y151-L154 PolarHBondContact O-N 2.97Å; Y151-T155 HydrophobicContact CD2-CG2 4Å; Y151-T155 HydrophobicContact CE1-CG2 4.43Å; Y151-T155 HydrophobicContact CE2-CG2 3.63Å; Y151-T155 WeakPolarHBondContact O-CB 3.27Å; Y151-T155 WeakPolarHBondContact O-CG2 3.41Å; Y151-T155 PolarHBondContact O-N 2.93Å; Y151-T155 VanDerWaalsContact O-N 3.15Å; Y151-T155 PolarHBondContact O-OG1 3.46Å
152	N	90.9	Very high	88.9	Confident	88 Å²	88	67.9 Å²	67.9	47%	0.471	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-47.4	176.1	-69	-5.1	0	0	0	111	S148 K149 L154 T155 N156 S159	S148-N152 WeakPolarHBondContact O-CB 3.49Å; S148-N152 PolarHBondContact O-N 3.29Å; S148-N152 PolarHBondContact O-OD1 2.92Å; K149-N152 PolarHBondContact O-N 3.32Å; N152-L154 PolarHBondContact O-N 3.48Å; N152-T155 PolarHBondContact O-N 2.93Å; N152-N156 PolarHBondContact O-N 3.39Å; N152-S159 PolarHBondContact O-OG 3.15Å
153	A	89.9	Confident	88.8	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-53.2	-35.8	177.4	0	0	0	0	0	113.6	F105 P107 K149 A150 R160 P169	F105-A153 HydrophobicContact CE1-CB 4.41Å; P107-A153 HydrophobicContact CB-CB 4.21Å; P107-A153 HydrophobicContact CG-CB 3.71Å; K149-A153 VanDerWaalsContact O-CB 3.3Å; K149-A153 WeakPolarHBondContact O-CB 3.42Å; K149-A153 PolarHBondContact O-N 2.99Å; A150-A153 PolarHBondContact O-N 3.47Å; A153-R160 WeakPolarHBondContact O-CA 3.17Å; A153-R160 VanDerWaalsContact O-CB 3.29Å; A153-R160 WeakPolarHBondContact O-CB 3.15Å; A153-R160 PolarHBondContact O-N 2.63Å; A153-P169 HydrophobicContact CB-CB 3.6Å; A153-P169 HydrophobicContact CB-CG 3.86Å
154	L	89.2	Confident	88.8	Confident	10 Å²	10	62.5 Å²	62.5	5%	0.052	30%	0.298	C	S	.	.	H	α-helix	trans	-95.5	-2.2	179.6	-60.5	-175.2	0	0	0	114.8	P107 F108 L111 I122 A150 Y151 N152	P107-L154 HydrophobicContact CB-CD1 3.94Å; P107-L154 HydrophobicContact CB-CD2 3.87Å; P107-L154 HydrophobicContact CB-CG 3.65Å; P107-L154 HydrophobicContact CG-CD2 4.24Å; P107-L154 HydrophobicContact CG-CG 4.43Å; F108-L154 HydrophobicContact CD1-CD1 3.89Å; F108-L154 HydrophobicContact CD2-CD1 4.44Å; F108-L154 HydrophobicContact CD2-CD2 4.25Å; F108-L154 HydrophobicContact CE1-CD1 3.78Å; F108-L154 HydrophobicContact CE1-CD2 4.26Å; F108-L154 HydrophobicContact CE2-CD1 4.34Å; F108-L154 HydrophobicContact CE2-CD2 3.61Å; F108-L154 HydrophobicContact CG-CD1 4.24Å; F108-L154 HydrophobicContact CZ-CD1 4.02Å; F108-L154 HydrophobicContact CZ-CD2 3.62Å; F108-L154 HydrophobicContact CZ-CG 4.49Å; L111-L154 HydrophobicContact CD1-CD1 3.97Å; I122-L154 HydrophobicContact CD1-CB 4.17Å; I122-L154 HydrophobicContact CD1-CD1 4.04Å; I122-L154 HydrophobicContact CG1-CD1 4.1Å; I122-L154 HydrophobicContact CG2-CB 4.07Å; I122-L154 HydrophobicContact CG2-CD1 4.35Å; A150-L154 PolarHBondContact O-N 3.26Å; Y151-L154 PolarHBondContact O-N 2.97Å; N152-L154 PolarHBondContact O-N 3.48Å
155	T	88	Confident	88.5	Confident	58 Å²	58	65 Å²	65	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-128.3	-17.7	-174.1	60.4	0	0	0	0	116.3	I122 Y151 N152	I122-T155 HydrophobicContact CG2-CG2 3.99Å; Y151-T155 HydrophobicContact CD2-CG2 4Å; Y151-T155 HydrophobicContact CE1-CG2 4.43Å; Y151-T155 HydrophobicContact CE2-CG2 3.63Å; Y151-T155 WeakPolarHBondContact O-CB 3.27Å; Y151-T155 WeakPolarHBondContact O-CG2 3.41Å; Y151-T155 PolarHBondContact O-N 2.93Å; Y151-T155 VanDerWaalsContact O-N 3.15Å; Y151-T155 PolarHBondContact O-OG1 3.46Å; N152-T155 PolarHBondContact O-N 2.93Å
156	N	88.8	Confident	88.2	Confident	77 Å²	77	64.7 Å²	64.7	41%	0.412	30%	0.303	S	S	.	.	S	Bend	trans	-99.6	125.1	165.1	167.6	39.4	0	0	0	109.6	N152 E158 S159 R160	N152-N156 PolarHBondContact O-N 3.39Å; N156-E158 VanDerWaalsContact C-N 3.3Å; N156-E158 PolarHBondContact O-N 3.17Å; N156-S159 VanDerWaalsContact CB-OG 3.3Å; N156-S159 WeakPolarHBondContact CB-OG 3.44Å; N156-S159 PolarHBondContact ND2-OG 2.96Å; N156-S159 PolarHBondContact O-N 3.01Å; N156-S159 PolarHBondContact O-OG 3.15Å; N156-R160 WeakPolarHBondContact O-CB 3.4Å; N156-R160 PolarHBondContact O-N 3.41Å
157	E	86.5	Confident	87.7	Confident	152 Å²	152	62.8 Å²	62.8	71%	0.71	31%	0.305	S	S	*	.	H	α-helix	trans	-56.9	-40	-173.6	-161.5	72.1	179.3	0	0	112.8	R160 K161	E157-R160 PolarHBondContact O-N 2.71Å; E157-K161 WeakPolarHBondContact O-CB 3.25Å; E157-K161 PolarHBondContact O-N 3.03Å
158	E	89	Confident	87.3	Confident	136 Å²	136	64.6 Å²	64.6	64%	0.636	32%	0.315	S	S	*	.	H	α-helix	trans	-66.1	-50.8	179.4	-179	178.8	-154	0	0	111.5	N156 R160 K161 N162	N156-E158 VanDerWaalsContact C-N 3.3Å; N156-E158 PolarHBondContact O-N 3.17Å; E158-R160 VanDerWaalsContact C-N 3.26Å; E158-R160 PolarHBondContact O-N 3.28Å; E158-K161 PolarHBondContact O-N 2.9Å; E158-N162 WeakPolarHBondContact O-CB 3.49Å; E158-N162 PolarHBondContact O-N 2.75Å; E158-N162 PolarHBondContact O-ND2 3.27Å
159	S	86.5	Confident	86.9	Confident	12 Å²	12	63.7 Å²	63.7	8%	0.084	31%	0.309	C	S	.	.	H	α-helix	trans	-68.4	-26.3	176.4	47.6	0	0	0	0	113.2	N152 N156 W163 P169	N152-S159 PolarHBondContact O-OG 3.15Å; N156-S159 VanDerWaalsContact CB-OG 3.3Å; N156-S159 WeakPolarHBondContact CB-OG 3.44Å; N156-S159 PolarHBondContact ND2-OG 2.96Å; N156-S159 PolarHBondContact O-N 3.01Å; N156-S159 PolarHBondContact O-OG 3.15Å; S159-W163 WeakPolarHBondContact O-CB 3.39Å; S159-W163 PolarHBondContact O-N 2.88Å; S159-P169 WeakPolarHBondContact CA-O 3.18Å; S159-P169 WeakPolarHBondContact CB-O 3.46Å; S159-P169 VanDerWaalsContact O-CA 3.31Å; S159-P169 WeakPolarHBondContact O-CA 3.36Å; S159-P169 WeakPolarHBondContact O-CB 3.29Å
160	R	87.3	Confident	86.4	Confident	96 Å²	96	66.4 Å²	66.4	36%	0.362	33%	0.326	S	S	.	.	H	α-helix	trans	-67.5	-51.9	172.2	-177.1	-176.6	169.6	133.3	13.3	110.3	A153 N156 E157 E158 N162 W163 E164	A153-R160 WeakPolarHBondContact O-CA 3.17Å; A153-R160 VanDerWaalsContact O-CB 3.29Å; A153-R160 WeakPolarHBondContact O-CB 3.15Å; A153-R160 PolarHBondContact O-N 2.63Å; N156-R160 WeakPolarHBondContact O-CB 3.4Å; N156-R160 PolarHBondContact O-N 3.41Å; E157-R160 PolarHBondContact O-N 2.71Å; E158-R160 VanDerWaalsContact C-N 3.26Å; E158-R160 PolarHBondContact O-N 3.28Å; R160-N162 VanDerWaalsContact C-N 3.31Å; R160-N162 PolarHBondContact O-N 2.9Å; R160-W163 PolarHBondContact O-N 3.01Å; R160-W163 VanDerWaalsContact O-N 3.11Å; R160-E164 HydrophobicContact CG-CG 4.49Å; R160-E164 IonicContact CZ-OE1 2.76Å; R160-E164 IonicContact NE-OE1 3.58Å; R160-E164 PolarHBondContact NE-OE1 2.71Å; R160-E164 IonicContact NE-OE2 3.84Å; R160-E164 IonicContact NH2-OE1 3.19Å; R160-E164 PolarHBondContact NH2-OE1 3.49Å; R160-E164 WeakPolarHBondContact O-CG 3.35Å; R160-E164 PolarHBondContact O-N 2.83Å
161	K	88	Confident	85.9	Confident	118 Å²	118	66.7 Å²	66.7	51%	0.513	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-43.3	175.2	-175.5	175.1	-180	-77.2	0	111.2	E157 E158 W163 E164 E165	E157-K161 WeakPolarHBondContact O-CB 3.25Å; E157-K161 PolarHBondContact O-N 3.03Å; E158-K161 PolarHBondContact O-N 2.9Å; K161-W163 VanDerWaalsContact C-N 3.29Å; K161-W163 PolarHBondContact O-N 2.99Å; K161-E164 CarbonylContact O-C 3.59Å; K161-E164 PolarHBondContact O-N 2.99Å; K161-E165 WeakPolarHBondContact CE-OE2 3.38Å; K161-E165 IonicContact NZ-OE1 3.71Å; K161-E165 IonicContact NZ-OE2 3.24Å; K161-E165 PolarHBondContact NZ-OE2 3.18Å; K161-E165 WeakPolarHBondContact O-CB 3.48Å; K161-E165 PolarHBondContact O-N 3.36Å
162	N	87.5	Confident	85.2	Confident	34 Å²	34	68.6 Å²	68.6	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-59.7	-38.5	175.6	-72.1	-14.7	0	0	0	112.6	E158 R160 Y166 N168 P169	E158-N162 WeakPolarHBondContact O-CB 3.49Å; E158-N162 PolarHBondContact O-N 2.75Å; E158-N162 PolarHBondContact O-ND2 3.27Å; R160-N162 VanDerWaalsContact C-N 3.31Å; R160-N162 PolarHBondContact O-N 2.9Å; N162-Y166 HydrophobicContact CB-CD2 4.47Å; N162-Y166 WeakPolarHBondContact O-CA 3.44Å; N162-Y166 WeakPolarHBondContact O-CB 3.42Å; N162-Y166 PolarHBondContact O-N 2.84Å; N162-N168 CarbonylContact C-O 3.58Å; N162-P169 WeakPolarHBondContact CB-O 3.22Å; N162-P169 PolarHBondContact ND2-O 3.45Å
163	W	85.7	Confident	84.2	Confident	44 Å²	44	67.3 Å²	67.3	17%	0.167	35%	0.354	C	S	.	.	H	α-helix	trans	-72.5	-38.7	175	-179.4	76.8	0	0	0	112.7	F105 P107 F108 S159 R160 K161 E165 G167 P169	F105-W163 PolarHBondContact O-NE1 2.95Å; P107-W163 HydrophobicContact CG-CD2 4.13Å; P107-W163 HydrophobicContact CG-CG 4.24Å; P107-W163 HydrophobicContact CG-CZ2 4.44Å; F108-W163 AromaticContact CD2-CH2 3.92Å; F108-W163 HydrophobicContact CD2-CH2 3.92Å; F108-W163 HydrophobicContact CD2-CZ3 4.46Å; F108-W163 AromaticContact CE2-CH2 3.68Å; F108-W163 HydrophobicContact CE2-CH2 3.68Å; F108-W163 AromaticContact CE2-CZ3 3.79Å; F108-W163 HydrophobicContact CE2-CZ3 3.79Å; S159-W163 WeakPolarHBondContact O-CB 3.39Å; S159-W163 PolarHBondContact O-N 2.88Å; R160-W163 PolarHBondContact O-N 3.01Å; R160-W163 VanDerWaalsContact O-N 3.11Å; K161-W163 VanDerWaalsContact C-N 3.29Å; K161-W163 PolarHBondContact O-N 2.99Å; W163-E165 VanDerWaalsContact C-N 3.32Å; W163-E165 PolarHBondContact O-N 2.85Å; W163-G167 VanDerWaalsContact CD1-O 3.25Å; W163-G167 WeakPolarHBondContact O-CA 3.41Å; W163-G167 PolarHBondContact O-N 3.36Å; W163-P169 HydrophobicContact CB-CB 4.4Å
164	E	85.2	Confident	83.3	Confident	112 Å²	112	71 Å²	71	52%	0.523	39%	0.385	S	S	.	.	H	α-helix	trans	-69.8	-25.7	175.6	-69.8	175.3	172.7	0	0	113	R160 K161	R160-E164 HydrophobicContact CG-CG 4.49Å; R160-E164 IonicContact CZ-OE1 2.76Å; R160-E164 IonicContact NE-OE1 3.58Å; R160-E164 PolarHBondContact NE-OE1 2.71Å; R160-E164 IonicContact NE-OE2 3.84Å; R160-E164 IonicContact NH2-OE1 3.19Å; R160-E164 PolarHBondContact NH2-OE1 3.49Å; R160-E164 WeakPolarHBondContact O-CG 3.35Å; R160-E164 PolarHBondContact O-N 2.83Å; K161-E164 CarbonylContact O-C 3.59Å; K161-E164 PolarHBondContact O-N 2.99Å
165	E	84.2	Confident	82.4	Confident	95 Å²	95	74.3 Å²	74.3	44%	0.444	41%	0.414	S	S	.	.	H	α-helix	trans	-100.3	-35.1	-176.7	-169.1	174.4	150.5	0	0	113.8	K161 W163	K161-E165 WeakPolarHBondContact CE-OE2 3.38Å; K161-E165 IonicContact NZ-OE1 3.71Å; K161-E165 IonicContact NZ-OE2 3.24Å; K161-E165 PolarHBondContact NZ-OE2 3.18Å; K161-E165 WeakPolarHBondContact O-CB 3.48Å; K161-E165 PolarHBondContact O-N 3.36Å; W163-E165 VanDerWaalsContact C-N 3.32Å; W163-E165 PolarHBondContact O-N 2.85Å
166	Y	80.6	Confident	81.5	Confident	109 Å²	109	78.7 Å²	78.7	43%	0.427	43%	0.43	S	S	.	.	H	α-helix	trans	-123.9	-0.3	-175.3	-52.8	-74.2	0	0	0	114.5	N162 N168 P172	N162-Y166 HydrophobicContact CB-CD2 4.47Å; N162-Y166 WeakPolarHBondContact O-CA 3.44Å; N162-Y166 WeakPolarHBondContact O-CB 3.42Å; N162-Y166 PolarHBondContact O-N 2.84Å; Y166-N168 PolarHBondContact O-N 3.05Å; Y166-P172 HydrophobicContact CD1-CB 3.74Å; Y166-P172 HydrophobicContact CD1-CG 4.43Å; Y166-P172 HydrophobicContact CE1-CB 3.97Å; Y166-P172 HydrophobicContact CE1-CG 4.3Å; Y166-P172 HydrophobicContact CG-CB 4.09Å
167	G	79.9	Confident	81.1	Confident	43 Å²	43	81.6 Å²	81.6	44%	0.443	44%	0.439	S	S	.	.	S	Bend	trans	72.5	0.1	-177.3	0	0	0	0	0	115.4	W163	W163-G167 VanDerWaalsContact CD1-O 3.25Å; W163-G167 WeakPolarHBondContact O-CA 3.41Å; W163-G167 PolarHBondContact O-N 3.36Å
168	N	82.5	Confident	80.9	Confident	40 Å²	40	77.3 Å²	77.3	21%	0.214	44%	0.435	C	S	.	.	S	Bend	trans	-137.5	126.6	179.6	173.9	47.6	0	0	0	110.2	K149 N162 Y166 D170 G171	K149-N168 PolarHBondContact NZ-OD1 3.23Å; N162-N168 CarbonylContact C-O 3.58Å; Y166-N168 PolarHBondContact O-N 3.05Å; N168-D170 PolarHBondContact O-N 3.14Å; N168-D170 VanDerWaalsContact O-N 3.13Å; N168-G171 PolarHBondContact ND2-O 2.97Å; N168-G171 PolarHBondContact O-N 3.05Å; N168-G171 VanDerWaalsContact O-N 3.13Å
169	P	80.6	Confident	80.8	Confident	6 Å²	6	73.4 Å²	73.4	4%	0.039	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.6	-176.6	26.8	-38.9	0	0	0	114.9	F105 K149 A153 S159 N162 W163 G171	F105-P169 HydrophobicContact CD1-CG 4.16Å; F105-P169 HydrophobicContact CE1-CG 3.86Å; K149-P169 HydrophobicContact CD-CG 4.39Å; K149-P169 HydrophobicContact CG-CG 4.14Å; A153-P169 HydrophobicContact CB-CB 3.6Å; A153-P169 HydrophobicContact CB-CG 3.86Å; S159-P169 WeakPolarHBondContact CA-O 3.18Å; S159-P169 WeakPolarHBondContact CB-O 3.46Å; S159-P169 VanDerWaalsContact O-CA 3.31Å; S159-P169 WeakPolarHBondContact O-CA 3.36Å; S159-P169 WeakPolarHBondContact O-CB 3.29Å; N162-P169 WeakPolarHBondContact CB-O 3.22Å; N162-P169 PolarHBondContact ND2-O 3.45Å; W163-P169 HydrophobicContact CB-CB 4.4Å; P169-G171 PolarHBondContact O-N 3.34Å
170	D	81.7	Confident	80.8	Confident	115 Å²	115	74.1 Å²	74.1	62%	0.615	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	0.4	-179.9	-42.7	-28	0	0	0	112.4	K149 N168	K149-D170 VanDerWaalsContact CE-OD1 3.28Å; K149-D170 WeakPolarHBondContact CE-OD1 3.46Å; K149-D170 WeakPolarHBondContact CE-OD2 3.29Å; K149-D170 VanDerWaalsContact NZ-CG 3.34Å; K149-D170 IonicContact NZ-OD1 2.69Å; K149-D170 PolarHBondContact NZ-OD1 2.66Å; K149-D170 IonicContact NZ-OD2 2.75Å; K149-D170 PolarHBondContact NZ-OD2 3.11Å; N168-D170 PolarHBondContact O-N 3.14Å; N168-D170 VanDerWaalsContact O-N 3.13Å
171	G	79.7	Confident	80.8	Confident	5 Å²	5	72.9 Å²	72.9	5%	0.052	43%	0.425	C	S	.	.	S	Bend	trans	101.1	-169.6	-177	0	0	0	0	0	113.3	N168 P169 G173	N168-G171 PolarHBondContact ND2-O 2.97Å; N168-G171 PolarHBondContact O-N 3.05Å; N168-G171 VanDerWaalsContact O-N 3.13Å; P169-G171 PolarHBondContact O-N 3.34Å; G171-G173 PolarHBondContact O-N 3.23Å
172	P	77.8	Confident	80.7	Confident	91 Å²	91	67.5 Å²	67.5	59%	0.591	40%	0.403	S	S	*	.	S	Bend	trans	-60.9	119.7	178.6	25.3	-33.1	0	0	0	110.2	Y166	Y166-P172 HydrophobicContact CD1-CB 3.74Å; Y166-P172 HydrophobicContact CD1-CG 4.43Å; Y166-P172 HydrophobicContact CE1-CB 3.97Å; Y166-P172 HydrophobicContact CE1-CG 4.3Å; Y166-P172 HydrophobicContact CG-CB 4.09Å
173	G	69.6	Low	80.5	Confident	60 Å²	60	69.4 Å²	69.4	62%	0.619	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-63.8	143.4	177.4	0	0	0	0	0	111.6	G171 A175	G171-G173 PolarHBondContact O-N 3.23Å; G173-A175 PolarHBondContact O-N 3.06Å
174	A	70.5	Confident	80.4	Confident	79 Å²	79	74 Å²	74	65%	0.653	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-60.7	136.8	169.5	0	0	0	0	0	109.8	H176	A174-H176 PolarHBondContact O-CD2 3.06Å; A174-H176 VanDerWaalsContact O-CD2 3.26Å; A174-H176 PolarHBondContact O-N 3.21Å
175	A	70.6	Confident	80.3	Confident	79 Å²	79	71.4 Å²	71.4	65%	0.653	42%	0.415	S	S	*	.			trans	-74.1	99.9	176.5	0	0	0	0	0	110	G173 F177	G173-A175 PolarHBondContact O-N 3.06Å; A175-F177 HydrophobicContact CB-CE2 4.3Å; A175-F177 HydrophobicContact CB-CZ 4.41Å; A175-F177 WeakPolarHBondContact O-CD2 3.21Å; A175-F177 PolarHBondContact O-N 3.1Å
176	H	70.4	Confident	80.2	Confident	149 Å²	149	70 Å²	70	69%	0.69	41%	0.413	S	S	*	.			trans	-79	115.9	173.1	-75.4	-99.5	0	0	0	109.9	E7 A174 G178	E7-H176 IonicContact OE2-ND1 3.47Å; A174-H176 PolarHBondContact O-CD2 3.06Å; A174-H176 VanDerWaalsContact O-CD2 3.26Å; A174-H176 PolarHBondContact O-N 3.21Å; H176-G178 PolarHBondContact O-N 2.82Å
177	F	79.5	Confident	80.4	Confident	139 Å²	139	69 Å²	69	61%	0.61	41%	0.412	S	S	*	.			trans	-84.7	96.2	179.2	-67.7	-82.9	0	0	0	110.4	F6 E7 A175	F6-F177 WeakPolarHBondContact CA-O 3.4Å; F6-F177 HydrophobicContact CD1-CB 3.95Å; F6-F177 HydrophobicContact CE1-CB 4.08Å; E7-F177 PolarHBondContact N-O 2.86Å; E7-F177 VanDerWaalsContact N-O 3.12Å; A175-F177 HydrophobicContact CB-CE2 4.3Å; A175-F177 HydrophobicContact CB-CZ 4.41Å; A175-F177 WeakPolarHBondContact O-CD2 3.21Å; A175-F177 PolarHBondContact O-N 3.1Å
178	G	81.5	Confident	80.5	Confident	61 Å²	61	75.6 Å²	75.6	63%	0.629	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	145.6	172.7	0	0	0	0	0	112.7	E7 H176	E7-G178 CarbonylContact O-C 3.52Å; E7-G178 VanDerWaalsContact O-CA 3.27Å; E7-G178 WeakPolarHBondContact O-CA 3.34Å; H176-G178 PolarHBondContact O-N 2.82Å
179	I	87.1	Confident	80.6	Confident	55 Å²	55	81.6 Å²	81.6	28%	0.282	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.7	166.6	-61.5	179.2	0	0	0	108.3	F6 E7 F8 D9 L181	F6-I179 HydrophobicContact CB-CD1 3.67Å; F6-I179 HydrophobicContact CB-CG1 4.01Å; F6-I179 HydrophobicContact CD1-CD1 3.77Å; F6-I179 HydrophobicContact CD1-CG1 3.88Å; F6-I179 HydrophobicContact CD2-CD1 4.08Å; F6-I179 HydrophobicContact CE1-CD1 4.42Å; F6-I179 HydrophobicContact CG-CD1 3.58Å; F6-I179 HydrophobicContact CG-CG1 4.09Å; E7-I179 PolarHBondContact O-N 3.5Å; F8-I179 HydrophobicContact CD1-CB 4.28Å; F8-I179 HydrophobicContact CD1-CG2 4.43Å; F8-I179 HydrophobicContact CE1-CB 4.24Å; F8-I179 HydrophobicContact CE1-CD1 4.28Å; F8-I179 HydrophobicContact CE1-CG2 4.21Å; F8-I179 HydrophobicContact CZ-CD1 4.36Å; D9-I179 PolarHBondContact N-O 3.47Å; I179-L181 HydrophobicContact CG2-CB 3.97Å; I179-L181 HydrophobicContact CG2-CD1 3.99Å; I179-L181 HydrophobicContact CG2-CG 3.88Å; I179-L181 PolarHBondContact O-N 2.88Å
180	A	87.2	Confident	80.9	Confident	27 Å²	27	83.5 Å²	83.5	22%	0.223	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	33.4	179	0	0	0	0	0	114.3	T14 F15 F18	T14-A180 HydrophobicContact CG2-CB 3.7Å; F15-A180 VanDerWaalsContact CA-O 3.3Å; F15-A180 WeakPolarHBondContact CA-O 3.34Å; F15-A180 VanDerWaalsContact CB-O 3.31Å; F15-A180 WeakPolarHBondContact CB-O 3.46Å; F15-A180 WeakPolarHBondContact CD2-O 3.45Å; F18-A180 HydrophobicContact CB-CB 4.08Å
181	L	87.8	Confident	81	Confident	69 Å²	69	82.5 Å²	82.5	36%	0.361	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	134	173.2	-73.6	175.3	0	0	0	109.2	F8 D9 I179 K183	F8-L181 HydrophobicContact CD1-CB 4.13Å; F8-L181 HydrophobicContact CE1-CB 4.37Å; D9-L181 PolarHBondContact N-O 3.49Å; I179-L181 HydrophobicContact CG2-CB 3.97Å; I179-L181 HydrophobicContact CG2-CD1 3.99Å; I179-L181 HydrophobicContact CG2-CG 3.88Å; I179-L181 PolarHBondContact O-N 2.88Å; L181-K183 PolarHBondContact O-N 3.36Å
182	P	84.7	Confident	81.5	Confident	6 Å²	6	90.9 Å²	90.9	4%	0.039	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	131.7	-176.4	-24.1	35	0	0	0	112.5	F15 W184 M185	F15-P182 HydrophobicContact CB-CG 3.75Å; F15-P182 HydrophobicContact CD1-CG 3.4Å; F15-P182 HydrophobicContact CD2-CG 4.02Å; F15-P182 HydrophobicContact CE1-CG 3.93Å; F15-P182 HydrophobicContact CE2-CG 4.48Å; F15-P182 HydrophobicContact CG-CG 3.44Å; F15-P182 VanDerWaalsContact CG-CG 3.44Å; F15-P182 HydrophobicContact CZ-CG 4.44Å; P182-W184 HydrophobicContact CB-CG 4.26Å; P182-W184 VanDerWaalsContact CB-NE1 3.32Å; P182-W184 PolarHBondContact O-N 3.42Å; P182-M185 WeakPolarHBondContact O-CB 3.5Å; P182-M185 PolarHBondContact O-N 3.37Å
183	K	84.8	Confident	82	Confident	74 Å²	74	92.6 Å²	92.6	32%	0.322	49%	0.49	S	S	.	.	H	α-helix	trans	-55.7	-30.4	-178	-164.8	163	-173.6	167.6	0	113.6	F8 D9 E10 L181 M185 V186 Q187	F8-K183 HydrophobicContact CB-CB 4.06Å; F8-K183 HydrophobicContact CB-CG 4.18Å; D9-K183 WeakPolarHBondContact O-CB 3.23Å; D9-K183 PolarHBondContact O-N 3.43Å; E10-K183 HydrophobicContact CG-CD 3.81Å; E10-K183 WeakPolarHBondContact OE1-CD 3.47Å; E10-K183 WeakPolarHBondContact OE1-CE 3.29Å; E10-K183 IonicContact OE1-NZ 3.9Å; E10-K183 PolarHBondContact OE1-NZ 3.1Å; L181-K183 PolarHBondContact O-N 3.36Å; K183-M185 PolarHBondContact O-N 3.06Å; K183-V186 PolarHBondContact O-N 3.44Å; K183-V186 VanDerWaalsContact O-N 3.16Å; K183-Q187 WeakPolarHBondContact O-CG 3.45Å; K183-Q187 PolarHBondContact O-N 2.92Å
184	W	83.6	Confident	83	Confident	141 Å²	141	92.7 Å²	92.7	53%	0.534	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-28.1	177	73.6	-102.9	0	0	0	114	P182 V186 N190	P182-W184 HydrophobicContact CB-CG 4.26Å; P182-W184 VanDerWaalsContact CB-NE1 3.32Å; P182-W184 PolarHBondContact O-N 3.42Å; W184-V186 VanDerWaalsContact C-N 3.32Å; W184-N190 WeakPolarHBondContact O-CB 3.29Å; W184-N190 PolarHBondContact O-ND2 3.31Å
185	M	82.7	Confident	83.9	Confident	57 Å²	57	92.3 Å²	92.3	28%	0.281	47%	0.465	S	S	.	.	H	α-helix	trans	-72.6	-27.7	-179.9	-167.6	-178.2	-64	0	0	112.2	P182 K183 V194	P182-M185 WeakPolarHBondContact O-CB 3.5Å; P182-M185 PolarHBondContact O-N 3.37Å; K183-M185 PolarHBondContact O-N 3.06Å; M185-V194 HydrophobicContact CG-CG2 3.93Å
186	V	82.1	Confident	84.9	Confident	64 Å²	64	90.3 Å²	90.3	39%	0.388	45%	0.452	S	S	.	.	H	α-helix	trans	-100.1	-14.6	-177.9	-171.8	0	0	0	0	111.9	F8 K183 W184	F8-V186 HydrophobicContact CD1-CG2 4.01Å; F8-V186 HydrophobicContact CE1-CG2 3.79Å; F8-V186 HydrophobicContact CE2-CG1 4.25Å; F8-V186 HydrophobicContact CE2-CG2 4.48Å; F8-V186 HydrophobicContact CG-CG2 4.45Å; F8-V186 HydrophobicContact CZ-CG1 4.36Å; F8-V186 HydrophobicContact CZ-CG2 4.04Å; K183-V186 PolarHBondContact O-N 3.44Å; K183-V186 VanDerWaalsContact O-N 3.16Å; W184-V186 VanDerWaalsContact C-N 3.32Å
187	Q	84	Confident	86	Confident	88 Å²	88	86.1 Å²	86.1	41%	0.411	44%	0.443	S	S	.	.	S	Bend	trans	-58.9	142.7	174	-80.5	166.1	6.4	0	0	112.1	K183 E189 N190 F191	K183-Q187 WeakPolarHBondContact O-CG 3.45Å; K183-Q187 PolarHBondContact O-N 2.92Å; Q187-E189 PolarHBondContact O-N 2.91Å; Q187-N190 PolarHBondContact O-N 3.29Å; Q187-F191 PolarHBondContact O-N 3.1Å
188	K	82.2	Confident	86.6	Confident	183 Å²	183	86.3 Å²	86.3	80%	0.796	44%	0.441	S	S	*	.	H	α-helix	trans	-54.4	-25.8	-173.6	-65.8	-179.1	178.9	178	0	114.8
189	E	84.2	Confident	87.2	Confident	166 Å²	166	87.9 Å²	87.9	78%	0.776	43%	0.434	S	S	*	.	H	α-helix	trans	-69.6	-40.7	179.2	-62.6	176	-166.7	0	0	111.9	Q187	Q187-E189 PolarHBondContact O-N 2.91Å
190	N	86.7	Confident	87.6	Confident	45 Å²	45	89.1 Å²	89.1	24%	0.241	44%	0.441	C	S	.	.	H	α-helix	trans	-98.3	-19.9	-178.6	-60.9	-56.1	0	0	0	113.3	W184 Q187 Y192 L193 V194	W184-N190 WeakPolarHBondContact O-CB 3.29Å; W184-N190 PolarHBondContact O-ND2 3.31Å; Q187-N190 PolarHBondContact O-N 3.29Å; N190-Y192 VanDerWaalsContact C-N 3.29Å; N190-Y192 PolarHBondContact O-N 3.04Å; N190-Y192 VanDerWaalsContact O-N 3.16Å; N190-L193 WeakPolarHBondContact O-CA 3.33Å; N190-L193 WeakPolarHBondContact O-CB 3.38Å; N190-L193 PolarHBondContact O-N 3.21Å; N190-V194 PolarHBondContact O-N 2.93Å
191	F	84.7	Confident	87.9	Confident	94 Å²	94	91.9 Å²	91.9	41%	0.412	45%	0.451	S	S	.	.	H	α-helix	trans	-45.8	-47.4	-177.9	-176.7	-104	0	0	0	113.6	Q187 L193 V194 I195	Q187-F191 PolarHBondContact O-N 3.1Å; F191-L193 PolarHBondContact O-N 2.61Å; F191-V194 PolarHBondContact O-N 3.48Å; F191-I195 HydrophobicContact CD1-CD1 3.87Å; F191-I195 HydrophobicContact CD2-CD1 4.19Å; F191-I195 HydrophobicContact CE1-CD1 3.43Å; F191-I195 VanDerWaalsContact CE1-CD1 3.43Å; F191-I195 HydrophobicContact CE2-CD1 3.79Å; F191-I195 HydrophobicContact CG-CD1 4.23Å; F191-I195 HydrophobicContact CZ-CD1 3.4Å; F191-I195 WeakPolarHBondContact O-CG1 3.48Å; F191-I195 PolarHBondContact O-N 2.63Å
192	Y	88.9	Confident	88.3	Confident	182 Å²	182	92.6 Å²	92.6	71%	0.714	45%	0.452	S	S	*	.	H	α-helix	trans	-68.6	-31	178.1	-64.5	-72.2	0	0	0	113.8	N190 G196	N190-Y192 VanDerWaalsContact C-N 3.29Å; N190-Y192 PolarHBondContact O-N 3.04Å; N190-Y192 VanDerWaalsContact O-N 3.16Å; Y192-G196 PolarHBondContact O-N 2.9Å
193	L	89.6	Confident	88.8	Confident	126 Å²	126	99.4 Å²	99.4	66%	0.66	49%	0.485	S	S	*	.	H	α-helix	trans	-72.5	-41.9	176.1	-63.8	175.1	0	0	0	111.1	N190 F191 G196 A197	N190-L193 WeakPolarHBondContact O-CA 3.33Å; N190-L193 WeakPolarHBondContact O-CB 3.38Å; N190-L193 PolarHBondContact O-N 3.21Å; F191-L193 PolarHBondContact O-N 2.61Å; L193-G196 PolarHBondContact O-N 2.84Å; L193-A197 WeakPolarHBondContact O-CB 3.49Å; L193-A197 PolarHBondContact O-N 3.42Å
194	V	89.4	Confident	89.2	Confident	63 Å²	63	100.9 Å²	100.9	38%	0.382	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-45.9	177.2	177.8	0	0	0	0	110.7	M185 N190 F191 A197 Y198	M185-V194 HydrophobicContact CG-CG2 3.93Å; N190-V194 PolarHBondContact O-N 2.93Å; F191-V194 PolarHBondContact O-N 3.48Å; V194-A197 PolarHBondContact O-N 3.23Å; V194-Y198 PolarHBondContact O-N 2.87Å
195	I	89.9	Confident	89.8	Confident	71 Å²	71	98.1 Å²	98.1	36%	0.364	49%	0.489	S	S	.	.	H	α-helix	trans	-66.1	-41.5	175.6	-70	172.7	0	0	0	111.3	F191 A197 Y198 I199	F191-I195 HydrophobicContact CD1-CD1 3.87Å; F191-I195 HydrophobicContact CD2-CD1 4.19Å; F191-I195 HydrophobicContact CE1-CD1 3.43Å; F191-I195 VanDerWaalsContact CE1-CD1 3.43Å; F191-I195 HydrophobicContact CE2-CD1 3.79Å; F191-I195 HydrophobicContact CG-CD1 4.23Å; F191-I195 HydrophobicContact CZ-CD1 3.4Å; F191-I195 WeakPolarHBondContact O-CG1 3.48Å; F191-I195 PolarHBondContact O-N 2.63Å; I195-A197 VanDerWaalsContact C-N 3.33Å; I195-A197 PolarHBondContact O-N 3.05Å; I195-Y198 PolarHBondContact O-N 3.19Å; I195-I199 HydrophobicContact CG2-CD1 3.72Å; I195-I199 HydrophobicContact CG2-CG1 4.32Å; I195-I199 WeakPolarHBondContact O-CG1 3.31Å; I195-I199 PolarHBondContact O-N 3.06Å
196	G	92.7	Very high	90.4	Very high	37 Å²	37	99.1 Å²	99.1	38%	0.381	50%	0.495	S	S	.	.	H	α-helix	trans	-59.8	-41.8	175.2	0	0	0	0	0	112.8	Y192 L193 L200	Y192-G196 PolarHBondContact O-N 2.9Å; L193-G196 PolarHBondContact O-N 2.84Å; G196-L200 VanDerWaalsContact O-CB 3.26Å; G196-L200 WeakPolarHBondContact O-CB 3.21Å; G196-L200 PolarHBondContact O-N 3.29Å
197	A	92.5	Very high	91	Very high	61 Å²	61	99.2 Å²	99.2	50%	0.504	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-39.7	174.5	0	0	0	0	0	112.5	L193 V194 I195 L200 L201	L193-A197 WeakPolarHBondContact O-CB 3.49Å; L193-A197 PolarHBondContact O-N 3.42Å; V194-A197 PolarHBondContact O-N 3.23Å; I195-A197 VanDerWaalsContact C-N 3.33Å; I195-A197 PolarHBondContact O-N 3.05Å; A197-L200 PolarHBondContact O-N 3.07Å; A197-L201 WeakPolarHBondContact O-CB 3.33Å; A197-L201 PolarHBondContact O-N 3.46Å
198	Y	91.7	Very high	91.6	Very high	143 Å²	143	100 Å²	100	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-46.9	175.9	-174.6	-88.3	0	0	0	112	V194 I195 L200 L201 F202	V194-Y198 PolarHBondContact O-N 2.87Å; I195-Y198 PolarHBondContact O-N 3.19Å; Y198-L200 VanDerWaalsContact C-N 3.35Å; Y198-L200 PolarHBondContact O-N 3.44Å; Y198-L201 PolarHBondContact O-N 2.91Å; Y198-F202 HydrophobicContact CD1-CD2 4.13Å; Y198-F202 AromaticContact CD2-CD2 3.72Å; Y198-F202 HydrophobicContact CD2-CD2 3.72Å; Y198-F202 AromaticContact CD2-CE2 3.7Å; Y198-F202 HydrophobicContact CD2-CE2 3.7Å; Y198-F202 AromaticContact CE1-CD2 3.89Å; Y198-F202 HydrophobicContact CE1-CD2 3.89Å; Y198-F202 HydrophobicContact CE1-CG 4.36Å; Y198-F202 AromaticContact CE2-CD2 3.46Å; Y198-F202 HydrophobicContact CE2-CD2 3.46Å; Y198-F202 VanDerWaalsContact CE2-CD2 3.46Å; Y198-F202 AromaticContact CE2-CE2 3.28Å; Y198-F202 HydrophobicContact CE2-CE2 3.28Å; Y198-F202 HydrophobicContact CE2-CG 4.47Å; Y198-F202 HydrophobicContact CE2-CZ 4.19Å; Y198-F202 HydrophobicContact CG-CD2 4.04Å; Y198-F202 HydrophobicContact CG-CE2 4.47Å; Y198-F202 AromaticContact CZ-CD2 3.54Å; Y198-F202 AromaticContact CZ-CE2 3.75Å; Y198-F202 WeakPolarHBondContact O-CD2 3.43Å; Y198-F202 PolarHBondContact O-N 3.43Å
199	I	95.5	Very high	92.2	Very high	93 Å²	93	94.4 Å²	94.4	48%	0.477	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-44.4	175.6	-67.4	169.2	0	0	0	110.3	I195 L201 M203	I195-I199 HydrophobicContact CG2-CD1 3.72Å; I195-I199 HydrophobicContact CG2-CG1 4.32Å; I195-I199 WeakPolarHBondContact O-CG1 3.31Å; I195-I199 PolarHBondContact O-N 3.06Å; I199-L201 VanDerWaalsContact C-N 3.32Å; I199-L201 PolarHBondContact O-N 3.11Å; I199-M203 HydrophobicContact CG2-CB 4.27Å; I199-M203 HydrophobicContact CG2-CG 4.25Å; I199-M203 WeakPolarHBondContact O-CA 3.37Å; I199-M203 VanDerWaalsContact O-CB 3.26Å; I199-M203 WeakPolarHBondContact O-CB 3.49Å; I199-M203 PolarHBondContact O-N 2.93Å
200	L	95.5	Very high	92.8	Very high	82 Å²	82	89.8 Å²	89.8	43%	0.429	47%	0.469	S	S	.	.	I	π-helix	trans	-62.3	-38.7	177	-173.1	151.6	0	0	0	111.8	G196 A197 Y198 M204 I205	G196-L200 VanDerWaalsContact O-CB 3.26Å; G196-L200 WeakPolarHBondContact O-CB 3.21Å; G196-L200 PolarHBondContact O-N 3.29Å; A197-L200 PolarHBondContact O-N 3.07Å; Y198-L200 VanDerWaalsContact C-N 3.35Å; Y198-L200 PolarHBondContact O-N 3.44Å; L200-M204 HydrophobicContact CG-CE 4.43Å; L200-M204 HydrophobicContact CG-SD 4.47Å; L200-M204 WeakPolarHBondContact O-CB 3.24Å; L200-M204 PolarHBondContact O-N 3.18Å; L200-I205 HydrophobicContact CD2-CD1 3.49Å; L200-I205 VanDerWaalsContact CD2-CD1 3.49Å; L200-I205 HydrophobicContact CD2-CG1 3.89Å; L200-I205 PolarHBondContact O-N 2.56Å
201	L	93.6	Very high	93.2	Very high	84 Å²	84	88.7 Å²	88.7	44%	0.44	47%	0.469	S	S	.	.	I	π-helix	trans	-67.3	-52.2	177.1	-177.6	60.3	0	0	0	112.2	A197 Y198 I199 I205 L206	A197-L201 WeakPolarHBondContact O-CB 3.33Å; A197-L201 PolarHBondContact O-N 3.46Å; Y198-L201 PolarHBondContact O-N 2.91Å; I199-L201 VanDerWaalsContact C-N 3.32Å; I199-L201 PolarHBondContact O-N 3.11Å; L201-I205 HydrophobicContact CD1-CB 4.4Å; L201-I205 HydrophobicContact CD1-CD1 4.47Å; L201-I205 HydrophobicContact CD1-CG2 4.37Å; L201-I205 PolarHBondContact O-N 2.78Å; L201-L206 WeakPolarHBondContact O-CB 3.42Å; L201-L206 PolarHBondContact O-N 2.78Å
202	F	95.2	Very high	93.6	Very high	85 Å²	85	88.2 Å²	88.2	37%	0.373	47%	0.474	S	S	.	.	I	π-helix	trans	-89.9	-26.4	-170.1	-75.5	-83	0	0	0	115.1	Y198 L206 P207	Y198-F202 HydrophobicContact CD1-CD2 4.13Å; Y198-F202 AromaticContact CD2-CD2 3.72Å; Y198-F202 HydrophobicContact CD2-CD2 3.72Å; Y198-F202 AromaticContact CD2-CE2 3.7Å; Y198-F202 HydrophobicContact CD2-CE2 3.7Å; Y198-F202 AromaticContact CE1-CD2 3.89Å; Y198-F202 HydrophobicContact CE1-CD2 3.89Å; Y198-F202 HydrophobicContact CE1-CG 4.36Å; Y198-F202 AromaticContact CE2-CD2 3.46Å; Y198-F202 HydrophobicContact CE2-CD2 3.46Å; Y198-F202 VanDerWaalsContact CE2-CD2 3.46Å; Y198-F202 AromaticContact CE2-CE2 3.28Å; Y198-F202 HydrophobicContact CE2-CE2 3.28Å; Y198-F202 HydrophobicContact CE2-CG 4.47Å; Y198-F202 HydrophobicContact CE2-CZ 4.19Å; Y198-F202 HydrophobicContact CG-CD2 4.04Å; Y198-F202 HydrophobicContact CG-CE2 4.47Å; Y198-F202 AromaticContact CZ-CD2 3.54Å; Y198-F202 AromaticContact CZ-CE2 3.75Å; Y198-F202 WeakPolarHBondContact O-CD2 3.43Å; Y198-F202 PolarHBondContact O-N 3.43Å; F202-L206 HydrophobicContact CD1-CD1 3.92Å; F202-L206 HydrophobicContact CE1-CD1 4.17Å; F202-P207 WeakPolarHBondContact O-CD 3.46Å
203	M	94.7	Very high	93.7	Very high	149 Å²	149	83.7 Å²	83.7	73%	0.734	46%	0.455	S	S	*	.	I	π-helix	trans	-102.3	-16.4	179.8	-60.1	-67.8	175.8	0	0	113.8	I199	I199-M203 HydrophobicContact CG2-CB 4.27Å; I199-M203 HydrophobicContact CG2-CG 4.25Å; I199-M203 WeakPolarHBondContact O-CA 3.37Å; I199-M203 VanDerWaalsContact O-CB 3.26Å; I199-M203 WeakPolarHBondContact O-CB 3.49Å; I199-M203 PolarHBondContact O-N 2.93Å
204	M	94	Very high	93.8	Very high	104 Å²	104	84 Å²	84	51%	0.512	45%	0.448	S	S	.	.	I	π-helix	trans	-118.2	-59.4	177.9	-172.4	-163.8	-57.7	0	0	112.4	L200 I208	L200-M204 HydrophobicContact CG-CE 4.43Å; L200-M204 HydrophobicContact CG-SD 4.47Å; L200-M204 WeakPolarHBondContact O-CB 3.24Å; L200-M204 PolarHBondContact O-N 3.18Å; M204-I208 HydrophobicContact CG-CD1 3.83Å; M204-I208 VanDerWaalsContact O-CB 3.3Å; M204-I208 WeakPolarHBondContact O-CB 3.41Å; M204-I208 WeakPolarHBondContact O-CD1 3.34Å; M204-I208 WeakPolarHBondContact O-CG1 3.4Å; M204-I208 PolarHBondContact O-N 3.3Å
205	I	95.3	Very high	93.9	Very high	84 Å²	84	89 Å²	89	43%	0.431	46%	0.461	S	S	.	.	I	π-helix	trans	-65.3	-50.5	-174.9	-67.5	177.9	0	0	0	111.1	L200 L201 S209	L200-I205 HydrophobicContact CD2-CD1 3.49Å; L200-I205 VanDerWaalsContact CD2-CD1 3.49Å; L200-I205 HydrophobicContact CD2-CG1 3.89Å; L200-I205 PolarHBondContact O-N 2.56Å; L201-I205 HydrophobicContact CD1-CB 4.4Å; L201-I205 HydrophobicContact CD1-CD1 4.47Å; L201-I205 HydrophobicContact CD1-CG2 4.37Å; L201-I205 PolarHBondContact O-N 2.78Å; I205-S209 VanDerWaalsContact O-CB 3.28Å; I205-S209 WeakPolarHBondContact O-CB 3.37Å; I205-S209 PolarHBondContact O-N 2.7Å; I205-S209 PolarHBondContact O-OG 2.85Å; I205-S209 VanDerWaalsContact O-OG 3.1Å
206	L	95.3	Very high	93.8	Very high	77 Å²	77	89.5 Å²	89.5	40%	0.403	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-50.2	-176.1	-173.2	161.6	0	0	0	112.7	L201 F202 I208 S209 V210	L201-L206 WeakPolarHBondContact O-CB 3.42Å; L201-L206 PolarHBondContact O-N 2.78Å; F202-L206 HydrophobicContact CD1-CD1 3.92Å; F202-L206 HydrophobicContact CE1-CD1 4.17Å; L206-I208 VanDerWaalsContact C-N 3.33Å; L206-I208 PolarHBondContact O-N 2.99Å; L206-S209 PolarHBondContact O-N 3.08Å; L206-S209 PolarHBondContact O-OG 3.39Å; L206-S209 VanDerWaalsContact O-OG 3.1Å; L206-V210 HydrophobicContact CD2-CG2 4Å; L206-V210 HydrophobicContact CG-CG2 4.36Å; L206-V210 WeakPolarHBondContact O-CB 3.49Å; L206-V210 VanDerWaalsContact O-CG2 3.3Å; L206-V210 WeakPolarHBondContact O-CG2 3.37Å; L206-V210 PolarHBondContact O-N 3.12Å
207	P	96.5	Very high	93.6	Very high	67 Å²	67	90.3 Å²	90.3	44%	0.435	46%	0.462	S	S	.	.	H	α-helix	trans	-66.1	-34.1	-179.7	-23.6	36.8	0	0	0	112.9	F202 G211	F202-P207 WeakPolarHBondContact O-CD 3.46Å; P207-G211 PolarHBondContact O-N 2.88Å
208	I	96	Very high	93.5	Very high	104 Å²	104	92.3 Å²	92.3	53%	0.533	46%	0.463	S	S	.	.	H	α-helix	trans	-72	-41.9	176	-65.2	174	0	0	0	111	M204 L206 V212	M204-I208 HydrophobicContact CG-CD1 3.83Å; M204-I208 VanDerWaalsContact O-CB 3.3Å; M204-I208 WeakPolarHBondContact O-CB 3.41Å; M204-I208 WeakPolarHBondContact O-CD1 3.34Å; M204-I208 WeakPolarHBondContact O-CG1 3.4Å; M204-I208 PolarHBondContact O-N 3.3Å; L206-I208 VanDerWaalsContact C-N 3.33Å; L206-I208 PolarHBondContact O-N 2.99Å; I208-V212 HydrophobicContact CG2-CG2 4.26Å; I208-V212 VanDerWaalsContact O-CB 3.29Å; I208-V212 WeakPolarHBondContact O-CB 3.35Å; I208-V212 VanDerWaalsContact O-CG2 3.23Å; I208-V212 WeakPolarHBondContact O-CG2 3.22Å; I208-V212 PolarHBondContact O-N 3.21Å
209	S	94.4	Very high	93.4	Very high	65 Å²	65	90.8 Å²	90.8	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-68.5	-45.6	-179.6	68.6	0	0	0	0	111.6	I205 L206 W213	I205-S209 VanDerWaalsContact O-CB 3.28Å; I205-S209 WeakPolarHBondContact O-CB 3.37Å; I205-S209 PolarHBondContact O-N 2.7Å; I205-S209 PolarHBondContact O-OG 2.85Å; I205-S209 VanDerWaalsContact O-OG 3.1Å; L206-S209 PolarHBondContact O-N 3.08Å; L206-S209 PolarHBondContact O-OG 3.39Å; L206-S209 VanDerWaalsContact O-OG 3.1Å; S209-W213 WeakPolarHBondContact O-CB 3.2Å; S209-W213 PolarHBondContact O-N 2.9Å
210	V	96	Very high	93.2	Very high	69 Å²	69	90.5 Å²	90.5	42%	0.418	45%	0.454	S	S	.	.	H	α-helix	trans	-62.6	-46.5	174.3	174.8	0	0	0	0	110.4	L206 V212 W213 W214	L206-V210 HydrophobicContact CD2-CG2 4Å; L206-V210 HydrophobicContact CG-CG2 4.36Å; L206-V210 WeakPolarHBondContact O-CB 3.49Å; L206-V210 VanDerWaalsContact O-CG2 3.3Å; L206-V210 WeakPolarHBondContact O-CG2 3.37Å; L206-V210 PolarHBondContact O-N 3.12Å; V210-V212 PolarHBondContact O-N 2.9Å; V210-W213 HydrophobicContact CG1-CE3 4.34Å; V210-W213 HydrophobicContact CG1-CZ3 4.49Å; V210-W213 PolarHBondContact O-N 2.79Å; V210-W214 VanDerWaalsContact O-CB 3.25Å; V210-W214 WeakPolarHBondContact O-CB 3.47Å; V210-W214 PolarHBondContact O-N 2.88Å
211	G	95.6	Very high	92.9	Very high	23 Å²	23	87.9 Å²	87.9	24%	0.237	44%	0.443	C	S	.	.	H	α-helix	trans	-60.8	-46.4	177.7	0	0	0	0	0	113.2	P207 W213 W214 Y215	P207-G211 PolarHBondContact O-N 2.88Å; G211-W213 VanDerWaalsContact C-N 3.35Å; G211-W213 PolarHBondContact O-N 3.35Å; G211-W214 PolarHBondContact O-N 3.37Å; G211-Y215 WeakPolarHBondContact O-CB 3.21Å; G211-Y215 WeakPolarHBondContact O-CD2 3.45Å; G211-Y215 PolarHBondContact O-N 2.76Å
212	V	93.8	Very high	92.5	Very high	84 Å²	84	91.3 Å²	91.3	51%	0.509	46%	0.462	S	S	.	.	H	α-helix	trans	-66	-36.8	177.6	169.1	0	0	0	0	111.8	I208 V210 N216	I208-V212 HydrophobicContact CG2-CG2 4.26Å; I208-V212 VanDerWaalsContact O-CB 3.29Å; I208-V212 WeakPolarHBondContact O-CB 3.35Å; I208-V212 VanDerWaalsContact O-CG2 3.23Å; I208-V212 WeakPolarHBondContact O-CG2 3.22Å; I208-V212 PolarHBondContact O-N 3.21Å; V210-V212 PolarHBondContact O-N 2.9Å; V212-N216 WeakPolarHBondContact O-CB 3.38Å; V212-N216 PolarHBondContact O-N 2.88Å; V212-N216 PolarHBondContact O-ND2 2.89Å
213	W	91.1	Very high	91.8	Very high	86 Å²	86	90.4 Å²	90.4	33%	0.326	46%	0.46	S	S	.	.	H	α-helix	trans	-65.5	-53.5	173.7	165.3	90.9	0	0	0	111	S209 V210 G211 Y215 N216 T217 I552	S209-W213 WeakPolarHBondContact O-CB 3.2Å; S209-W213 PolarHBondContact O-N 2.9Å; V210-W213 HydrophobicContact CG1-CE3 4.34Å; V210-W213 HydrophobicContact CG1-CZ3 4.49Å; V210-W213 PolarHBondContact O-N 2.79Å; G211-W213 VanDerWaalsContact C-N 3.35Å; G211-W213 PolarHBondContact O-N 3.35Å; W213-Y215 PolarHBondContact O-N 3.01Å; W213-N216 PolarHBondContact O-N 3.22Å; W213-T217 PolarHBondContact O-N 2.83Å; W213-T217 PolarHBondContact O-OG1 3.29Å; W213-I552 HydrophobicContact CH2-CD1 4.47Å; W213-I552 HydrophobicContact CH2-CG2 4.01Å; W213-I552 HydrophobicContact CZ2-CB 4.1Å; W213-I552 HydrophobicContact CZ2-CD1 3.76Å; W213-I552 HydrophobicContact CZ2-CG1 3.72Å; W213-I552 HydrophobicContact CZ2-CG2 3.77Å
214	W	91.9	Very high	91.5	Very high	134 Å²	134	86.2 Å²	86.2	51%	0.508	44%	0.441	S	S	.	.	H	α-helix	trans	-55.5	-53.5	179.5	-179.8	-100.7	0	0	0	112.1	V210 G211 N216 T217 M218	V210-W214 VanDerWaalsContact O-CB 3.25Å; V210-W214 WeakPolarHBondContact O-CB 3.47Å; V210-W214 PolarHBondContact O-N 2.88Å; G211-W214 PolarHBondContact O-N 3.37Å; W214-N216 PolarHBondContact O-N 2.93Å; W214-N216 VanDerWaalsContact O-N 3.12Å; W214-T217 PolarHBondContact O-N 3.34Å; W214-M218 HydrophobicContact CD2-CG 3.89Å; W214-M218 HydrophobicContact CD2-SD 4.44Å; W214-M218 HydrophobicContact CG-CG 4.14Å; W214-M218 HydrophobicContact CH2-CE 4.28Å; W214-M218 HydrophobicContact CH2-SD 4.1Å; W214-M218 HydrophobicContact CZ2-CE 4.26Å; W214-M218 HydrophobicContact CZ2-CG 4.05Å; W214-M218 HydrophobicContact CZ2-SD 3.49Å; W214-M218 WeakPolarHBondContact CZ2-SD 3.44Å; W214-M218 VanDerWaalsContact O-CB 3.3Å; W214-M218 WeakPolarHBondContact O-CB 3.4Å; W214-M218 VanDerWaalsContact O-CG 3.24Å; W214-M218 WeakPolarHBondContact O-CG 3.34Å; W214-M218 PolarHBondContact O-N 3.34Å
215	Y	90.7	Very high	91.3	Very high	167 Å²	167	81.2 Å²	81.2	66%	0.655	42%	0.417	S	S	*	.	H	α-helix	trans	-63.7	-18	178	-80.3	-59.3	0	0	0	113.6	G211 W213 K219	G211-Y215 WeakPolarHBondContact O-CB 3.21Å; G211-Y215 WeakPolarHBondContact O-CD2 3.45Å; G211-Y215 PolarHBondContact O-N 2.76Å; W213-Y215 PolarHBondContact O-N 3.01Å; Y215-K219 VanDerWaalsContact O-CE 3.25Å; Y215-K219 WeakPolarHBondContact O-CE 3.46Å; Y215-K219 WeakPolarHBondContact O-CG 3.49Å; Y215-K219 PolarHBondContact O-NZ 2.97Å
216	N	88.3	Confident	91.2	Very high	81 Å²	81	78.6 Å²	78.6	43%	0.433	40%	0.403	S	S	.	.	H	α-helix	trans	-89.5	-41.9	173.6	-74.3	-33	0	0	0	111.8	V212 W213 W214 K219 F220	V212-N216 WeakPolarHBondContact O-CB 3.38Å; V212-N216 PolarHBondContact O-N 2.88Å; V212-N216 PolarHBondContact O-ND2 2.89Å; W213-N216 PolarHBondContact O-N 3.22Å; W214-N216 PolarHBondContact O-N 2.93Å; W214-N216 VanDerWaalsContact O-N 3.12Å; N216-K219 PolarHBondContact OD1-NZ 3.04Å; N216-F220 WeakPolarHBondContact O-CD2 3.39Å; N216-F220 VanDerWaalsContact O-CE2 3.23Å; N216-F220 WeakPolarHBondContact O-CE2 3.3Å
217	T	89.1	Confident	91.1	Very high	55 Å²	55	78 Å²	78	34%	0.337	40%	0.4	S	S	.	.	H	α-helix	trans	-63.9	-47.3	177	-55.4	0	0	0	0	111.8	W213 W214 K219 F220	W213-T217 PolarHBondContact O-N 2.83Å; W213-T217 PolarHBondContact O-OG1 3.29Å; W214-T217 PolarHBondContact O-N 3.34Å; T217-K219 PolarHBondContact O-N 2.92Å; T217-F220 PolarHBondContact O-N 3.06Å; T217-F220 VanDerWaalsContact O-N 3.1Å
218	M	89.6	Confident	91	Very high	103 Å²	103	77.3 Å²	77.3	51%	0.507	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-9	-178.3	-74.5	-94.5	91.4	0	0	115.8	W214 L227	W214-M218 HydrophobicContact CD2-CG 3.89Å; W214-M218 HydrophobicContact CD2-SD 4.44Å; W214-M218 HydrophobicContact CG-CG 4.14Å; W214-M218 HydrophobicContact CH2-CE 4.28Å; W214-M218 HydrophobicContact CH2-SD 4.1Å; W214-M218 HydrophobicContact CZ2-CE 4.26Å; W214-M218 HydrophobicContact CZ2-CG 4.05Å; W214-M218 HydrophobicContact CZ2-SD 3.49Å; W214-M218 WeakPolarHBondContact CZ2-SD 3.44Å; W214-M218 VanDerWaalsContact O-CB 3.3Å; W214-M218 WeakPolarHBondContact O-CB 3.4Å; W214-M218 VanDerWaalsContact O-CG 3.24Å; W214-M218 WeakPolarHBondContact O-CG 3.34Å; W214-M218 PolarHBondContact O-N 3.34Å; M218-L227 WeakPolarHBondContact O-CD1 3.3Å
219	K	90.4	Very high	91	Very high	111 Å²	111	72.4 Å²	72.4	48%	0.483	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-8.7	178.1	-67.3	177.9	-179.9	114.1	0	113.4	Y215 N216 T217 L227	Y215-K219 VanDerWaalsContact O-CE 3.25Å; Y215-K219 WeakPolarHBondContact O-CE 3.46Å; Y215-K219 WeakPolarHBondContact O-CG 3.49Å; Y215-K219 PolarHBondContact O-NZ 2.97Å; N216-K219 PolarHBondContact OD1-NZ 3.04Å; T217-K219 PolarHBondContact O-N 2.92Å; K219-L227 PolarHBondContact O-N 3.12Å
220	F	90.7	Very high	91	Very high	86 Å²	86	70.9 Å²	70.9	38%	0.377	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-119.4	148.2	-174.1	-57	-84.3	0	0	0	111.9	N216 T217 N224 V225 L226	N216-F220 WeakPolarHBondContact O-CD2 3.39Å; N216-F220 VanDerWaalsContact O-CE2 3.23Å; N216-F220 WeakPolarHBondContact O-CE2 3.3Å; T217-F220 PolarHBondContact O-N 3.06Å; T217-F220 VanDerWaalsContact O-N 3.1Å; F220-N224 WeakPolarHBondContact CD1-O 3.3Å; F220-V225 CarbonylContact C-O 3.58Å; F220-V225 VanDerWaalsContact CA-O 3.24Å; F220-V225 WeakPolarHBondContact CA-O 3.27Å; F220-L226 HydrophobicContact CD1-CD1 4.14Å; F220-L226 HydrophobicContact CD1-CG 4.21Å; F220-L226 HydrophobicContact CE1-CD1 3.63Å; F220-L226 HydrophobicContact CE1-CG 3.91Å
221	S	88.7	Confident	90.9	Very high	27 Å²	27	74.3 Å²	74.3	19%	0.189	36%	0.36	C	S	.	.			trans	-65	163.7	159.3	157.3	0	0	0	0	110.8	N223 N224 V225 E337	S221-N223 PolarHBondContact O-N 3.23Å; S221-N223 VanDerWaalsContact O-N 3.12Å; S221-N223 PolarHBondContact OG-N 2.98Å; S221-N224 WeakPolarHBondContact O-CA 3.23Å; S221-N224 PolarHBondContact O-N 2.67Å; S221-V225 PolarHBondContact N-O 3.29Å; S221-E337 WeakPolarHBondContact CB-OE2 3.41Å; S221-E337 PolarHBondContact OG-OE2 3.29Å
222	N	84.7	Confident	90.8	Very high	157 Å²	157	75.8 Å²	75.8	84%	0.84	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-36.4	171.9	-61.5	-8.5	0	0	0	112.2	N224	N222-N224 PolarHBondContact O-N 2.96Å; N222-N224 VanDerWaalsContact O-N 3.14Å; N222-N224 PolarHBondContact O-ND2 3.05Å; N222-N224 VanDerWaalsContact O-ND2 3.11Å
223	N	81	Confident	90.9	Very high	65 Å²	65	71.8 Å²	71.8	35%	0.348	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	15.7	174.9	-73.6	-36.2	0	0	0	114.3	S221 V225 R333 E337	S221-N223 PolarHBondContact O-N 3.23Å; S221-N223 VanDerWaalsContact O-N 3.12Å; S221-N223 PolarHBondContact OG-N 2.98Å; N223-V225 PolarHBondContact O-N 3.33Å; N223-R333 VanDerWaalsContact O-CD 3.26Å; N223-R333 WeakPolarHBondContact O-CD 3.43Å; N223-R333 PolarHBondContact O-NH1 2.74Å; N223-E337 HydrophobicContact CB-CG 3.84Å; N223-E337 PolarHBondContact ND2-OE1 3.11Å
224	N	87.6	Confident	90.9	Very high	61 Å²	61	68.3 Å²	68.3	33%	0.326	32%	0.323	S	S	.	.	S	Bend	trans	60.4	22.4	177.4	-73.5	-111	0	0	0	114.3	F220 S221 N222 R333	F220-N224 WeakPolarHBondContact CD1-O 3.3Å; S221-N224 WeakPolarHBondContact O-CA 3.23Å; S221-N224 PolarHBondContact O-N 2.67Å; N222-N224 PolarHBondContact O-N 2.96Å; N222-N224 VanDerWaalsContact O-N 3.14Å; N222-N224 PolarHBondContact O-ND2 3.05Å; N222-N224 VanDerWaalsContact O-ND2 3.11Å; N224-R333 VanDerWaalsContact CB-NH1 3.27Å; N224-R333 PolarHBondContact O-NH1 3.49Å; N224-R333 PolarHBondContact O-NH2 2.89Å
225	V	91.5	Very high	90.8	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.315	C	S	.	.			trans	-94.9	143.1	176.3	166.2	0	0	0	0	110	F220 S221 N223 T229 I230 E257 R333 L334 E337	F220-V225 CarbonylContact C-O 3.58Å; F220-V225 VanDerWaalsContact CA-O 3.24Å; F220-V225 WeakPolarHBondContact CA-O 3.27Å; S221-V225 PolarHBondContact N-O 3.29Å; N223-V225 PolarHBondContact O-N 3.33Å; V225-T229 HydrophobicContact CG1-CG2 4Å; V225-I230 HydrophobicContact CG1-CD1 4.15Å; V225-I230 HydrophobicContact CG1-CG1 3.98Å; V225-E257 VanDerWaalsContact CA-OE1 3.24Å; V225-E257 WeakPolarHBondContact CA-OE1 3.21Å; V225-E257 WeakPolarHBondContact CG1-OE1 3.5Å; V225-R333 HydrophobicContact CG2-CG 4.08Å; V225-L334 HydrophobicContact CG1-CD2 3.95Å; V225-L334 HydrophobicContact CG2-CD2 3.83Å; V225-E337 HydrophobicContact CB-CB 4.49Å; V225-E337 HydrophobicContact CB-CG 3.89Å; V225-E337 HydrophobicContact CG1-CB 4.3Å; V225-E337 HydrophobicContact CG1-CG 4.23Å; V225-E337 HydrophobicContact CG2-CB 4.36Å; V225-E337 HydrophobicContact CG2-CG 3.72Å
226	L	93.3	Very high	90.9	Very high	29 Å²	29	56.4 Å²	56.4	15%	0.152	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-64.4	135.2	-177.8	-78	83.6	0	0	0	111.2	F220 D228 T229 I230 E257 Y262	F220-L226 HydrophobicContact CD1-CD1 4.14Å; F220-L226 HydrophobicContact CD1-CG 4.21Å; F220-L226 HydrophobicContact CE1-CD1 3.63Å; F220-L226 HydrophobicContact CE1-CG 3.91Å; L226-D228 PolarHBondContact O-N 2.88Å; L226-T229 WeakPolarHBondContact O-CA 3.42Å; L226-T229 VanDerWaalsContact O-CB 3.31Å; L226-T229 WeakPolarHBondContact O-CB 3.47Å; L226-T229 PolarHBondContact O-N 3.01Å; L226-I230 PolarHBondContact O-N 3.03Å; L226-E257 HydrophobicContact CD1-CG 3.94Å; L226-E257 VanDerWaalsContact CD1-OE1 3.26Å; L226-E257 WeakPolarHBondContact CD1-OE1 3.4Å; L226-E257 PolarHBondContact N-OE1 2.85Å; L226-Y262 HydrophobicContact CD2-CD1 3.57Å; L226-Y262 HydrophobicContact CD2-CE1 4.4Å; L226-Y262 HydrophobicContact CD2-CG 4.25Å
227	L	93.2	Very high	91	Very high	63 Å²	63	52.6 Å²	52.6	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-59.3	-30.6	176.9	-64.1	176.8	0	0	0	112.6	M218 K219 T229 I230 R231	M218-L227 WeakPolarHBondContact O-CD1 3.3Å; K219-L227 PolarHBondContact O-N 3.12Å; L227-T229 VanDerWaalsContact C-N 3.33Å; L227-T229 PolarHBondContact O-N 2.96Å; L227-I230 HydrophobicContact CD2-CD1 4.36Å; L227-I230 PolarHBondContact O-N 3.35Å; L227-R231 VanDerWaalsContact O-CG 3.31Å; L227-R231 WeakPolarHBondContact O-CG 3.5Å; L227-R231 PolarHBondContact O-N 2.95Å
228	D	93.8	Very high	90.8	Very high	54 Å²	54	54.3 Å²	54.3	29%	0.289	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-30.9	173.9	-68.6	-20	0	0	0	113.1	L226 R231 Y232 Y256	L226-D228 PolarHBondContact O-N 2.88Å; D228-R231 IonicContact OD1-CZ 3.31Å; D228-R231 IonicContact OD1-NH1 2.72Å; D228-R231 PolarHBondContact OD1-NH1 3.15Å; D228-Y232 WeakPolarHBondContact O-CB 3.37Å; D228-Y232 PolarHBondContact O-N 3.24Å; D228-Y232 VanDerWaalsContact O-N 3.1Å; D228-Y256 HydrophobicContact CB-CD2 3.89Å; D228-Y256 HydrophobicContact CB-CE2 4Å; D228-Y256 WeakPolarHBondContact O-CE2 3.5Å
229	T	95.4	Very high	90.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.1	-41.9	172.8	-69.3	0	0	0	0	110.5	V225 L226 L227 Y232 F233 A255 Y256 E257 L334	V225-T229 HydrophobicContact CG1-CG2 4Å; L226-T229 WeakPolarHBondContact O-CA 3.42Å; L226-T229 VanDerWaalsContact O-CB 3.31Å; L226-T229 WeakPolarHBondContact O-CB 3.47Å; L226-T229 PolarHBondContact O-N 3.01Å; L227-T229 VanDerWaalsContact C-N 3.33Å; L227-T229 PolarHBondContact O-N 2.96Å; T229-Y232 WeakPolarHBondContact O-CB 3.28Å; T229-Y232 PolarHBondContact O-N 3.25Å; T229-F233 HydrophobicContact CG2-CD1 4.4Å; T229-F233 HydrophobicContact CG2-CD2 3.97Å; T229-F233 HydrophobicContact CG2-CE1 3.89Å; T229-F233 HydrophobicContact CG2-CE2 3.39Å; T229-F233 HydrophobicContact CG2-CG 4.45Å; T229-F233 HydrophobicContact CG2-CZ 3.36Å; T229-F233 VanDerWaalsContact O-CG 3.27Å; T229-F233 WeakPolarHBondContact O-CG 3.43Å; T229-F233 PolarHBondContact O-N 3.05Å; T229-A255 HydrophobicContact CG2-CB 3.69Å; T229-Y256 WeakPolarHBondContact OG1-CB 3.39Å; T229-Y256 PolarHBondContact OG1-N 2.89Å; T229-E257 WeakPolarHBondContact CB-OE2 3.27Å; T229-E257 WeakPolarHBondContact CG2-OE2 3.35Å; T229-E257 PolarHBondContact OG1-OE2 3.31Å; T229-L334 HydrophobicContact CG2-CD2 4.16Å
230	I	94.4	Very high	90.3	Very high	33 Å²	33	51.3 Å²	51.3	17%	0.169	26%	0.258	C	S	.	.	H	α-helix	trans	-66	-45	177.7	-65.9	161.7	0	0	0	110.7	V225 L226 L227 Y232 F233 C234 E337	V225-I230 HydrophobicContact CG1-CD1 4.15Å; V225-I230 HydrophobicContact CG1-CG1 3.98Å; L226-I230 PolarHBondContact O-N 3.03Å; L227-I230 HydrophobicContact CD2-CD1 4.36Å; L227-I230 PolarHBondContact O-N 3.35Å; I230-Y232 VanDerWaalsContact C-N 3.28Å; I230-Y232 PolarHBondContact O-N 2.91Å; I230-F233 PolarHBondContact O-N 2.93Å; I230-F233 VanDerWaalsContact O-N 3.09Å; I230-C234 PolarHBondContact O-N 3.17Å; I230-C234 PolarHBondContact O-SG 3.06Å; I230-C234 VanDerWaalsContact O-SG 3.41Å; I230-E337 WeakPolarHBondContact CD1-OE2 3.08Å
231	R	93.9	Very high	89.7	Confident	142 Å²	142	49.2 Å²	49.2	54%	0.536	25%	0.253	S	S	.	.	H	α-helix	trans	-53.7	-44.5	171.6	-72.9	166.9	176.9	149.8	-1.6	112.1	L227 D228 G235	L227-R231 VanDerWaalsContact O-CG 3.31Å; L227-R231 WeakPolarHBondContact O-CG 3.5Å; L227-R231 PolarHBondContact O-N 2.95Å; D228-R231 IonicContact OD1-CZ 3.31Å; D228-R231 IonicContact OD1-NH1 2.72Å; D228-R231 PolarHBondContact OD1-NH1 3.15Å; R231-G235 PolarHBondContact O-N 3.36Å
232	Y	94.3	Very high	89.6	Confident	53 Å²	53	52.8 Å²	52.8	21%	0.208	26%	0.263	C	S	.	.	H	α-helix	trans	-65.5	-41.2	176	173.5	-98.4	0	0	0	112.6	D228 T229 I230 A236 V251 T254	D228-Y232 WeakPolarHBondContact O-CB 3.37Å; D228-Y232 PolarHBondContact O-N 3.24Å; D228-Y232 VanDerWaalsContact O-N 3.1Å; T229-Y232 WeakPolarHBondContact O-CB 3.28Å; T229-Y232 PolarHBondContact O-N 3.25Å; I230-Y232 VanDerWaalsContact C-N 3.28Å; I230-Y232 PolarHBondContact O-N 2.91Å; Y232-A236 WeakPolarHBondContact O-CB 3.22Å; Y232-A236 PolarHBondContact O-N 3.48Å; Y232-V251 HydrophobicContact CE1-CG1 4.06Å; Y232-T254 HydrophobicContact CE1-CG2 3.97Å; Y232-T254 HydrophobicContact CE2-CG2 4.16Å
233	F	94.6	Very high	89.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-51.9	175.5	-67.8	-18.9	0	0	0	111.7	T229 I230 G235 A236 F237 V251 A255 L334 M338	T229-F233 HydrophobicContact CG2-CD1 4.4Å; T229-F233 HydrophobicContact CG2-CD2 3.97Å; T229-F233 HydrophobicContact CG2-CE1 3.89Å; T229-F233 HydrophobicContact CG2-CE2 3.39Å; T229-F233 HydrophobicContact CG2-CG 4.45Å; T229-F233 HydrophobicContact CG2-CZ 3.36Å; T229-F233 VanDerWaalsContact O-CG 3.27Å; T229-F233 WeakPolarHBondContact O-CG 3.43Å; T229-F233 PolarHBondContact O-N 3.05Å; I230-F233 PolarHBondContact O-N 2.93Å; I230-F233 VanDerWaalsContact O-N 3.09Å; F233-G235 VanDerWaalsContact C-N 3.34Å; F233-G235 PolarHBondContact O-N 2.9Å; F233-A236 PolarHBondContact O-N 3.48Å; F233-A236 VanDerWaalsContact O-N 3.12Å; F233-F237 HydrophobicContact CB-CD2 4.28Å; F233-F237 HydrophobicContact CB-CE2 3.91Å; F233-F237 WeakPolarHBondContact O-CD2 3.46Å; F233-F237 WeakPolarHBondContact O-CG 3.34Å; F233-F237 PolarHBondContact O-N 2.86Å; F233-V251 HydrophobicContact CD1-CG1 3.57Å; F233-V251 HydrophobicContact CE1-CG1 3.93Å; F233-A255 HydrophobicContact CE1-CB 4.38Å; F233-A255 HydrophobicContact CZ-CB 4.1Å; F233-L334 WeakPolarHBondContact CE2-O 3.44Å; F233-M338 HydrophobicContact CD1-CG 4Å; F233-M338 HydrophobicContact CD2-CB 4.39Å; F233-M338 HydrophobicContact CD2-CG 3.44Å; F233-M338 VanDerWaalsContact CD2-CG 3.44Å; F233-M338 HydrophobicContact CE1-CG 3.92Å; F233-M338 HydrophobicContact CE1-SD 4.07Å; F233-M338 HydrophobicContact CE2-CB 4.49Å; F233-M338 HydrophobicContact CE2-CG 3.34Å; F233-M338 HydrophobicContact CE2-SD 4.25Å; F233-M338 HydrophobicContact CG-CG 3.78Å; F233-M338 HydrophobicContact CZ-CG 3.58Å; F233-M338 HydrophobicContact CZ-SD 3.89Å
234	C	91.8	Very high	90.3	Very high	13 Å²	13	44.3 Å²	44.3	9%	0.088	22%	0.224	C	C	.	.	H	α-helix	trans	-56	-47	176.2	-63.8	0	0	0	0	111.5	I230 A236 F237 M238 V345	I230-C234 PolarHBondContact O-N 3.17Å; I230-C234 PolarHBondContact O-SG 3.06Å; I230-C234 VanDerWaalsContact O-SG 3.41Å; C234-A236 VanDerWaalsContact C-N 3.33Å; C234-A236 PolarHBondContact O-N 2.69Å; C234-F237 PolarHBondContact O-N 2.73Å; C234-M238 HydrophobicContact CB-CE 4.31Å; C234-M238 WeakPolarHBondContact O-CG 3.4Å; C234-M238 PolarHBondContact O-N 2.85Å; C234-V345 HydrophobicContact CB-CG2 3.92Å
235	G	90.9	Very high	90.5	Very high	33 Å²	33	41.9 Å²	41.9	34%	0.34	21%	0.21	S	C	.	.	H	α-helix	trans	-60.2	-38.2	176.2	0	0	0	0	0	114	R231 F233 R239	R231-G235 PolarHBondContact O-N 3.36Å; F233-G235 VanDerWaalsContact C-N 3.34Å; F233-G235 PolarHBondContact O-N 2.9Å; G235-R239 PolarHBondContact O-N 3.38Å
236	A	91.3	Very high	90.5	Very high	19 Å²	19	44.1 Å²	44.1	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-69.4	-38.3	175.4	0	0	0	0	0	112.5	Y232 F233 C234 S240 M243 V251	Y232-A236 WeakPolarHBondContact O-CB 3.22Å; Y232-A236 PolarHBondContact O-N 3.48Å; F233-A236 PolarHBondContact O-N 3.48Å; F233-A236 VanDerWaalsContact O-N 3.12Å; C234-A236 VanDerWaalsContact C-N 3.33Å; C234-A236 PolarHBondContact O-N 2.69Å; A236-S240 PolarHBondContact O-N 3Å; A236-M243 HydrophobicContact CB-CE 4.18Å; A236-M243 WeakPolarHBondContact O-CE 3.44Å; A236-V251 HydrophobicContact CB-CG1 4.15Å; A236-V251 HydrophobicContact CB-CG2 3.91Å
237	F	89.8	Confident	90.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-74.7	-39.2	-179.7	-65.7	-49.1	0	0	0	113.2	F233 C234 R239 S240 P241 M243 M338 L342 V345 T365	F233-F237 HydrophobicContact CB-CD2 4.28Å; F233-F237 HydrophobicContact CB-CE2 3.91Å; F233-F237 WeakPolarHBondContact O-CD2 3.46Å; F233-F237 WeakPolarHBondContact O-CG 3.34Å; F233-F237 PolarHBondContact O-N 2.86Å; C234-F237 PolarHBondContact O-N 2.73Å; F237-R239 VanDerWaalsContact C-N 3.33Å; F237-R239 PolarHBondContact O-N 3.42Å; F237-S240 CarbonylContact O-C 3.27Å; F237-S240 VanDerWaalsContact O-C 3.27Å; F237-S240 PolarHBondContact O-N 3.14Å; F237-P241 WeakPolarHBondContact O-CA 3.42Å; F237-M243 HydrophobicContact CD1-CE 3.54Å; F237-M243 HydrophobicContact CD1-SD 3.93Å; F237-M243 HydrophobicContact CE1-CE 3.95Å; F237-M243 HydrophobicContact CE1-SD 3.78Å; F237-M243 HydrophobicContact CG-CE 4.49Å; F237-M338 HydrophobicContact CE1-CE 4.39Å; F237-M338 HydrophobicContact CE2-CB 4.05Å; F237-M338 HydrophobicContact CE2-CG 4.29Å; F237-M338 WeakPolarHBondContact CE2-O 3.37Å; F237-M338 HydrophobicContact CZ-CB 3.91Å; F237-M338 HydrophobicContact CZ-CE 3.72Å; F237-M338 HydrophobicContact CZ-CG 4.12Å; F237-L342 HydrophobicContact CB-CD2 3.99Å; F237-L342 HydrophobicContact CD1-CD1 4.4Å; F237-L342 HydrophobicContact CD1-CD2 3.54Å; F237-L342 HydrophobicContact CD1-CG 3.93Å; F237-L342 HydrophobicContact CD2-CD2 4.02Å; F237-L342 HydrophobicContact CD2-CG 3.72Å; F237-L342 HydrophobicContact CE1-CD1 3.97Å; F237-L342 HydrophobicContact CE1-CD2 3.96Å; F237-L342 HydrophobicContact CE1-CG 3.94Å; F237-L342 HydrophobicContact CE2-CD1 4.18Å; F237-L342 HydrophobicContact CE2-CD2 4.39Å; F237-L342 HydrophobicContact CE2-CG 3.73Å; F237-L342 HydrophobicContact CG-CD2 3.58Å; F237-L342 HydrophobicContact CG-CG 3.84Å; F237-L342 HydrophobicContact CZ-CD1 3.84Å; F237-L342 HydrophobicContact CZ-CD2 4.36Å; F237-L342 HydrophobicContact CZ-CG 3.85Å; F237-V345 HydrophobicContact CB-CG2 4.43Å; F237-T365 HydrophobicContact CD1-CG2 4.27Å; F237-T365 HydrophobicContact CE1-CG2 4.09Å
238	M	86.4	Confident	90.5	Very high	91 Å²	91	45.4 Å²	45.4	45%	0.448	22%	0.223	S	C	.	.	H	α-helix	trans	-58.7	-43.1	173.1	-74	-175.6	-73.7	0	0	111.8	C234 V345 L938	C234-M238 HydrophobicContact CB-CE 4.31Å; C234-M238 WeakPolarHBondContact O-CG 3.4Å; C234-M238 PolarHBondContact O-N 2.85Å; M238-V345 HydrophobicContact CG-CB 4.38Å; M238-V345 HydrophobicContact CG-CG1 3.65Å; M238-V345 HydrophobicContact CG-CG2 3.79Å; M238-L938 HydrophobicContact CE-CD1 4.09Å; M238-L938 HydrophobicContact CE-CD2 4.32Å
239	R	85.3	Confident	90.5	Very high	136 Å²	136	43 Å²	43	51%	0.513	21%	0.21	S	C	.	.	H	α-helix	trans	-73.1	-26.1	178.5	-174.2	168.5	-176.7	158.6	-5.7	114.1	G235 F237 D924 D927	G235-R239 PolarHBondContact O-N 3.38Å; F237-R239 VanDerWaalsContact C-N 3.33Å; F237-R239 PolarHBondContact O-N 3.42Å; R239-D924 IonicContact CZ-OD2 2.84Å; R239-D924 IonicContact NE-OD2 3.26Å; R239-D924 PolarHBondContact NE-OD2 3.05Å; R239-D924 VanDerWaalsContact NH2-CG 3.27Å; R239-D924 IonicContact NH2-OD1 2.64Å; R239-D924 PolarHBondContact NH2-OD1 3.46Å; R239-D924 IonicContact NH2-OD2 2.84Å; R239-D924 PolarHBondContact NH2-OD2 3.03Å; R239-D927 IonicContact CZ-OD2 3.09Å; R239-D927 VanDerWaalsContact NH1-CG 3.27Å; R239-D927 IonicContact NH1-OD2 2.72Å; R239-D927 PolarHBondContact NH1-OD2 3.11Å; R239-D927 IonicContact NH2-OD2 2.64Å; R239-D927 PolarHBondContact NH2-OD2 3.1Å
240	S	84.3	Confident	90.4	Very high	16 Å²	16	46.3 Å²	46.3	11%	0.112	23%	0.225	C	C	.	.			trans	-140.2	72.7	-173.5	172.6	0	0	0	0	110.7	A236 F237 Y242 M243 R247	A236-S240 PolarHBondContact O-N 3Å; F237-S240 CarbonylContact O-C 3.27Å; F237-S240 VanDerWaalsContact O-C 3.27Å; F237-S240 PolarHBondContact O-N 3.14Å; S240-Y242 VanDerWaalsContact C-N 3.27Å; S240-Y242 CarbonylContact O-C 3.57Å; S240-Y242 PolarHBondContact O-N 3.42Å; S240-Y242 PolarHBondContact OG-O 3.08Å; S240-Y242 VanDerWaalsContact OG-O 3.06Å; S240-M243 VanDerWaalsContact O-CG 3.27Å; S240-M243 WeakPolarHBondContact O-CG 3.42Å; S240-R247 VanDerWaalsContact OG-CD 3.25Å; S240-R247 WeakPolarHBondContact OG-CD 3.25Å; S240-R247 PolarHBondContact OG-NH1 3.37Å
241	P	77.3	Confident	90.4	Very high	42 Å²	42	45 Å²	45	27%	0.273	22%	0.219	S	C	.	.	S	Bend	trans	-60.6	-35.2	-172.3	21.4	-33.6	0	0	0	113.6	F237 P360 H362 T365	F237-P241 WeakPolarHBondContact O-CA 3.42Å; P241-P360 HydrophobicContact CB-CB 3.39Å; P241-P360 HydrophobicContact CG-CB 3.93Å; P241-H362 VanDerWaalsContact CB-CE1 3.48Å; P241-H362 WeakPolarHBondContact CB-CE1 3.45Å; P241-H362 PolarHBondContact O-ND1 3.44Å; P241-T365 PolarHBondContact O-OG1 3.14Å
242	Y	86.3	Confident	90.6	Very high	101 Å²	101	38.3 Å²	38.3	40%	0.396	19%	0.193	S	C	.	.	S	Bend	trans	-91	121.9	166.7	-178	-99.6	0	0	0	110.8	S240 A364 T365	S240-Y242 VanDerWaalsContact C-N 3.27Å; S240-Y242 CarbonylContact O-C 3.57Å; S240-Y242 PolarHBondContact O-N 3.42Å; S240-Y242 PolarHBondContact OG-O 3.08Å; S240-Y242 VanDerWaalsContact OG-O 3.06Å; Y242-A364 HydrophobicContact CD2-CB 4.12Å; Y242-A364 HydrophobicContact CE2-CB 3.84Å; Y242-T365 WeakPolarHBondContact CA-OG1 3.45Å
243	M	89.7	Confident	90.6	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.015	18%	0.183	C	C	.	.			trans	-129	122.1	169.9	-56.4	-166.1	-179.5	0	0	111.4	A236 F237 S240 R247 I248 V251 T365 N368	A236-M243 HydrophobicContact CB-CE 4.18Å; A236-M243 WeakPolarHBondContact O-CE 3.44Å; F237-M243 HydrophobicContact CD1-CE 3.54Å; F237-M243 HydrophobicContact CD1-SD 3.93Å; F237-M243 HydrophobicContact CE1-CE 3.95Å; F237-M243 HydrophobicContact CE1-SD 3.78Å; F237-M243 HydrophobicContact CG-CE 4.49Å; S240-M243 VanDerWaalsContact O-CG 3.27Å; S240-M243 WeakPolarHBondContact O-CG 3.42Å; M243-R247 HydrophobicContact CB-CB 4.15Å; M243-R247 HydrophobicContact CB-CG 4.25Å; M243-R247 HydrophobicContact CG-CB 4.49Å; M243-R247 HydrophobicContact CG-CG 4.04Å; M243-R247 HydrophobicContact SD-CG 3.91Å; M243-I248 HydrophobicContact CB-CD1 4.18Å; M243-I248 HydrophobicContact CB-CG1 3.59Å; M243-I248 HydrophobicContact SD-CG1 4.26Å; M243-V251 HydrophobicContact CE-CG2 3.97Å; M243-V251 HydrophobicContact SD-CG2 3.92Å; M243-T365 HydrophobicContact CB-CG2 3.91Å; M243-T365 HydrophobicContact CG-CG2 4.12Å; M243-T365 PolarHBondContact N-OG1 3.08Å; M243-N368 PolarHBondContact O-ND2 3.44Å
244	A	91.1	Very high	90.7	Very high	42 Å²	42	36.2 Å²	36.2	35%	0.347	19%	0.186	S	C	.	.			trans	-71.6	156.9	163.1	0	0	0	0	0	111	P246 R247 I248	A244-P246 VanDerWaalsContact C-N 3.32Å; A244-P246 WeakPolarHBondContact O-CD 3.34Å; A244-R247 PolarHBondContact O-N 3.45Å; A244-I248 PolarHBondContact O-N 3.49Å
245	M	92	Very high	90.9	Very high	9 Å²	9	35.6 Å²	35.6	4%	0.044	18%	0.182	C	C	.	.	H	α-helix	trans	-41.4	-44.3	-176.6	-172	62.1	70.2	0	0	115.4	R247 I248 I249 N368 H371 L372 M375	M245-R247 VanDerWaalsContact C-N 3.35Å; M245-R247 PolarHBondContact O-N 2.91Å; M245-I248 PolarHBondContact O-N 3.33Å; M245-I249 HydrophobicContact CG-CD1 4.09Å; M245-I249 WeakPolarHBondContact O-CG1 3.41Å; M245-I249 PolarHBondContact O-N 3.25Å; M245-I249 HydrophobicContact SD-CD1 4.43Å; M245-N368 HydrophobicContact CE-CB 4.28Å; M245-N368 WeakPolarHBondContact CE-O 3.09Å; M245-H371 HydrophobicContact CE-CB 4.17Å; M245-L372 HydrophobicContact CE-CB 4.27Å; M245-L372 HydrophobicContact SD-CB 3.81Å; M245-L372 HydrophobicContact SD-CD1 3.81Å; M245-L372 HydrophobicContact SD-CD2 4.37Å; M245-L372 HydrophobicContact SD-CG 4.18Å; M245-M375 HydrophobicContact CE-SD 3.62Å; M245-M375 HydrophobicContact CG-CE 4.09Å; M245-M375 HydrophobicContact CG-SD 4.29Å; M245-M375 HydrophobicContact SD-CE 4.2Å; M245-M375 HydrophobicContact SD-SD 3.98Å
246	P	91.5	Very high	91.1	Very high	47 Å²	47	36.5 Å²	36.5	31%	0.305	18%	0.175	S	C	.	.	H	α-helix	trans	-69.9	-26.7	-180	-17.9	32.9	0	0	0	114.6	A244 K250 F285	A244-P246 VanDerWaalsContact C-N 3.32Å; A244-P246 WeakPolarHBondContact O-CD 3.34Å; P246-K250 PolarHBondContact O-N 3.05Å; P246-F285 HydrophobicContact CB-CD2 4.3Å; P246-F285 HydrophobicContact CB-CE1 4.25Å; P246-F285 HydrophobicContact CB-CE2 3.44Å; P246-F285 VanDerWaalsContact CB-CE2 3.44Å; P246-F285 HydrophobicContact CB-CZ 3.42Å; P246-F285 VanDerWaalsContact CB-CZ 3.42Å; P246-F285 HydrophobicContact CG-CD2 4.49Å; P246-F285 HydrophobicContact CG-CE2 3.83Å; P246-F285 HydrophobicContact CG-CZ 4.31Å
247	R	91.4	Very high	91.2	Very high	120 Å²	120	36 Å²	36	45%	0.453	17%	0.17	S	C	.	.	H	α-helix	trans	-75.4	-37.5	175.1	-172.8	177.8	-79.1	176.8	-3.6	110.3	S240 M243 A244 M245 K250 V251	S240-R247 VanDerWaalsContact OG-CD 3.25Å; S240-R247 WeakPolarHBondContact OG-CD 3.25Å; S240-R247 PolarHBondContact OG-NH1 3.37Å; M243-R247 HydrophobicContact CB-CB 4.15Å; M243-R247 HydrophobicContact CB-CG 4.25Å; M243-R247 HydrophobicContact CG-CB 4.49Å; M243-R247 HydrophobicContact CG-CG 4.04Å; M243-R247 HydrophobicContact SD-CG 3.91Å; A244-R247 PolarHBondContact O-N 3.45Å; M245-R247 VanDerWaalsContact C-N 3.35Å; M245-R247 PolarHBondContact O-N 2.91Å; R247-K250 WeakPolarHBondContact O-CB 3.4Å; R247-K250 PolarHBondContact O-N 2.94Å; R247-K250 VanDerWaalsContact O-N 3.15Å; R247-V251 WeakPolarHBondContact O-CG2 3.12Å; R247-V251 PolarHBondContact O-N 3.49Å
248	I	94.2	Very high	91.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-44.7	171.5	-63.2	172.9	0	0	0	110.5	M243 A244 M245 K250 V251 L252 M338 T365 N368 L372	M243-I248 HydrophobicContact CB-CD1 4.18Å; M243-I248 HydrophobicContact CB-CG1 3.59Å; M243-I248 HydrophobicContact SD-CG1 4.26Å; A244-I248 PolarHBondContact O-N 3.49Å; M245-I248 PolarHBondContact O-N 3.33Å; I248-K250 VanDerWaalsContact C-N 3.33Å; I248-K250 PolarHBondContact O-N 3.45Å; I248-V251 PolarHBondContact O-N 3.46Å; I248-V251 VanDerWaalsContact O-N 3.16Å; I248-L252 WeakPolarHBondContact O-CB 3.35Å; I248-L252 PolarHBondContact O-N 3Å; I248-M338 HydrophobicContact CG2-CE 3.66Å; I248-T365 HydrophobicContact CD1-CG2 4.29Å; I248-N368 HydrophobicContact CD1-CB 3.28Å; I248-L372 HydrophobicContact CG2-CD2 3.85Å
249	I	95.1	Very high	91.8	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-62.7	-36.6	173.8	-65.2	167.8	0	0	0	111.5	M245 S253 R303 I306 Y307 L310 L372	M245-I249 HydrophobicContact CG-CD1 4.09Å; M245-I249 WeakPolarHBondContact O-CG1 3.41Å; M245-I249 PolarHBondContact O-N 3.25Å; M245-I249 HydrophobicContact SD-CD1 4.43Å; I249-S253 VanDerWaalsContact O-CB 3.29Å; I249-S253 WeakPolarHBondContact O-CB 3.25Å; I249-S253 PolarHBondContact O-N 3.12Å; I249-S253 PolarHBondContact O-OG 3.3Å; I249-R303 HydrophobicContact CG2-CG 4.13Å; I249-I306 HydrophobicContact CG2-CG2 4.01Å; I249-Y307 HydrophobicContact CD1-CE1 4.01Å; I249-Y307 HydrophobicContact CG2-CE2 3.9Å; I249-L310 HydrophobicContact CD1-CD1 4.18Å; I249-L372 HydrophobicContact CD1-CD1 4.02Å; I249-L372 HydrophobicContact CG1-CD1 3.89Å; I249-L372 HydrophobicContact CG1-CD2 3.91Å
250	K	93.5	Very high	92.1	Very high	70 Å²	70	28 Å²	28	30%	0.304	14%	0.141	S	C	.	.	H	α-helix	trans	-60.2	-43.4	171.8	-179.6	-179.2	178.3	-178.5	0	111.5	P246 R247 I248 T254 D925	P246-K250 PolarHBondContact O-N 3.05Å; R247-K250 WeakPolarHBondContact O-CB 3.4Å; R247-K250 PolarHBondContact O-N 2.94Å; R247-K250 VanDerWaalsContact O-N 3.15Å; I248-K250 VanDerWaalsContact C-N 3.33Å; I248-K250 PolarHBondContact O-N 3.45Å; K250-T254 PolarHBondContact O-OG1 2.9Å; K250-D925 IonicContact NZ-OD1 3.12Å; K250-D925 PolarHBondContact NZ-OD1 2.93Å
251	V	94.8	Very high	92.4	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-67.8	-55.2	178.4	173.5	0	0	0	0	111.1	Y232 F233 A236 M243 R247 I248 S253 T254 M338	Y232-V251 HydrophobicContact CE1-CG1 4.06Å; F233-V251 HydrophobicContact CD1-CG1 3.57Å; F233-V251 HydrophobicContact CE1-CG1 3.93Å; A236-V251 HydrophobicContact CB-CG1 4.15Å; A236-V251 HydrophobicContact CB-CG2 3.91Å; M243-V251 HydrophobicContact CE-CG2 3.97Å; M243-V251 HydrophobicContact SD-CG2 3.92Å; R247-V251 WeakPolarHBondContact O-CG2 3.12Å; R247-V251 PolarHBondContact O-N 3.49Å; I248-V251 PolarHBondContact O-N 3.46Å; I248-V251 VanDerWaalsContact O-N 3.16Å; V251-S253 VanDerWaalsContact C-N 3.27Å; V251-S253 PolarHBondContact O-N 2.88Å; V251-T254 WeakPolarHBondContact O-CB 3.26Å; V251-T254 PolarHBondContact O-N 3.23Å; V251-M338 HydrophobicContact CB-CE 4.15Å; V251-M338 HydrophobicContact CG1-CE 3.86Å
252	L	96.7	Very high	93	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-52.8	-43	178.5	175	61.9	0	0	0	112.4	I248 T254 A255 F258 I306 L334 I335 M338 L372	I248-L252 WeakPolarHBondContact O-CB 3.35Å; I248-L252 PolarHBondContact O-N 3Å; L252-T254 PolarHBondContact O-N 3.1Å; L252-T254 VanDerWaalsContact O-N 3.1Å; L252-A255 PolarHBondContact O-N 2.83Å; L252-F258 WeakPolarHBondContact O-CE2 3.21Å; L252-I306 HydrophobicContact CD2-CD1 4.37Å; L252-L334 HydrophobicContact CD1-CB 3.53Å; L252-L334 HydrophobicContact CD1-CD1 4.19Å; L252-I335 HydrophobicContact CD1-CG1 4.12Å; L252-I335 HydrophobicContact CD2-CD1 3.91Å; L252-I335 HydrophobicContact CD2-CG1 3.89Å; L252-M338 HydrophobicContact CB-CE 4.31Å; L252-M338 HydrophobicContact CB-SD 3.84Å; L252-M338 HydrophobicContact CD1-SD 3.97Å; L252-M338 HydrophobicContact CG-SD 4.46Å; L252-L372 HydrophobicContact CD2-CD2 3.79Å
253	S	95.8	Very high	93.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18	179	-58.3	0	0	0	0	113.9	I249 V251 S299 R303	I249-S253 VanDerWaalsContact O-CB 3.29Å; I249-S253 WeakPolarHBondContact O-CB 3.25Å; I249-S253 PolarHBondContact O-N 3.12Å; I249-S253 PolarHBondContact O-OG 3.3Å; V251-S253 VanDerWaalsContact C-N 3.27Å; V251-S253 PolarHBondContact O-N 2.88Å; S253-S299 VanDerWaalsContact O-CA 3.29Å; S253-S299 WeakPolarHBondContact O-CA 3.39Å; S253-R303 WeakPolarHBondContact OG-CA 3.44Å; S253-R303 VanDerWaalsContact OG-CB 3.29Å; S253-R303 WeakPolarHBondContact OG-CB 3.35Å; S253-R303 WeakPolarHBondContact OG-CG 3.37Å; S253-R303 PolarHBondContact OG-N 3.03Å
254	T	95.3	Very high	93	Very high	10 Å²	10	42.8 Å²	42.8	6%	0.061	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	3.1	-173.4	-46.7	0	0	0	0	112.7	Y232 K250 V251 L252 Y298 S299	Y232-T254 HydrophobicContact CE1-CG2 3.97Å; Y232-T254 HydrophobicContact CE2-CG2 4.16Å; K250-T254 PolarHBondContact O-OG1 2.9Å; V251-T254 WeakPolarHBondContact O-CB 3.26Å; V251-T254 PolarHBondContact O-N 3.23Å; L252-T254 PolarHBondContact O-N 3.1Å; L252-T254 VanDerWaalsContact O-N 3.1Å; T254-Y298 PolarHBondContact O-OH 3.11Å; T254-S299 PolarHBondContact OG1-OG 3.39Å
255	A	96	Very high	92.7	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.			trans	-53.8	141.2	172.5	0	0	0	0	0	112.5	T229 F233 L252 E257 F258 L334	T229-A255 HydrophobicContact CG2-CB 3.69Å; F233-A255 HydrophobicContact CE1-CB 4.38Å; F233-A255 HydrophobicContact CZ-CB 4.1Å; L252-A255 PolarHBondContact O-N 2.83Å; A255-E257 PolarHBondContact O-N 3.21Å; A255-F258 HydrophobicContact CB-CD2 4.15Å; A255-F258 HydrophobicContact CB-CE2 4.4Å; A255-F258 WeakPolarHBondContact O-CB 3.24Å; A255-F258 PolarHBondContact O-N 2.74Å; A255-L334 HydrophobicContact CB-CD1 4.07Å; A255-L334 HydrophobicContact CB-CD2 4.21Å
256	Y	95	Very high	92.5	Very high	51 Å²	51	47.7 Å²	47.7	20%	0.2	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-69.4	-19.7	-178.8	-68.4	-83	0	0	0	113	D228 T229 F258 N259 Y262	D228-Y256 HydrophobicContact CB-CD2 3.89Å; D228-Y256 HydrophobicContact CB-CE2 4Å; D228-Y256 WeakPolarHBondContact O-CE2 3.5Å; T229-Y256 WeakPolarHBondContact OG1-CB 3.39Å; T229-Y256 PolarHBondContact OG1-N 2.89Å; Y256-F258 PolarHBondContact O-N 3.44Å; Y256-F258 VanDerWaalsContact O-N 3.17Å; Y256-N259 HydrophobicContact CD1-CB 4.41Å; Y256-N259 VanDerWaalsContact O-CB 3.29Å; Y256-N259 WeakPolarHBondContact O-CB 3.38Å; Y256-N259 PolarHBondContact O-N 3.31Å; Y256-Y262 AromaticContact CD1-CD2 3.68Å; Y256-Y262 HydrophobicContact CD1-CD2 3.68Å; Y256-Y262 HydrophobicContact CD1-CE1 4.22Å; Y256-Y262 AromaticContact CD1-CE2 3.32Å; Y256-Y262 HydrophobicContact CD1-CE2 3.32Å; Y256-Y262 HydrophobicContact CD1-CG 4.29Å; Y256-Y262 AromaticContact CD1-CZ 3.61Å; Y256-Y262 AromaticContact CE1-CE2 3.77Å; Y256-Y262 HydrophobicContact CE1-CE2 3.77Å; Y256-Y262 AromaticContact CE1-CZ 3.91Å; Y256-Y262 HydrophobicContact CG-CD2 4.38Å; Y256-Y262 HydrophobicContact CG-CE1 4.46Å; Y256-Y262 HydrophobicContact CG-CE2 4.26Å
257	E	94	Very high	92.3	Very high	9 Å²	9	49.9 Å²	49.9	4%	0.042	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-52.8	-28.9	163.8	-77.9	78	177.2	0	0	112.8	V225 L226 T229 A255 N263 I266 R333 L334	V225-E257 VanDerWaalsContact CA-OE1 3.24Å; V225-E257 WeakPolarHBondContact CA-OE1 3.21Å; V225-E257 WeakPolarHBondContact CG1-OE1 3.5Å; L226-E257 HydrophobicContact CD1-CG 3.94Å; L226-E257 VanDerWaalsContact CD1-OE1 3.26Å; L226-E257 WeakPolarHBondContact CD1-OE1 3.4Å; L226-E257 PolarHBondContact N-OE1 2.85Å; T229-E257 WeakPolarHBondContact CB-OE2 3.27Å; T229-E257 WeakPolarHBondContact CG2-OE2 3.35Å; T229-E257 PolarHBondContact OG1-OE2 3.31Å; A255-E257 PolarHBondContact O-N 3.21Å; E257-N263 WeakPolarHBondContact O-CB 3.39Å; E257-N263 PolarHBondContact O-ND2 2.85Å; E257-I266 WeakPolarHBondContact O-CD1 3.41Å; E257-R333 IonicContact OE1-NH2 3.59Å; E257-R333 PolarHBondContact OE1-NH2 3.15Å; E257-L334 HydrophobicContact CB-CD1 4.28Å; E257-L334 HydrophobicContact CB-CD2 4.46Å; E257-L334 HydrophobicContact CG-CD2 4.02Å
258	F	95.1	Very high	92	Very high	3 Å²	3	47.3 Å²	47.3	1%	0.013	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-91.5	-0.8	177.3	-56.7	-33.6	0	0	0	113.8	L252 A255 Y256 I266 Y298 A302 I327 L334	L252-F258 WeakPolarHBondContact O-CE2 3.21Å; A255-F258 HydrophobicContact CB-CD2 4.15Å; A255-F258 HydrophobicContact CB-CE2 4.4Å; A255-F258 WeakPolarHBondContact O-CB 3.24Å; A255-F258 PolarHBondContact O-N 2.74Å; Y256-F258 PolarHBondContact O-N 3.44Å; Y256-F258 VanDerWaalsContact O-N 3.17Å; F258-I266 VanDerWaalsContact CA-CD1 3.46Å; F258-I266 HydrophobicContact CB-CD1 4.38Å; F258-I266 HydrophobicContact CD1-CD1 4.13Å; F258-Y298 VanDerWaalsContact C-CD2 3.45Å; F258-Y298 HydrophobicContact CB-CD2 4.1Å; F258-Y298 HydrophobicContact CB-CE2 4.42Å; F258-Y298 WeakPolarHBondContact O-CD2 3.49Å; F258-A302 HydrophobicContact CB-CB 4.3Å; F258-A302 HydrophobicContact CD2-CB 4.1Å; F258-A302 HydrophobicContact CG-CB 4.31Å; F258-I327 HydrophobicContact CD1-CG1 3.9Å; F258-I327 HydrophobicContact CE1-CB 4.11Å; F258-I327 HydrophobicContact CE1-CG1 3.9Å; F258-I327 HydrophobicContact CE1-CG2 4.03Å; F258-I327 HydrophobicContact CE2-CG2 4.22Å; F258-I327 HydrophobicContact CG-CG1 4.49Å; F258-I327 HydrophobicContact CZ-CB 4.37Å; F258-I327 HydrophobicContact CZ-CG1 4.46Å; F258-I327 HydrophobicContact CZ-CG2 3.78Å; F258-L334 HydrophobicContact CE1-CD1 3.99Å; F258-L334 HydrophobicContact CE2-CD1 3.81Å; F258-L334 HydrophobicContact CZ-CD1 3.41Å; F258-L334 VanDerWaalsContact CZ-CD1 3.41Å
259	N	93.5	Very high	91.8	Very high	14 Å²	14	49.5 Å²	49.5	8%	0.075	24%	0.239	C	C	.	.			trans	-97.5	120.3	-176.4	-172.1	-24.3	0	0	0	111.4	Y256 N261 Y262 N263 Y298	Y256-N259 HydrophobicContact CD1-CB 4.41Å; Y256-N259 VanDerWaalsContact O-CB 3.29Å; Y256-N259 WeakPolarHBondContact O-CB 3.38Å; Y256-N259 PolarHBondContact O-N 3.31Å; N259-N261 PolarHBondContact O-N 2.92Å; N259-N261 WeakPolarHBondContact OD1-CB 3.2Å; N259-N261 PolarHBondContact OD1-N 3.47Å; N259-N261 VanDerWaalsContact OD1-N 3.1Å; N259-Y262 HydrophobicContact CB-CD2 4.19Å; N259-Y262 PolarHBondContact O-N 2.76Å; N259-N263 PolarHBondContact O-N 3.14Å; N259-Y298 HydrophobicContact CB-CD1 4.2Å; N259-Y298 HydrophobicContact CB-CD2 4.01Å; N259-Y298 HydrophobicContact CB-CE1 3.95Å; N259-Y298 HydrophobicContact CB-CE2 3.74Å; N259-Y298 HydrophobicContact CB-CG 4.24Å; N259-Y298 WeakPolarHBondContact ND2-CE1 3Å
260	P	91.5	Very high	91.4	Very high	41 Å²	41	54.8 Å²	54.8	27%	0.266	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-14.6	-177.3	29.1	-38.8	0	0	0	114.6	N263	P260-N263 WeakPolarHBondContact CA-O 3.47Å
261	N	90.5	Very high	91.3	Very high	141 Å²	141	53.2 Å²	53.2	75%	0.754	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-32.2	175	-66	-13.2	0	0	0	112.3	N259	N259-N261 PolarHBondContact O-N 2.92Å; N259-N261 WeakPolarHBondContact OD1-CB 3.2Å; N259-N261 PolarHBondContact OD1-N 3.47Å; N259-N261 VanDerWaalsContact OD1-N 3.1Å
262	Y	89.3	Confident	91	Very high	110 Å²	110	53.2 Å²	53.2	43%	0.431	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-43.5	-179.6	-70.4	-105.7	0	0	0	110.4	L226 Y256 N259	L226-Y262 HydrophobicContact CD2-CD1 3.57Å; L226-Y262 HydrophobicContact CD2-CE1 4.4Å; L226-Y262 HydrophobicContact CD2-CG 4.25Å; Y256-Y262 AromaticContact CD1-CD2 3.68Å; Y256-Y262 HydrophobicContact CD1-CD2 3.68Å; Y256-Y262 HydrophobicContact CD1-CE1 4.22Å; Y256-Y262 AromaticContact CD1-CE2 3.32Å; Y256-Y262 HydrophobicContact CD1-CE2 3.32Å; Y256-Y262 HydrophobicContact CD1-CG 4.29Å; Y256-Y262 AromaticContact CD1-CZ 3.61Å; Y256-Y262 AromaticContact CE1-CE2 3.77Å; Y256-Y262 HydrophobicContact CE1-CE2 3.77Å; Y256-Y262 AromaticContact CE1-CZ 3.91Å; Y256-Y262 HydrophobicContact CG-CD2 4.38Å; Y256-Y262 HydrophobicContact CG-CE1 4.46Å; Y256-Y262 HydrophobicContact CG-CE2 4.26Å; N259-Y262 HydrophobicContact CB-CD2 4.19Å; N259-Y262 PolarHBondContact O-N 2.76Å
263	N	88.9	Confident	90.6	Very high	26 Å²	26	55.1 Å²	55.1	14%	0.139	28%	0.281	C	S	.	.			trans	-112.3	106.3	-176.7	-175.6	1.6	0	0	0	112.4	E257 N259 P260 E265 I266 Y326	E257-N263 WeakPolarHBondContact O-CB 3.39Å; E257-N263 PolarHBondContact O-ND2 2.85Å; N259-N263 PolarHBondContact O-N 3.14Å; P260-N263 WeakPolarHBondContact CA-O 3.47Å; N263-E265 PolarHBondContact O-N 3.12Å; N263-E265 WeakPolarHBondContact OD1-CB 3.23Å; N263-E265 PolarHBondContact OD1-N 3.42Å; N263-I266 PolarHBondContact O-N 2.9Å; N263-Y326 PolarHBondContact ND2-OH 3.11Å
264	K	87.1	Confident	90.3	Very high	197 Å²	197	60 Å²	60	86%	0.857	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-11.3	-179.6	-64.7	175.9	-175.5	168.5	0	114.3	I266	K264-I266 PolarHBondContact O-N 3.05Å
265	E	85.2	Confident	90.1	Very high	129 Å²	129	61.4 Å²	61.4	60%	0.603	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-19	175.3	-57.8	-167.6	126.7	0	0	112	N263 Y326	N263-E265 PolarHBondContact O-N 3.12Å; N263-E265 WeakPolarHBondContact OD1-CB 3.23Å; N263-E265 PolarHBondContact OD1-N 3.42Å; E265-Y326 HydrophobicContact CB-CE2 3.78Å; E265-Y326 HydrophobicContact CG-CE2 4.49Å; E265-Y326 WeakPolarHBondContact OE2-CE2 3.06Å; E265-Y326 VanDerWaalsContact OE2-CZ 3.27Å; E265-Y326 PolarHBondContact OE2-OH 3.22Å
266	I	88.5	Confident	89.8	Confident	25 Å²	25	61.4 Å²	61.4	13%	0.128	32%	0.317	C	S	.	.			trans	-95	122.6	-178	-67.6	-179.1	0	0	0	111.3	E257 F258 N263 K264 Y326	E257-I266 WeakPolarHBondContact O-CD1 3.41Å; F258-I266 VanDerWaalsContact CA-CD1 3.46Å; F258-I266 HydrophobicContact CB-CD1 4.38Å; F258-I266 HydrophobicContact CD1-CD1 4.13Å; N263-I266 PolarHBondContact O-N 2.9Å; K264-I266 PolarHBondContact O-N 3.05Å; I266-Y326 HydrophobicContact CD1-CD1 3.86Å; I266-Y326 HydrophobicContact CD1-CE1 3.76Å; I266-Y326 HydrophobicContact CG1-CD1 3.87Å; I266-Y326 HydrophobicContact CG1-CE1 3.83Å
267	I	86.8	Confident	89.6	Confident	92 Å²	92	61.2 Å²	61.2	47%	0.472	32%	0.322	S	S	.	.			trans	-106.6	121.8	-173.1	-51.6	177.5	0	0	0	109.7	R269 K301	I267-R269 HydrophobicContact CB-CG 4.49Å; I267-R269 HydrophobicContact CG2-CG 3.73Å; I267-K301 PolarHBondContact O-NZ 3.41Å
268	C	85.3	Confident	89.4	Confident	66 Å²	66	64 Å²	64	45%	0.446	34%	0.341	S	S	.	.			trans	-86.7	108.3	161.8	-68.9	0	0	0	0	108.6	D272	C268-D272 WeakPolarHBondContact CA-OD2 3.21Å
269	R	89.1	Confident	89.2	Confident	46 Å²	46	64.1 Å²	64.1	17%	0.174	34%	0.342	C	S	.	.			trans	-93.9	147.8	-179.1	-57.8	-175.6	-163.6	75.6	5.1	110.1	I267 S271 D272 T319 D323	I267-R269 HydrophobicContact CB-CG 4.49Å; I267-R269 HydrophobicContact CG2-CG 3.73Å; R269-S271 PolarHBondContact O-N 2.81Å; R269-S271 VanDerWaalsContact O-N 3.16Å; R269-D272 PolarHBondContact N-OD2 2.84Å; R269-D272 IonicContact NH1-OD1 2.75Å; R269-D272 VanDerWaalsContact O-CB 3.23Å; R269-D272 WeakPolarHBondContact O-CB 3.34Å; R269-D272 VanDerWaalsContact O-CG 3.26Å; R269-D272 PolarHBondContact O-N 2.83Å; R269-T319 PolarHBondContact NH1-O 2.92Å; R269-D323 IonicContact CZ-OD1 3.67Å; R269-D323 IonicContact CZ-OD2 3.87Å; R269-D323 VanDerWaalsContact NH1-CG 3.27Å; R269-D323 IonicContact NH1-OD1 3.83Å; R269-D323 PolarHBondContact NH1-OD1 3Å; R269-D323 VanDerWaalsContact NH1-OD1 3.09Å; R269-D323 IonicContact NH1-OD2 2.72Å; R269-D323 PolarHBondContact NH1-OD2 3.24Å; R269-D323 IonicContact NH2-OD1 3.46Å; R269-D323 PolarHBondContact NH2-OD1 3.47Å; R269-D323 IonicContact NH2-OD2 2.79Å
270	P	88.1	Confident	89	Confident	113 Å²	113	63.8 Å²	63.8	73%	0.734	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.7	169.5	-25.6	35.5	0	0	0	113.6	D272 N273	P270-D272 VanDerWaalsContact C-N 3.34Å; P270-N273 VanDerWaalsContact O-CB 3.27Å; P270-N273 WeakPolarHBondContact O-CB 3.26Å; P270-N273 PolarHBondContact O-N 2.83Å; P270-N273 PolarHBondContact O-ND2 3.49Å
271	S	90.1	Very high	88.8	Confident	37 Å²	37	67.3 Å²	67.3	26%	0.259	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-20.7	177.3	73.9	0	0	0	0	113.5	R269 N273 T274 E275	R269-S271 PolarHBondContact O-N 2.81Å; R269-S271 VanDerWaalsContact O-N 3.16Å; S271-N273 PolarHBondContact O-N 2.96Å; S271-N273 VanDerWaalsContact O-N 3.15Å; S271-T274 PolarHBondContact O-N 2.95Å; S271-T274 PolarHBondContact O-OG1 2.84Å; S271-E275 WeakPolarHBondContact CB-OE1 3.32Å; S271-E275 WeakPolarHBondContact O-CB 3.24Å; S271-E275 WeakPolarHBondContact O-CG 3.32Å; S271-E275 PolarHBondContact O-N 3.41Å; S271-E275 PolarHBondContact OG-OE1 3.04Å
272	D	90	Very high	88.7	Confident	7 Å²	7	66.4 Å²	66.4	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-53.8	-35.9	168.2	-57.1	-18.4	0	0	0	109.9	C268 R269 P270 T274 E275 L276 K301 W598	C268-D272 WeakPolarHBondContact CA-OD2 3.21Å; R269-D272 PolarHBondContact N-OD2 2.84Å; R269-D272 IonicContact NH1-OD1 2.75Å; R269-D272 VanDerWaalsContact O-CB 3.23Å; R269-D272 WeakPolarHBondContact O-CB 3.34Å; R269-D272 VanDerWaalsContact O-CG 3.26Å; R269-D272 PolarHBondContact O-N 2.83Å; P270-D272 VanDerWaalsContact C-N 3.34Å; D272-T274 PolarHBondContact O-N 2.71Å; D272-T274 VanDerWaalsContact O-N 3.12Å; D272-E275 PolarHBondContact O-N 3.31Å; D272-L276 VanDerWaalsContact O-CB 3.3Å; D272-L276 WeakPolarHBondContact O-CB 3.24Å; D272-L276 PolarHBondContact O-N 2.83Å; D272-K301 VanDerWaalsContact CG-NZ 3.26Å; D272-K301 IonicContact OD1-NZ 3.07Å; D272-K301 PolarHBondContact OD1-NZ 2.64Å; D272-K301 IonicContact OD2-NZ 2.97Å; D272-K301 PolarHBondContact OD2-NZ 2.85Å; D272-W598 VanDerWaalsContact O-CH2 3.25Å; D272-W598 WeakPolarHBondContact O-CH2 3.37Å; D272-W598 WeakPolarHBondContact O-CZ3 3.24Å
273	N	86.6	Confident	88.6	Confident	40 Å²	40	61.2 Å²	61.2	21%	0.214	33%	0.325	C	S	.	.	H	α-helix	trans	-60.8	-20.7	179	-68.4	-49.2	0	0	0	114.4	P270 S271 P596 W598	P270-N273 VanDerWaalsContact O-CB 3.27Å; P270-N273 WeakPolarHBondContact O-CB 3.26Å; P270-N273 PolarHBondContact O-N 2.83Å; P270-N273 PolarHBondContact O-ND2 3.49Å; S271-N273 PolarHBondContact O-N 2.96Å; S271-N273 VanDerWaalsContact O-N 3.15Å; N273-P596 WeakPolarHBondContact OD1-CA 3.32Å; N273-P596 WeakPolarHBondContact OD1-CB 3.34Å; N273-W598 VanDerWaalsContact CA-CZ3 3.48Å; N273-W598 HydrophobicContact CB-CZ3 4.48Å
274	T	90.4	Very high	88.3	Confident	103 Å²	103	62.6 Å²	62.6	63%	0.632	34%	0.335	S	S	*	.	H	α-helix	trans	-108	-32.4	177.6	43	0	0	0	0	112.9	S271 D272 P278	S271-T274 PolarHBondContact O-N 2.95Å; S271-T274 PolarHBondContact O-OG1 2.84Å; D272-T274 PolarHBondContact O-N 2.71Å; D272-T274 VanDerWaalsContact O-N 3.12Å; T274-P278 VanDerWaalsContact O-CD 3.3Å; T274-P278 WeakPolarHBondContact O-CD 3.13Å
275	E	90.9	Very high	87.8	Confident	39 Å²	39	56.6 Å²	56.6	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-84.5	-34.7	-174.7	-65.8	170.9	-125.5	0	0	113.2	S271 D272 P278 T319 L320	S271-E275 WeakPolarHBondContact CB-OE1 3.32Å; S271-E275 WeakPolarHBondContact O-CB 3.24Å; S271-E275 WeakPolarHBondContact O-CG 3.32Å; S271-E275 PolarHBondContact O-N 3.41Å; S271-E275 PolarHBondContact OG-OE1 3.04Å; D272-E275 PolarHBondContact O-N 3.31Å; E275-P278 WeakPolarHBondContact O-CD 3.29Å; E275-P278 WeakPolarHBondContact O-CG 3.3Å; E275-T319 PolarHBondContact OE1-OG1 3.3Å; E275-T319 WeakPolarHBondContact OE2-CB 3.25Å; E275-T319 PolarHBondContact OE2-OG1 2.86Å; E275-L320 HydrophobicContact CB-CD1 3.64Å; E275-L320 HydrophobicContact CB-CG 4.22Å
276	L	90.1	Very high	87.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-74.4	-39.3	-174.5	-158.8	75.5	0	0	0	114.7	D272 L279 I280 K301 A304 L320 W598	D272-L276 VanDerWaalsContact O-CB 3.3Å; D272-L276 WeakPolarHBondContact O-CB 3.24Å; D272-L276 PolarHBondContact O-N 2.83Å; L276-L279 HydrophobicContact CD1-CD2 4.39Å; L276-L279 PolarHBondContact O-N 3.16Å; L276-I280 HydrophobicContact CD2-CD1 3.91Å; L276-I280 HydrophobicContact CG-CD1 3.81Å; L276-I280 HydrophobicContact CG-CG1 4.25Å; L276-I280 WeakPolarHBondContact O-CG1 3.43Å; L276-I280 PolarHBondContact O-N 3.24Å; L276-K301 HydrophobicContact CD1-CG 4.22Å; L276-K301 HydrophobicContact CD2-CB 4.06Å; L276-K301 HydrophobicContact CD2-CG 4.46Å; L276-A304 HydrophobicContact CD1-CB 4.05Å; L276-L320 HydrophobicContact CD1-CD1 4.42Å; L276-W598 HydrophobicContact CB-CH2 3.72Å; L276-W598 HydrophobicContact CB-CZ2 4.22Å; L276-W598 HydrophobicContact CB-CZ3 4.1Å; L276-W598 HydrophobicContact CD2-CH2 3.85Å; L276-W598 HydrophobicContact CD2-CZ2 3.43Å; L276-W598 VanDerWaalsContact CD2-CZ2 3.43Å; L276-W598 HydrophobicContact CG-CH2 4.43Å; L276-W598 HydrophobicContact CG-CZ2 4.44Å
277	P	89.5	Confident	86.7	Confident	48 Å²	48	53 Å²	53	31%	0.312	30%	0.296	S	S	.	.	H	α-helix	trans	-58.3	-48.4	179.7	-25.5	36.2	0	0	0	115.1	L279 I280 M281 W598	P277-L279 VanDerWaalsContact C-N 3.31Å; P277-L279 PolarHBondContact O-N 3.15Å; P277-I280 PolarHBondContact O-N 2.62Å; P277-M281 WeakPolarHBondContact O-CG 3.49Å; P277-M281 PolarHBondContact O-N 2.83Å; P277-M281 VanDerWaalsContact O-N 3.14Å; P277-W598 HydrophobicContact CG-CE3 3.57Å; P277-W598 HydrophobicContact CG-CZ3 3.62Å
278	P	90.4	Very high	85.8	Confident	66 Å²	66	54.1 Å²	54.1	43%	0.429	30%	0.302	S	S	.	.	H	α-helix	trans	-65.8	-34.6	177.5	26.2	-33.6	0	0	0	111.9	T274 E275 M281 Q282	T274-P278 VanDerWaalsContact O-CD 3.3Å; T274-P278 WeakPolarHBondContact O-CD 3.13Å; E275-P278 WeakPolarHBondContact O-CD 3.29Å; E275-P278 WeakPolarHBondContact O-CG 3.3Å; P278-M281 PolarHBondContact O-N 2.58Å; P278-Q282 WeakPolarHBondContact O-CG 3.38Å; P278-Q282 PolarHBondContact O-N 2.69Å
279	L	90.9	Very high	84.6	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.037	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-45.8	175.2	-176.9	64.3	0	0	0	111.9	L276 P277 M281 Q282 I283 L305 A308 L313 L315 L320	L276-L279 HydrophobicContact CD1-CD2 4.39Å; L276-L279 PolarHBondContact O-N 3.16Å; P277-L279 VanDerWaalsContact C-N 3.31Å; P277-L279 PolarHBondContact O-N 3.15Å; L279-M281 VanDerWaalsContact C-N 3.25Å; L279-M281 PolarHBondContact O-N 3.49Å; L279-Q282 PolarHBondContact O-N 3.09Å; L279-Q282 VanDerWaalsContact O-N 3.11Å; L279-I283 HydrophobicContact CD1-CD1 4.46Å; L279-I283 HydrophobicContact CG-CD1 4.09Å; L279-I283 WeakPolarHBondContact O-CD1 3.15Å; L279-I283 WeakPolarHBondContact O-CG1 3.25Å; L279-I283 PolarHBondContact O-N 2.83Å; L279-L305 HydrophobicContact CD2-CD2 4.24Å; L279-A308 HydrophobicContact CD1-CB 3.9Å; L279-A308 HydrophobicContact CD2-CB 4.08Å; L279-A308 HydrophobicContact CG-CB 4.34Å; L279-L313 HydrophobicContact CD1-CD1 3.77Å; L279-L315 HydrophobicContact CD1-CD2 3.67Å; L279-L315 HydrophobicContact CD2-CD2 3.64Å; L279-L315 HydrophobicContact CG-CD2 4.27Å; L279-L320 HydrophobicContact CD2-CD1 4.21Å
280	I	89.3	Confident	83.2	Confident	6 Å²	6	64.3 Å²	64.3	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-61.7	-34.4	176.3	-69.6	171	0	0	0	111.3	L276 P277 F286 I293 V300 A304	L276-I280 HydrophobicContact CD2-CD1 3.91Å; L276-I280 HydrophobicContact CG-CD1 3.81Å; L276-I280 HydrophobicContact CG-CG1 4.25Å; L276-I280 WeakPolarHBondContact O-CG1 3.43Å; L276-I280 PolarHBondContact O-N 3.24Å; P277-I280 PolarHBondContact O-N 2.62Å; I280-F286 HydrophobicContact CG2-CB 3.88Å; I280-F286 HydrophobicContact CG2-CD1 4.34Å; I280-F286 HydrophobicContact CG2-CD2 4.01Å; I280-F286 HydrophobicContact CG2-CG 3.84Å; I280-I293 HydrophobicContact CG2-CD1 3.75Å; I280-V300 HydrophobicContact CD1-CG1 3.96Å; I280-A304 HydrophobicContact CD1-CB 4.41Å; I280-A304 HydrophobicContact CG1-CB 3.82Å
281	M	87.6	Confident	81.9	Confident	116 Å²	116	64.6 Å²	64.6	57%	0.571	33%	0.329	S	S	*	.	H	α-helix	trans	-75.8	-19.1	176	-62.7	-68	91.8	0	0	114	P277 P278 L279 T287	P277-M281 WeakPolarHBondContact O-CG 3.49Å; P277-M281 PolarHBondContact O-N 2.83Å; P277-M281 VanDerWaalsContact O-N 3.14Å; P278-M281 PolarHBondContact O-N 2.58Å; L279-M281 VanDerWaalsContact C-N 3.25Å; L279-M281 PolarHBondContact O-N 3.49Å; M281-T287 HydrophobicContact CE-CG2 4.41Å; M281-T287 WeakPolarHBondContact O-CG2 3.46Å
282	Q	88	Confident	80.6	Confident	121 Å²	121	66.4 Å²	66.4	57%	0.565	35%	0.347	S	S	*	.	H	α-helix	trans	-81.8	-29.4	173.8	-72.8	170	3.6	0	0	112.7	P278 L279 P284	P278-Q282 WeakPolarHBondContact O-CG 3.38Å; P278-Q282 PolarHBondContact O-N 2.69Å; L279-Q282 PolarHBondContact O-N 3.09Å; L279-Q282 VanDerWaalsContact O-N 3.11Å; Q282-P284 WeakPolarHBondContact O-CD 3.49Å
283	I	88.4	Confident	79.9	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.005	36%	0.363	C	S	.	.	S	Bend	trans	-76.2	117.5	-176.9	-69.2	159	0	0	0	110.1	L279 F285 F286 A304 Y307 A308 L313	L279-I283 HydrophobicContact CD1-CD1 4.46Å; L279-I283 HydrophobicContact CG-CD1 4.09Å; L279-I283 WeakPolarHBondContact O-CD1 3.15Å; L279-I283 WeakPolarHBondContact O-CG1 3.25Å; L279-I283 PolarHBondContact O-N 2.83Å; I283-F285 VanDerWaalsContact C-N 3.26Å; I283-F285 HydrophobicContact CG2-CB 4.23Å; I283-F285 PolarHBondContact O-N 2.72Å; I283-F285 VanDerWaalsContact O-N 3.16Å; I283-F286 HydrophobicContact CB-CD2 3.91Å; I283-F286 HydrophobicContact CD1-CD2 4.38Å; I283-F286 HydrophobicContact CD1-CE2 4.26Å; I283-F286 HydrophobicContact CG2-CD2 3.61Å; I283-F286 HydrophobicContact CG2-CE2 4.05Å; I283-F286 PolarHBondContact O-N 3.47Å; I283-A304 HydrophobicContact CD1-CB 4.28Å; I283-A304 WeakPolarHBondContact CD1-O 3.16Å; I283-Y307 HydrophobicContact CG2-CD2 4.39Å; I283-Y307 HydrophobicContact CG2-CG 3.98Å; I283-A308 HydrophobicContact CD1-CB 4.42Å; I283-L313 HydrophobicContact CG1-CD1 4.04Å
284	P	82	Confident	79.4	Confident	55 Å²	55	69.4 Å²	69.4	36%	0.357	36%	0.364	S	S	.	.	H	α-helix	trans	-58.9	-34.2	-173.8	-26.2	35	0	0	0	114.2	Q282 F286 T287 I288	Q282-P284 WeakPolarHBondContact O-CD 3.49Å; P284-F286 VanDerWaalsContact C-N 3.29Å; P284-F286 PolarHBondContact O-N 2.93Å; P284-T287 PolarHBondContact O-N 3.45Å; P284-T287 VanDerWaalsContact O-N 3.13Å; P284-T287 PolarHBondContact O-OG1 3.03Å; P284-I288 HydrophobicContact CB-CD1 3.78Å; P284-I288 HydrophobicContact CB-CG1 4.42Å; P284-I288 WeakPolarHBondContact O-CB 3.36Å; P284-I288 WeakPolarHBondContact O-CD1 3.36Å; P284-I288 VanDerWaalsContact O-CG1 3.23Å; P284-I288 WeakPolarHBondContact O-CG1 3.48Å; P284-I288 PolarHBondContact O-N 3.16Å
285	F	76.6	Confident	78.9	Confident	71 Å²	71	65.5 Å²	65.5	31%	0.311	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-35.4	-177.9	-177.1	-103.8	0	0	0	113.6	P246 I283 F289 Y307	P246-F285 HydrophobicContact CB-CD2 4.3Å; P246-F285 HydrophobicContact CB-CE1 4.25Å; P246-F285 HydrophobicContact CB-CE2 3.44Å; P246-F285 VanDerWaalsContact CB-CE2 3.44Å; P246-F285 HydrophobicContact CB-CZ 3.42Å; P246-F285 VanDerWaalsContact CB-CZ 3.42Å; P246-F285 HydrophobicContact CG-CD2 4.49Å; P246-F285 HydrophobicContact CG-CE2 3.83Å; P246-F285 HydrophobicContact CG-CZ 4.31Å; I283-F285 VanDerWaalsContact C-N 3.26Å; I283-F285 HydrophobicContact CG2-CB 4.23Å; I283-F285 PolarHBondContact O-N 2.72Å; I283-F285 VanDerWaalsContact O-N 3.16Å; F285-F289 HydrophobicContact CD2-CE2 4.48Å; F285-F289 HydrophobicContact CE2-CD2 4.41Å; F285-F289 HydrophobicContact CE2-CE2 4.36Å; F285-Y307 HydrophobicContact CB-CE1 4.27Å; F285-Y307 HydrophobicContact CB-CE2 4.45Å; F285-Y307 HydrophobicContact CD1-CD2 4.41Å; F285-Y307 AromaticContact CD1-CE2 3.59Å; F285-Y307 HydrophobicContact CD1-CE2 3.59Å; F285-Y307 AromaticContact CD1-CZ 3.66Å; F285-Y307 HydrophobicContact CE1-CE2 4.2Å; F285-Y307 HydrophobicContact CG-CE1 4.32Å; F285-Y307 HydrophobicContact CG-CE2 4.17Å; F285-Y307 AromaticContact CG-CZ 3.86Å
286	F	78.2	Confident	78.7	Confident	22 Å²	22	64.8 Å²	64.8	10%	0.096	34%	0.343	C	S	.	.	H	α-helix	trans	-81.2	-21.8	178.3	-68	-72.7	0	0	0	113.3	I280 I283 P284 I293 R303 A304 Y307	I280-F286 HydrophobicContact CG2-CB 3.88Å; I280-F286 HydrophobicContact CG2-CD1 4.34Å; I280-F286 HydrophobicContact CG2-CD2 4.01Å; I280-F286 HydrophobicContact CG2-CG 3.84Å; I283-F286 HydrophobicContact CB-CD2 3.91Å; I283-F286 HydrophobicContact CD1-CD2 4.38Å; I283-F286 HydrophobicContact CD1-CE2 4.26Å; I283-F286 HydrophobicContact CG2-CD2 3.61Å; I283-F286 HydrophobicContact CG2-CE2 4.05Å; I283-F286 PolarHBondContact O-N 3.47Å; P284-F286 VanDerWaalsContact C-N 3.29Å; P284-F286 PolarHBondContact O-N 2.93Å; F286-I293 HydrophobicContact CD1-CG1 4.15Å; F286-I293 HydrophobicContact CE1-CG2 4.3Å; F286-R303 HydrophobicContact CZ-CB 4.31Å; F286-R303 HydrophobicContact CZ-CG 4.1Å; F286-A304 HydrophobicContact CE2-CB 4.28Å; F286-Y307 HydrophobicContact CE2-CD2 4.01Å; F286-Y307 HydrophobicContact CZ-CD2 4.34Å
287	T	73.2	Confident	78.6	Confident	57 Å²	57	67.4 Å²	67.4	35%	0.35	36%	0.36	S	S	.	.	H	α-helix	trans	-96.4	-41.5	-175	54.4	0	0	0	0	113.2	M281 P284 F289 K290	M281-T287 HydrophobicContact CE-CG2 4.41Å; M281-T287 WeakPolarHBondContact O-CG2 3.46Å; P284-T287 PolarHBondContact O-N 3.45Å; P284-T287 VanDerWaalsContact O-N 3.13Å; P284-T287 PolarHBondContact O-OG1 3.03Å; T287-F289 PolarHBondContact O-N 2.73Å; T287-K290 PolarHBondContact O-N 2.91Å
288	I	67	Low	78.7	Confident	116 Å²	116	66.5 Å²	66.5	60%	0.595	35%	0.351	S	S	*	.	H	α-helix	trans	-53.6	-49.2	-176.3	-72.9	165.8	0	0	0	111.9	P284	P284-I288 HydrophobicContact CB-CD1 3.78Å; P284-I288 HydrophobicContact CB-CG1 4.42Å; P284-I288 WeakPolarHBondContact O-CB 3.36Å; P284-I288 WeakPolarHBondContact O-CD1 3.36Å; P284-I288 VanDerWaalsContact O-CG1 3.23Å; P284-I288 WeakPolarHBondContact O-CG1 3.48Å; P284-I288 PolarHBondContact O-N 3.16Å
289	F	60.7	Low	78.9	Confident	129 Å²	129	63.4 Å²	63.4	57%	0.566	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.5	-170	-69	-71.6	0	0	0	115	F285 T287 K291	F285-F289 HydrophobicContact CD2-CE2 4.48Å; F285-F289 HydrophobicContact CE2-CD2 4.41Å; F285-F289 HydrophobicContact CE2-CE2 4.36Å; T287-F289 PolarHBondContact O-N 2.73Å; F289-K291 HydrophobicContact CB-CB 4.49Å; F289-K291 HydrophobicContact CB-CG 4.14Å; F289-K291 PolarHBondContact O-N 3.46Å
290	K	58.9	Low	78.9	Confident	197 Å²	197	63.2 Å²	63.2	86%	0.857	33%	0.329	S	S	*	.			trans	49.8	8.8	-170.9	-63.4	179.9	180	172.3	0	115.6	T287	T287-K290 PolarHBondContact O-N 2.91Å
291	K	60.8	Low	79.1	Confident	118 Å²	118	63.6 Å²	63.6	51%	0.513	33%	0.331	S	S	.	.			trans	-62.4	152.8	-177.8	-76.3	-161.9	175.7	-149	0	110.5	F289 I293 D923	F289-K291 HydrophobicContact CB-CB 4.49Å; F289-K291 HydrophobicContact CB-CG 4.14Å; F289-K291 PolarHBondContact O-N 3.46Å; K291-I293 PolarHBondContact O-N 3.27Å; K291-D923 IonicContact NZ-OD1 3.05Å; K291-D923 PolarHBondContact NZ-OD1 2.67Å
292	A	62.5	Low	79.5	Confident	76 Å²	76	58.2 Å²	58.2	63%	0.628	31%	0.305	S	S	*	.			trans	-59.9	140	175.8	0	0	0	0	0	110.1	V294	A292-V294 HydrophobicContact CB-CG2 3.8Å; A292-V294 PolarHBondContact O-N 2.98Å
293	I	75.2	Confident	79.8	Confident	71 Å²	71	53.1 Å²	53.1	36%	0.364	28%	0.28	S	S	.	.			trans	-78.9	83.2	173.5	-58.2	160.8	0	0	0	106.7	I280 F286 K291 V300	I280-I293 HydrophobicContact CG2-CD1 3.75Å; F286-I293 HydrophobicContact CD1-CG1 4.15Å; F286-I293 HydrophobicContact CE1-CG2 4.3Å; K291-I293 PolarHBondContact O-N 3.27Å; I293-V300 HydrophobicContact CG2-CB 4.26Å; I293-V300 HydrophobicContact CG2-CG1 3.48Å; I293-V300 VanDerWaalsContact CG2-CG1 3.48Å; I293-V300 HydrophobicContact CG2-CG2 3.73Å
294	V	76.1	Confident	80.1	Confident	39 Å²	39	53 Å²	53	24%	0.236	28%	0.28	C	S	.	.			trans	-84.9	141.8	-175.2	-179.2	0	0	0	0	111.4	A292 R303	A292-V294 HydrophobicContact CB-CG2 3.8Å; A292-V294 PolarHBondContact O-N 2.98Å; V294-R303 PolarHBondContact O-NH1 3.03Å; V294-R303 PolarHBondContact O-NH2 3.41Å; V294-R303 VanDerWaalsContact O-NH2 3.08Å
295	G	80.7	Confident	80.7	Confident	21 Å²	21	50.4 Å²	50.4	22%	0.216	26%	0.263	C	S	.	.	S	Bend	trans	119.1	157.1	177.7	0	0	0	0	0	112.9	V300 E928	G295-V300 WeakPolarHBondContact O-CG2 3.31Å; G295-E928 WeakPolarHBondContact CA-OE1 3.32Å; G295-E928 WeakPolarHBondContact CA-OE2 3.28Å
296	S	86.7	Confident	81.7	Confident	23 Å²	23	47 Å²	47	16%	0.161	25%	0.248	C	C	.	.			trans	-46.9	148.1	170.6	55.6	0	0	0	0	113.7	Y298 S299 V300 E928	S296-Y298 VanDerWaalsContact C-N 3.27Å; S296-Y298 PolarHBondContact O-N 3.5Å; S296-Y298 WeakPolarHBondContact OG-CE1 3.44Å; S296-S299 WeakPolarHBondContact O-CB 3.11Å; S296-S299 PolarHBondContact O-N 3.38Å; S296-V300 PolarHBondContact O-N 2.99Å; S296-E928 WeakPolarHBondContact CB-OE1 3.12Å; S296-E928 PolarHBondContact N-OE1 2.87Å; S296-E928 PolarHBondContact N-OE2 3.28Å; S296-E928 PolarHBondContact OG-OE1 2.89Å
297	P	88.3	Confident	82.5	Confident	55 Å²	55	46.7 Å²	46.7	36%	0.357	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-25.7	-169.8	24	-34.3	0	0	0	114.3	K301 P596	P297-K301 WeakPolarHBondContact O-CB 3.24Å; P297-K301 PolarHBondContact O-N 3.26Å; P297-P596 HydrophobicContact CB-CG 3.7Å; P297-P596 HydrophobicContact CG-CG 4.32Å
298	Y	91.8	Very high	83.6	Confident	30 Å²	30	44 Å²	44	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-72.3	-41.2	172.8	76.6	-93	0	0	0	111.2	T254 F258 N259 S296 V300 K301 A302	T254-Y298 PolarHBondContact O-OH 3.11Å; F258-Y298 VanDerWaalsContact C-CD2 3.45Å; F258-Y298 HydrophobicContact CB-CD2 4.1Å; F258-Y298 HydrophobicContact CB-CE2 4.42Å; F258-Y298 WeakPolarHBondContact O-CD2 3.49Å; N259-Y298 HydrophobicContact CB-CD1 4.2Å; N259-Y298 HydrophobicContact CB-CD2 4.01Å; N259-Y298 HydrophobicContact CB-CE1 3.95Å; N259-Y298 HydrophobicContact CB-CE2 3.74Å; N259-Y298 HydrophobicContact CB-CG 4.24Å; N259-Y298 WeakPolarHBondContact ND2-CE1 3Å; S296-Y298 VanDerWaalsContact C-N 3.27Å; S296-Y298 PolarHBondContact O-N 3.5Å; S296-Y298 WeakPolarHBondContact OG-CE1 3.44Å; Y298-V300 VanDerWaalsContact C-N 3.34Å; Y298-V300 PolarHBondContact O-N 3.05Å; Y298-K301 WeakPolarHBondContact O-CB 3.45Å; Y298-K301 PolarHBondContact O-N 3.12Å; Y298-A302 WeakPolarHBondContact O-CB 3.35Å; Y298-A302 PolarHBondContact O-N 2.94Å
299	S	93	Very high	85	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-41.4	174.8	172.6	0	0	0	0	111.5	S253 T254 S296 A302 R303	S253-S299 VanDerWaalsContact O-CA 3.29Å; S253-S299 WeakPolarHBondContact O-CA 3.39Å; T254-S299 PolarHBondContact OG1-OG 3.39Å; S296-S299 WeakPolarHBondContact O-CB 3.11Å; S296-S299 PolarHBondContact O-N 3.38Å; S299-A302 PolarHBondContact O-N 2.92Å; S299-R303 VanDerWaalsContact O-CB 3.22Å; S299-R303 WeakPolarHBondContact O-CB 3.32Å; S299-R303 PolarHBondContact O-N 3.31Å; S299-R303 PolarHBondContact OG-NH2 3.37Å
300	V	92.1	Very high	86.7	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-43.3	173.8	173.2	0	0	0	0	111.8	I280 I293 G295 S296 Y298 A304	I280-V300 HydrophobicContact CD1-CG1 3.96Å; I293-V300 HydrophobicContact CG2-CB 4.26Å; I293-V300 HydrophobicContact CG2-CG1 3.48Å; I293-V300 VanDerWaalsContact CG2-CG1 3.48Å; I293-V300 HydrophobicContact CG2-CG2 3.73Å; G295-V300 WeakPolarHBondContact O-CG2 3.31Å; S296-V300 PolarHBondContact O-N 2.99Å; Y298-V300 VanDerWaalsContact C-N 3.34Å; Y298-V300 PolarHBondContact O-N 3.05Å; V300-A304 WeakPolarHBondContact O-CB 3.43Å; V300-A304 PolarHBondContact O-N 3.13Å
301	K	93.8	Very high	88.3	Confident	15 Å²	15	27.2 Å²	27.2	7%	0.065	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-48.5	174.1	179.9	176.7	175.9	177.4	0	111.2	I267 D272 L276 P297 Y298 R303 A304 L305 D323	I267-K301 PolarHBondContact O-NZ 3.41Å; D272-K301 VanDerWaalsContact CG-NZ 3.26Å; D272-K301 IonicContact OD1-NZ 3.07Å; D272-K301 PolarHBondContact OD1-NZ 2.64Å; D272-K301 IonicContact OD2-NZ 2.97Å; D272-K301 PolarHBondContact OD2-NZ 2.85Å; L276-K301 HydrophobicContact CD1-CG 4.22Å; L276-K301 HydrophobicContact CD2-CB 4.06Å; L276-K301 HydrophobicContact CD2-CG 4.46Å; P297-K301 WeakPolarHBondContact O-CB 3.24Å; P297-K301 PolarHBondContact O-N 3.26Å; Y298-K301 WeakPolarHBondContact O-CB 3.45Å; Y298-K301 PolarHBondContact O-N 3.12Å; K301-R303 PolarHBondContact O-N 3.21Å; K301-A304 PolarHBondContact O-N 3.02Å; K301-L305 HydrophobicContact CG-CD1 3.92Å; K301-L305 VanDerWaalsContact O-CG 3.28Å; K301-L305 WeakPolarHBondContact O-CG 3.5Å; K301-L305 PolarHBondContact O-N 3.33Å; K301-D323 WeakPolarHBondContact CE-OD2 3.43Å; K301-D323 IonicContact NZ-OD2 2.7Å; K301-D323 PolarHBondContact NZ-OD2 3.22Å
302	A	95.4	Very high	89.9	Confident	3 Å²	3	24.8 Å²	24.8	3%	0.025	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-45.6	-179.8	0	0	0	0	0	112.1	F258 Y298 S299 A304 L305 I306 I327	F258-A302 HydrophobicContact CB-CB 4.3Å; F258-A302 HydrophobicContact CD2-CB 4.1Å; F258-A302 HydrophobicContact CG-CB 4.31Å; Y298-A302 WeakPolarHBondContact O-CB 3.35Å; Y298-A302 PolarHBondContact O-N 2.94Å; S299-A302 PolarHBondContact O-N 2.92Å; A302-A304 PolarHBondContact O-N 3.49Å; A302-L305 PolarHBondContact O-N 2.65Å; A302-L305 VanDerWaalsContact O-N 3.15Å; A302-I306 WeakPolarHBondContact O-CG1 3.35Å; A302-I306 PolarHBondContact O-N 3.46Å; A302-I327 HydrophobicContact CB-CD1 3.98Å
303	R	94.6	Very high	91.3	Very high	13 Å²	13	23.3 Å²	23.3	5%	0.049	12%	0.123	C	C	.	.	H	α-helix	trans	-59.3	-44.2	177.5	-156.9	179.4	-49.1	152.1	11.1	112.3	I249 S253 F286 V294 S299 K301 I306 Y307	I249-R303 HydrophobicContact CG2-CG 4.13Å; S253-R303 WeakPolarHBondContact OG-CA 3.44Å; S253-R303 VanDerWaalsContact OG-CB 3.29Å; S253-R303 WeakPolarHBondContact OG-CB 3.35Å; S253-R303 WeakPolarHBondContact OG-CG 3.37Å; S253-R303 PolarHBondContact OG-N 3.03Å; F286-R303 HydrophobicContact CZ-CB 4.31Å; F286-R303 HydrophobicContact CZ-CG 4.1Å; V294-R303 PolarHBondContact O-NH1 3.03Å; V294-R303 PolarHBondContact O-NH2 3.41Å; V294-R303 VanDerWaalsContact O-NH2 3.08Å; S299-R303 VanDerWaalsContact O-CB 3.22Å; S299-R303 WeakPolarHBondContact O-CB 3.32Å; S299-R303 PolarHBondContact O-N 3.31Å; S299-R303 PolarHBondContact OG-NH2 3.37Å; K301-R303 PolarHBondContact O-N 3.21Å; R303-I306 PolarHBondContact O-N 2.88Å; R303-Y307 HydrophobicContact CG-CD2 4.27Å; R303-Y307 HydrophobicContact CG-CE2 4Å; R303-Y307 VanDerWaalsContact O-CD2 3.23Å; R303-Y307 WeakPolarHBondContact O-CD2 3.44Å; R303-Y307 PolarHBondContact O-N 2.58Å
304	A	94	Very high	92.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.9	-39.5	175.7	0	0	0	0	0	112.4	L276 I280 I283 F286 V300 K301 A302 Y307 A308	L276-A304 HydrophobicContact CD1-CB 4.05Å; I280-A304 HydrophobicContact CD1-CB 4.41Å; I280-A304 HydrophobicContact CG1-CB 3.82Å; I283-A304 HydrophobicContact CD1-CB 4.28Å; I283-A304 WeakPolarHBondContact CD1-O 3.16Å; F286-A304 HydrophobicContact CE2-CB 4.28Å; V300-A304 WeakPolarHBondContact O-CB 3.43Å; V300-A304 PolarHBondContact O-N 3.13Å; K301-A304 PolarHBondContact O-N 3.02Å; A302-A304 PolarHBondContact O-N 3.49Å; A304-Y307 PolarHBondContact O-N 2.95Å; A304-A308 WeakPolarHBondContact O-CB 3.35Å; A304-A308 PolarHBondContact O-N 3.16Å
305	L	95.9	Very high	92.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.2	-31.8	177.6	-66.3	171.9	0	0	0	113	L279 K301 A302 H309 L315 L320 D323 R324 I327	L279-L305 HydrophobicContact CD2-CD2 4.24Å; K301-L305 HydrophobicContact CG-CD1 3.92Å; K301-L305 VanDerWaalsContact O-CG 3.28Å; K301-L305 WeakPolarHBondContact O-CG 3.5Å; K301-L305 PolarHBondContact O-N 3.33Å; A302-L305 PolarHBondContact O-N 2.65Å; A302-L305 VanDerWaalsContact O-N 3.15Å; L305-H309 PolarHBondContact O-N 2.92Å; L305-L315 HydrophobicContact CD2-CD1 3.77Å; L305-L320 HydrophobicContact CD2-CB 3.93Å; L305-L320 HydrophobicContact CD2-CD2 4.27Å; L305-L320 HydrophobicContact CD2-CG 4.47Å; L305-D323 HydrophobicContact CD1-CB 3.7Å; L305-R324 HydrophobicContact CB-CB 4.35Å; L305-R324 HydrophobicContact CD2-CB 4.29Å; L305-I327 HydrophobicContact CB-CD1 4.14Å; L305-I327 HydrophobicContact CD1-CD1 3.67Å
306	I	96.7	Very high	93.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-53.2	170.5	-70.9	165.3	0	0	0	110.1	I249 L252 A302 R303 A308 H309 L310 I327 I328 L376	I249-I306 HydrophobicContact CG2-CG2 4.01Å; L252-I306 HydrophobicContact CD2-CD1 4.37Å; A302-I306 WeakPolarHBondContact O-CG1 3.35Å; A302-I306 PolarHBondContact O-N 3.46Å; R303-I306 PolarHBondContact O-N 2.88Å; I306-A308 VanDerWaalsContact C-N 3.31Å; I306-A308 PolarHBondContact O-N 3.33Å; I306-H309 WeakPolarHBondContact O-CA 3.22Å; I306-H309 VanDerWaalsContact O-CB 3.25Å; I306-H309 WeakPolarHBondContact O-CB 3.4Å; I306-H309 PolarHBondContact O-N 3.27Å; I306-L310 HydrophobicContact CG2-CD1 4.21Å; I306-L310 HydrophobicContact CG2-CG 4.46Å; I306-L310 WeakPolarHBondContact O-CG 3.44Å; I306-L310 PolarHBondContact O-N 3.31Å; I306-I327 HydrophobicContact CD1-CG2 3.98Å; I306-I327 HydrophobicContact CG1-CG2 3.72Å; I306-I328 HydrophobicContact CG1-CD1 4.31Å; I306-L376 HydrophobicContact CG2-CD2 4.11Å
307	Y	95.6	Very high	93.5	Very high	15 Å²	15	32.5 Å²	32.5	6%	0.059	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-38.3	177.2	-76.8	-63.9	0	0	0	112.7	I249 I283 F285 F286 R303 A304 H309 L310 E311	I249-Y307 HydrophobicContact CD1-CE1 4.01Å; I249-Y307 HydrophobicContact CG2-CE2 3.9Å; I283-Y307 HydrophobicContact CG2-CD2 4.39Å; I283-Y307 HydrophobicContact CG2-CG 3.98Å; F285-Y307 HydrophobicContact CB-CE1 4.27Å; F285-Y307 HydrophobicContact CB-CE2 4.45Å; F285-Y307 HydrophobicContact CD1-CD2 4.41Å; F285-Y307 AromaticContact CD1-CE2 3.59Å; F285-Y307 HydrophobicContact CD1-CE2 3.59Å; F285-Y307 AromaticContact CD1-CZ 3.66Å; F285-Y307 HydrophobicContact CE1-CE2 4.2Å; F285-Y307 HydrophobicContact CG-CE1 4.32Å; F285-Y307 HydrophobicContact CG-CE2 4.17Å; F285-Y307 AromaticContact CG-CZ 3.86Å; F286-Y307 HydrophobicContact CE2-CD2 4.01Å; F286-Y307 HydrophobicContact CZ-CD2 4.34Å; R303-Y307 HydrophobicContact CG-CD2 4.27Å; R303-Y307 HydrophobicContact CG-CE2 4Å; R303-Y307 VanDerWaalsContact O-CD2 3.23Å; R303-Y307 WeakPolarHBondContact O-CD2 3.44Å; R303-Y307 PolarHBondContact O-N 2.58Å; A304-Y307 PolarHBondContact O-N 2.95Å; Y307-H309 PolarHBondContact O-N 3.35Å; Y307-L310 HydrophobicContact CD1-CD1 4.43Å; Y307-L310 PolarHBondContact O-N 3.49Å; Y307-E311 WeakPolarHBondContact O-CB 3.27Å; Y307-E311 WeakPolarHBondContact O-CG 3.37Å; Y307-E311 PolarHBondContact O-N 2.96Å
308	A	95.7	Very high	93.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66	-17.3	173.2	0	0	0	0	0	114.1	L279 I283 A304 I306 L313 L315 R324	L279-A308 HydrophobicContact CD1-CB 3.9Å; L279-A308 HydrophobicContact CD2-CB 4.08Å; L279-A308 HydrophobicContact CG-CB 4.34Å; I283-A308 HydrophobicContact CD1-CB 4.42Å; A304-A308 WeakPolarHBondContact O-CB 3.35Å; A304-A308 PolarHBondContact O-N 3.16Å; I306-A308 VanDerWaalsContact C-N 3.31Å; I306-A308 PolarHBondContact O-N 3.33Å; A308-L313 HydrophobicContact CB-CB 4.31Å; A308-L313 HydrophobicContact CB-CD1 4.19Å; A308-L313 PolarHBondContact O-N 3.16Å; A308-L315 HydrophobicContact CB-CD1 4.35Å; A308-L315 HydrophobicContact CB-CD2 4.47Å; A308-R324 PolarHBondContact O-NH1 3.45Å
309	H	96.7	Very high	93.5	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.028	19%	0.193	C	C	.	.	H	α-helix	trans	-80.7	-50.8	168.6	-175.7	72.4	0	0	0	111.3	L305 I306 Y307 E311 R312 R324 I328 L376 A379 Y745	L305-H309 PolarHBondContact O-N 2.92Å; I306-H309 WeakPolarHBondContact O-CA 3.22Å; I306-H309 VanDerWaalsContact O-CB 3.25Å; I306-H309 WeakPolarHBondContact O-CB 3.4Å; I306-H309 PolarHBondContact O-N 3.27Å; Y307-H309 PolarHBondContact O-N 3.35Å; H309-E311 VanDerWaalsContact C-N 3.3Å; H309-E311 PolarHBondContact O-N 2.75Å; H309-R312 WeakPolarHBondContact O-CA 3.3Å; H309-R312 PolarHBondContact O-N 2.8Å; H309-R324 HydrophobicContact CB-CG 4.19Å; H309-I328 HydrophobicContact CB-CD1 3.63Å; H309-I328 HydrophobicContact CB-CG1 3.94Å; H309-L376 PolarHBondContact NE2-O 2.79Å; H309-A379 WeakPolarHBondContact NE2-CB 3.06Å; H309-Y745 PolarHBondContact CE1-O 2.97Å
310	L	95.7	Very high	93.5	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-35.4	-177.6	-58.2	178.7	0	0	0	112.7	I249 I306 Y307 R312 M375 L376 T381	I249-L310 HydrophobicContact CD1-CD1 4.18Å; I306-L310 HydrophobicContact CG2-CD1 4.21Å; I306-L310 HydrophobicContact CG2-CG 4.46Å; I306-L310 WeakPolarHBondContact O-CG 3.44Å; I306-L310 PolarHBondContact O-N 3.31Å; Y307-L310 HydrophobicContact CD1-CD1 4.43Å; Y307-L310 PolarHBondContact O-N 3.49Å; L310-R312 VanDerWaalsContact C-N 3.29Å; L310-M375 HydrophobicContact CD1-CE 3.84Å; L310-M375 HydrophobicContact CD2-CB 4.12Å; L310-M375 WeakPolarHBondContact CD2-O 3.49Å; L310-L376 HydrophobicContact CD2-CD2 4.07Å; L310-L376 HydrophobicContact CD2-CG 4.48Å; L310-T381 HydrophobicContact CB-CG2 3.73Å
311	E	93	Very high	93.6	Very high	79 Å²	79	39 Å²	39	37%	0.369	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	3.8	174.2	-60.8	-72.4	-166.9	0	0	113.1	Y307 H309 L313 T381	Y307-E311 WeakPolarHBondContact O-CB 3.27Å; Y307-E311 WeakPolarHBondContact O-CG 3.37Å; Y307-E311 PolarHBondContact O-N 2.96Å; H309-E311 VanDerWaalsContact C-N 3.3Å; H309-E311 PolarHBondContact O-N 2.75Å; E311-L313 HydrophobicContact CB-CD2 4.27Å; E311-L313 HydrophobicContact CB-CG 4Å; E311-L313 PolarHBondContact O-N 3.02Å; E311-L313 VanDerWaalsContact O-N 3.16Å; E311-T381 HydrophobicContact CG-CG2 4.16Å
312	R	94.1	Very high	93.5	Very high	68 Å²	68	41.6 Å²	41.6	26%	0.257	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	30.7	179.6	-58.1	179	175.1	-179.3	-6.4	114.9	H309 L310 Q378 A379 L388	H309-R312 WeakPolarHBondContact O-CA 3.3Å; H309-R312 PolarHBondContact O-N 2.8Å; L310-R312 VanDerWaalsContact C-N 3.29Å; R312-Q378 PolarHBondContact NH2-O 3.22Å; R312-A379 HydrophobicContact CG-CB 4.14Å; R312-A379 WeakPolarHBondContact CG-O 3.19Å; R312-A379 PolarHBondContact NE-O 3.43Å; R312-L388 PolarHBondContact NH1-O 2.87Å; R312-L388 PolarHBondContact NH2-O 2.96Å
313	L	93.2	Very high	93.5	Very high	45 Å²	45	42.1 Å²	42.1	24%	0.236	22%	0.224	C	C	.	.			trans	-64.2	148.5	-178	-59.3	-178.2	0	0	0	112.2	L279 I283 A308 E311 R324	L279-L313 HydrophobicContact CD1-CD1 3.77Å; I283-L313 HydrophobicContact CG1-CD1 4.04Å; A308-L313 HydrophobicContact CB-CB 4.31Å; A308-L313 HydrophobicContact CB-CD1 4.19Å; A308-L313 PolarHBondContact O-N 3.16Å; E311-L313 HydrophobicContact CB-CD2 4.27Å; E311-L313 HydrophobicContact CB-CG 4Å; E311-L313 PolarHBondContact O-N 3.02Å; E311-L313 VanDerWaalsContact O-N 3.16Å; L313-R324 PolarHBondContact O-NH1 2.82Å
314	E	91.7	Very high	93.5	Very high	190 Å²	190	42.8 Å²	42.8	89%	0.888	23%	0.226	S	C	*	.			trans	-77.9	138.2	171.6	-62.7	-167.7	161	0	0	110.5
315	L	92.5	Very high	93.5	Very high	22 Å²	22	45 Å²	45	12%	0.115	24%	0.236	C	C	.	.			trans	-133	149.8	-179	-66.2	-180	0	0	0	109.8	L279 L305 A308 A317 L320 H321 R324	L279-L315 HydrophobicContact CD1-CD2 3.67Å; L279-L315 HydrophobicContact CD2-CD2 3.64Å; L279-L315 HydrophobicContact CG-CD2 4.27Å; L305-L315 HydrophobicContact CD2-CD1 3.77Å; A308-L315 HydrophobicContact CB-CD1 4.35Å; A308-L315 HydrophobicContact CB-CD2 4.47Å; L315-A317 PolarHBondContact O-N 3.46Å; L315-L320 HydrophobicContact CB-CB 4.47Å; L315-L320 HydrophobicContact CD1-CB 4.31Å; L315-H321 HydrophobicContact CB-CB 4.18Å; L315-R324 HydrophobicContact CD1-CB 4.07Å; L315-R324 HydrophobicContact CD1-CG 4.46Å
316	P	92.5	Very high	93.4	Very high	67 Å²	67	47 Å²	47	44%	0.435	24%	0.244	S	C	.	.			trans	-61.4	125.2	179.7	-19	31.1	0	0	0	111.3	N318 T319 H321	P316-N318 PolarHBondContact O-N 3.04Å; P316-N318 VanDerWaalsContact O-N 3.11Å; P316-T319 WeakPolarHBondContact CB-OG1 3.38Å; P316-T319 PolarHBondContact O-N 2.86Å; P316-H321 VanDerWaalsContact O-CB 3.26Å; P316-H321 WeakPolarHBondContact O-CB 3.41Å; P316-H321 PolarHBondContact O-N 3.17Å
317	A	87.7	Confident	93.3	Very high	67 Å²	67	47.5 Å²	47.5	55%	0.554	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-29.8	-165.1	0	0	0	0	0	114.6	L315 V322	L315-A317 PolarHBondContact O-N 3.46Å; A317-V322 WeakPolarHBondContact O-CG2 3.19Å
318	N	87.6	Confident	93.4	Very high	145 Å²	145	46.9 Å²	46.9	78%	0.775	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-4.3	-172.5	-61.5	-17.5	0	0	0	114.1	P316	P316-N318 PolarHBondContact O-N 3.04Å; P316-N318 VanDerWaalsContact O-N 3.11Å
319	T	92.2	Very high	93.3	Very high	25 Å²	25	50.8 Å²	50.8	15%	0.153	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	-100.4	-176.4	52.4	0	0	0	0	110.5	R269 E275 P316 H321 V322 D323	R269-T319 PolarHBondContact NH1-O 2.92Å; E275-T319 PolarHBondContact OE1-OG1 3.3Å; E275-T319 WeakPolarHBondContact OE2-CB 3.25Å; E275-T319 PolarHBondContact OE2-OG1 2.86Å; P316-T319 WeakPolarHBondContact CB-OG1 3.38Å; P316-T319 PolarHBondContact O-N 2.86Å; T319-H321 PolarHBondContact O-N 3.5Å; T319-V322 PolarHBondContact O-N 2.85Å; T319-V322 VanDerWaalsContact O-N 3.13Å; T319-D323 PolarHBondContact O-N 3.36Å
320	L	93.5	Very high	93.1	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-25.3	-174.5	-68.4	-175.3	0	0	0	113.6	E275 L276 L279 L305 L315 D323 R324	E275-L320 HydrophobicContact CB-CD1 3.64Å; E275-L320 HydrophobicContact CB-CG 4.22Å; L276-L320 HydrophobicContact CD1-CD1 4.42Å; L279-L320 HydrophobicContact CD2-CD1 4.21Å; L305-L320 HydrophobicContact CD2-CB 3.93Å; L305-L320 HydrophobicContact CD2-CD2 4.27Å; L305-L320 HydrophobicContact CD2-CG 4.47Å; L315-L320 HydrophobicContact CB-CB 4.47Å; L315-L320 HydrophobicContact CD1-CB 4.31Å; L320-D323 PolarHBondContact O-N 2.93Å; L320-R324 WeakPolarHBondContact O-CB 3.06Å; L320-R324 PolarHBondContact O-N 2.83Å
321	H	93.4	Very high	93.1	Very high	53 Å²	53	51.9 Å²	51.9	25%	0.245	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-41.1	174.8	-173.5	98.5	0	0	0	112.3	L315 P316 T319 D323 R324 Q325	L315-H321 HydrophobicContact CB-CB 4.18Å; P316-H321 VanDerWaalsContact O-CB 3.26Å; P316-H321 WeakPolarHBondContact O-CB 3.41Å; P316-H321 PolarHBondContact O-N 3.17Å; T319-H321 PolarHBondContact O-N 3.5Å; H321-D323 VanDerWaalsContact C-N 3.34Å; H321-R324 PolarHBondContact ND1-NH2 3.31Å; H321-R324 PolarHBondContact O-N 3.25Å; H321-Q325 PolarHBondContact CD2-NE2 2.9Å; H321-Q325 VanDerWaalsContact CD2-NE2 3.3Å; H321-Q325 PolarHBondContact NE2-NE2 2.93Å; H321-Q325 WeakPolarHBondContact O-CG 3.23Å; H321-Q325 PolarHBondContact O-N 3.41Å
322	V	92.4	Very high	93.2	Very high	70 Å²	70	48.9 Å²	48.9	42%	0.424	25%	0.254	S	S	.	.	H	α-helix	trans	-63.8	-43.6	178	-175.3	0	0	0	0	110	A317 T319 R324 Q325 Y326	A317-V322 WeakPolarHBondContact O-CG2 3.19Å; T319-V322 PolarHBondContact O-N 2.85Å; T319-V322 VanDerWaalsContact O-N 3.13Å; V322-R324 PolarHBondContact O-N 3Å; V322-Q325 WeakPolarHBondContact O-CB 3.37Å; V322-Q325 PolarHBondContact O-N 3.31Å; V322-Y326 PolarHBondContact O-N 3.49Å
323	D	94.1	Very high	93.1	Very high	14 Å²	14	47 Å²	47	8%	0.075	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-39.6	179.5	-52.2	-12.9	0	0	0	111.3	R269 K301 L305 T319 L320 H321 Y326 I327	R269-D323 IonicContact CZ-OD1 3.67Å; R269-D323 IonicContact CZ-OD2 3.87Å; R269-D323 VanDerWaalsContact NH1-CG 3.27Å; R269-D323 IonicContact NH1-OD1 3.83Å; R269-D323 PolarHBondContact NH1-OD1 3Å; R269-D323 VanDerWaalsContact NH1-OD1 3.09Å; R269-D323 IonicContact NH1-OD2 2.72Å; R269-D323 PolarHBondContact NH1-OD2 3.24Å; R269-D323 IonicContact NH2-OD1 3.46Å; R269-D323 PolarHBondContact NH2-OD1 3.47Å; R269-D323 IonicContact NH2-OD2 2.79Å; K301-D323 WeakPolarHBondContact CE-OD2 3.43Å; K301-D323 IonicContact NZ-OD2 2.7Å; K301-D323 PolarHBondContact NZ-OD2 3.22Å; L305-D323 HydrophobicContact CD1-CB 3.7Å; T319-D323 PolarHBondContact O-N 3.36Å; L320-D323 PolarHBondContact O-N 2.93Å; H321-D323 VanDerWaalsContact C-N 3.34Å; D323-Y326 WeakPolarHBondContact O-CB 3.23Å; D323-Y326 PolarHBondContact O-N 2.64Å; D323-I327 WeakPolarHBondContact O-CD1 3.33Å; D323-I327 WeakPolarHBondContact O-CG1 3.1Å; D323-I327 PolarHBondContact O-N 2.84Å
324	R	95.4	Very high	93.3	Very high	27 Å²	27	44.9 Å²	44.9	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-48.1	172.4	-175.7	176.3	72.3	-177.9	2.5	111.2	L305 A308 H309 L313 L315 L320 H321 V322 Y326 I327 I328	L305-R324 HydrophobicContact CB-CB 4.35Å; L305-R324 HydrophobicContact CD2-CB 4.29Å; A308-R324 PolarHBondContact O-NH1 3.45Å; H309-R324 HydrophobicContact CB-CG 4.19Å; L313-R324 PolarHBondContact O-NH1 2.82Å; L315-R324 HydrophobicContact CD1-CB 4.07Å; L315-R324 HydrophobicContact CD1-CG 4.46Å; L320-R324 WeakPolarHBondContact O-CB 3.06Å; L320-R324 PolarHBondContact O-N 2.83Å; H321-R324 PolarHBondContact ND1-NH2 3.31Å; H321-R324 PolarHBondContact O-N 3.25Å; V322-R324 PolarHBondContact O-N 3Å; R324-Y326 VanDerWaalsContact C-N 3.26Å; R324-Y326 PolarHBondContact O-N 3.37Å; R324-I327 PolarHBondContact O-N 3.08Å; R324-I328 HydrophobicContact CG-CG1 4.01Å; R324-I328 WeakPolarHBondContact O-CB 3.29Å; R324-I328 VanDerWaalsContact O-CG1 3.22Å; R324-I328 WeakPolarHBondContact O-CG1 3.3Å; R324-I328 PolarHBondContact O-N 2.87Å
325	Q	93.5	Very high	93.5	Very high	45 Å²	45	35.8 Å²	35.8	21%	0.21	19%	0.193	C	C	.	.	H	α-helix	trans	-57.6	-41.1	176.4	-71.2	-176.8	3.9	0	0	111.7	H62 H321 V322 K329 P747	H62-Q325 PolarHBondContact CE1-NE2 3.24Å; H62-Q325 PolarHBondContact CE1-OE1 2.91Å; H62-Q325 PolarHBondContact NE2-NE2 3.26Å; H62-Q325 PolarHBondContact NE2-OE1 2.93Å; H321-Q325 PolarHBondContact CD2-NE2 2.9Å; H321-Q325 VanDerWaalsContact CD2-NE2 3.3Å; H321-Q325 PolarHBondContact NE2-NE2 2.93Å; H321-Q325 WeakPolarHBondContact O-CG 3.23Å; H321-Q325 PolarHBondContact O-N 3.41Å; V322-Q325 WeakPolarHBondContact O-CB 3.37Å; V322-Q325 PolarHBondContact O-N 3.31Å; Q325-K329 WeakPolarHBondContact O-CB 3.47Å; Q325-K329 PolarHBondContact O-N 2.62Å; Q325-P747 HydrophobicContact CB-CB 4.04Å; Q325-P747 HydrophobicContact CG-CB 4.23Å; Q325-P747 WeakPolarHBondContact O-CG 3.35Å
326	Y	93.5	Very high	93.5	Very high	44 Å²	44	36.4 Å²	36.4	17%	0.173	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-52.5	177.5	-168.2	-85.2	0	0	0	112	N263 E265 I266 V322 D323 R324 I328 K329 H330	N263-Y326 PolarHBondContact ND2-OH 3.11Å; E265-Y326 HydrophobicContact CB-CE2 3.78Å; E265-Y326 HydrophobicContact CG-CE2 4.49Å; E265-Y326 WeakPolarHBondContact OE2-CE2 3.06Å; E265-Y326 VanDerWaalsContact OE2-CZ 3.27Å; E265-Y326 PolarHBondContact OE2-OH 3.22Å; I266-Y326 HydrophobicContact CD1-CD1 3.86Å; I266-Y326 HydrophobicContact CD1-CE1 3.76Å; I266-Y326 HydrophobicContact CG1-CD1 3.87Å; I266-Y326 HydrophobicContact CG1-CE1 3.83Å; V322-Y326 PolarHBondContact O-N 3.49Å; D323-Y326 WeakPolarHBondContact O-CB 3.23Å; D323-Y326 PolarHBondContact O-N 2.64Å; R324-Y326 VanDerWaalsContact C-N 3.26Å; R324-Y326 PolarHBondContact O-N 3.37Å; Y326-I328 PolarHBondContact O-N 2.88Å; Y326-K329 WeakPolarHBondContact O-CB 3.47Å; Y326-K329 PolarHBondContact O-N 3.22Å; Y326-H330 AromaticContact CE1-CD2 3.69Å; Y326-H330 AromaticContact CZ-CD2 3.71Å; Y326-H330 AromaticContact CZ-NE2 3.83Å; Y326-H330 PolarHBondContact O-CD2 3.15Å; Y326-H330 VanDerWaalsContact O-CD2 3.31Å; Y326-H330 PolarHBondContact O-N 2.8Å
327	I	95.8	Very high	93.5	Very high	9 Å²	9	33.6 Å²	33.6	5%	0.046	18%	0.177	C	C	.	.	H	α-helix	trans	-61.5	-48.6	-178	-70.9	156.8	0	0	0	110.9	F258 A302 L305 I306 D323 R324 K329 H330 S331	F258-I327 HydrophobicContact CD1-CG1 3.9Å; F258-I327 HydrophobicContact CE1-CB 4.11Å; F258-I327 HydrophobicContact CE1-CG1 3.9Å; F258-I327 HydrophobicContact CE1-CG2 4.03Å; F258-I327 HydrophobicContact CE2-CG2 4.22Å; F258-I327 HydrophobicContact CG-CG1 4.49Å; F258-I327 HydrophobicContact CZ-CB 4.37Å; F258-I327 HydrophobicContact CZ-CG1 4.46Å; F258-I327 HydrophobicContact CZ-CG2 3.78Å; A302-I327 HydrophobicContact CB-CD1 3.98Å; L305-I327 HydrophobicContact CB-CD1 4.14Å; L305-I327 HydrophobicContact CD1-CD1 3.67Å; I306-I327 HydrophobicContact CD1-CG2 3.98Å; I306-I327 HydrophobicContact CG1-CG2 3.72Å; D323-I327 WeakPolarHBondContact O-CD1 3.33Å; D323-I327 WeakPolarHBondContact O-CG1 3.1Å; D323-I327 PolarHBondContact O-N 2.84Å; R324-I327 PolarHBondContact O-N 3.08Å; I327-K329 VanDerWaalsContact C-N 3.33Å; I327-K329 PolarHBondContact O-N 3.23Å; I327-H330 PolarHBondContact O-N 3.12Å; I327-H330 VanDerWaalsContact O-N 3.16Å; I327-S331 PolarHBondContact O-N 2.91Å; I327-S331 PolarHBondContact O-OG 2.61Å
328	I	96.6	Very high	93.8	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-33.1	-177.5	-61.3	-62.4	0	0	0	112	I306 H309 R324 Y326 H330 P332 L376 F746 P747	I306-I328 HydrophobicContact CG1-CD1 4.31Å; H309-I328 HydrophobicContact CB-CD1 3.63Å; H309-I328 HydrophobicContact CB-CG1 3.94Å; R324-I328 HydrophobicContact CG-CG1 4.01Å; R324-I328 WeakPolarHBondContact O-CB 3.29Å; R324-I328 VanDerWaalsContact O-CG1 3.22Å; R324-I328 WeakPolarHBondContact O-CG1 3.3Å; R324-I328 PolarHBondContact O-N 2.87Å; Y326-I328 PolarHBondContact O-N 2.88Å; I328-H330 VanDerWaalsContact C-N 3.31Å; I328-H330 PolarHBondContact O-N 3.26Å; I328-P332 WeakPolarHBondContact O-CD 3.38Å; I328-L376 HydrophobicContact CD1-CD2 3.55Å; I328-F746 HydrophobicContact CG2-CD2 3.69Å; I328-F746 HydrophobicContact CG2-CE2 3.83Å; I328-F746 WeakPolarHBondContact O-CE2 3.32Å; I328-P747 HydrophobicContact CB-CG 4.48Å; I328-P747 HydrophobicContact CG2-CG 4.36Å
329	K	93.8	Very high	94.1	Very high	83 Å²	83	23.5 Å²	23.5	36%	0.361	11%	0.114	S	C	.	.	H	α-helix	trans	-60.3	-40	172.5	173.1	-172.1	165.9	-133.1	0	112.1	Q325 Y326 I327 P747 V748	Q325-K329 WeakPolarHBondContact O-CB 3.47Å; Q325-K329 PolarHBondContact O-N 2.62Å; Y326-K329 WeakPolarHBondContact O-CB 3.47Å; Y326-K329 PolarHBondContact O-N 3.22Å; I327-K329 VanDerWaalsContact C-N 3.33Å; I327-K329 PolarHBondContact O-N 3.23Å; K329-P747 HydrophobicContact CB-CG 3.71Å; K329-V748 HydrophobicContact CD-CG1 4.22Å; K329-V748 HydrophobicContact CG-CG1 4.05Å
330	H	93.4	Very high	94.1	Very high	33 Å²	33	25.3 Å²	25.3	15%	0.153	12%	0.123	C	C	.	.	H	α-helix	trans	-95.6	-13.8	-173.4	-74	-73.2	0	0	0	114.5	Y326 I327 I328 L334	Y326-H330 AromaticContact CE1-CD2 3.69Å; Y326-H330 AromaticContact CZ-CD2 3.71Å; Y326-H330 AromaticContact CZ-NE2 3.83Å; Y326-H330 PolarHBondContact O-CD2 3.15Å; Y326-H330 VanDerWaalsContact O-CD2 3.31Å; Y326-H330 PolarHBondContact O-N 2.8Å; I327-H330 PolarHBondContact O-N 3.12Å; I327-H330 VanDerWaalsContact O-N 3.16Å; I328-H330 VanDerWaalsContact C-N 3.31Å; I328-H330 PolarHBondContact O-N 3.26Å; H330-L334 PolarHBondContact O-N 2.88Å
331	S	95.8	Very high	94	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-43.6	-178.2	-65	0	0	0	0	115.2	I327 R333 L334 I335	I327-S331 PolarHBondContact O-N 2.91Å; I327-S331 PolarHBondContact O-OG 2.61Å; S331-R333 PolarHBondContact O-N 3.34Å; S331-L334 WeakPolarHBondContact O-CB 3.26Å; S331-L334 PolarHBondContact O-N 2.64Å; S331-L334 VanDerWaalsContact O-N 3.14Å; S331-I335 WeakPolarHBondContact O-CG1 3.08Å; S331-I335 PolarHBondContact O-N 3.12Å
332	P	93.9	Very high	93.9	Very high	16 Å²	16	22.9 Å²	22.9	10%	0.104	11%	0.112	C	C	.	.	H	α-helix	trans	-56.3	-51.9	-179.5	-28.4	37.4	0	0	0	112.9	I328 L334 I335 D336 I373 F746	I328-P332 WeakPolarHBondContact O-CD 3.38Å; P332-L334 PolarHBondContact O-N 3.44Å; P332-L334 VanDerWaalsContact O-N 3.15Å; P332-I335 CarbonylContact O-C 3.55Å; P332-I335 WeakPolarHBondContact O-CA 3.28Å; P332-I335 WeakPolarHBondContact O-CB 3.37Å; P332-I335 PolarHBondContact O-N 3.23Å; P332-D336 PolarHBondContact O-N 3.2Å; P332-I373 HydrophobicContact CB-CG2 4.09Å; P332-I373 HydrophobicContact CG-CG2 4.38Å; P332-F746 HydrophobicContact CG-CE2 4.14Å; P332-F746 HydrophobicContact CG-CZ 3.96Å
333	R	93.1	Very high	93.7	Very high	28 Å²	28	20.8 Å²	20.8	11%	0.106	10%	0.098	C	C	.	.	H	α-helix	trans	-54.1	-36.5	176	-171.2	-170	82.7	146.9	8.5	113.9	N223 N224 V225 E257 S331 D336 E337 Y547	N223-R333 VanDerWaalsContact O-CD 3.26Å; N223-R333 WeakPolarHBondContact O-CD 3.43Å; N223-R333 PolarHBondContact O-NH1 2.74Å; N224-R333 VanDerWaalsContact CB-NH1 3.27Å; N224-R333 PolarHBondContact O-NH1 3.49Å; N224-R333 PolarHBondContact O-NH2 2.89Å; V225-R333 HydrophobicContact CG2-CG 4.08Å; E257-R333 IonicContact OE1-NH2 3.59Å; E257-R333 PolarHBondContact OE1-NH2 3.15Å; S331-R333 PolarHBondContact O-N 3.34Å; R333-D336 VanDerWaalsContact CA-OD2 3.32Å; R333-D336 WeakPolarHBondContact CA-OD2 3.21Å; R333-E337 PolarHBondContact O-N 3.24Å; R333-Y547 WeakPolarHBondContact CD-OH 3.4Å; R333-Y547 HydrophobicContact CG-CE1 4.28Å; R333-Y547 WeakPolarHBondContact CG-OH 3.41Å
334	L	96	Very high	93.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-73.1	-32.7	176.5	-68.9	168.2	0	0	0	111.5	V225 T229 F233 L252 A255 E257 F258 H330 S331 P332 M338	V225-L334 HydrophobicContact CG1-CD2 3.95Å; V225-L334 HydrophobicContact CG2-CD2 3.83Å; T229-L334 HydrophobicContact CG2-CD2 4.16Å; F233-L334 WeakPolarHBondContact CE2-O 3.44Å; L252-L334 HydrophobicContact CD1-CB 3.53Å; L252-L334 HydrophobicContact CD1-CD1 4.19Å; A255-L334 HydrophobicContact CB-CD1 4.07Å; A255-L334 HydrophobicContact CB-CD2 4.21Å; E257-L334 HydrophobicContact CB-CD1 4.28Å; E257-L334 HydrophobicContact CB-CD2 4.46Å; E257-L334 HydrophobicContact CG-CD2 4.02Å; F258-L334 HydrophobicContact CE1-CD1 3.99Å; F258-L334 HydrophobicContact CE2-CD1 3.81Å; F258-L334 HydrophobicContact CZ-CD1 3.41Å; F258-L334 VanDerWaalsContact CZ-CD1 3.41Å; H330-L334 PolarHBondContact O-N 2.88Å; S331-L334 WeakPolarHBondContact O-CB 3.26Å; S331-L334 PolarHBondContact O-N 2.64Å; S331-L334 VanDerWaalsContact O-N 3.14Å; P332-L334 PolarHBondContact O-N 3.44Å; P332-L334 VanDerWaalsContact O-N 3.15Å; L334-M338 VanDerWaalsContact O-CG 3.24Å; L334-M338 WeakPolarHBondContact O-CG 3.47Å; L334-M338 PolarHBondContact O-N 3.01Å
335	I	95.8	Very high	93	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-72	-38.2	174.1	-64.1	161.1	0	0	0	111	L252 S331 P332 E337 M338 I339 C369 L372 I373 L376	L252-I335 HydrophobicContact CD1-CG1 4.12Å; L252-I335 HydrophobicContact CD2-CD1 3.91Å; L252-I335 HydrophobicContact CD2-CG1 3.89Å; S331-I335 WeakPolarHBondContact O-CG1 3.08Å; S331-I335 PolarHBondContact O-N 3.12Å; P332-I335 CarbonylContact O-C 3.55Å; P332-I335 WeakPolarHBondContact O-CA 3.28Å; P332-I335 WeakPolarHBondContact O-CB 3.37Å; P332-I335 PolarHBondContact O-N 3.23Å; I335-E337 VanDerWaalsContact C-N 3.29Å; I335-E337 PolarHBondContact O-N 3.47Å; I335-M338 HydrophobicContact CG1-SD 4.49Å; I335-M338 CarbonylContact O-C 3.6Å; I335-M338 WeakPolarHBondContact O-CA 3.1Å; I335-M338 WeakPolarHBondContact O-CB 3.31Å; I335-M338 PolarHBondContact O-N 3.19Å; I335-I339 HydrophobicContact CG2-CD1 4.31Å; I335-I339 WeakPolarHBondContact O-CG1 3.44Å; I335-I339 PolarHBondContact O-N 3.13Å; I335-C369 HydrophobicContact CG2-CB 4.05Å; I335-C369 WeakPolarHBondContact CG2-O 3.39Å; I335-L372 HydrophobicContact CD1-CB 4.12Å; I335-L372 HydrophobicContact CD1-CD2 3.86Å; I335-L372 HydrophobicContact CD1-CG 3.74Å; I335-L372 HydrophobicContact CG1-CD2 4.33Å; I335-I373 HydrophobicContact CB-CD1 4.44Å; I335-I373 HydrophobicContact CB-CG1 4.18Å; I335-I373 HydrophobicContact CD1-CG1 4.13Å; I335-I373 HydrophobicContact CG2-CD1 3.94Å; I335-I373 HydrophobicContact CG2-CG1 3.7Å; I335-L376 HydrophobicContact CD1-CD1 3.49Å; I335-L376 VanDerWaalsContact CD1-CD1 3.49Å
336	D	92.6	Very high	92.4	Very high	35 Å²	35	25.4 Å²	25.4	19%	0.187	12%	0.116	C	C	.	.	H	α-helix	trans	-58.2	-44.7	173.5	-53.4	-34.7	0	0	0	110.1	P332 R333 I339 N340	P332-D336 PolarHBondContact O-N 3.2Å; R333-D336 VanDerWaalsContact CA-OD2 3.32Å; R333-D336 WeakPolarHBondContact CA-OD2 3.21Å; D336-I339 WeakPolarHBondContact O-CB 3.36Å; D336-I339 PolarHBondContact O-N 2.99Å; D336-N340 PolarHBondContact O-N 3.3Å
337	E	93.5	Very high	91.9	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.037	13%	0.131	C	C	.	.	H	α-helix	trans	-72.1	-25.9	173.4	-69.4	-68.9	87.5	0	0	114	S221 N223 V225 I230 R333 I335 I339 N340 S341	S221-E337 WeakPolarHBondContact CB-OE2 3.41Å; S221-E337 PolarHBondContact OG-OE2 3.29Å; N223-E337 HydrophobicContact CB-CG 3.84Å; N223-E337 PolarHBondContact ND2-OE1 3.11Å; V225-E337 HydrophobicContact CB-CB 4.49Å; V225-E337 HydrophobicContact CB-CG 3.89Å; V225-E337 HydrophobicContact CG1-CB 4.3Å; V225-E337 HydrophobicContact CG1-CG 4.23Å; V225-E337 HydrophobicContact CG2-CB 4.36Å; V225-E337 HydrophobicContact CG2-CG 3.72Å; I230-E337 WeakPolarHBondContact CD1-OE2 3.08Å; R333-E337 PolarHBondContact O-N 3.24Å; I335-E337 VanDerWaalsContact C-N 3.29Å; I335-E337 PolarHBondContact O-N 3.47Å; E337-I339 VanDerWaalsContact C-N 3.34Å; E337-N340 PolarHBondContact OE1-ND2 3.48Å; E337-S341 VanDerWaalsContact O-CB 3.29Å; E337-S341 WeakPolarHBondContact O-CB 3.42Å; E337-S341 PolarHBondContact O-N 3.25Å; E337-S341 PolarHBondContact O-OG 3.49Å
338	M	94.4	Very high	91.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.8	-36.4	168.2	-75.2	168.7	72	0	0	111.4	F233 F237 I248 V251 L252 L334 I335 S341 L342	F233-M338 HydrophobicContact CD1-CG 4Å; F233-M338 HydrophobicContact CD2-CB 4.39Å; F233-M338 HydrophobicContact CD2-CG 3.44Å; F233-M338 VanDerWaalsContact CD2-CG 3.44Å; F233-M338 HydrophobicContact CE1-CG 3.92Å; F233-M338 HydrophobicContact CE1-SD 4.07Å; F233-M338 HydrophobicContact CE2-CB 4.49Å; F233-M338 HydrophobicContact CE2-CG 3.34Å; F233-M338 HydrophobicContact CE2-SD 4.25Å; F233-M338 HydrophobicContact CG-CG 3.78Å; F233-M338 HydrophobicContact CZ-CG 3.58Å; F233-M338 HydrophobicContact CZ-SD 3.89Å; F237-M338 HydrophobicContact CE1-CE 4.39Å; F237-M338 HydrophobicContact CE2-CB 4.05Å; F237-M338 HydrophobicContact CE2-CG 4.29Å; F237-M338 WeakPolarHBondContact CE2-O 3.37Å; F237-M338 HydrophobicContact CZ-CB 3.91Å; F237-M338 HydrophobicContact CZ-CE 3.72Å; F237-M338 HydrophobicContact CZ-CG 4.12Å; I248-M338 HydrophobicContact CG2-CE 3.66Å; V251-M338 HydrophobicContact CB-CE 4.15Å; V251-M338 HydrophobicContact CG1-CE 3.86Å; L252-M338 HydrophobicContact CB-CE 4.31Å; L252-M338 HydrophobicContact CB-SD 3.84Å; L252-M338 HydrophobicContact CD1-SD 3.97Å; L252-M338 HydrophobicContact CG-SD 4.46Å; L334-M338 VanDerWaalsContact O-CG 3.24Å; L334-M338 WeakPolarHBondContact O-CG 3.47Å; L334-M338 PolarHBondContact O-N 3.01Å; I335-M338 HydrophobicContact CG1-SD 4.49Å; I335-M338 CarbonylContact O-C 3.6Å; I335-M338 WeakPolarHBondContact O-CA 3.1Å; I335-M338 WeakPolarHBondContact O-CB 3.31Å; I335-M338 PolarHBondContact O-N 3.19Å; M338-S341 PolarHBondContact O-N 2.94Å; M338-L342 WeakPolarHBondContact O-CB 3.2Å; M338-L342 WeakPolarHBondContact O-CD1 3.5Å; M338-L342 WeakPolarHBondContact O-CG 3.36Å; M338-L342 PolarHBondContact O-N 2.99Å
339	I	92.9	Very high	90.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-46	174.1	-67	163.6	0	0	0	109.7	I335 D336 E337 S341 L342 L343 I366 C369 M370 W755	I335-I339 HydrophobicContact CG2-CD1 4.31Å; I335-I339 WeakPolarHBondContact O-CG1 3.44Å; I335-I339 PolarHBondContact O-N 3.13Å; D336-I339 WeakPolarHBondContact O-CB 3.36Å; D336-I339 PolarHBondContact O-N 2.99Å; E337-I339 VanDerWaalsContact C-N 3.34Å; I339-S341 VanDerWaalsContact C-N 3.33Å; I339-S341 PolarHBondContact O-N 2.98Å; I339-L342 WeakPolarHBondContact O-CB 3.49Å; I339-L342 PolarHBondContact O-N 2.83Å; I339-L342 VanDerWaalsContact O-N 3.17Å; I339-L343 HydrophobicContact CG2-CD1 3.97Å; I339-L343 VanDerWaalsContact O-CG 3.28Å; I339-L343 WeakPolarHBondContact O-CG 3.26Å; I339-L343 PolarHBondContact O-N 3.21Å; I339-I366 HydrophobicContact CG2-CG2 4.43Å; I339-C369 HydrophobicContact CD1-CB 4.27Å; I339-C369 HydrophobicContact CG1-CB 3.77Å; I339-M370 HydrophobicContact CD1-CG 3.71Å; I339-W755 HydrophobicContact CD1-CH2 4.13Å; I339-W755 HydrophobicContact CD1-CZ2 3.81Å; I339-W755 HydrophobicContact CG2-CH2 4.33Å; I339-W755 HydrophobicContact CG2-CZ3 4.39Å
340	N	92.1	Very high	89	Confident	63 Å²	63	30.6 Å²	30.6	34%	0.337	16%	0.161	S	C	.	.	H	α-helix	trans	-60.6	-40.4	173.8	-68.8	-28.3	0	0	0	112.4	D336 E337 L342 L343 Y344	D336-N340 PolarHBondContact O-N 3.3Å; E337-N340 PolarHBondContact OE1-ND2 3.48Å; N340-L342 PolarHBondContact O-N 2.85Å; N340-L343 PolarHBondContact O-N 3.4Å; N340-Y344 PolarHBondContact O-N 3.23Å
341	S	91.2	Very high	87.9	Confident	3 Å²	3	35 Å²	35	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-39	174.3	-57.5	0	0	0	0	112.4	E337 M338 I339 V345	E337-S341 VanDerWaalsContact O-CB 3.29Å; E337-S341 WeakPolarHBondContact O-CB 3.42Å; E337-S341 PolarHBondContact O-N 3.25Å; E337-S341 PolarHBondContact O-OG 3.49Å; M338-S341 PolarHBondContact O-N 2.94Å; I339-S341 VanDerWaalsContact C-N 3.33Å; I339-S341 PolarHBondContact O-N 2.98Å; S341-V345 WeakPolarHBondContact O-CB 3.41Å; S341-V345 WeakPolarHBondContact O-CG2 3.19Å; S341-V345 PolarHBondContact O-N 3.32Å
342	L	91.1	Very high	86.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.2	-37.9	174.5	-82.4	157.7	0	0	0	112.4	F237 M338 I339 N340 L346 H362 T365 I366	F237-L342 HydrophobicContact CB-CD2 3.99Å; F237-L342 HydrophobicContact CD1-CD1 4.4Å; F237-L342 HydrophobicContact CD1-CD2 3.54Å; F237-L342 HydrophobicContact CD1-CG 3.93Å; F237-L342 HydrophobicContact CD2-CD2 4.02Å; F237-L342 HydrophobicContact CD2-CG 3.72Å; F237-L342 HydrophobicContact CE1-CD1 3.97Å; F237-L342 HydrophobicContact CE1-CD2 3.96Å; F237-L342 HydrophobicContact CE1-CG 3.94Å; F237-L342 HydrophobicContact CE2-CD1 4.18Å; F237-L342 HydrophobicContact CE2-CD2 4.39Å; F237-L342 HydrophobicContact CE2-CG 3.73Å; F237-L342 HydrophobicContact CG-CD2 3.58Å; F237-L342 HydrophobicContact CG-CG 3.84Å; F237-L342 HydrophobicContact CZ-CD1 3.84Å; F237-L342 HydrophobicContact CZ-CD2 4.36Å; F237-L342 HydrophobicContact CZ-CG 3.85Å; M338-L342 WeakPolarHBondContact O-CB 3.2Å; M338-L342 WeakPolarHBondContact O-CD1 3.5Å; M338-L342 WeakPolarHBondContact O-CG 3.36Å; M338-L342 PolarHBondContact O-N 2.99Å; I339-L342 WeakPolarHBondContact O-CB 3.49Å; I339-L342 PolarHBondContact O-N 2.83Å; I339-L342 VanDerWaalsContact O-N 3.17Å; N340-L342 PolarHBondContact O-N 2.85Å; L342-L346 VanDerWaalsContact O-CB 3.29Å; L342-L346 WeakPolarHBondContact O-CB 3.44Å; L342-L346 PolarHBondContact O-N 3.18Å; L342-H362 WeakPolarHBondContact CD2-ND1 3.31Å; L342-T365 HydrophobicContact CD1-CG2 3.89Å; L342-T365 HydrophobicContact CD2-CG2 3.74Å; L342-T365 HydrophobicContact CG-CG2 4.47Å; L342-I366 HydrophobicContact CB-CD1 4.38Å; L342-I366 HydrophobicContact CB-CG1 3.86Å; L342-I366 HydrophobicContact CD1-CG1 3.92Å; L342-I366 HydrophobicContact CG-CG1 4.32Å
343	L	89.2	Confident	84.6	Confident	27 Å²	27	41.8 Å²	41.8	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-70	-39.7	177.9	-66.9	163.5	0	0	0	111.5	I339 N340 L346 A347 I366 L766 K769 P770	I339-L343 HydrophobicContact CG2-CD1 3.97Å; I339-L343 VanDerWaalsContact O-CG 3.28Å; I339-L343 WeakPolarHBondContact O-CG 3.26Å; I339-L343 PolarHBondContact O-N 3.21Å; N340-L343 PolarHBondContact O-N 3.4Å; L343-L346 PolarHBondContact O-N 2.92Å; L343-A347 PolarHBondContact O-N 3.27Å; L343-I366 HydrophobicContact CD2-CD1 4.32Å; L343-L766 HydrophobicContact CD2-CD2 3.57Å; L343-K769 HydrophobicContact CD1-CG 4.29Å; L343-P770 HydrophobicContact CD2-CG 4.44Å
344	Y	87.3	Confident	82.6	Confident	149 Å²	149	48.1 Å²	48.1	58%	0.584	26%	0.259	S	S	*	.	H	α-helix	trans	-62.3	-47.3	172.2	176.8	-101.4	0	0	0	112	N340 L346 A347 V348	N340-Y344 PolarHBondContact O-N 3.23Å; Y344-L346 VanDerWaalsContact C-N 3.29Å; Y344-L346 PolarHBondContact O-N 3.21Å; Y344-A347 PolarHBondContact O-N 2.73Å; Y344-V348 HydrophobicContact CE1-CG2 4.16Å; Y344-V348 HydrophobicContact CE2-CG2 4.24Å; Y344-V348 WeakPolarHBondContact O-CG2 3.47Å; Y344-V348 PolarHBondContact O-N 3.46Å; Y344-V348 VanDerWaalsContact O-N 3.1Å
345	V	86.6	Confident	80.4	Confident	6 Å²	6	51.9 Å²	51.9	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-35.5	175.7	168.7	0	0	0	0	112	C234 F237 M238 S341 A349	C234-V345 HydrophobicContact CB-CG2 3.92Å; F237-V345 HydrophobicContact CB-CG2 4.43Å; M238-V345 HydrophobicContact CG-CB 4.38Å; M238-V345 HydrophobicContact CG-CG1 3.65Å; M238-V345 HydrophobicContact CG-CG2 3.79Å; S341-V345 WeakPolarHBondContact O-CB 3.41Å; S341-V345 WeakPolarHBondContact O-CG2 3.19Å; S341-V345 PolarHBondContact O-N 3.32Å; V345-A349 VanDerWaalsContact O-CB 3.24Å; V345-A349 WeakPolarHBondContact O-CB 3.3Å; V345-A349 PolarHBondContact O-N 3.27Å
346	L	82.2	Confident	77.9	Confident	28 Å²	28	63.6 Å²	63.6	15%	0.147	33%	0.329	C	S	.	.	H	α-helix	trans	-65.7	-41.4	174.5	178.6	64	0	0	0	112	L342 L343 Y344 A349 M350 L766	L342-L346 VanDerWaalsContact O-CB 3.29Å; L342-L346 WeakPolarHBondContact O-CB 3.44Å; L342-L346 PolarHBondContact O-N 3.18Å; L343-L346 PolarHBondContact O-N 2.92Å; Y344-L346 VanDerWaalsContact C-N 3.29Å; Y344-L346 PolarHBondContact O-N 3.21Å; L346-A349 CarbonylContact O-C 3.56Å; L346-A349 PolarHBondContact O-N 2.75Å; L346-M350 HydrophobicContact CD1-CG 4.37Å; L346-M350 HydrophobicContact CD1-SD 4.17Å; L346-M350 HydrophobicContact CG-SD 4.06Å; L346-M350 WeakPolarHBondContact O-CB 3.17Å; L346-M350 VanDerWaalsContact O-CG 3.3Å; L346-M350 WeakPolarHBondContact O-CG 3.46Å; L346-M350 PolarHBondContact O-N 3.36Å; L346-L766 HydrophobicContact CD2-CB 4.41Å; L346-L766 HydrophobicContact CD2-CD2 4.48Å
347	A	81.4	Confident	76	Confident	59 Å²	59	68.7 Å²	68.7	49%	0.488	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-49.4	178	0	0	0	0	0	111.8	L343 Y344 A349 M350 D351	L343-A347 PolarHBondContact O-N 3.27Å; Y344-A347 PolarHBondContact O-N 2.73Å; A347-A349 VanDerWaalsContact C-N 3.29Å; A347-A349 PolarHBondContact O-N 2.98Å; A347-M350 WeakPolarHBondContact O-CB 3.35Å; A347-M350 PolarHBondContact O-N 3.02Å; A347-D351 PolarHBondContact O-N 2.95Å
348	V	80.7	Confident	74.2	Confident	53 Å²	53	77.5 Å²	77.5	32%	0.321	39%	0.39	S	S	.	.	H	α-helix	trans	-58.7	-41.5	175.3	176.7	0	0	0	0	111.2	Y344 M350 D351 E352	Y344-V348 HydrophobicContact CE1-CG2 4.16Å; Y344-V348 HydrophobicContact CE2-CG2 4.24Å; Y344-V348 WeakPolarHBondContact O-CG2 3.47Å; Y344-V348 PolarHBondContact O-N 3.46Å; Y344-V348 VanDerWaalsContact O-N 3.1Å; V348-M350 PolarHBondContact O-N 3.18Å; V348-D351 PolarHBondContact O-N 3.16Å; V348-E352 PolarHBondContact O-N 2.87Å; V348-E352 VanDerWaalsContact O-N 3.1Å
349	A	75.1	Confident	72.3	Confident	19 Å²	19	79.5 Å²	79.5	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-76.1	-1.6	176.8	0	0	0	0	0	114.7	V345 L346 A347 P360	V345-A349 VanDerWaalsContact O-CB 3.24Å; V345-A349 WeakPolarHBondContact O-CB 3.3Å; V345-A349 PolarHBondContact O-N 3.27Å; L346-A349 CarbonylContact O-C 3.56Å; L346-A349 PolarHBondContact O-N 2.75Å; A347-A349 VanDerWaalsContact C-N 3.29Å; A347-A349 PolarHBondContact O-N 2.98Å; A349-P360 HydrophobicContact CB-CG 3.73Å
350	M	70.6	Confident	70.7	Confident	115 Å²	115	81.3 Å²	81.3	57%	0.567	41%	0.414	S	S	*	.	H	α-helix	trans	-99.2	-38.3	171.5	-80.1	177.7	57.7	0	0	111.7	L346 A347 V348 A353	L346-M350 HydrophobicContact CD1-CG 4.37Å; L346-M350 HydrophobicContact CD1-SD 4.17Å; L346-M350 HydrophobicContact CG-SD 4.06Å; L346-M350 WeakPolarHBondContact O-CB 3.17Å; L346-M350 VanDerWaalsContact O-CG 3.3Å; L346-M350 WeakPolarHBondContact O-CG 3.46Å; L346-M350 PolarHBondContact O-N 3.36Å; A347-M350 WeakPolarHBondContact O-CB 3.35Å; A347-M350 PolarHBondContact O-N 3.02Å; V348-M350 PolarHBondContact O-N 3.18Å; M350-A353 WeakPolarHBondContact O-CB 3.41Å; M350-A353 PolarHBondContact O-N 3.25Å
351	D	69.9	Low	69.2	Low	127 Å²	127	82 Å²	82	68%	0.679	42%	0.415	S	S	*	.	H	α-helix	trans	-57.5	-50.9	167	175.4	23.9	0	0	0	110.6	A347 V348 A353	A347-D351 PolarHBondContact O-N 2.95Å; V348-D351 PolarHBondContact O-N 3.16Å; D351-A353 PolarHBondContact O-N 3.31Å
352	E	64.4	Low	68.5	Low	122 Å²	122	82 Å²	82	57%	0.57	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-60.7	-12.2	172.6	-72.1	-172.5	173.9	0	0	114.5	V348 N354 S355	V348-E352 PolarHBondContact O-N 2.87Å; V348-E352 VanDerWaalsContact O-N 3.1Å; E352-N354 VanDerWaalsContact C-N 3.27Å; E352-N354 PolarHBondContact O-N 3.43Å; E352-S355 WeakPolarHBondContact O-CA 3.37Å; E352-S355 VanDerWaalsContact O-CB 3.29Å; E352-S355 WeakPolarHBondContact O-CB 3.45Å; E352-S355 PolarHBondContact O-N 3.23Å
353	A	55.4	Low	68.4	Low	36 Å²	36	82.4 Å²	82.4	30%	0.298	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-70.2	-20.8	-173.8	0	0	0	0	0	113.7	M350 D351 S355 R356 T359	M350-A353 WeakPolarHBondContact O-CB 3.41Å; M350-A353 PolarHBondContact O-N 3.25Å; D351-A353 PolarHBondContact O-N 3.31Å; A353-S355 PolarHBondContact O-N 2.85Å; A353-R356 PolarHBondContact O-N 3.45Å; A353-T359 HydrophobicContact CB-CG2 3.88Å
354	N	52.5	Low	68.4	Low	161 Å²	161	82.8 Å²	82.8	86%	0.861	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-57.9	-25.7	165.8	-83.8	-34.2	0	0	0	111.7	E352 R356	E352-N354 VanDerWaalsContact C-N 3.27Å; E352-N354 PolarHBondContact O-N 3.43Å; N354-R356 VanDerWaalsContact C-N 3.32Å; N354-R356 PolarHBondContact O-N 3.06Å
355	S	48.7	Very low	68.7	Low	79 Å²	79	75.7 Å²	75.7	55%	0.552	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-89.5	46.7	176.4	-169.7	0	0	0	0	114	E352 A353 H357	E352-S355 WeakPolarHBondContact O-CA 3.37Å; E352-S355 VanDerWaalsContact O-CB 3.29Å; E352-S355 WeakPolarHBondContact O-CB 3.45Å; E352-S355 PolarHBondContact O-N 3.23Å; A353-S355 PolarHBondContact O-N 2.85Å; S355-H357 PolarHBondContact O-CD2 3.47Å; S355-H357 PolarHBondContact O-N 3.01Å
356	R	44.8	Very low	69	Low	245 Å²	245	75.4 Å²	75.4	93%	0.925	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	-2.5	164.8	-56.5	-179.2	178.5	178.2	0.3	118	A353 N354	A353-R356 PolarHBondContact O-N 3.45Å; N354-R356 VanDerWaalsContact C-N 3.32Å; N354-R356 PolarHBondContact O-N 3.06Å
357	H	51.1	Low	69.6	Low	143 Å²	143	75.2 Å²	75.2	66%	0.662	39%	0.393	S	S	*	.			trans	-85	132.4	-177.1	-75.9	-72.3	0	0	0	111.9	S355 T359	S355-H357 PolarHBondContact O-CD2 3.47Å; S355-H357 PolarHBondContact O-N 3.01Å; H357-T359 PolarHBondContact O-N 3.02Å; H357-T359 VanDerWaalsContact O-N 3.15Å
358	K	56	Low	70.2	Confident	192 Å²	192	74.4 Å²	74.4	84%	0.835	38%	0.38	S	S	*	.			trans	-67.5	110.4	-176.7	-174.4	177.1	-174.6	175.2	0	110
359	T	55.4	Low	70.9	Confident	42 Å²	42	71.9 Å²	71.9	26%	0.258	37%	0.365	S	S	.	.			trans	-46.2	125.1	-173.1	56.5	0	0	0	0	112.3	A353 H357 Q765	A353-T359 HydrophobicContact CB-CG2 3.88Å; H357-T359 PolarHBondContact O-N 3.02Å; H357-T359 VanDerWaalsContact O-N 3.15Å; T359-Q765 PolarHBondContact OG1-NE2 2.84Å
360	P	58.6	Low	71.8	Confident	39 Å²	39	71.2 Å²	71.2	25%	0.253	36%	0.358	S	S	.	.			trans	-62.3	137.4	-174.5	18.2	-28.7	0	0	0	113.6	P241 A349 H362	P241-P360 HydrophobicContact CB-CB 3.39Å; P241-P360 HydrophobicContact CG-CB 3.93Å; A349-P360 HydrophobicContact CB-CG 3.73Å; P360-H362 VanDerWaalsContact C-N 3.27Å; P360-H362 WeakPolarHBondContact CB-NE2 3.35Å; P360-H362 VanDerWaalsContact CG-NE2 3.31Å; P360-H362 WeakPolarHBondContact CG-NE2 3.48Å; P360-H362 PolarHBondContact O-CD2 2.92Å; P360-H362 PolarHBondContact O-N 3.42Å
361	Q	62.1	Low	73	Confident	76 Å²	76	67.1 Å²	67.1	36%	0.355	34%	0.338	S	S	.	.			trans	-78	66.6	-174.5	-66.6	-171.1	-4	0	0	113.3	L363 R764	Q361-L363 PolarHBondContact O-N 3.37Å; Q361-R764 VanDerWaalsContact OE1-CD 3.27Å
362	H	75.8	Confident	74.3	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.019	31%	0.306	C	S	.	.			trans	-72.1	-20.9	-176.6	-72.7	-71.7	0	0	0	115.1	P241 L342 P360 A364 T365 I366	P241-H362 VanDerWaalsContact CB-CE1 3.48Å; P241-H362 WeakPolarHBondContact CB-CE1 3.45Å; P241-H362 PolarHBondContact O-ND1 3.44Å; L342-H362 WeakPolarHBondContact CD2-ND1 3.31Å; P360-H362 VanDerWaalsContact C-N 3.27Å; P360-H362 WeakPolarHBondContact CB-NE2 3.35Å; P360-H362 VanDerWaalsContact CG-NE2 3.31Å; P360-H362 WeakPolarHBondContact CG-NE2 3.48Å; P360-H362 PolarHBondContact O-CD2 2.92Å; P360-H362 PolarHBondContact O-N 3.42Å; H362-A364 VanDerWaalsContact C-N 3.33Å; H362-A364 PolarHBondContact O-N 3.46Å; H362-T365 WeakPolarHBondContact O-CA 3.48Å; H362-T365 WeakPolarHBondContact O-CB 3.12Å; H362-T365 PolarHBondContact O-N 2.92Å; H362-I366 HydrophobicContact CB-CD1 4.24Å; H362-I366 WeakPolarHBondContact O-CG1 3.39Å; H362-I366 PolarHBondContact O-N 2.91Å
363	L	88.3	Confident	75.8	Confident	9 Å²	9	55.3 Å²	55.3	5%	0.047	28%	0.279	C	S	.	.	H	α-helix	trans	-52.1	-47.5	-175.8	178.7	65.4	0	0	0	112.6	Q361 T365 I366 E367 Y757 A759 R764 L766	Q361-L363 PolarHBondContact O-N 3.37Å; L363-T365 VanDerWaalsContact C-N 3.28Å; L363-T365 PolarHBondContact O-N 3.1Å; L363-I366 PolarHBondContact O-N 3.31Å; L363-E367 HydrophobicContact CD1-CG 4.28Å; L363-E367 WeakPolarHBondContact O-CB 3.44Å; L363-E367 WeakPolarHBondContact O-CG 3.46Å; L363-E367 PolarHBondContact O-N 2.7Å; L363-Y757 HydrophobicContact CD1-CE2 4.2Å; L363-A759 HydrophobicContact CD1-CB 3.86Å; L363-A759 HydrophobicContact CD2-CB 3.87Å; L363-R764 WeakPolarHBondContact CB-O 3.47Å; L363-L766 HydrophobicContact CD1-CB 4.48Å; L363-L766 HydrophobicContact CD1-CD1 4.13Å
364	A	90.7	Very high	77.8	Confident	34 Å²	34	53.7 Å²	53.7	28%	0.281	27%	0.265	S	S	.	.	H	α-helix	trans	-64.4	-32.2	178.8	0	0	0	0	0	112.8	Y242 H362 N368	Y242-A364 HydrophobicContact CD2-CB 4.12Å; Y242-A364 HydrophobicContact CE2-CB 3.84Å; H362-A364 VanDerWaalsContact C-N 3.33Å; H362-A364 PolarHBondContact O-N 3.46Å; A364-N368 WeakPolarHBondContact O-CB 3.3Å; A364-N368 PolarHBondContact O-N 2.72Å; A364-N368 PolarHBondContact O-ND2 2.87Å; A364-N368 VanDerWaalsContact O-ND2 3.15Å
365	T	93	Very high	79.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-72.4	-41.8	176.3	-56.7	0	0	0	0	111.2	F237 P241 Y242 M243 I248 L342 H362 L363 N368 C369	F237-T365 HydrophobicContact CD1-CG2 4.27Å; F237-T365 HydrophobicContact CE1-CG2 4.09Å; P241-T365 PolarHBondContact O-OG1 3.14Å; Y242-T365 WeakPolarHBondContact CA-OG1 3.45Å; M243-T365 HydrophobicContact CB-CG2 3.91Å; M243-T365 HydrophobicContact CG-CG2 4.12Å; M243-T365 PolarHBondContact N-OG1 3.08Å; I248-T365 HydrophobicContact CD1-CG2 4.29Å; L342-T365 HydrophobicContact CD1-CG2 3.89Å; L342-T365 HydrophobicContact CD2-CG2 3.74Å; L342-T365 HydrophobicContact CG-CG2 4.47Å; H362-T365 WeakPolarHBondContact O-CA 3.48Å; H362-T365 WeakPolarHBondContact O-CB 3.12Å; H362-T365 PolarHBondContact O-N 2.92Å; L363-T365 VanDerWaalsContact C-N 3.28Å; L363-T365 PolarHBondContact O-N 3.1Å; T365-N368 PolarHBondContact O-N 3.1Å; T365-C369 PolarHBondContact O-N 3.18Å; T365-C369 PolarHBondContact O-SG 3.39Å; T365-C369 VanDerWaalsContact O-SG 3.32Å
366	I	93.1	Very high	82.2	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-46.8	174	-66.8	166	0	0	0	110.4	I339 L342 L343 H362 L363 N368 C369 M370 L766	I339-I366 HydrophobicContact CG2-CG2 4.43Å; L342-I366 HydrophobicContact CB-CD1 4.38Å; L342-I366 HydrophobicContact CB-CG1 3.86Å; L342-I366 HydrophobicContact CD1-CG1 3.92Å; L342-I366 HydrophobicContact CG-CG1 4.32Å; L343-I366 HydrophobicContact CD2-CD1 4.32Å; H362-I366 HydrophobicContact CB-CD1 4.24Å; H362-I366 WeakPolarHBondContact O-CG1 3.39Å; H362-I366 PolarHBondContact O-N 2.91Å; L363-I366 PolarHBondContact O-N 3.31Å; I366-N368 PolarHBondContact O-N 2.76Å; I366-C369 WeakPolarHBondContact O-CB 3.26Å; I366-C369 PolarHBondContact O-N 3.38Å; I366-M370 HydrophobicContact CG2-CE 3.68Å; I366-M370 HydrophobicContact CG2-SD 4.26Å; I366-M370 WeakPolarHBondContact O-CG 3.26Å; I366-M370 PolarHBondContact O-N 2.8Å; I366-L766 HydrophobicContact CD1-CD2 4.23Å
367	E	93.4	Very high	84.7	Confident	24 Å²	24	30.7 Å²	30.7	11%	0.112	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-38.2	177.8	-71.2	-165.9	123.4	0	0	112.9	L363 M370 H371 Y757 R761 R802	L363-E367 HydrophobicContact CD1-CG 4.28Å; L363-E367 WeakPolarHBondContact O-CB 3.44Å; L363-E367 WeakPolarHBondContact O-CG 3.46Å; L363-E367 PolarHBondContact O-N 2.7Å; E367-M370 PolarHBondContact O-N 2.85Å; E367-H371 WeakPolarHBondContact O-CB 3.32Å; E367-H371 PolarHBondContact O-N 2.93Å; E367-Y757 WeakPolarHBondContact CG-OH 3.28Å; E367-Y757 PolarHBondContact OE1-OH 2.9Å; E367-R761 IonicContact OE1-CZ 2.66Å; E367-R761 VanDerWaalsContact OE1-CZ 3.3Å; E367-R761 IonicContact OE1-NH1 2.78Å; E367-R761 PolarHBondContact OE1-NH1 3.25Å; E367-R761 IonicContact OE1-NH2 2.68Å; E367-R761 PolarHBondContact OE1-NH2 3.28Å; E367-R761 IonicContact OE2-CZ 2.76Å; E367-R761 IonicContact OE2-NH1 2.71Å; E367-R761 PolarHBondContact OE2-NH1 3.44Å; E367-R761 IonicContact OE2-NH2 3.77Å; E367-R802 IonicContact OE1-NH1 3.94Å; E367-R802 PolarHBondContact OE1-NH1 3.05Å; E367-R802 VanDerWaalsContact OE1-NH1 3.15Å
368	N	94.6	Very high	86.8	Confident	42 Å²	42	24 Å²	24	23%	0.225	12%	0.123	C	C	.	.	H	α-helix	trans	-67.8	-34.7	173.6	-70.9	-23.6	0	0	0	112	M243 M245 I248 A364 T365 I366 H371 L372	M243-N368 PolarHBondContact O-ND2 3.44Å; M245-N368 HydrophobicContact CE-CB 4.28Å; M245-N368 WeakPolarHBondContact CE-O 3.09Å; I248-N368 HydrophobicContact CD1-CB 3.28Å; A364-N368 WeakPolarHBondContact O-CB 3.3Å; A364-N368 PolarHBondContact O-N 2.72Å; A364-N368 PolarHBondContact O-ND2 2.87Å; A364-N368 VanDerWaalsContact O-ND2 3.15Å; T365-N368 PolarHBondContact O-N 3.1Å; I366-N368 PolarHBondContact O-N 2.76Å; N368-H371 PolarHBondContact O-N 3.02Å; N368-L372 PolarHBondContact O-N 2.57Å; N368-L372 VanDerWaalsContact O-N 3.07Å
369	C	95.1	Very high	88.8	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.3	-51.5	171.2	-73.7	0	0	0	0	110.7	I335 I339 T365 I366 H371 L372	I335-C369 HydrophobicContact CG2-CB 4.05Å; I335-C369 WeakPolarHBondContact CG2-O 3.39Å; I339-C369 HydrophobicContact CD1-CB 4.27Å; I339-C369 HydrophobicContact CG1-CB 3.77Å; T365-C369 PolarHBondContact O-N 3.18Å; T365-C369 PolarHBondContact O-SG 3.39Å; T365-C369 VanDerWaalsContact O-SG 3.32Å; I366-C369 WeakPolarHBondContact O-CB 3.26Å; I366-C369 PolarHBondContact O-N 3.38Å; C369-H371 VanDerWaalsContact C-N 3.28Å; C369-H371 PolarHBondContact O-N 3.09Å; C369-L372 WeakPolarHBondContact O-CB 3.37Å; C369-L372 PolarHBondContact O-N 3.21Å; C369-L372 VanDerWaalsContact O-N 3.11Å
370	M	95.3	Very high	90.7	Very high	4 Å²	4	13 Å²	13	2%	0.02	7%	0.072	C	C	.	.	H	α-helix	trans	-55	-42.8	175.5	-69.7	169.9	177.6	0	0	112	I339 I366 E367 L372 I373 P374 W755 Y757 P770	I339-M370 HydrophobicContact CD1-CG 3.71Å; I366-M370 HydrophobicContact CG2-CE 3.68Å; I366-M370 HydrophobicContact CG2-SD 4.26Å; I366-M370 WeakPolarHBondContact O-CG 3.26Å; I366-M370 PolarHBondContact O-N 2.8Å; E367-M370 PolarHBondContact O-N 2.85Å; M370-L372 VanDerWaalsContact C-N 3.33Å; M370-L372 PolarHBondContact O-N 3.27Å; M370-I373 PolarHBondContact O-N 2.81Å; M370-P374 WeakPolarHBondContact O-CD 3.27Å; M370-W755 HydrophobicContact CE-CB 4.11Å; M370-W755 HydrophobicContact CE-CD2 3.98Å; M370-W755 HydrophobicContact CE-CE3 3.85Å; M370-W755 HydrophobicContact CE-CG 4.13Å; M370-W755 HydrophobicContact CG-CD2 4.35Å; M370-W755 HydrophobicContact CG-CG 4.1Å; M370-W755 HydrophobicContact SD-CB 4.04Å; M370-W755 HydrophobicContact SD-CG 4.21Å; M370-Y757 HydrophobicContact CE-CD1 4.18Å; M370-Y757 HydrophobicContact CE-CE1 4.07Å; M370-Y757 HydrophobicContact SD-CD1 4.4Å; M370-Y757 HydrophobicContact SD-CE1 3.7Å; M370-P770 HydrophobicContact CE-CB 3.55Å; M370-P770 HydrophobicContact CE-CG 3.72Å
371	H	95.8	Very high	92.3	Very high	30 Å²	30	12.8 Å²	12.8	14%	0.139	7%	0.07	C	C	.	.	H	α-helix	trans	-71.3	-22.7	-179.6	-165	62.7	0	0	0	114.2	M245 E367 N368 C369 I373 P374 M375 M807	M245-H371 HydrophobicContact CE-CB 4.17Å; E367-H371 WeakPolarHBondContact O-CB 3.32Å; E367-H371 PolarHBondContact O-N 2.93Å; N368-H371 PolarHBondContact O-N 3.02Å; C369-H371 VanDerWaalsContact C-N 3.28Å; C369-H371 PolarHBondContact O-N 3.09Å; H371-I373 PolarHBondContact O-N 2.82Å; H371-P374 VanDerWaalsContact O-CD 3.27Å; H371-P374 WeakPolarHBondContact O-CD 3.33Å; H371-P374 WeakPolarHBondContact O-CG 3.48Å; H371-M375 WeakPolarHBondContact O-CG 3.33Å; H371-M375 PolarHBondContact O-N 2.83Å; H371-M807 WeakPolarHBondContact NE2-CE 3.4Å
372	L	96.6	Very high	93.6	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67	-25.8	174.4	-176.4	54.5	0	0	0	112.2	M245 I248 I249 L252 I335 N368 C369 M370 M375 L376	M245-L372 HydrophobicContact CE-CB 4.27Å; M245-L372 HydrophobicContact SD-CB 3.81Å; M245-L372 HydrophobicContact SD-CD1 3.81Å; M245-L372 HydrophobicContact SD-CD2 4.37Å; M245-L372 HydrophobicContact SD-CG 4.18Å; I248-L372 HydrophobicContact CG2-CD2 3.85Å; I249-L372 HydrophobicContact CD1-CD1 4.02Å; I249-L372 HydrophobicContact CG1-CD1 3.89Å; I249-L372 HydrophobicContact CG1-CD2 3.91Å; L252-L372 HydrophobicContact CD2-CD2 3.79Å; I335-L372 HydrophobicContact CD1-CB 4.12Å; I335-L372 HydrophobicContact CD1-CD2 3.86Å; I335-L372 HydrophobicContact CD1-CG 3.74Å; I335-L372 HydrophobicContact CG1-CD2 4.33Å; N368-L372 PolarHBondContact O-N 2.57Å; N368-L372 VanDerWaalsContact O-N 3.07Å; C369-L372 WeakPolarHBondContact O-CB 3.37Å; C369-L372 PolarHBondContact O-N 3.21Å; C369-L372 VanDerWaalsContact O-N 3.11Å; M370-L372 VanDerWaalsContact C-N 3.33Å; M370-L372 PolarHBondContact O-N 3.27Å; L372-M375 HydrophobicContact CD1-CB 4.5Å; L372-M375 HydrophobicContact CD1-CE 4.14Å; L372-M375 WeakPolarHBondContact O-CB 3.43Å; L372-L376 HydrophobicContact CD1-CD1 4.22Å; L372-L376 HydrophobicContact CD1-CG 4.14Å; L372-L376 HydrophobicContact CG-CD1 3.94Å; L372-L376 HydrophobicContact CG-CG 4.37Å; L372-L376 WeakPolarHBondContact O-CD1 3.19Å; L372-L376 WeakPolarHBondContact O-CG 3.26Å; L372-L376 PolarHBondContact O-N 2.66Å; L372-L376 VanDerWaalsContact O-N 3.08Å
373	I	96.3	Very high	94.3	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-56.1	179.1	-45.6	179.5	0	0	0	112.1	P332 I335 M370 H371 M375 L376 V377 D804	P332-I373 HydrophobicContact CB-CG2 4.09Å; P332-I373 HydrophobicContact CG-CG2 4.38Å; I335-I373 HydrophobicContact CB-CD1 4.44Å; I335-I373 HydrophobicContact CB-CG1 4.18Å; I335-I373 HydrophobicContact CD1-CG1 4.13Å; I335-I373 HydrophobicContact CG2-CD1 3.94Å; I335-I373 HydrophobicContact CG2-CG1 3.7Å; M370-I373 PolarHBondContact O-N 2.81Å; H371-I373 PolarHBondContact O-N 2.82Å; I373-M375 VanDerWaalsContact C-N 3.28Å; I373-M375 PolarHBondContact O-N 3.01Å; I373-L376 PolarHBondContact O-N 2.68Å; I373-L376 VanDerWaalsContact O-N 3.08Å; I373-V377 HydrophobicContact CG2-CG2 4.35Å; I373-V377 WeakPolarHBondContact O-CG2 3.43Å; I373-V377 PolarHBondContact O-N 2.99Å; I373-D804 CarbonylContact C-O 3.59Å; I373-D804 HydrophobicContact CB-CB 4.47Å; I373-D804 HydrophobicContact CG2-CB 4.17Å; I373-D804 WeakPolarHBondContact CG2-O 3.4Å
374	P	96.4	Very high	94.5	Very high	1 Å²	1	21 Å²	21	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-63.8	-31.6	177.1	25.2	-34.2	0	0	0	112.5	M370 H371 L376 V377 Q378 M807	M370-P374 WeakPolarHBondContact O-CD 3.27Å; H371-P374 VanDerWaalsContact O-CD 3.27Å; H371-P374 WeakPolarHBondContact O-CD 3.33Å; H371-P374 WeakPolarHBondContact O-CG 3.48Å; P374-L376 VanDerWaalsContact C-N 3.33Å; P374-L376 PolarHBondContact O-N 3.2Å; P374-V377 PolarHBondContact O-N 3.23Å; P374-Q378 VanDerWaalsContact O-CB 3.3Å; P374-Q378 WeakPolarHBondContact O-CB 3.22Å; P374-Q378 WeakPolarHBondContact O-CG 3.35Å; P374-Q378 PolarHBondContact O-N 2.78Å; P374-M807 HydrophobicContact CB-SD 3.93Å; P374-M807 HydrophobicContact CG-SD 4.16Å
375	M	97.1	Very high	94.6	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-56.6	-45.2	170.6	-77	175.8	52.9	0	0	112	M245 L310 H371 L372 I373 A379 L380 D382 M807	M245-M375 HydrophobicContact CE-SD 3.62Å; M245-M375 HydrophobicContact CG-CE 4.09Å; M245-M375 HydrophobicContact CG-SD 4.29Å; M245-M375 HydrophobicContact SD-CE 4.2Å; M245-M375 HydrophobicContact SD-SD 3.98Å; L310-M375 HydrophobicContact CD1-CE 3.84Å; L310-M375 HydrophobicContact CD2-CB 4.12Å; L310-M375 WeakPolarHBondContact CD2-O 3.49Å; H371-M375 WeakPolarHBondContact O-CG 3.33Å; H371-M375 PolarHBondContact O-N 2.83Å; L372-M375 HydrophobicContact CD1-CB 4.5Å; L372-M375 HydrophobicContact CD1-CE 4.14Å; L372-M375 WeakPolarHBondContact O-CB 3.43Å; I373-M375 VanDerWaalsContact C-N 3.28Å; I373-M375 PolarHBondContact O-N 3.01Å; M375-A379 CarbonylContact O-C 3.22Å; M375-A379 VanDerWaalsContact O-CA 3.27Å; M375-A379 WeakPolarHBondContact O-CA 3.4Å; M375-A379 PolarHBondContact O-N 3.39Å; M375-L380 WeakPolarHBondContact CB-O 2.98Å; M375-L380 PolarHBondContact O-N 2.8Å; M375-D382 HydrophobicContact CE-CB 4.13Å; M375-D382 HydrophobicContact SD-CB 4.06Å; M375-M807 HydrophobicContact CB-SD 4.41Å; M375-M807 HydrophobicContact CG-CE 3.63Å; M375-M807 HydrophobicContact CG-SD 3.79Å
376	L	97.3	Very high	94.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-72.6	-39.2	177.5	-68.1	164.8	0	0	0	112.6	I306 H309 L310 I328 I335 L372 I373 P374	I306-L376 HydrophobicContact CG2-CD2 4.11Å; H309-L376 PolarHBondContact NE2-O 2.79Å; L310-L376 HydrophobicContact CD2-CD2 4.07Å; L310-L376 HydrophobicContact CD2-CG 4.48Å; I328-L376 HydrophobicContact CD1-CD2 3.55Å; I335-L376 HydrophobicContact CD1-CD1 3.49Å; I335-L376 VanDerWaalsContact CD1-CD1 3.49Å; L372-L376 HydrophobicContact CD1-CD1 4.22Å; L372-L376 HydrophobicContact CD1-CG 4.14Å; L372-L376 HydrophobicContact CG-CD1 3.94Å; L372-L376 HydrophobicContact CG-CG 4.37Å; L372-L376 WeakPolarHBondContact O-CD1 3.19Å; L372-L376 WeakPolarHBondContact O-CG 3.26Å; L372-L376 PolarHBondContact O-N 2.66Å; L372-L376 VanDerWaalsContact O-N 3.08Å; I373-L376 PolarHBondContact O-N 2.68Å; I373-L376 VanDerWaalsContact O-N 3.08Å; P374-L376 VanDerWaalsContact C-N 3.33Å; P374-L376 PolarHBondContact O-N 3.2Å
377	V	96.4	Very high	94.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.7	-42.4	178.7	171.7	0	0	0	0	111.5	I373 P374 V741 C743 F746 K750	I373-V377 HydrophobicContact CG2-CG2 4.35Å; I373-V377 WeakPolarHBondContact O-CG2 3.43Å; I373-V377 PolarHBondContact O-N 2.99Å; P374-V377 PolarHBondContact O-N 3.23Å; V377-V741 HydrophobicContact CG1-CG1 4.03Å; V377-C743 HydrophobicContact CG1-CB 3.63Å; V377-C743 WeakPolarHBondContact O-CB 3.45Å; V377-F746 HydrophobicContact CG2-CD2 4.32Å; V377-F746 HydrophobicContact CG2-CE2 4.28Å; V377-K750 HydrophobicContact CG1-CG 4.13Å; V377-K750 HydrophobicContact CG2-CD 4.4Å; V377-K750 HydrophobicContact CG2-CG 4.31Å
378	Q	96.3	Very high	94.7	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-88.2	-9.2	-179.6	-64.5	-63.6	-25.9	0	0	113.7	R312 P374 L380 Q389 H742 S805 M807	R312-Q378 PolarHBondContact NH2-O 3.22Å; P374-Q378 VanDerWaalsContact O-CB 3.3Å; P374-Q378 WeakPolarHBondContact O-CB 3.22Å; P374-Q378 WeakPolarHBondContact O-CG 3.35Å; P374-Q378 PolarHBondContact O-N 2.78Å; Q378-L380 HydrophobicContact CB-CD1 4.07Å; Q378-L380 HydrophobicContact CB-CG 4.24Å; Q378-Q389 HydrophobicContact CB-CG 4.13Å; Q378-Q389 HydrophobicContact CG-CG 3.89Å; Q378-H742 PolarHBondContact NE2-O 2.99Å; Q378-H742 PolarHBondContact OE1-O 3.23Å; Q378-S805 PolarHBondContact NE2-O 3.45Å; Q378-M807 HydrophobicContact CB-CG 4.32Å; Q378-M807 HydrophobicContact CG-CG 4.37Å
379	A	96.7	Very high	94.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	62.8	-172.6	0	0	0	0	0	111.2	H309 R312 M375 Y745	H309-A379 WeakPolarHBondContact NE2-CB 3.06Å; R312-A379 HydrophobicContact CG-CB 4.14Å; R312-A379 WeakPolarHBondContact CG-O 3.19Å; R312-A379 PolarHBondContact NE-O 3.43Å; M375-A379 CarbonylContact O-C 3.22Å; M375-A379 VanDerWaalsContact O-CA 3.27Å; M375-A379 WeakPolarHBondContact O-CA 3.4Å; M375-A379 PolarHBondContact O-N 3.39Å; A379-Y745 HydrophobicContact CB-CD2 4Å; A379-Y745 HydrophobicContact CB-CG 4.03Å
380	L	95.3	Very high	94.6	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.026	12%	0.119	C	C	.	.			trans	-138.3	141.3	-178.1	-71.6	177.1	0	0	0	110.9	M375 Q378 A384 L388 Q389 M807	M375-L380 WeakPolarHBondContact CB-O 2.98Å; M375-L380 PolarHBondContact O-N 2.8Å; Q378-L380 HydrophobicContact CB-CD1 4.07Å; Q378-L380 HydrophobicContact CB-CG 4.24Å; L380-A384 HydrophobicContact CB-CB 4.14Å; L380-A384 HydrophobicContact CD2-CB 3.99Å; L380-L388 HydrophobicContact CD1-CB 4.22Å; L380-L388 HydrophobicContact CD2-CB 3.58Å; L380-L388 HydrophobicContact CD2-CD1 4.07Å; L380-L388 HydrophobicContact CD2-CG 4.47Å; L380-Q389 HydrophobicContact CD1-CG 3.75Å; L380-M807 HydrophobicContact CD1-CG 4.08Å
381	T	93.2	Very high	94.5	Very high	33 Å²	33	21 Å²	21	20%	0.202	12%	0.12	C	C	.	.			trans	-74.1	155.5	168.7	49.3	0	0	0	0	111.6	L310 E311 N383 A384	L310-T381 HydrophobicContact CB-CG2 3.73Å; E311-T381 HydrophobicContact CG-CG2 4.16Å; T381-N383 VanDerWaalsContact C-N 3.25Å; T381-N383 PolarHBondContact O-N 3.34Å; T381-A384 WeakPolarHBondContact O-CB 2.8Å; T381-A384 PolarHBondContact O-N 3.02Å
382	D	89.9	Confident	94.4	Very high	81 Å²	81	21.9 Å²	21.9	43%	0.433	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-45.3	177.2	-172	9.5	0	0	0	112.9	M375 A384	M375-D382 HydrophobicContact CE-CB 4.13Å; M375-D382 HydrophobicContact SD-CB 4.06Å; D382-A384 VanDerWaalsContact C-N 3.33Å; D382-A384 PolarHBondContact O-N 3.03Å
383	N	89.8	Confident	94.2	Very high	158 Å²	158	22.2 Å²	22.2	85%	0.845	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	4.8	179.7	-65.4	-71.4	0	0	0	114.9	T381	T381-N383 VanDerWaalsContact C-N 3.25Å; T381-N383 PolarHBondContact O-N 3.34Å
384	A	91.5	Very high	93.9	Very high	23 Å²	23	25.1 Å²	25.1	19%	0.19	14%	0.144	C	C	.	.	S	Bend	trans	-79.2	148.7	-175.9	0	0	0	0	0	112.4	L380 T381 D382 P386 L388	L380-A384 HydrophobicContact CB-CB 4.14Å; L380-A384 HydrophobicContact CD2-CB 3.99Å; T381-A384 WeakPolarHBondContact O-CB 2.8Å; T381-A384 PolarHBondContact O-N 3.02Å; D382-A384 VanDerWaalsContact C-N 3.33Å; D382-A384 PolarHBondContact O-N 3.03Å; A384-P386 WeakPolarHBondContact O-CD 3.47Å; A384-L388 HydrophobicContact CB-CD1 4.33Å
385	S	93.3	Very high	93.5	Very high	36 Å²	36	30.6 Å²	30.6	25%	0.252	17%	0.169	S	C	.	.			trans	-67.9	126.7	175.3	179.2	0	0	0	0	110.7	L387 L388	S385-L387 PolarHBondContact O-N 2.89Å; S385-L388 WeakPolarHBondContact O-CB 3.49Å; S385-L388 PolarHBondContact O-N 3.05Å
386	P	93.4	Very high	93.1	Very high	30 Å²	30	34.6 Å²	34.6	20%	0.195	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-56.6	-21.8	177.9	-28.6	36.2	0	0	0	114.8	A384 L388 Q389 M807 D808	A384-P386 WeakPolarHBondContact O-CD 3.47Å; P386-L388 PolarHBondContact O-N 3.26Å; P386-L388 VanDerWaalsContact O-N 3.16Å; P386-Q389 WeakPolarHBondContact O-CB 3.23Å; P386-Q389 WeakPolarHBondContact O-CG 3.5Å; P386-Q389 PolarHBondContact O-N 2.93Å; P386-Q389 PolarHBondContact O-NE2 3.5Å; P386-M807 HydrophobicContact CB-CB 4.39Å; P386-D808 HydrophobicContact CB-CB 3.72Å; P386-D808 WeakPolarHBondContact CB-OD2 3.42Å; P386-D808 HydrophobicContact CG-CB 3.72Å
387	L	93.5	Very high	92.6	Very high	4 Å²	4	36 Å²	36	2%	0.021	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-60.9	-19.1	173.5	-64.2	175.7	0	0	0	113.2	S385 Q389 L390 L398 M401 I408 V411 L414	S385-L387 PolarHBondContact O-N 2.89Å; L387-Q389 PolarHBondContact O-N 3.45Å; L387-L390 HydrophobicContact CD2-CD1 4.49Å; L387-L390 WeakPolarHBondContact O-CB 3.47Å; L387-L390 PolarHBondContact O-N 3.36Å; L387-L398 HydrophobicContact CB-CD2 3.86Å; L387-L398 HydrophobicContact CD1-CD2 3.89Å; L387-L398 HydrophobicContact CG-CD2 4.5Å; L387-M401 HydrophobicContact CD1-CE 4Å; L387-I408 HydrophobicContact CD1-CG2 4.24Å; L387-V411 HydrophobicContact CD2-CG2 4.2Å; L387-L414 HydrophobicContact CD2-CB 4.12Å; L387-L414 HydrophobicContact CD2-CD2 4.02Å
388	L	94.2	Very high	92.2	Very high	21 Å²	21	36.9 Å²	36.9	11%	0.11	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-73.8	-2	175.9	-67.6	166.7	0	0	0	114.3	R312 L380 A384 S385 P386 L390 I393 L398	R312-L388 PolarHBondContact NH1-O 2.87Å; R312-L388 PolarHBondContact NH2-O 2.96Å; L380-L388 HydrophobicContact CD1-CB 4.22Å; L380-L388 HydrophobicContact CD2-CB 3.58Å; L380-L388 HydrophobicContact CD2-CD1 4.07Å; L380-L388 HydrophobicContact CD2-CG 4.47Å; A384-L388 HydrophobicContact CB-CD1 4.33Å; S385-L388 WeakPolarHBondContact O-CB 3.49Å; S385-L388 PolarHBondContact O-N 3.05Å; P386-L388 PolarHBondContact O-N 3.26Å; P386-L388 VanDerWaalsContact O-N 3.16Å; L388-L390 VanDerWaalsContact C-N 3.34Å; L388-I393 HydrophobicContact CD2-CG2 4.42Å; L388-L398 HydrophobicContact CD1-CD1 3.89Å; L388-L398 HydrophobicContact CD2-CD1 3.67Å; L388-L398 HydrophobicContact CD2-CG 4.38Å; L388-L398 HydrophobicContact CG-CD1 3.69Å
389	Q	94.3	Very high	91.8	Very high	3 Å²	3	44 Å²	44	1%	0.014	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-73.4	-27.7	167.2	-62.6	176.9	97.2	0	0	112.2	Q378 L380 P386 L387 M444 H742 Y806 M807	Q378-Q389 HydrophobicContact CB-CG 4.13Å; Q378-Q389 HydrophobicContact CG-CG 3.89Å; L380-Q389 HydrophobicContact CD1-CG 3.75Å; P386-Q389 WeakPolarHBondContact O-CB 3.23Å; P386-Q389 WeakPolarHBondContact O-CG 3.5Å; P386-Q389 PolarHBondContact O-N 2.93Å; P386-Q389 PolarHBondContact O-NE2 3.5Å; L387-Q389 PolarHBondContact O-N 3.45Å; Q389-M444 HydrophobicContact CB-CE 3.99Å; Q389-H742 PolarHBondContact O-CE1 3.1Å; Q389-H742 PolarHBondContact O-ND1 3.26Å; Q389-Y806 VanDerWaalsContact OE1-CA 3.29Å; Q389-M807 HydrophobicContact CG-CB 4.49Å; Q389-M807 PolarHBondContact NE2-O 2.96Å
390	L	94.2	Very high	91.3	Very high	5 Å²	5	47 Å²	47	3%	0.026	25%	0.246	C	C	.	.	S	Bend	trans	-75.1	144.2	-178.6	-65.9	173.5	0	0	0	111	L387 L388 I393 V411 L414 I437 V440 M444	L387-L390 HydrophobicContact CD2-CD1 4.49Å; L387-L390 WeakPolarHBondContact O-CB 3.47Å; L387-L390 PolarHBondContact O-N 3.36Å; L388-L390 VanDerWaalsContact C-N 3.34Å; L390-I393 HydrophobicContact CB-CD1 3.77Å; L390-I393 HydrophobicContact CB-CG1 4.01Å; L390-I393 HydrophobicContact CD1-CD1 3.72Å; L390-I393 HydrophobicContact CG-CD1 4.38Å; L390-V411 HydrophobicContact CD1-CG1 4.17Å; L390-V411 HydrophobicContact CD1-CG2 4.26Å; L390-V411 HydrophobicContact CD2-CG1 4.15Å; L390-V411 HydrophobicContact CG-CG1 4.41Å; L390-V411 HydrophobicContact CG-CG2 4.23Å; L390-L414 HydrophobicContact CD1-CD2 3.72Å; L390-I437 HydrophobicContact CD1-CG2 4.24Å; L390-I437 HydrophobicContact CD2-CG2 4.46Å; L390-V440 HydrophobicContact CD2-CG1 4.11Å; L390-M444 HydrophobicContact CD2-CE 4.16Å; L390-M444 HydrophobicContact CD2-SD 4.02Å
391	P	93.5	Very high	90.8	Very high	6 Å²	6	47 Å²	47	4%	0.039	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	151.6	178.7	29.5	-36.1	0	0	0	111	C51 C53 I393 D436 I437 V440	C51-P391 VanDerWaalsContact SG-CB 3.58Å; C53-P391 HydrophobicContact CB-CB 4.06Å; P391-I393 PolarHBondContact O-N 2.72Å; P391-D436 HydrophobicContact CB-CB 4.4Å; P391-D436 HydrophobicContact CG-CB 3.97Å; P391-D436 WeakPolarHBondContact CG-O 3.12Å; P391-I437 HydrophobicContact CG-CG1 3.98Å; P391-I437 WeakPolarHBondContact O-CD1 3.46Å; P391-I437 VanDerWaalsContact O-CG1 3.23Å; P391-I437 WeakPolarHBondContact O-CG1 3.46Å; P391-V440 HydrophobicContact CG-CB 4.31Å; P391-V440 HydrophobicContact CG-CG2 3.86Å
392	H	93.1	Very high	90.4	Very high	48 Å²	48	47.9 Å²	47.9	22%	0.222	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	-11.5	180	-47.8	-72.3	0	0	0	116.7	C53 T394 Q397 L429 Q433 D436	C53-H392 WeakPolarHBondContact CB-CE1 3.32Å; H392-T394 PolarHBondContact O-N 3.46Å; H392-Q397 PolarHBondContact O-NE2 2.82Å; H392-Q397 PolarHBondContact O-OE1 3.24Å; H392-L429 HydrophobicContact CB-CD2 3.93Å; H392-Q433 HydrophobicContact CB-CB 4.33Å; H392-Q433 HydrophobicContact CB-CG 4.47Å; H392-D436 IonicContact CD2-OD2 2.58Å; H392-D436 IonicContact CE1-OD2 2.63Å; H392-D436 IonicContact NE2-OD2 3.92Å; H392-D436 PolarHBondContact NE2-OD2 2.96Å
393	I	91.8	Very high	90.1	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.041	27%	0.269	C	S	.	.			trans	-74.6	125.7	176.7	-56.9	-163.2	0	0	0	110.7	L388 L390 P391 L398 M401 L414 I437	L388-I393 HydrophobicContact CD2-CG2 4.42Å; L390-I393 HydrophobicContact CB-CD1 3.77Å; L390-I393 HydrophobicContact CB-CG1 4.01Å; L390-I393 HydrophobicContact CD1-CD1 3.72Å; L390-I393 HydrophobicContact CG-CD1 4.38Å; P391-I393 PolarHBondContact O-N 2.72Å; I393-L398 HydrophobicContact CG2-CD2 4.32Å; I393-L398 HydrophobicContact CG2-CG 4.2Å; I393-M401 HydrophobicContact CD1-CE 4.21Å; I393-M401 HydrophobicContact CG2-CE 3.97Å; I393-L414 HydrophobicContact CD1-CD2 4.42Å; I393-I437 HydrophobicContact CD1-CD1 4.17Å; I393-I437 HydrophobicContact CG1-CD1 3.9Å
394	T	90.7	Very high	89.6	Confident	61 Å²	61	47.3 Å²	47.3	37%	0.374	25%	0.252	S	S	.	.			trans	-128.5	168.1	-178.3	62.4	0	0	0	0	111.9	H392 T396 Q397 L398	H392-T394 PolarHBondContact O-N 3.46Å; T394-T396 PolarHBondContact O-N 2.89Å; T394-T396 VanDerWaalsContact O-N 3.11Å; T394-T396 PolarHBondContact OG1-OG1 3.4Å; T394-Q397 PolarHBondContact O-N 2.65Å; T394-L398 PolarHBondContact O-N 2.94Å
395	Q	89.2	Confident	88.8	Confident	116 Å²	116	49.2 Å²	49.2	54%	0.542	26%	0.257	S	S	.	.	H	α-helix	trans	-63.1	-16.9	-179.4	-163.6	63.7	6.2	0	0	114.2	R399	Q395-R399 WeakPolarHBondContact O-CG 3.27Å; Q395-R399 PolarHBondContact O-NE 3.35Å
396	T	87.7	Confident	87.7	Confident	88 Å²	88	57.6 Å²	57.6	54%	0.54	28%	0.283	S	S	.	.	H	α-helix	trans	-78.1	-43.8	168.9	50.4	0	0	0	0	111.3	T394 R399 H400	T394-T396 PolarHBondContact O-N 2.89Å; T394-T396 VanDerWaalsContact O-N 3.11Å; T394-T396 PolarHBondContact OG1-OG1 3.4Å; T396-R399 PolarHBondContact O-N 2.88Å; T396-H400 PolarHBondContact O-N 3.28Å; T396-H400 VanDerWaalsContact O-N 3.13Å
397	Q	87.5	Confident	87.2	Confident	29 Å²	29	62.7 Å²	62.7	14%	0.136	31%	0.309	C	S	.	.	H	α-helix	trans	-66.3	-39.7	177.4	-65.1	175.8	29.5	0	0	112.1	H392 T394 R399 H400 M401	H392-Q397 PolarHBondContact O-NE2 2.82Å; H392-Q397 PolarHBondContact O-OE1 3.24Å; T394-Q397 PolarHBondContact O-N 2.65Å; Q397-R399 VanDerWaalsContact C-N 3.34Å; Q397-R399 PolarHBondContact O-N 2.67Å; Q397-H400 WeakPolarHBondContact O-CB 3.5Å; Q397-H400 PolarHBondContact O-N 2.86Å; Q397-H400 VanDerWaalsContact O-N 3.12Å; Q397-M401 WeakPolarHBondContact O-CG 3.36Å; Q397-M401 PolarHBondContact O-N 2.88Å
398	L	88.3	Confident	86.9	Confident	19 Å²	19	63.6 Å²	63.6	10%	0.099	31%	0.313	C	S	.	.	H	α-helix	trans	-55.6	-46.8	172.5	-79.1	175.1	0	0	0	112.4	L387 L388 I393 T394 H400 M401 A402	L387-L398 HydrophobicContact CB-CD2 3.86Å; L387-L398 HydrophobicContact CD1-CD2 3.89Å; L387-L398 HydrophobicContact CG-CD2 4.5Å; L388-L398 HydrophobicContact CD1-CD1 3.89Å; L388-L398 HydrophobicContact CD2-CD1 3.67Å; L388-L398 HydrophobicContact CD2-CG 4.38Å; L388-L398 HydrophobicContact CG-CD1 3.69Å; I393-L398 HydrophobicContact CG2-CD2 4.32Å; I393-L398 HydrophobicContact CG2-CG 4.2Å; T394-L398 PolarHBondContact O-N 2.94Å; L398-H400 VanDerWaalsContact C-N 3.29Å; L398-H400 PolarHBondContact O-N 3.47Å; L398-M401 HydrophobicContact CD2-CE 3.72Å; L398-M401 HydrophobicContact CG-CE 4.39Å; L398-M401 PolarHBondContact O-N 3.42Å; L398-A402 WeakPolarHBondContact O-CB 3.38Å; L398-A402 PolarHBondContact O-N 2.87Å
399	R	87.4	Confident	86.6	Confident	151 Å²	151	69.8 Å²	69.8	57%	0.57	34%	0.339	S	S	*	.	H	α-helix	trans	-61.3	-38.3	176.7	-74.7	-179.8	-76.4	168.1	-5.9	111.8	Q395 T396 Q397 T403	Q395-R399 WeakPolarHBondContact O-CG 3.27Å; Q395-R399 PolarHBondContact O-NE 3.35Å; T396-R399 PolarHBondContact O-N 2.88Å; Q397-R399 VanDerWaalsContact C-N 3.34Å; Q397-R399 PolarHBondContact O-N 2.67Å; R399-T403 VanDerWaalsContact O-CB 3.32Å; R399-T403 WeakPolarHBondContact O-CB 3.5Å; R399-T403 PolarHBondContact O-N 3.07Å; R399-T403 PolarHBondContact O-OG1 3.16Å
400	H	85.6	Confident	86.3	Confident	62 Å²	62	70.8 Å²	70.8	29%	0.287	35%	0.347	S	S	.	.	H	α-helix	trans	-67	-42.4	174.1	167.1	-100.3	0	0	0	112.8	T396 Q397 L398 T403 K404 L425	T396-H400 PolarHBondContact O-N 3.28Å; T396-H400 VanDerWaalsContact O-N 3.13Å; Q397-H400 WeakPolarHBondContact O-CB 3.5Å; Q397-H400 PolarHBondContact O-N 2.86Å; Q397-H400 VanDerWaalsContact O-N 3.12Å; L398-H400 VanDerWaalsContact C-N 3.29Å; L398-H400 PolarHBondContact O-N 3.47Å; H400-T403 PolarHBondContact O-N 2.72Å; H400-K404 PolarHBondContact CE1-NZ 3.07Å; H400-K404 VanDerWaalsContact NE2-CE 3.31Å; H400-K404 WeakPolarHBondContact NE2-CE 3.32Å; H400-K404 PolarHBondContact NE2-NZ 2.75Å; H400-K404 PolarHBondContact O-N 3.27Å; H400-L425 PolarHBondContact CE1-O 3Å
401	M	85.9	Confident	86.2	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-64.7	-50.5	176.6	-67.6	-169.2	-63.5	0	0	111.5	L387 I393 Q397 L398 T403 K404 Q405 L425 L426	L387-M401 HydrophobicContact CD1-CE 4Å; I393-M401 HydrophobicContact CD1-CE 4.21Å; I393-M401 HydrophobicContact CG2-CE 3.97Å; Q397-M401 WeakPolarHBondContact O-CG 3.36Å; Q397-M401 PolarHBondContact O-N 2.88Å; L398-M401 HydrophobicContact CD2-CE 3.72Å; L398-M401 HydrophobicContact CG-CE 4.39Å; L398-M401 PolarHBondContact O-N 3.42Å; M401-T403 VanDerWaalsContact C-N 3.27Å; M401-T403 PolarHBondContact O-N 2.86Å; M401-K404 PolarHBondContact O-N 3.4Å; M401-Q405 PolarHBondContact O-N 2.9Å; M401-L425 HydrophobicContact CB-CD2 4.21Å; M401-L425 HydrophobicContact CB-CG 4.42Å; M401-L425 HydrophobicContact CG-CD2 3.72Å; M401-L425 HydrophobicContact CG-CG 3.96Å; M401-L425 HydrophobicContact SD-CD2 3.6Å; M401-L425 VanDerWaalsContact SD-CD2 3.6Å; M401-L425 HydrophobicContact SD-CG 4.44Å; M401-L426 HydrophobicContact SD-CD2 3.64Å
402	A	83.9	Confident	86.1	Confident	51 Å²	51	73.7 Å²	73.7	42%	0.421	36%	0.357	S	S	.	.	H	α-helix	trans	-60.8	-33.9	177.4	0	0	0	0	0	112.8	L398 R406	L398-A402 WeakPolarHBondContact O-CB 3.38Å; L398-A402 PolarHBondContact O-N 2.87Å; A402-R406 WeakPolarHBondContact O-CG 3.47Å; A402-R406 PolarHBondContact O-N 2.89Å
403	T	82.8	Confident	86	Confident	114 Å²	114	75.6 Å²	75.6	70%	0.699	37%	0.366	S	S	*	.	H	α-helix	trans	-64.1	-39.1	173.4	-60.3	0	0	0	0	112.1	R399 H400 M401	R399-T403 VanDerWaalsContact O-CB 3.32Å; R399-T403 WeakPolarHBondContact O-CB 3.5Å; R399-T403 PolarHBondContact O-N 3.07Å; R399-T403 PolarHBondContact O-OG1 3.16Å; H400-T403 PolarHBondContact O-N 2.72Å; M401-T403 VanDerWaalsContact C-N 3.27Å; M401-T403 PolarHBondContact O-N 2.86Å
404	K	79.2	Confident	86	Confident	113 Å²	113	75.2 Å²	75.2	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-84.8	-38.5	-177.8	-78.5	179.2	167.4	173.4	0	114	H400 M401 L425	H400-K404 PolarHBondContact CE1-NZ 3.07Å; H400-K404 VanDerWaalsContact NE2-CE 3.31Å; H400-K404 WeakPolarHBondContact NE2-CE 3.32Å; H400-K404 PolarHBondContact NE2-NZ 2.75Å; H400-K404 PolarHBondContact O-N 3.27Å; M401-K404 PolarHBondContact O-N 3.4Å; K404-L425 HydrophobicContact CB-CD1 4.27Å
405	Q	75.3	Confident	86	Confident	64 Å²	64	72.8 Å²	72.8	30%	0.299	35%	0.349	S	S	.	.			trans	-145.1	93.9	-179.4	-64.8	-170.3	33	0	0	109.8	M401 N407 I408 L425	M401-Q405 PolarHBondContact O-N 2.9Å; Q405-N407 PolarHBondContact O-N 3.22Å; Q405-I408 HydrophobicContact CB-CD1 3.83Å; Q405-I408 HydrophobicContact CB-CG1 4.03Å; Q405-I408 PolarHBondContact O-N 2.9Å; Q405-L425 HydrophobicContact CB-CD1 4.05Å; Q405-L425 HydrophobicContact CG-CD1 3.88Å
406	R	71.1	Confident	86	Confident	212 Å²	212	73 Å²	73	80%	0.8	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-12.8	-178	-67.5	-179.3	179.5	-169.5	-0.6	115	A402	A402-R406 WeakPolarHBondContact O-CG 3.47Å; A402-R406 PolarHBondContact O-N 2.89Å
407	N	82.2	Confident	86	Confident	137 Å²	137	70.1 Å²	70.1	73%	0.733	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-8.8	-170.8	-63.2	6.8	0	0	0	113.7	Q405 K409 Q413	Q405-N407 PolarHBondContact O-N 3.22Å; N407-K409 PolarHBondContact O-N 3.22Å; N407-Q413 PolarHBondContact O-OE1 3.43Å
408	I	87.5	Confident	86.1	Confident	22 Å²	22	72.2 Å²	72.2	11%	0.113	35%	0.351	C	S	.	.			trans	-84.8	112.9	177	-45.8	171.3	0	0	0	108.6	L387 Q405 Q413 L414 L417 L425	L387-I408 HydrophobicContact CD1-CG2 4.24Å; Q405-I408 HydrophobicContact CB-CD1 3.83Å; Q405-I408 HydrophobicContact CB-CG1 4.03Å; Q405-I408 PolarHBondContact O-N 2.9Å; I408-Q413 HydrophobicContact CG2-CB 4.21Å; I408-L414 HydrophobicContact CD1-CD1 4.49Å; I408-L414 HydrophobicContact CG2-CB 3.95Å; I408-L417 HydrophobicContact CD1-CD1 3.71Å; I408-L417 HydrophobicContact CG1-CD1 4.5Å; I408-L425 HydrophobicContact CD1-CD1 3.79Å; I408-L425 HydrophobicContact CD1-CD2 3.57Å; I408-L425 HydrophobicContact CD1-CG 4.35Å
409	K	86.6	Confident	86.1	Confident	151 Å²	151	74.9 Å²	74.9	66%	0.657	37%	0.365	S	S	*	.			trans	-121.3	-37.9	177.7	-63.7	-176.5	178.2	-177.5	0	112.9	N407	N407-K409 PolarHBondContact O-N 3.22Å
410	S	89.9	Confident	86.1	Confident	25 Å²	25	74.3 Å²	74.3	18%	0.175	37%	0.374	C	S	.	.	S	Bend	trans	-105.6	160.8	-178.9	62.6	0	0	0	0	113.4	R412 Q413 L414 D808	S410-R412 VanDerWaalsContact C-N 3.31Å; S410-R412 PolarHBondContact O-N 3.38Å; S410-Q413 VanDerWaalsContact N-OE1 3.17Å; S410-Q413 PolarHBondContact O-N 3.44Å; S410-Q413 WeakPolarHBondContact OG-CG 3.42Å; S410-Q413 PolarHBondContact OG-N 3.47Å; S410-Q413 PolarHBondContact OG-OE1 3.14Å; S410-L414 PolarHBondContact O-N 2.95Å; S410-D808 WeakPolarHBondContact CA-OD2 3.39Å; S410-D808 WeakPolarHBondContact CB-OD2 3.45Å
411	V	92.1	Very high	86.3	Confident	2 Å²	2	77.2 Å²	77.2	1%	0.012	39%	0.385	C	S	.	.	H	α-helix	trans	-61.3	-41.6	175.1	179.5	0	0	0	0	110.7	L387 L390 Q413 L414 I415 M444 L482 D808	L387-V411 HydrophobicContact CD2-CG2 4.2Å; L390-V411 HydrophobicContact CD1-CG1 4.17Å; L390-V411 HydrophobicContact CD1-CG2 4.26Å; L390-V411 HydrophobicContact CD2-CG1 4.15Å; L390-V411 HydrophobicContact CG-CG1 4.41Å; L390-V411 HydrophobicContact CG-CG2 4.23Å; V411-Q413 VanDerWaalsContact C-N 3.27Å; V411-Q413 PolarHBondContact O-N 3.25Å; V411-L414 WeakPolarHBondContact O-CB 3.38Å; V411-L414 PolarHBondContact O-N 2.96Å; V411-I415 HydrophobicContact CG1-CG1 4.23Å; V411-I415 WeakPolarHBondContact O-CG1 3.26Å; V411-I415 PolarHBondContact O-N 2.89Å; V411-M444 HydrophobicContact CG1-SD 3.92Å; V411-L482 HydrophobicContact CG1-CD2 3.87Å; V411-D808 PolarHBondContact N-OD2 3.21Å
412	R	91	Very high	86.5	Confident	69 Å²	69	77.2 Å²	77.2	26%	0.26	39%	0.385	S	S	.	.	H	α-helix	trans	-55.5	-39.2	176.4	-168.2	176.8	-56.9	-170.1	8.7	112.6	S410 N416 L482	S410-R412 VanDerWaalsContact C-N 3.31Å; S410-R412 PolarHBondContact O-N 3.38Å; R412-N416 WeakPolarHBondContact O-CB 3.34Å; R412-N416 VanDerWaalsContact O-CG 3.22Å; R412-N416 PolarHBondContact O-N 3.38Å; R412-N416 VanDerWaalsContact O-N 3.09Å; R412-N416 PolarHBondContact O-OD1 2.83Å; R412-L482 HydrophobicContact CB-CD1 4.28Å; R412-L482 HydrophobicContact CG-CD1 4.01Å
413	Q	91.1	Very high	86.9	Confident	88 Å²	88	77.7 Å²	77.7	41%	0.411	38%	0.376	S	S	.	.	H	α-helix	trans	-69.9	-32.3	176.5	-74.2	169	-18.2	0	0	113.3	N407 I408 S410 V411	N407-Q413 PolarHBondContact O-OE1 3.43Å; I408-Q413 HydrophobicContact CG2-CB 4.21Å; S410-Q413 VanDerWaalsContact N-OE1 3.17Å; S410-Q413 PolarHBondContact O-N 3.44Å; S410-Q413 WeakPolarHBondContact OG-CG 3.42Å; S410-Q413 PolarHBondContact OG-N 3.47Å; S410-Q413 PolarHBondContact OG-OE1 3.14Å; V411-Q413 VanDerWaalsContact C-N 3.27Å; V411-Q413 PolarHBondContact O-N 3.25Å
414	L	91	Very high	87.2	Confident	0 Å²	0	75 Å²	75	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-71	-39.3	176	177.9	61.8	0	0	0	111.7	L387 L390 I393 I408 S410 V411 L417 R422 L425 L426	L387-L414 HydrophobicContact CD2-CB 4.12Å; L387-L414 HydrophobicContact CD2-CD2 4.02Å; L390-L414 HydrophobicContact CD1-CD2 3.72Å; I393-L414 HydrophobicContact CD1-CD2 4.42Å; I408-L414 HydrophobicContact CD1-CD1 4.49Å; I408-L414 HydrophobicContact CG2-CB 3.95Å; S410-L414 PolarHBondContact O-N 2.95Å; V411-L414 WeakPolarHBondContact O-CB 3.38Å; V411-L414 PolarHBondContact O-N 2.96Å; L414-L417 HydrophobicContact CD1-CD1 4.43Å; L414-R422 HydrophobicContact CD1-CG 4.31Å; L414-R422 WeakPolarHBondContact O-CD 3.35Å; L414-R422 WeakPolarHBondContact O-CG 3.38Å; L414-L425 HydrophobicContact CD1-CD2 3.55Å; L414-L426 HydrophobicContact CD2-CD1 4.47Å
415	I	90.2	Very high	87.7	Confident	10 Å²	10	69.9 Å²	69.9	5%	0.051	34%	0.343	C	S	.	.	H	α-helix	trans	-74.2	-39.3	-178.7	-60.6	-53.3	0	0	0	112.1	V411 L417 R422 S441 L482 L483	V411-I415 HydrophobicContact CG1-CG1 4.23Å; V411-I415 WeakPolarHBondContact O-CG1 3.26Å; V411-I415 PolarHBondContact O-N 2.89Å; I415-L417 PolarHBondContact O-N 2.91Å; I415-R422 PolarHBondContact O-NH1 3.28Å; I415-S441 WeakPolarHBondContact CD1-OG 3.45Å; I415-L482 HydrophobicContact CG1-CD2 4.47Å; I415-L483 HydrophobicContact CG2-CB 4.04Å; I415-L483 HydrophobicContact CG2-CD1 4.12Å
416	N	88.8	Confident	88.3	Confident	121 Å²	121	66.9 Å²	66.9	65%	0.647	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-0.7	176.7	-69.7	5.7	0	0	0	114.3	R412	R412-N416 WeakPolarHBondContact O-CB 3.34Å; R412-N416 VanDerWaalsContact O-CG 3.22Å; R412-N416 PolarHBondContact O-N 3.38Å; R412-N416 VanDerWaalsContact O-N 3.09Å; R412-N416 PolarHBondContact O-OD1 2.83Å
417	L	89.1	Confident	89.1	Confident	27 Å²	27	66.8 Å²	66.8	14%	0.141	33%	0.329	C	S	.	.	S	Bend	trans	-74.6	137.4	168.2	-73.1	178.3	0	0	0	111.1	I408 L414 I415 R422	I408-L417 HydrophobicContact CD1-CD1 3.71Å; I408-L417 HydrophobicContact CG1-CD1 4.5Å; L414-L417 HydrophobicContact CD1-CD1 4.43Å; I415-L417 PolarHBondContact O-N 2.91Å; L417-R422 HydrophobicContact CB-CB 4.17Å; L417-R422 PolarHBondContact O-NH1 3.46Å
418	P	89.4	Confident	89.4	Confident	73 Å²	73	63.7 Å²	63.7	47%	0.474	32%	0.318	S	S	.	.			trans	-50.3	140	167.3	-27.4	34.3	0	0	0	112.3	D420 K421 R422	P418-D420 VanDerWaalsContact C-N 3.31Å; P418-D420 PolarHBondContact O-N 3.32Å; P418-D420 VanDerWaalsContact O-N 3.16Å; P418-K421 HydrophobicContact CG-CD 4.31Å; P418-K421 WeakPolarHBondContact O-CA 3.26Å; P418-K421 WeakPolarHBondContact O-CB 3.36Å; P418-K421 PolarHBondContact O-N 3.48Å; P418-R422 PolarHBondContact O-N 3.24Å
419	D	87.1	Confident	89.6	Confident	76 Å²	76	63 Å²	63	41%	0.406	31%	0.314	S	S	.	.	H	α-helix	trans	-51.8	-42.6	-169.1	-78	44.1	0	0	0	114.2	K421 R422 R423	D419-K421 VanDerWaalsContact C-N 3.34Å; D419-K421 PolarHBondContact O-N 2.97Å; D419-R422 PolarHBondContact O-N 3.36Å; D419-R422 IonicContact OD1-CZ 2.7Å; D419-R422 IonicContact OD1-NH1 2.67Å; D419-R422 PolarHBondContact OD1-NH1 2.79Å; D419-R422 IonicContact OD1-NH2 3.56Å; D419-R422 PolarHBondContact OD1-NH2 3.1Å; D419-R422 VanDerWaalsContact OD1-NH2 3.07Å; D419-R422 IonicContact OD2-CZ 3.29Å; D419-R422 IonicContact OD2-NH1 2.74Å; D419-R422 IonicContact OD2-NH2 3.08Å; D419-R422 PolarHBondContact OD2-NH2 2.87Å; D419-R423 WeakPolarHBondContact O-CB 3.48Å; D419-R423 PolarHBondContact O-N 3.32Å
420	D	87.6	Confident	89.8	Confident	139 Å²	139	58.3 Å²	58.3	74%	0.743	30%	0.301	S	S	*	.	H	α-helix	trans	-59.2	-44.4	175.4	-57.5	-52.7	0	0	0	112.2	P418 A424	P418-D420 VanDerWaalsContact C-N 3.31Å; P418-D420 PolarHBondContact O-N 3.32Å; P418-D420 VanDerWaalsContact O-N 3.16Å; D420-A424 WeakPolarHBondContact O-CB 3.33Å; D420-A424 PolarHBondContact O-N 3.22Å
421	K	90.2	Very high	89.9	Confident	122 Å²	122	61.6 Å²	61.6	53%	0.53	32%	0.317	S	S	.	.	H	α-helix	trans	-69	-38.9	178.9	-64.7	-179.5	-179.2	174.7	0	110.5	P418 D419 L425	P418-K421 HydrophobicContact CG-CD 4.31Å; P418-K421 WeakPolarHBondContact O-CA 3.26Å; P418-K421 WeakPolarHBondContact O-CB 3.36Å; P418-K421 PolarHBondContact O-N 3.48Å; D419-K421 VanDerWaalsContact C-N 3.34Å; D419-K421 PolarHBondContact O-N 2.97Å; K421-L425 VanDerWaalsContact O-CB 3.3Å; K421-L425 WeakPolarHBondContact O-CB 3.42Å; K421-L425 PolarHBondContact O-N 3.41Å
422	R	91.5	Very high	89.7	Confident	6 Å²	6	67.4 Å²	67.4	2%	0.023	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-47.2	177.6	-161.4	167.6	69.5	-112.4	-1.4	111.3	L414 I415 L417 P418 D419 L425 L426 Y434	L414-R422 HydrophobicContact CD1-CG 4.31Å; L414-R422 WeakPolarHBondContact O-CD 3.35Å; L414-R422 WeakPolarHBondContact O-CG 3.38Å; I415-R422 PolarHBondContact O-NH1 3.28Å; L417-R422 HydrophobicContact CB-CB 4.17Å; L417-R422 PolarHBondContact O-NH1 3.46Å; P418-R422 PolarHBondContact O-N 3.24Å; D419-R422 PolarHBondContact O-N 3.36Å; D419-R422 IonicContact OD1-CZ 2.7Å; D419-R422 IonicContact OD1-NH1 2.67Å; D419-R422 PolarHBondContact OD1-NH1 2.79Å; D419-R422 IonicContact OD1-NH2 3.56Å; D419-R422 PolarHBondContact OD1-NH2 3.1Å; D419-R422 VanDerWaalsContact OD1-NH2 3.07Å; D419-R422 IonicContact OD2-CZ 3.29Å; D419-R422 IonicContact OD2-NH1 2.74Å; D419-R422 IonicContact OD2-NH2 3.08Å; D419-R422 PolarHBondContact OD2-NH2 2.87Å; R422-L425 PolarHBondContact O-N 3.4Å; R422-L426 WeakPolarHBondContact O-CB 3.48Å; R422-L426 PolarHBondContact O-N 2.91Å; R422-L426 VanDerWaalsContact O-N 3.1Å; R422-Y434 PolarHBondContact NE-OH 3.24Å
423	R	90.8	Very high	89.8	Confident	60 Å²	60	67 Å²	67	23%	0.226	35%	0.345	C	S	.	.	H	α-helix	trans	-67	-39.7	174.8	-170.1	73	-175.7	109.1	-5.4	112.2	D419 L426 R427 L429 D431 Y434	D419-R423 WeakPolarHBondContact O-CB 3.48Å; D419-R423 PolarHBondContact O-N 3.32Å; R423-L426 PolarHBondContact NH1-O 3.38Å; R423-L426 CarbonylContact O-C 3.35Å; R423-L426 VanDerWaalsContact O-C 3.22Å; R423-L426 PolarHBondContact O-N 3.44Å; R423-R427 WeakPolarHBondContact O-CA 3.2Å; R423-R427 PolarHBondContact O-N 3.13Å; R423-L429 PolarHBondContact NH1-O 3.19Å; R423-L429 PolarHBondContact NH2-O 3.1Å; R423-D431 IonicContact CZ-OD1 3.42Å; R423-D431 IonicContact NE-OD1 3.41Å; R423-D431 PolarHBondContact NE-OD1 3.08Å; R423-D431 IonicContact NH2-OD1 3.38Å; R423-D431 PolarHBondContact NH2-OD1 3.36Å; R423-D431 IonicContact NH2-OD2 3.91Å; R423-Y434 VanDerWaalsContact CD-CD1 3.41Å; R423-Y434 VanDerWaalsContact CD-CE1 3.45Å
424	A	89.3	Confident	89.8	Confident	59 Å²	59	63.7 Å²	63.7	49%	0.488	33%	0.329	S	S	.	.	H	α-helix	trans	-68.3	-33	178.2	0	0	0	0	0	113.5	D420 R427	D420-A424 WeakPolarHBondContact O-CB 3.33Å; D420-A424 PolarHBondContact O-N 3.22Å; A424-R427 WeakPolarHBondContact O-CB 3.03Å
425	L	89.1	Confident	89.8	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-66	-44	170.6	-169	100	0	0	0	110.7	H400 M401 K404 Q405 I408 L414 K421 R422 R427	H400-L425 PolarHBondContact CE1-O 3Å; M401-L425 HydrophobicContact CB-CD2 4.21Å; M401-L425 HydrophobicContact CB-CG 4.42Å; M401-L425 HydrophobicContact CG-CD2 3.72Å; M401-L425 HydrophobicContact CG-CG 3.96Å; M401-L425 HydrophobicContact SD-CD2 3.6Å; M401-L425 VanDerWaalsContact SD-CD2 3.6Å; M401-L425 HydrophobicContact SD-CG 4.44Å; K404-L425 HydrophobicContact CB-CD1 4.27Å; Q405-L425 HydrophobicContact CB-CD1 4.05Å; Q405-L425 HydrophobicContact CG-CD1 3.88Å; I408-L425 HydrophobicContact CD1-CD1 3.79Å; I408-L425 HydrophobicContact CD1-CD2 3.57Å; I408-L425 HydrophobicContact CD1-CG 4.35Å; L414-L425 HydrophobicContact CD1-CD2 3.55Å; K421-L425 VanDerWaalsContact O-CB 3.3Å; K421-L425 WeakPolarHBondContact O-CB 3.42Å; K421-L425 PolarHBondContact O-N 3.41Å; R422-L425 PolarHBondContact O-N 3.4Å; L425-R427 VanDerWaalsContact C-N 3.34Å; L425-R427 PolarHBondContact O-N 3.12Å
426	L	89.7	Confident	89.8	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.01	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	23.6	179.6	-64.5	174.8	0	0	0	114	M401 L414 R422 R423 S428 L429 Y434 I437	M401-L426 HydrophobicContact SD-CD2 3.64Å; L414-L426 HydrophobicContact CD2-CD1 4.47Å; R422-L426 WeakPolarHBondContact O-CB 3.48Å; R422-L426 PolarHBondContact O-N 2.91Å; R422-L426 VanDerWaalsContact O-N 3.1Å; R423-L426 PolarHBondContact NH1-O 3.38Å; R423-L426 CarbonylContact O-C 3.35Å; R423-L426 VanDerWaalsContact O-C 3.22Å; R423-L426 PolarHBondContact O-N 3.44Å; L426-S428 PolarHBondContact O-N 2.87Å; L426-L429 HydrophobicContact CB-CD1 4.35Å; L426-L429 HydrophobicContact CD2-CD1 4.18Å; L426-L429 WeakPolarHBondContact O-CB 3.34Å; L426-L429 PolarHBondContact O-N 3.48Å; L426-Y434 HydrophobicContact CB-CD2 4.23Å; L426-Y434 HydrophobicContact CB-CE2 4.47Å; L426-Y434 HydrophobicContact CD1-CD2 4.02Å; L426-Y434 HydrophobicContact CD1-CE2 3.96Å; L426-I437 HydrophobicContact CD1-CD1 4.17Å
427	R	87.9	Confident	90	Very high	210 Å²	210	61.6 Å²	61.6	79%	0.792	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.8	-177.9	170.3	176.3	165.5	-174.1	-5.1	114	R423 A424 L425 L429	R423-R427 WeakPolarHBondContact O-CA 3.2Å; R423-R427 PolarHBondContact O-N 3.13Å; A424-R427 WeakPolarHBondContact O-CB 3.03Å; L425-R427 VanDerWaalsContact C-N 3.34Å; L425-R427 PolarHBondContact O-N 3.12Å; R427-L429 PolarHBondContact O-N 3.42Å
428	S	88.3	Confident	90.1	Very high	72 Å²	72	60.5 Å²	60.5	50%	0.503	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-10.9	178.2	52.2	0	0	0	0	114.3	L426	L426-S428 PolarHBondContact O-N 2.87Å
429	L	90.3	Very high	90.2	Very high	6 Å²	6	57.6 Å²	57.6	3%	0.031	29%	0.287	C	S	.	.	S	Bend	trans	-99.3	139	-178.9	-63.8	-180	0	0	0	111.4	H392 R423 L426 R427 Q433 I437	H392-L429 HydrophobicContact CB-CD2 3.93Å; R423-L429 PolarHBondContact NH1-O 3.19Å; R423-L429 PolarHBondContact NH2-O 3.1Å; L426-L429 HydrophobicContact CB-CD1 4.35Å; L426-L429 HydrophobicContact CD2-CD1 4.18Å; L426-L429 WeakPolarHBondContact O-CB 3.34Å; L426-L429 PolarHBondContact O-N 3.48Å; R427-L429 PolarHBondContact O-N 3.42Å; L429-Q433 HydrophobicContact CB-CB 3.91Å; L429-Q433 HydrophobicContact CD2-CB 4.12Å; L429-Q433 HydrophobicContact CG-CB 4.44Å; L429-I437 HydrophobicContact CD1-CD1 3.33Å
430	S	92.4	Very high	90.4	Very high	53 Å²	53	54.1 Å²	54.1	37%	0.371	27%	0.268	S	S	.	.			trans	-61.3	162.8	170	77.6	0	0	0	0	111.2	E432 Q433 Y434	S430-E432 PolarHBondContact O-N 3.47Å; S430-E432 PolarHBondContact OG-N 2.94Å; S430-Q433 PolarHBondContact O-N 3.23Å; S430-Q433 VanDerWaalsContact O-N 3.14Å; S430-Q433 WeakPolarHBondContact OG-CG 3.38Å; S430-Q433 PolarHBondContact OG-N 3.28Å; S430-Y434 WeakPolarHBondContact O-CB 3.08Å; S430-Y434 PolarHBondContact O-N 3.25Å
431	D	90.5	Very high	90.6	Very high	95 Å²	95	47.5 Å²	47.5	51%	0.508	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-29.2	178	-59.1	-65.6	0	0	0	112.3	R423 R435	R423-D431 IonicContact CZ-OD1 3.42Å; R423-D431 IonicContact NE-OD1 3.41Å; R423-D431 PolarHBondContact NE-OD1 3.08Å; R423-D431 IonicContact NH2-OD1 3.38Å; R423-D431 PolarHBondContact NH2-OD1 3.36Å; R423-D431 IonicContact NH2-OD2 3.91Å; D431-R435 VanDerWaalsContact O-CB 3.23Å; D431-R435 WeakPolarHBondContact O-CB 3.42Å; D431-R435 PolarHBondContact O-N 2.85Å
432	E	88.9	Confident	90.5	Very high	124 Å²	124	42.8 Å²	42.8	58%	0.579	22%	0.215	S	C	*	.	H	α-helix	trans	-69.2	-40.7	173	-57	-165	123.3	0	0	112.9	S430 R435 D436	S430-E432 PolarHBondContact O-N 3.47Å; S430-E432 PolarHBondContact OG-N 2.94Å; E432-R435 WeakPolarHBondContact O-CB 3.47Å; E432-D436 PolarHBondContact O-N 3.46Å
433	Q	92.2	Very high	90.3	Very high	61 Å²	61	44.5 Å²	44.5	29%	0.285	23%	0.228	S	C	.	.	H	α-helix	trans	-70.4	-37.4	176.7	-68.7	175.9	-46.4	0	0	111.6	H392 L429 S430 D436 I437	H392-Q433 HydrophobicContact CB-CB 4.33Å; H392-Q433 HydrophobicContact CB-CG 4.47Å; L429-Q433 HydrophobicContact CB-CB 3.91Å; L429-Q433 HydrophobicContact CD2-CB 4.12Å; L429-Q433 HydrophobicContact CG-CB 4.44Å; S430-Q433 PolarHBondContact O-N 3.23Å; S430-Q433 VanDerWaalsContact O-N 3.14Å; S430-Q433 WeakPolarHBondContact OG-CG 3.38Å; S430-Q433 PolarHBondContact OG-N 3.28Å; Q433-D436 PolarHBondContact O-N 2.89Å; Q433-I437 PolarHBondContact O-N 3.47Å
434	Y	92	Very high	90.4	Very high	18 Å²	18	42.1 Å²	42.1	7%	0.071	22%	0.22	C	C	.	.	H	α-helix	trans	-68.2	-41.4	174	-177.1	-111.9	0	0	0	111.4	R422 R423 L426 S430 D436 I437 L438	R422-Y434 PolarHBondContact NE-OH 3.24Å; R423-Y434 VanDerWaalsContact CD-CD1 3.41Å; R423-Y434 VanDerWaalsContact CD-CE1 3.45Å; L426-Y434 HydrophobicContact CB-CD2 4.23Å; L426-Y434 HydrophobicContact CB-CE2 4.47Å; L426-Y434 HydrophobicContact CD1-CD2 4.02Å; L426-Y434 HydrophobicContact CD1-CE2 3.96Å; S430-Y434 WeakPolarHBondContact O-CB 3.08Å; S430-Y434 PolarHBondContact O-N 3.25Å; Y434-D436 PolarHBondContact O-N 2.82Å; Y434-I437 PolarHBondContact O-N 2.84Å; Y434-L438 HydrophobicContact CD1-CD1 4.11Å; Y434-L438 HydrophobicContact CD1-CG 4.45Å; Y434-L438 HydrophobicContact CE1-CD1 3.63Å; Y434-L438 HydrophobicContact CE1-CD2 4.42Å; Y434-L438 HydrophobicContact CE1-CG 4.11Å; Y434-L438 HydrophobicContact CE2-CD2 4.35Å; Y434-L438 WeakPolarHBondContact O-CG 3.41Å; Y434-L438 PolarHBondContact O-N 3.14Å
435	R	90.1	Very high	90.5	Very high	80 Å²	80	39.4 Å²	39.4	30%	0.302	20%	0.197	S	C	.	.	H	α-helix	trans	-54.4	-49.7	169.5	176.2	-167.2	66.8	-155.5	-5.9	111.1	D431 E432 I437 L438 T439 M492	D431-R435 VanDerWaalsContact O-CB 3.23Å; D431-R435 WeakPolarHBondContact O-CB 3.42Å; D431-R435 PolarHBondContact O-N 2.85Å; E432-R435 WeakPolarHBondContact O-CB 3.47Å; R435-I437 VanDerWaalsContact C-N 3.26Å; R435-I437 PolarHBondContact O-N 3.19Å; R435-L438 PolarHBondContact O-N 2.99Å; R435-L438 VanDerWaalsContact O-N 3.1Å; R435-T439 WeakPolarHBondContact O-CB 3.27Å; R435-T439 PolarHBondContact O-N 3.48Å; R435-T439 PolarHBondContact O-OG1 2.97Å; R435-T439 VanDerWaalsContact O-OG1 3.07Å; R435-M492 HydrophobicContact CG-CE 3.88Å
436	D	91.6	Very high	90.6	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-55.2	-41.1	178.2	-87.3	-6.8	0	0	0	112.2	M52 C53 P391 H392 E432 Q433 Y434 V440	M52-D436 VanDerWaalsContact N-CG 3.3Å; M52-D436 PolarHBondContact N-OD1 3.03Å; M52-D436 PolarHBondContact N-OD2 2.92Å; C53-D436 PolarHBondContact N-OD2 3.21Å; P391-D436 HydrophobicContact CB-CB 4.4Å; P391-D436 HydrophobicContact CG-CB 3.97Å; P391-D436 WeakPolarHBondContact CG-O 3.12Å; H392-D436 IonicContact CD2-OD2 2.58Å; H392-D436 IonicContact CE1-OD2 2.63Å; H392-D436 IonicContact NE2-OD2 3.92Å; H392-D436 PolarHBondContact NE2-OD2 2.96Å; E432-D436 PolarHBondContact O-N 3.46Å; Q433-D436 PolarHBondContact O-N 2.89Å; Y434-D436 PolarHBondContact O-N 2.82Å; D436-V440 WeakPolarHBondContact O-CG2 3.33Å; D436-V440 PolarHBondContact O-N 2.74Å
437	I	92.4	Very high	90.8	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-48.5	174.7	-70.5	177.1	0	0	0	111.2	L390 P391 I393 L426 L429 Q433 Y434 R435 T439 V440 S441	L390-I437 HydrophobicContact CD1-CG2 4.24Å; L390-I437 HydrophobicContact CD2-CG2 4.46Å; P391-I437 HydrophobicContact CG-CG1 3.98Å; P391-I437 WeakPolarHBondContact O-CD1 3.46Å; P391-I437 VanDerWaalsContact O-CG1 3.23Å; P391-I437 WeakPolarHBondContact O-CG1 3.46Å; I393-I437 HydrophobicContact CD1-CD1 4.17Å; I393-I437 HydrophobicContact CG1-CD1 3.9Å; L426-I437 HydrophobicContact CD1-CD1 4.17Å; L429-I437 HydrophobicContact CD1-CD1 3.33Å; Q433-I437 PolarHBondContact O-N 3.47Å; Y434-I437 PolarHBondContact O-N 2.84Å; R435-I437 VanDerWaalsContact C-N 3.26Å; R435-I437 PolarHBondContact O-N 3.19Å; I437-T439 VanDerWaalsContact C-N 3.35Å; I437-T439 PolarHBondContact O-N 2.79Å; I437-V440 PolarHBondContact O-N 2.86Å; I437-S441 WeakPolarHBondContact O-CB 3.43Å; I437-S441 PolarHBondContact O-N 3.2Å; I437-S441 PolarHBondContact O-OG 3.42Å
438	L	91.4	Very high	91	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-41.9	178.6	-63.5	-176.3	0	0	0	111.8	Y434 R435 S441 S442 L483 V488 A491	Y434-L438 HydrophobicContact CD1-CD1 4.11Å; Y434-L438 HydrophobicContact CD1-CG 4.45Å; Y434-L438 HydrophobicContact CE1-CD1 3.63Å; Y434-L438 HydrophobicContact CE1-CD2 4.42Å; Y434-L438 HydrophobicContact CE1-CG 4.11Å; Y434-L438 HydrophobicContact CE2-CD2 4.35Å; Y434-L438 WeakPolarHBondContact O-CG 3.41Å; Y434-L438 PolarHBondContact O-N 3.14Å; R435-L438 PolarHBondContact O-N 2.99Å; R435-L438 VanDerWaalsContact O-N 3.1Å; L438-S441 PolarHBondContact O-N 2.97Å; L438-S442 PolarHBondContact O-N 3.04Å; L438-S442 PolarHBondContact O-OG 3.27Å; L438-L483 HydrophobicContact CB-CD2 4.19Å; L438-L483 HydrophobicContact CD2-CD2 3.83Å; L438-V488 HydrophobicContact CB-CG1 4.24Å; L438-V488 HydrophobicContact CB-CG2 4.29Å; L438-A491 HydrophobicContact CD1-CB 4.21Å
439	T	90	Very high	91.2	Very high	12 Å²	12	35 Å²	35	7%	0.074	18%	0.175	C	C	.	.	H	α-helix	trans	-60	-48.9	176.9	-62.3	0	0	0	0	111.4	R49 R435 I437 S441 S442 S443	R49-T439 WeakPolarHBondContact O-CG2 3.5Å; R435-T439 WeakPolarHBondContact O-CB 3.27Å; R435-T439 PolarHBondContact O-N 3.48Å; R435-T439 PolarHBondContact O-OG1 2.97Å; R435-T439 VanDerWaalsContact O-OG1 3.07Å; I437-T439 VanDerWaalsContact C-N 3.35Å; I437-T439 PolarHBondContact O-N 2.79Å; T439-S441 VanDerWaalsContact C-N 3.34Å; T439-S441 PolarHBondContact O-N 3.36Å; T439-S442 PolarHBondContact O-N 3.1Å; T439-S442 PolarHBondContact O-OG 3.03Å; T439-S443 PolarHBondContact O-N 2.88Å
440	V	91.8	Very high	91.4	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-62.9	-41.9	175.9	169.8	0	0	0	0	111.4	C51 L390 P391 D436 I437 S442 S443 M444 H742	C51-V440 HydrophobicContact CB-CG2 3.83Å; L390-V440 HydrophobicContact CD2-CG1 4.11Å; P391-V440 HydrophobicContact CG-CB 4.31Å; P391-V440 HydrophobicContact CG-CG2 3.86Å; D436-V440 WeakPolarHBondContact O-CG2 3.33Å; D436-V440 PolarHBondContact O-N 2.74Å; I437-V440 PolarHBondContact O-N 2.86Å; V440-S442 VanDerWaalsContact C-N 3.29Å; V440-S442 PolarHBondContact O-N 3Å; V440-S443 PolarHBondContact O-N 2.71Å; V440-S443 PolarHBondContact O-OG 3.28Å; V440-M444 HydrophobicContact CG1-CE 4.1Å; V440-M444 HydrophobicContact CG1-SD 4.26Å; V440-M444 PolarHBondContact O-N 3.46Å; V440-M444 VanDerWaalsContact O-N 3.07Å; V440-H742 HydrophobicContact CG1-CB 3.75Å; V440-H742 HydrophobicContact CG2-CB 4.33Å; V440-H742 WeakPolarHBondContact CG2-CD2 3.38Å
441	S	91.9	Very high	91.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-32	178.5	-52.1	0	0	0	0	112.7	I415 I437 L438 T439 S443	I415-S441 WeakPolarHBondContact CD1-OG 3.45Å; I437-S441 WeakPolarHBondContact O-CB 3.43Å; I437-S441 PolarHBondContact O-N 3.2Å; I437-S441 PolarHBondContact O-OG 3.42Å; L438-S441 PolarHBondContact O-N 2.97Å; T439-S441 VanDerWaalsContact C-N 3.34Å; T439-S441 PolarHBondContact O-N 3.36Å; S441-S443 VanDerWaalsContact C-N 3.3Å
442	S	89.2	Confident	91.4	Very high	24 Å²	24	39.3 Å²	39.3	17%	0.168	19%	0.185	C	C	.	.	H	α-helix	trans	-74.3	-17	172.7	70.6	0	0	0	0	114.1	L438 T439 V440 P481 L483	L438-S442 PolarHBondContact O-N 3.04Å; L438-S442 PolarHBondContact O-OG 3.27Å; T439-S442 PolarHBondContact O-N 3.1Å; T439-S442 PolarHBondContact O-OG 3.03Å; V440-S442 VanDerWaalsContact C-N 3.29Å; V440-S442 PolarHBondContact O-N 3Å; S442-P481 VanDerWaalsContact O-CB 3.26Å; S442-P481 WeakPolarHBondContact O-CB 3.39Å; S442-L483 WeakPolarHBondContact CA-O 3.33Å; S442-L483 WeakPolarHBondContact CB-O 3.46Å
443	S	87.6	Confident	91.5	Very high	42 Å²	42	35.6 Å²	35.6	29%	0.294	17%	0.172	S	C	.	.	H	α-helix	trans	-88.5	-28.9	172.9	64.3	0	0	0	0	113.4	T439 V440 S441 R479	T439-S443 PolarHBondContact O-N 2.88Å; V440-S443 PolarHBondContact O-N 2.71Å; V440-S443 PolarHBondContact O-OG 3.28Å; S441-S443 VanDerWaalsContact C-N 3.3Å; S443-R479 PolarHBondContact O-NH2 3.48Å
444	M	91.9	Very high	91.2	Very high	9 Å²	9	35 Å²	35	4%	0.044	17%	0.17	C	C	.	.	S	Bend	trans	-63.4	143.2	179.6	-78	170.3	157.3	0	0	112.1	Q389 L390 V411 V440 L482 Y806	Q389-M444 HydrophobicContact CB-CE 3.99Å; L390-M444 HydrophobicContact CD2-CE 4.16Å; L390-M444 HydrophobicContact CD2-SD 4.02Å; V411-M444 HydrophobicContact CG1-SD 3.92Å; V440-M444 HydrophobicContact CG1-CE 4.1Å; V440-M444 HydrophobicContact CG1-SD 4.26Å; V440-M444 PolarHBondContact O-N 3.46Å; V440-M444 VanDerWaalsContact O-N 3.07Å; M444-L482 HydrophobicContact CB-CB 4.24Å; M444-L482 HydrophobicContact CB-CD2 4.16Å; M444-L482 WeakPolarHBondContact O-CB 3.49Å; M444-L482 PolarHBondContact O-N 3.19Å; M444-Y806 HydrophobicContact CE-CD1 3.86Å; M444-Y806 HydrophobicContact CE-CE1 3.83Å; M444-Y806 HydrophobicContact CG-CD1 4.33Å; M444-Y806 HydrophobicContact CG-CE1 3.79Å
445	P	92.4	Very high	90.9	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.019	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	146.3	-176.3	31	-34	0	0	0	113	R479 W754 Y806	P445-R479 HydrophobicContact CB-CG 4.3Å; P445-W754 HydrophobicContact CB-CH2 4.08Å; P445-W754 HydrophobicContact CB-CZ2 3.87Å; P445-W754 HydrophobicContact CG-CH2 3.66Å; P445-W754 HydrophobicContact CG-CZ2 3.68Å; P445-Y806 HydrophobicContact CG-CD2 3.96Å; P445-Y806 HydrophobicContact CG-CE2 3.92Å
446	Y	91.2	Very high	90.2	Very high	83 Å²	83	34.9 Å²	34.9	33%	0.325	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.5	157.6	177.8	-88.5	0	0	0	106.9	E448 K480 L482	Y446-E448 HydrophobicContact CD1-CG 4.27Å; Y446-E448 HydrophobicContact CE1-CG 3.66Å; Y446-K480 HydrophobicContact CD1-CB 4.47Å; Y446-K480 PolarHBondContact N-O 2.81Å; Y446-K480 PolarHBondContact O-N 2.85Å; Y446-L482 HydrophobicContact CD2-CD1 4.25Å
447	L	92.2	Very high	89.1	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.5	175.6	-57.5	-171.8	0	0	0	110.7	L477 K478 R479 W754 L776 V801 F811	L447-L477 HydrophobicContact CD1-CD2 4.32Å; L447-K478 CarbonylContact C-O 3.52Å; L447-K478 WeakPolarHBondContact CA-O 3.45Å; L447-R479 HydrophobicContact CD2-CB 4Å; L447-R479 HydrophobicContact CD2-CG 4.09Å; L447-W754 HydrophobicContact CD1-CD2 3.95Å; L447-W754 HydrophobicContact CD1-CE3 3.69Å; L447-W754 HydrophobicContact CD1-CH2 3.69Å; L447-W754 HydrophobicContact CD1-CZ2 3.94Å; L447-W754 HydrophobicContact CD1-CZ3 3.55Å; L447-W754 HydrophobicContact CD2-CH2 4.28Å; L447-W754 HydrophobicContact CD2-CZ2 4.04Å; L447-W754 HydrophobicContact CG-CH2 3.87Å; L447-W754 HydrophobicContact CG-CZ2 4.12Å; L447-W754 HydrophobicContact CG-CZ3 4.19Å; L447-L776 HydrophobicContact CD2-CD2 3.83Å; L447-V801 HydrophobicContact CD1-CG1 3.96Å; L447-F811 HydrophobicContact CB-CD1 4.24Å; L447-F811 HydrophobicContact CB-CD2 4.39Å; L447-F811 HydrophobicContact CB-CE1 3.75Å; L447-F811 HydrophobicContact CB-CE2 3.95Å; L447-F811 HydrophobicContact CB-CZ 3.6Å; L447-F811 HydrophobicContact CD1-CD2 4.19Å; L447-F811 HydrophobicContact CD1-CE2 4Å; L447-F811 HydrophobicContact CD1-CZ 4.48Å; L447-F811 HydrophobicContact CG-CD2 4.47Å; L447-F811 HydrophobicContact CG-CE2 3.87Å; L447-F811 HydrophobicContact CG-CZ 3.9Å; L447-F811 VanDerWaalsContact O-CE1 3.28Å; L447-F811 WeakPolarHBondContact O-CE1 3.37Å
448	E	92.9	Very high	87.5	Confident	71 Å²	71	45.4 Å²	45.4	33%	0.332	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.1	157.7	-68.6	170.2	-175.9	0	0	107.5	Y446 K478 K480	Y446-E448 HydrophobicContact CD1-CG 4.27Å; Y446-E448 HydrophobicContact CE1-CG 3.66Å; E448-K478 HydrophobicContact CB-CB 4.05Å; E448-K478 PolarHBondContact N-O 3.47Å; E448-K478 PolarHBondContact O-N 3.33Å; E448-K480 WeakPolarHBondContact OE1-CE 3.23Å; E448-K480 IonicContact OE1-NZ 2.71Å; E448-K480 PolarHBondContact OE1-NZ 3.18Å; E448-K480 WeakPolarHBondContact OE2-CE 3.3Å; E448-K480 IonicContact OE2-NZ 3.3Å; E448-K480 PolarHBondContact OE2-NZ 3.45Å
449	L	93	Very high	86	Confident	36 Å²	36	52.1 Å²	52.1	19%	0.188	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.7	-175.4	168.3	57.5	0	0	0	108.4	V475 L477 L799 V801 E813	L449-V475 HydrophobicContact CD1-CG1 3.54Å; L449-L477 HydrophobicContact CB-CD2 4.23Å; L449-L477 HydrophobicContact CD1-CD2 3.69Å; L449-L477 HydrophobicContact CG-CD2 4.48Å; L449-L799 HydrophobicContact CD1-CD2 3.89Å; L449-L799 HydrophobicContact CD2-CD2 4.25Å; L449-L799 HydrophobicContact CD2-CG 4.48Å; L449-L799 HydrophobicContact CG-CD2 4.49Å; L449-V801 HydrophobicContact CD1-CG2 4.36Å; L449-V801 HydrophobicContact CD2-CG2 4.07Å; L449-E813 HydrophobicContact CD2-CB 3.94Å; L449-E813 HydrophobicContact CD2-CG 3.7Å; L449-E813 HydrophobicContact CG-CG 4.15Å
450	S	93.3	Very high	84.5	Confident	53 Å²	53	61 Å²	61	37%	0.371	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	147.3	173.2	44	0	0	0	0	109.7	V476	S450-V476 PolarHBondContact N-O 2.83Å; S450-V476 PolarHBondContact O-N 3.07Å; S450-V476 PolarHBondContact OG-O 3.23Å
451	Y	92.7	Very high	83	Confident	88 Å²	88	68.6 Å²	68.6	35%	0.345	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	157.2	179.5	68.9	-93.9	0	0	0	111.1	T474 E813 C814 I815	Y451-T474 CarbonylContact C-O 3.57Å; Y451-T474 VanDerWaalsContact CA-O 3.31Å; Y451-T474 WeakPolarHBondContact CA-O 3.45Å; Y451-E813 HydrophobicContact CE1-CB 4.39Å; Y451-C814 PolarHBondContact OH-O 3.36Å; Y451-I815 HydrophobicContact CD1-CD1 4.46Å; Y451-I815 HydrophobicContact CD1-CG1 4.28Å; Y451-I815 HydrophobicContact CD2-CD1 3.84Å; Y451-I815 HydrophobicContact CD2-CG1 4.05Å; Y451-I815 HydrophobicContact CE1-CG1 4.06Å; Y451-I815 HydrophobicContact CE2-CB 4.25Å; Y451-I815 HydrophobicContact CE2-CD1 4.12Å; Y451-I815 HydrophobicContact CE2-CG1 3.83Å; Y451-I815 HydrophobicContact CE2-CG2 4.01Å; Y451-I815 HydrophobicContact CG-CD1 4.05Å; Y451-I815 HydrophobicContact CG-CG1 4.28Å
452	R	91.4	Very high	81.6	Confident	104 Å²	104	72 Å²	72	39%	0.392	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	156	162.4	63.4	-176.8	-171.2	-88.2	-3.3	109.1	E454 V473 T474 E781	R452-E454 VanDerWaalsContact CD-OE2 3.24Å; R452-E454 WeakPolarHBondContact CD-OE2 3.4Å; R452-E454 IonicContact CZ-OE1 2.77Å; R452-E454 IonicContact CZ-OE2 3.59Å; R452-E454 IonicContact NE-OE1 3.7Å; R452-E454 PolarHBondContact NE-OE1 2.83Å; R452-E454 IonicContact NE-OE2 3.33Å; R452-E454 PolarHBondContact NE-OE2 3.27Å; R452-E454 IonicContact NH2-OE1 2.78Å; R452-E454 PolarHBondContact NH2-OE1 2.74Å; R452-V473 CarbonylContact O-C 3.57Å; R452-V473 WeakPolarHBondContact O-CA 3.39Å; R452-T474 PolarHBondContact N-O 3.21Å; R452-T474 PolarHBondContact NH2-OG1 3.46Å; R452-T474 PolarHBondContact O-N 2.83Å; R452-E781 IonicContact CZ-OE1 3.88Å; R452-E781 IonicContact NH1-OE1 2.75Å; R452-E781 PolarHBondContact NH1-OE1 3.45Å; R452-E781 IonicContact NH2-OE1 3.89Å; R452-E781 PolarHBondContact NH2-OE1 2.88Å; R452-E781 VanDerWaalsContact NH2-OE1 3.12Å
453	C	89.3	Confident	80.7	Confident	47 Å²	47	75.9 Å²	75.9	32%	0.318	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.4	176.2	-56	0	0	0	0	107.4	T472 I815	C453-T472 WeakPolarHBondContact CA-O 3.36Å; C453-I815 VanDerWaalsContact SG-CG2 3.53Å
454	E	87.4	Confident	80.4	Confident	49 Å²	49	74.1 Å²	74.1	23%	0.229	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	137.7	-172.7	58	-145.6	160.7	0	0	109.1	R452 L456 T472 T474	R452-E454 VanDerWaalsContact CD-OE2 3.24Å; R452-E454 WeakPolarHBondContact CD-OE2 3.4Å; R452-E454 IonicContact CZ-OE1 2.77Å; R452-E454 IonicContact CZ-OE2 3.59Å; R452-E454 IonicContact NE-OE1 3.7Å; R452-E454 PolarHBondContact NE-OE1 2.83Å; R452-E454 IonicContact NE-OE2 3.33Å; R452-E454 PolarHBondContact NE-OE2 3.27Å; R452-E454 IonicContact NH2-OE1 2.78Å; R452-E454 PolarHBondContact NH2-OE1 2.74Å; E454-L456 HydrophobicContact CG-CD2 4.06Å; E454-T472 HydrophobicContact CG-CG2 4.45Å; E454-T472 PolarHBondContact N-O 3.03Å; E454-T472 WeakPolarHBondContact O-CA 3.14Å; E454-T472 WeakPolarHBondContact O-CB 3.38Å; E454-T472 PolarHBondContact O-N 2.96Å; E454-T472 VanDerWaalsContact O-O 3.13Å; E454-T474 WeakPolarHBondContact OE1-CB 3.45Å; E454-T474 PolarHBondContact OE1-OG1 2.8Å
455	V	85.5	Confident	80.2	Confident	26 Å²	26	74.6 Å²	74.6	16%	0.158	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.4	161.1	-177.8	0	0	0	0	104.7	E458 I465	V455-E458 HydrophobicContact CG1-CG 4.37Å; V455-E458 WeakPolarHBondContact CG1-OE1 3.47Å; V455-I465 HydrophobicContact CG2-CB 4.47Å; V455-I465 HydrophobicContact CG2-CG1 3.78Å
456	L	75.6	Confident	80	Confident	68 Å²	68	76.3 Å²	76.3	36%	0.356	39%	0.39	S	S	.	.	S	Bend	trans	-83.4	153	169.3	-58.4	176.4	0	0	0	107.3	E454 T472	E454-L456 HydrophobicContact CG-CD2 4.06Å; L456-T472 HydrophobicContact CD1-CG2 4.27Å
457	D	68.4	Low	80	Confident	171 Å²	171	73.4 Å²	73.4	91%	0.914	38%	0.381	S	S	*	.	S	Bend	trans	82.3	3	177.2	-42.2	-39.9	0	0	0	117.3
458	E	59.4	Low	79.7	Confident	56 Å²	56	75 Å²	75	26%	0.262	39%	0.388	S	S	.	.	S	Bend	trans	-95.4	153.8	162.1	-74.3	175.7	-134.1	0	0	111.3	V455	V455-E458 HydrophobicContact CG1-CG 4.37Å; V455-E458 WeakPolarHBondContact CG1-OE1 3.47Å
459	D	60	Low	79.5	Confident	146 Å²	146	72.6 Å²	72.6	78%	0.781	38%	0.379	S	S	*	.			trans	-56.3	143.1	178.9	-76.8	-57.3	0	0	0	112	D461 D462	D459-D461 PolarHBondContact O-N 3.46Å; D459-D462 PolarHBondContact O-N 3.16Å
460	E	57.5	Low	79.4	Confident	199 Å²	199	74.3 Å²	74.3	93%	0.93	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-19.5	-166.9	-65.4	-170.7	139	0	0	116
461	D	59.8	Low	79.3	Confident	162 Å²	162	71.8 Å²	71.8	87%	0.866	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-26.8	-179	-75.9	-47.5	0	0	0	114.7	D459 S463	D459-D461 PolarHBondContact O-N 3.46Å; D461-S463 PolarHBondContact O-N 2.99Å
462	D	63.2	Low	79.3	Confident	71 Å²	71	67.7 Å²	67.7	38%	0.38	35%	0.353	S	S	.	.			trans	-107	59.4	-164.2	-129.3	-1.7	0	0	0	112.1	D459 S464 R825	D459-D462 PolarHBondContact O-N 3.16Å; D462-S464 PolarHBondContact O-N 3.46Å; D462-R825 IonicContact OD2-NH2 3.19Å
463	S	70.3	Confident	79.4	Confident	105 Å²	105	62.8 Å²	62.8	73%	0.734	34%	0.335	S	S	*	.			trans	-68.7	56.8	-174.6	-39.6	0	0	0	0	115.3	D461	D461-S463 PolarHBondContact O-N 2.99Å
464	S	81.8	Confident	79.7	Confident	6 Å²	6	60.6 Å²	60.6	4%	0.042	32%	0.32	C	S	.	.			trans	-117.4	114	-168	73.3	0	0	0	0	114	D462 W466 R820	D462-S464 PolarHBondContact O-N 3.46Å; S464-W466 PolarHBondContact O-N 2.87Å; S464-W466 PolarHBondContact O-NE1 3.49Å; S464-W466 PolarHBondContact OG-NE1 3.03Å; S464-R820 VanDerWaalsContact CB-NH1 3.32Å
465	I	87.3	Confident	80	Confident	18 Å²	18	58.2 Å²	58.2	9%	0.092	31%	0.309	C	S	.	.			trans	-71.2	123	177.5	-61.2	163.7	0	0	0	109.7	V455 V471 A788 F817 V819 R820	V455-I465 HydrophobicContact CG2-CB 4.47Å; V455-I465 HydrophobicContact CG2-CG1 3.78Å; I465-V471 HydrophobicContact CD1-CG1 3.98Å; I465-V471 HydrophobicContact CD1-CG2 4.07Å; I465-V471 HydrophobicContact CG1-CG2 4.04Å; I465-V471 HydrophobicContact CG2-CG2 3.69Å; I465-A788 HydrophobicContact CG2-CB 3.66Å; I465-F817 HydrophobicContact CD1-CB 3.89Å; I465-F817 HydrophobicContact CD1-CD2 3.97Å; I465-F817 HydrophobicContact CD1-CG 4.3Å; I465-F817 HydrophobicContact CG2-CD2 4.42Å; I465-V819 HydrophobicContact CG2-CG2 4.12Å; I465-V819 CarbonylContact O-C 3.6Å; I465-V819 WeakPolarHBondContact O-CA 3.31Å; I465-R820 PolarHBondContact O-N 2.88Å
466	W	88.7	Confident	80.5	Confident	40 Å²	40	57.8 Å²	57.8	15%	0.152	31%	0.306	C	S	.	.			trans	-105	171	174	-59.2	-19.8	0	0	0	110.5	S464 S469 A788 L822 P823 I826	S464-W466 PolarHBondContact O-N 2.87Å; S464-W466 PolarHBondContact O-NE1 3.49Å; S464-W466 PolarHBondContact OG-NE1 3.03Å; W466-S469 PolarHBondContact O-N 3.25Å; W466-S469 PolarHBondContact O-OG 3.07Å; W466-A788 WeakPolarHBondContact O-CB 3.4Å; W466-L822 HydrophobicContact CB-CD1 3.77Å; W466-L822 HydrophobicContact CD2-CD1 3.65Å; W466-L822 HydrophobicContact CE3-CD1 3.54Å; W466-L822 HydrophobicContact CG-CD1 3.76Å; W466-L822 HydrophobicContact CZ3-CD1 4.46Å; W466-P823 HydrophobicContact CZ2-CG 4.41Å; W466-I826 HydrophobicContact CE3-CD1 4.22Å; W466-I826 HydrophobicContact CH2-CD1 3.34Å; W466-I826 HydrophobicContact CZ2-CD1 3.9Å; W466-I826 HydrophobicContact CZ3-CD1 3.5Å
467	P	89.5	Confident	81.4	Confident	21 Å²	21	54.5 Å²	54.5	14%	0.136	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	144.2	173	-23.4	37.3	0	0	0	110.6	S469 P792 V819 R820	P467-S469 PolarHBondContact O-N 3.15Å; P467-P792 HydrophobicContact CG-CG 4.05Å; P467-V819 HydrophobicContact CB-CG1 4.44Å; P467-V819 HydrophobicContact CG-CG1 3.96Å; P467-R820 WeakPolarHBondContact CD-O 3.5Å
468	F	86.5	Confident	82.6	Confident	39 Å²	39	49.8 Å²	49.8	17%	0.171	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	-3.9	-179.7	-52.6	-85.3	0	0	0	117.1	V787 A788 P790 L880 A888 S889 I892	F468-V787 HydrophobicContact CB-CG1 4.39Å; F468-V787 HydrophobicContact CD1-CG1 4.43Å; F468-A788 WeakPolarHBondContact CA-O 3.38Å; F468-A788 PolarHBondContact N-O 2.87Å; F468-A788 VanDerWaalsContact N-O 3.08Å; F468-P790 HydrophobicContact CD1-CB 4.38Å; F468-P790 HydrophobicContact CD2-CB 4.36Å; F468-P790 HydrophobicContact CE1-CB 3.71Å; F468-P790 HydrophobicContact CE2-CB 3.68Å; F468-P790 HydrophobicContact CZ-CB 3.31Å; F468-L880 HydrophobicContact CD1-CD1 4.14Å; F468-L880 HydrophobicContact CE1-CD1 4.21Å; F468-A888 HydrophobicContact CE1-CB 4.13Å; F468-A888 HydrophobicContact CE2-CB 4.02Å; F468-A888 HydrophobicContact CZ-CB 3.54Å; F468-S889 WeakPolarHBondContact CD2-OG 3.3Å; F468-I892 HydrophobicContact CE2-CD1 4.26Å; F468-I892 HydrophobicContact CZ-CD1 4.07Å
469	S	89	Confident	84.3	Confident	20 Å²	20	48.1 Å²	48.1	14%	0.14	25%	0.252	C	S	.	.			trans	-67	146.4	179	83.1	0	0	0	0	112.4	W466 P467 V471 A788	W466-S469 PolarHBondContact O-N 3.25Å; W466-S469 PolarHBondContact O-OG 3.07Å; P467-S469 PolarHBondContact O-N 3.15Å; S469-V471 PolarHBondContact O-N 3.36Å; S469-A788 VanDerWaalsContact O-CB 3.27Å; S469-A788 WeakPolarHBondContact O-CB 3.42Å; S469-A788 PolarHBondContact O-N 2.62Å
470	M	90.6	Very high	85.8	Confident	71 Å²	71	45.5 Å²	45.5	35%	0.35	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	100.6	-176.9	-178.1	57.4	113.8	0	0	110.7	R785 I877	M470-R785 HydrophobicContact CE-CB 4.14Å; M470-R785 HydrophobicContact SD-CB 3.84Å; M470-I877 HydrophobicContact CE-CD1 4.36Å
471	V	91.6	Very high	87.4	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120	-178.2	-173.8	0	0	0	0	109.9	I465 S469 V473 R785 F786 A788	I465-V471 HydrophobicContact CD1-CG1 3.98Å; I465-V471 HydrophobicContact CD1-CG2 4.07Å; I465-V471 HydrophobicContact CG1-CG2 4.04Å; I465-V471 HydrophobicContact CG2-CG2 3.69Å; S469-V471 PolarHBondContact O-N 3.36Å; V471-V473 HydrophobicContact CG1-CG2 4.39Å; V471-R785 WeakPolarHBondContact O-CA 3.18Å; V471-F786 HydrophobicContact CB-CD1 4.17Å; V471-F786 HydrophobicContact CB-CE1 3.74Å; V471-F786 HydrophobicContact CB-CE2 4.13Å; V471-F786 HydrophobicContact CB-CZ 3.72Å; V471-F786 HydrophobicContact CG1-CD1 4.49Å; V471-F786 HydrophobicContact CG1-CE1 3.71Å; V471-F786 HydrophobicContact CG1-CZ 3.8Å; V471-F786 HydrophobicContact CG2-CE2 4.19Å; V471-F786 HydrophobicContact CG2-CZ 4.07Å; V471-F786 PolarHBondContact N-O 3.24Å; V471-F786 PolarHBondContact O-N 2.87Å; V471-A788 HydrophobicContact CG2-CB 3.95Å
472	T	93.1	Very high	88.8	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.8	169.1	-64.7	0	0	0	0	109.9	C453 E454 L456 Q783 R785	C453-T472 WeakPolarHBondContact CA-O 3.36Å; E454-T472 HydrophobicContact CG-CG2 4.45Å; E454-T472 PolarHBondContact N-O 3.03Å; E454-T472 WeakPolarHBondContact O-CA 3.14Å; E454-T472 WeakPolarHBondContact O-CB 3.38Å; E454-T472 PolarHBondContact O-N 2.96Å; E454-T472 VanDerWaalsContact O-O 3.13Å; L456-T472 HydrophobicContact CD1-CG2 4.27Å; T472-Q783 HydrophobicContact CG2-CB 4.01Å; T472-Q783 HydrophobicContact CG2-CG 3.88Å; T472-R785 HydrophobicContact CG2-CG 4.48Å
473	V	93.3	Very high	89.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	102.6	169.3	-179.5	0	0	0	0	108	R452 V471 V475 L758 L784 F786 I815	R452-V473 CarbonylContact O-C 3.57Å; R452-V473 WeakPolarHBondContact O-CA 3.39Å; V471-V473 HydrophobicContact CG1-CG2 4.39Å; V473-V475 HydrophobicContact CG1-CG2 3.95Å; V473-L758 HydrophobicContact CB-CD1 4.29Å; V473-L758 HydrophobicContact CG2-CD1 3.88Å; V473-L784 HydrophobicContact CB-CB 4.35Å; V473-L784 PolarHBondContact N-O 2.96Å; V473-L784 PolarHBondContact O-N 3.47Å; V473-F786 HydrophobicContact CG2-CD1 4.23Å; V473-F786 HydrophobicContact CG2-CE1 3.68Å; V473-I815 HydrophobicContact CG1-CD1 3.44Å; V473-I815 VanDerWaalsContact CG1-CD1 3.44Å; V473-I815 HydrophobicContact CG2-CD1 4.36Å
474	T	94.3	Very high	90.4	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120.5	175.3	-51.4	0	0	0	0	109.9	Y451 R452 E454 E781 L782 Q783	Y451-T474 CarbonylContact C-O 3.57Å; Y451-T474 VanDerWaalsContact CA-O 3.31Å; Y451-T474 WeakPolarHBondContact CA-O 3.45Å; R452-T474 PolarHBondContact N-O 3.21Å; R452-T474 PolarHBondContact NH2-OG1 3.46Å; R452-T474 PolarHBondContact O-N 2.83Å; E454-T474 WeakPolarHBondContact OE1-CB 3.45Å; E454-T474 PolarHBondContact OE1-OG1 2.8Å; T474-E781 HydrophobicContact CG2-CG 3.58Å; T474-E781 WeakPolarHBondContact CG2-OE1 3.15Å; T474-L782 WeakPolarHBondContact CA-O 3.32Å; T474-Q783 HydrophobicContact CG2-CG 4.17Å
475	V	94.9	Very high	89.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.1	-173.9	179.3	0	0	0	0	109.5	L449 V473 L477 E781 L782 L784 L799	L449-V475 HydrophobicContact CD1-CG1 3.54Å; V473-V475 HydrophobicContact CG1-CG2 3.95Å; V475-L477 HydrophobicContact CG1-CG 4.49Å; V475-E781 WeakPolarHBondContact O-CA 3.34Å; V475-L782 HydrophobicContact CB-CD1 4.17Å; V475-L782 HydrophobicContact CB-CG 4.14Å; V475-L782 PolarHBondContact N-O 3.24Å; V475-L782 PolarHBondContact O-N 3.48Å; V475-L784 HydrophobicContact CG2-CD1 4Å; V475-L784 HydrophobicContact CG2-CG 4.43Å; V475-L799 HydrophobicContact CB-CD2 4.49Å; V475-L799 HydrophobicContact CG1-CD2 4Å; V475-L799 HydrophobicContact CG2-CD1 4.09Å; V475-L799 HydrophobicContact CG2-CD2 3.64Å
476	V	95.4	Very high	89.1	Confident	16 Å²	16	33.5 Å²	33.5	10%	0.097	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.9	176.3	177.3	0	0	0	0	109.2	S450 E779 E781	S450-V476 PolarHBondContact N-O 2.83Å; S450-V476 PolarHBondContact O-N 3.07Å; S450-V476 PolarHBondContact OG-O 3.23Å; V476-E779 HydrophobicContact CG1-CG 4.08Å; V476-E781 HydrophobicContact CG2-CB 4.09Å; V476-E781 HydrophobicContact CG2-CG 3.79Å
477	L	94.7	Very high	87.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.9	176.7	-71.1	-179.1	0	0	0	111.1	L447 L449 V475 I756 I773 L776 E779 E780 V801	L447-L477 HydrophobicContact CD1-CD2 4.32Å; L449-L477 HydrophobicContact CB-CD2 4.23Å; L449-L477 HydrophobicContact CD1-CD2 3.69Å; L449-L477 HydrophobicContact CG-CD2 4.48Å; V475-L477 HydrophobicContact CG1-CG 4.49Å; L477-I756 HydrophobicContact CD1-CD1 3.49Å; L477-I756 VanDerWaalsContact CD1-CD1 3.49Å; L477-I773 HydrophobicContact CD1-CD1 3.76Å; L477-L776 HydrophobicContact CB-CD1 4.38Å; L477-L776 HydrophobicContact CB-CD2 4.12Å; L477-L776 HydrophobicContact CD1-CD2 4.29Å; L477-E779 CarbonylContact O-C 3.56Å; L477-E779 VanDerWaalsContact O-CA 3.26Å; L477-E779 WeakPolarHBondContact O-CA 3.37Å; L477-E780 PolarHBondContact N-O 3.48Å; L477-E780 PolarHBondContact O-N 2.8Å; L477-V801 HydrophobicContact CD1-CG1 4.14Å; L477-V801 HydrophobicContact CD2-CG1 4.18Å; L477-V801 HydrophobicContact CD2-CG2 4.23Å
478	K	94.8	Very high	86.8	Confident	71 Å²	71	32.7 Å²	32.7	31%	0.309	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.2	177.7	-82.2	165.8	174.5	153.9	0	110.8	L447 E448 T778 E779	L447-K478 CarbonylContact C-O 3.52Å; L447-K478 WeakPolarHBondContact CA-O 3.45Å; E448-K478 HydrophobicContact CB-CB 4.05Å; E448-K478 PolarHBondContact N-O 3.47Å; E448-K478 PolarHBondContact O-N 3.33Å; K478-T778 CarbonylContact C-O 3.56Å; K478-T778 WeakPolarHBondContact CA-O 3.48Å; K478-E779 WeakPolarHBondContact CE-OE1 3.48Å; K478-E779 WeakPolarHBondContact CE-OE2 3.31Å; K478-E779 HydrophobicContact CG-CB 4.38Å; K478-E779 HydrophobicContact CG-CG 4.07Å; K478-E779 IonicContact NZ-OE1 2.62Å; K478-E779 PolarHBondContact NZ-OE1 2.87Å; K478-E779 IonicContact NZ-OE2 2.86Å
479	R	93.5	Very high	85.6	Confident	22 Å²	22	33.3 Å²	33.3	8%	0.083	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.4	-179	-171	-170.4	-177.1	-72.2	-6.4	111	S443 P445 L447 H739 E752 L776 Q777 T778	S443-R479 PolarHBondContact O-NH2 3.48Å; P445-R479 HydrophobicContact CB-CG 4.3Å; L447-R479 HydrophobicContact CD2-CB 4Å; L447-R479 HydrophobicContact CD2-CG 4.09Å; R479-H739 PolarHBondContact NE-ND1 2.85Å; R479-H739 PolarHBondContact NH1-CD2 2.97Å; R479-H739 PolarHBondContact NH1-CE1 2.82Å; R479-H739 PolarHBondContact NH1-NE2 3.21Å; R479-E752 IonicContact CZ-OE1 2.59Å; R479-E752 IonicContact CZ-OE2 3.46Å; R479-E752 VanDerWaalsContact CZ-OE2 3.31Å; R479-E752 IonicContact NE-OE1 3.16Å; R479-E752 IonicContact NE-OE2 2.63Å; R479-E752 PolarHBondContact NE-OE2 3.29Å; R479-E752 VanDerWaalsContact NH2-CD 3.29Å; R479-E752 IonicContact NH2-OE1 2.75Å; R479-E752 PolarHBondContact NH2-OE1 3.33Å; R479-E752 IonicContact NH2-OE2 2.71Å; R479-E752 PolarHBondContact NH2-OE2 2.82Å; R479-L776 HydrophobicContact CB-CD1 4.17Å; R479-L776 HydrophobicContact CB-CD2 4.23Å; R479-L776 HydrophobicContact CB-CG 4.03Å; R479-Q777 WeakPolarHBondContact CD-O 3.36Å; R479-T778 PolarHBondContact N-O 3.32Å
480	K	91.8	Very high	84.1	Confident	91 Å²	91	36 Å²	36	40%	0.396	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	154.8	171	-62.8	-178.5	-173.9	172.7	0	109.9	Y446 E448	Y446-K480 HydrophobicContact CD1-CB 4.47Å; Y446-K480 PolarHBondContact N-O 2.81Å; Y446-K480 PolarHBondContact O-N 2.85Å; E448-K480 WeakPolarHBondContact OE1-CE 3.23Å; E448-K480 IonicContact OE1-NZ 2.71Å; E448-K480 PolarHBondContact OE1-NZ 3.18Å; E448-K480 WeakPolarHBondContact OE2-CE 3.3Å; E448-K480 IonicContact OE2-NZ 3.3Å; E448-K480 PolarHBondContact OE2-NZ 3.45Å
481	P	90.5	Very high	82.5	Confident	47 Å²	47	34.2 Å²	34.2	31%	0.305	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	140.3	169.6	30.5	-34.4	0	0	0	110.2	S442 L483	S442-P481 VanDerWaalsContact O-CB 3.26Å; S442-P481 WeakPolarHBondContact O-CB 3.39Å; P481-L483 PolarHBondContact O-N 3.44Å
482	L	89.6	Confident	80.7	Confident	23 Å²	23	37.5 Å²	37.5	12%	0.12	21%	0.214	C	C	.	.	S	Bend	trans	-66.8	-20.8	-179.8	-179.7	64.6	0	0	0	113.3	V411 R412 I415 M444 Y446	V411-L482 HydrophobicContact CG1-CD2 3.87Å; R412-L482 HydrophobicContact CB-CD1 4.28Å; R412-L482 HydrophobicContact CG-CD1 4.01Å; I415-L482 HydrophobicContact CG1-CD2 4.47Å; M444-L482 HydrophobicContact CB-CB 4.24Å; M444-L482 HydrophobicContact CB-CD2 4.16Å; M444-L482 WeakPolarHBondContact O-CB 3.49Å; M444-L482 PolarHBondContact O-N 3.19Å; Y446-L482 HydrophobicContact CD2-CD1 4.25Å
483	L	87.1	Confident	78.7	Confident	20 Å²	20	43.1 Å²	43.1	11%	0.105	24%	0.244	C	C	.	.	S	Bend	trans	-136.6	131.7	169.3	177.1	64.4	0	0	0	109	I415 L438 S442 P481 P485 A487 V488	I415-L483 HydrophobicContact CG2-CB 4.04Å; I415-L483 HydrophobicContact CG2-CD1 4.12Å; L438-L483 HydrophobicContact CB-CD2 4.19Å; L438-L483 HydrophobicContact CD2-CD2 3.83Å; S442-L483 WeakPolarHBondContact CA-O 3.33Å; S442-L483 WeakPolarHBondContact CB-O 3.46Å; P481-L483 PolarHBondContact O-N 3.44Å; L483-P485 WeakPolarHBondContact O-CD 3.48Å; L483-A487 HydrophobicContact CD1-CB 4.07Å; L483-V488 HydrophobicContact CD2-CG2 4.2Å
484	D	81	Confident	76.6	Confident	83 Å²	83	46.7 Å²	46.7	44%	0.444	27%	0.274	S	S	.	.			trans	-56.1	122.4	175.5	-178.2	-7.6	0	0	0	110.7	N486 A487	D484-N486 PolarHBondContact O-N 2.88Å; D484-N486 VanDerWaalsContact O-N 3.07Å; D484-N486 WeakPolarHBondContact OD1-CB 3.45Å; D484-N486 PolarHBondContact OD1-N 2.95Å; D484-N486 PolarHBondContact OD1-ND2 3.48Å; D484-A487 WeakPolarHBondContact O-CB 3.39Å; D484-A487 PolarHBondContact O-N 3.5Å
485	P	71.2	Confident	74.3	Confident	35 Å²	35	52.5 Å²	52.5	23%	0.227	31%	0.305	C	S	.	.	H	α-helix	trans	-51.9	-28.1	174.3	-28.5	36.4	0	0	0	114.5	L483 V488	L483-P485 WeakPolarHBondContact O-CD 3.48Å; P485-V488 WeakPolarHBondContact O-CB 3.38Å; P485-V488 PolarHBondContact O-N 2.97Å
486	N	69.7	Low	71.5	Confident	100 Å²	100	55.1 Å²	55.1	54%	0.535	33%	0.332	S	S	.	.	H	α-helix	trans	-71.1	-28.5	177.3	-58.6	-62.6	0	0	0	112.8	D484 V488 S489 S490	D484-N486 PolarHBondContact O-N 2.88Å; D484-N486 VanDerWaalsContact O-N 3.07Å; D484-N486 WeakPolarHBondContact OD1-CB 3.45Å; D484-N486 PolarHBondContact OD1-N 2.95Å; D484-N486 PolarHBondContact OD1-ND2 3.48Å; N486-V488 PolarHBondContact O-N 3.33Å; N486-S489 PolarHBondContact O-N 2.93Å; N486-S489 PolarHBondContact O-OG 3.39Å; N486-S490 PolarHBondContact O-N 3.48Å; N486-S490 PolarHBondContact O-OG 3.31Å; N486-S490 VanDerWaalsContact O-OG 3.12Å
487	A	63.7	Low	68.6	Low	32 Å²	32	62.3 Å²	62.3	26%	0.264	36%	0.364	S	S	.	.	H	α-helix	trans	-64.1	-32.6	172.3	0	0	0	0	0	111.3	L483 D484 S490 A491	L483-A487 HydrophobicContact CD1-CB 4.07Å; D484-A487 WeakPolarHBondContact O-CB 3.39Å; D484-A487 PolarHBondContact O-N 3.5Å; A487-S490 PolarHBondContact O-N 2.63Å; A487-A491 WeakPolarHBondContact O-CB 3.26Å; A487-A491 PolarHBondContact O-N 3.22Å
488	V	66.4	Low	65.6	Low	13 Å²	13	68.5 Å²	68.5	8%	0.079	40%	0.402	C	S	.	.	H	α-helix	trans	-67.1	-40	177.8	-167.4	0	0	0	0	111.3	L438 L483 P485 N486 M492	L438-V488 HydrophobicContact CB-CG1 4.24Å; L438-V488 HydrophobicContact CB-CG2 4.29Å; L483-V488 HydrophobicContact CD2-CG2 4.2Å; P485-V488 WeakPolarHBondContact O-CB 3.38Å; P485-V488 PolarHBondContact O-N 2.97Å; N486-V488 PolarHBondContact O-N 3.33Å; V488-M492 HydrophobicContact CG1-CE 4.35Å; V488-M492 WeakPolarHBondContact O-CG 3.29Å; V488-M492 PolarHBondContact O-N 3.43Å
489	S	60.5	Low	62.7	Low	51 Å²	51	70.9 Å²	70.9	36%	0.357	42%	0.423	S	S	.	.	H	α-helix	trans	-74.7	-34.5	176	56.2	0	0	0	0	112.7	N486 M492 N493	N486-S489 PolarHBondContact O-N 2.93Å; N486-S489 PolarHBondContact O-OG 3.39Å; S489-M492 WeakPolarHBondContact O-CB 3.48Å; S489-M492 PolarHBondContact O-N 3.38Å; S489-N493 PolarHBondContact O-N 2.99Å
490	S	58.5	Low	59.7	Low	76 Å²	76	77.2 Å²	77.2	53%	0.531	46%	0.458	S	S	.	.	H	α-helix	trans	-60.4	-43.7	170.7	-61.5	0	0	0	0	112.1	N486 A487 M492 N493 A494	N486-S490 PolarHBondContact O-N 3.48Å; N486-S490 PolarHBondContact O-OG 3.31Å; N486-S490 VanDerWaalsContact O-OG 3.12Å; A487-S490 PolarHBondContact O-N 2.63Å; S490-M492 VanDerWaalsContact C-N 3.29Å; S490-M492 PolarHBondContact O-N 3.22Å; S490-N493 PolarHBondContact O-N 2.75Å; S490-A494 PolarHBondContact O-N 2.59Å
491	A	56	Low	57.1	Low	34 Å²	34	79.4 Å²	79.4	28%	0.281	48%	0.48	S	S	.	.	H	α-helix	trans	-65.5	-27.3	175.7	0	0	0	0	0	113.6	L438 A487	L438-A491 HydrophobicContact CD1-CB 4.21Å; A487-A491 WeakPolarHBondContact O-CB 3.26Å; A487-A491 PolarHBondContact O-N 3.22Å
492	M	54.3	Low	54.3	Low	70 Å²	70	84.7 Å²	84.7	35%	0.345	51%	0.505	S	S	.	.	H	α-helix	trans	-70.7	-46.1	170.7	-70.1	176.8	178.4	0	0	111.8	R435 V488 S489 S490	R435-M492 HydrophobicContact CG-CE 3.88Å; V488-M492 HydrophobicContact CG1-CE 4.35Å; V488-M492 WeakPolarHBondContact O-CG 3.29Å; V488-M492 PolarHBondContact O-N 3.43Å; S489-M492 WeakPolarHBondContact O-CB 3.48Å; S489-M492 PolarHBondContact O-N 3.38Å; S490-M492 VanDerWaalsContact C-N 3.29Å; S490-M492 PolarHBondContact O-N 3.22Å
493	N	51.8	Low	51.7	Low	120 Å²	120	90 Å²	90	64%	0.642	54%	0.539	S	S	*	.	H	α-helix	trans	-76.6	-30.6	-170.7	-68.9	-9.2	0	0	0	113.3	S489 S490 N495 G496	S489-N493 PolarHBondContact O-N 2.99Å; S490-N493 PolarHBondContact O-N 2.75Å; N493-N495 PolarHBondContact O-N 3.24Å; N493-G496 PolarHBondContact O-N 3.07Å
494	A	49.7	Very low	49.1	Very low	76 Å²	76	95.9 Å²	95.9	63%	0.628	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-58.2	-31.1	-179.7	0	0	0	0	0	113.6	S490 G496	S490-A494 PolarHBondContact O-N 2.59Å; A494-G496 VanDerWaalsContact C-N 3.32Å; A494-G496 PolarHBondContact O-N 3.01Å
495	N	45.2	Very low	47	Very low	122 Å²	122	98.7 Å²	98.7	65%	0.652	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-86.7	3	179.6	-68.8	-9.3	0	0	0	113.7	N493	N493-N495 PolarHBondContact O-N 3.24Å
496	G	35.7	Very low	45.2	Very low	55 Å²	55	102 Å²	102	57%	0.567	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-95.4	-14	-175.5	0	0	0	0	0	116.3	N493 A494	N493-G496 PolarHBondContact O-N 3.07Å; A494-G496 VanDerWaalsContact C-N 3.32Å; A494-G496 PolarHBondContact O-N 3.01Å
497	H	35.1	Very low	43.7	Very low	167 Å²	167	104 Å²	104	77%	0.773	62%	0.62	S	S	*	*			trans	-128	79.6	-171.6	-81.6	-46.9	0	0	0	113.9
498	T	32.2	Very low	42.3	Very low	131 Å²	131	108.1 Å²	108.1	80%	0.804	65%	0.646	S	S	*	*			trans	-119.4	64.3	165.4	52.7	0	0	0	0	111.4
499	T	34.2	Very low	40.8	Very low	120 Å²	120	111.4 Å²	111.4	74%	0.736	68%	0.682	S	S	*	*			trans	-128	88	175.6	51.1	0	0	0	0	111.5
500	N	29.7	Very low	39.4	Very low	156 Å²	156	115.1 Å²	115.1	83%	0.834	70%	0.703	S	S	*	*			trans	14.1	103.4	161.7	-60.8	-12.4	0	0	0	119.5
501	T	36.2	Very low	38.1	Very low	137 Å²	137	116.9 Å²	116.9	84%	0.84	71%	0.711	S	S	*	*			trans	-140.6	110.3	142.2	44.6	0	0	0	0	110.3
502	N	32	Very low	37	Very low	158 Å²	158	122.1 Å²	122.1	85%	0.845	73%	0.734	S	S	*	*			trans	-88.9	120.3	172.5	-71.6	-27.9	0	0	0	110
503	T	35.3	Very low	35.9	Very low	135 Å²	135	124.1 Å²	124.1	83%	0.828	76%	0.755	S	S	*	*			trans	-136.9	125.2	156.6	-54.7	0	0	0	0	109.1
504	I	33	Very low	35.1	Very low	143 Å²	143	124.3 Å²	124.3	73%	0.733	76%	0.763	S	S	*	*			trans	-104.7	126.7	-176.2	-60.1	166.1	0	0	0	109	T506	I504-T506 HydrophobicContact CG2-CG2 4.16Å
505	T	37.2	Very low	34.2	Very low	142 Å²	142	126.7 Å²	126.7	87%	0.871	77%	0.77	S	S	*	*			trans	-141.9	143.2	153.2	30.5	0	0	0	0	109.5
506	T	32.4	Very low	33.5	Very low	105 Å²	105	126.7 Å²	126.7	64%	0.644	77%	0.774	S	S	*	*			trans	-123.1	149.5	-170.3	56	0	0	0	0	110.7	I504	I504-T506 HydrophobicContact CG2-CG2 4.16Å
507	N	38.7	Very low	33.2	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	79%	0.791	S	S	*	*				175.7	134.2	114.5	-84.1	-9.8	0	0	0	114.1
508	S	34.3	Very low	33.1	Very low	118 Å²	118	129.9 Å²	129.9	83%	0.825	79%	0.79	S	S	*	*			trans	-13.4	139.3	154.4	54.2	0	0	0	0	120.4
509	G	34.3	Very low	32.8	Very low	81 Å²	81	132 Å²	132	84%	0.835	80%	0.796	S	S	*	*			trans	-164.8	109	159.5	0	0	0	0	0	111.8
510	T	32.7	Very low	32.8	Very low	130 Å²	130	131.6 Å²	131.6	80%	0.798	80%	0.798	S	S	*	*			trans	-91.5	158.2	-167.1	38.2	0	0	0	0	116.1
511	T	31.3	Very low	32.6	Very low	112 Å²	112	129.4 Å²	129.4	69%	0.687	80%	0.795	S	S	*	*			trans	74.9	114.2	146	44.1	0	0	0	0	122.3
512	N	32.4	Very low	32.3	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	80%	0.797	S	S	*	*				92	130.4	122.4	-64.5	-2.7	0	0	0	123.1
513	S	30.8	Very low	32.1	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	80%	0.797	S	S	*	*			trans	89.3	142.9	149.2	-60.7	0	0	0	0	119.4
514	P	35.8	Very low	31.8	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	80%	0.799	S	S	*	*			trans	-108	145.4	-169.9	39.3	-30.5	0	0	0	114.1
515	T	29.3	Very low	31.5	Very low	126 Å²	126	140.8 Å²	140.8	77%	0.773	81%	0.805	S	S	*	*			trans	-149.6	128.2	171.1	-15.5	0	0	0	0	112.3
516	T	31.1	Very low	30.9	Very low	121 Å²	121	137.3 Å²	137.3	74%	0.742	80%	0.798	S	S	*	*			trans	36.9	115.8	149	53.6	0	0	0	0	120.3
517	L	29.3	Very low	30.6	Very low	174 Å²	174	141.4 Å²	141.4	91%	0.911	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-61.4	138.9	148.3	-69.5	162.6	0	0	0	110.3
518	P	32.3	Very low	30	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-100.1	135.5	155.7	34.3	-26.8	0	0	0	110.6
519	D	27.3	Very low	29.5	Very low	175 Å²	175	144 Å²	144	94%	0.936	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-65.2	140.3	165.2	-73.6	-59.4	0	0	0	110.7
520	S	32.6	Very low	29.2	Very low	112 Å²	112	148.5 Å²	148.5	78%	0.783	82%	0.815	S	S	*	*			trans	-148.3	97.7	166.4	-171.6	0	0	0	0	109.8
521	S	27.2	Very low	29	Very low	109 Å²	109	148.4 Å²	148.4	76%	0.762	81%	0.809	S	S	*	*			trans	-66.3	130.4	170.7	55.6	0	0	0	0	110.7
522	Y	30.1	Very low	28.7	Very low	227 Å²	227	148.2 Å²	148.2	89%	0.89	80%	0.804	S	S	*	*			trans	-146.1	126.6	149.9	-127.1	-88.9	0	0	0	111.4
523	F	26.9	Very low	28.6	Very low	194 Å²	194	149.1 Å²	149.1	85%	0.851	80%	0.797	S	S	*	*			trans	-72.1	131.2	164.3	-108.7	-105.2	0	0	0	108.3
524	D	28.5	Very low	28.6	Very low	159 Å²	159	147.8 Å²	147.8	85%	0.85	78%	0.781	S	S	*	*			trans	-142.6	154.9	147.6	-154.5	-0.3	0	0	0	111.3
525	R	27.4	Very low	28.4	Very low	233 Å²	233	144 Å²	144	88%	0.879	76%	0.76	S	S	*	*			trans	-102.8	122.2	-173.3	-73.7	171.1	162.7	167.3	-6.5	110.9
526	G	25.2	Very low	28.6	Very low	69 Å²	69	143.3 Å²	143.3	71%	0.711	74%	0.744	S	S	*	*			trans	141.6	150.7	154.6	0	0	0	0	0	114.7
527	Q	25.6	Very low	28.7	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	73%	0.734	S	S	*	*			trans	57.3	55.6	167.9	-54.2	-174.4	12.9	0	0	115.2	M529	Q527-M529 PolarHBondContact O-N 2.85Å
528	T	25.7	Very low	28.7	Very low	142 Å²	142	138 Å²	138	87%	0.871	71%	0.712	S	S	*	*			trans	-57.3	107.4	145.5	37.4	0	0	0	0	108	Q530	T528-Q530 PolarHBondContact O-N 2.94Å
529	M	24.5	Very low	28.7	Very low	172 Å²	172	138.8 Å²	138.8	85%	0.847	71%	0.71	S	S	*	*			trans	-59.1	114.9	173.7	-87.5	-178.2	65.1	0	0	109	Q527 L531	Q527-M529 PolarHBondContact O-N 2.85Å; M529-L531 VanDerWaalsContact C-N 3.29Å; M529-L531 PolarHBondContact O-N 3.32Å
530	Q	26.5	Very low	28.8	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.822	69%	0.691	S	S	*	*			trans	-71.1	85.6	179.9	-169.1	172.5	9	0	0	109.4	T528 D532	T528-Q530 PolarHBondContact O-N 2.94Å; Q530-D532 PolarHBondContact O-N 2.85Å; Q530-D532 VanDerWaalsContact O-N 3.16Å
531	L	28.2	Very low	28.7	Very low	129 Å²	129	134.1 Å²	134.1	68%	0.675	68%	0.683	S	S	*	*			trans	-57.8	117.1	170.3	-79.6	165.5	0	0	0	108.4	M529 W533	M529-L531 VanDerWaalsContact C-N 3.29Å; M529-L531 PolarHBondContact O-N 3.32Å; L531-W533 VanDerWaalsContact C-N 3.32Å; L531-W533 PolarHBondContact O-N 3.12Å
532	D	26.8	Very low	28.8	Very low	107 Å²	107	133.2 Å²	133.2	57%	0.572	67%	0.669	S	S	*	*			trans	-78	77.5	-165.5	-172.7	23.9	0	0	0	112.8	Q530 N534	Q530-D532 PolarHBondContact O-N 2.85Å; Q530-D532 VanDerWaalsContact O-N 3.16Å; D532-N534 PolarHBondContact O-N 3.47Å; D532-N534 VanDerWaalsContact OD1-CB 3.32Å; D532-N534 WeakPolarHBondContact OD1-CB 3.49Å; D532-N534 PolarHBondContact OD1-N 3.01Å; D532-N534 PolarHBondContact OD1-ND2 2.98Å
533	W	30.2	Very low	28.7	Very low	164 Å²	164	124.6 Å²	124.6	62%	0.621	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-67.8	-11.6	176.1	-71.8	102.2	0	0	0	113.5	L531 A535 Y536	L531-W533 VanDerWaalsContact C-N 3.32Å; L531-W533 PolarHBondContact O-N 3.12Å; W533-A535 PolarHBondContact O-N 2.98Å; W533-Y536 PolarHBondContact O-N 3.07Å
534	N	30	Very low	28.8	Very low	85 Å²	85	118 Å²	118	46%	0.455	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-61	-19.2	177.5	-55.8	-65	0	0	0	112.9	D532 Y536 N537	D532-N534 PolarHBondContact O-N 3.47Å; D532-N534 VanDerWaalsContact OD1-CB 3.32Å; D532-N534 WeakPolarHBondContact OD1-CB 3.49Å; D532-N534 PolarHBondContact OD1-N 3.01Å; D532-N534 PolarHBondContact OD1-ND2 2.98Å; N534-Y536 PolarHBondContact O-N 3.16Å; N534-N537 PolarHBondContact O-N 2.92Å
535	A	32.6	Very low	28.9	Very low	45 Å²	45	119.1 Å²	119.1	37%	0.372	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-55.9	-13.7	173.3	0	0	0	0	0	114.8	Q46 W533	Q46-A535 PolarHBondContact NE2-O 2.8Å; W533-A535 PolarHBondContact O-N 2.98Å
536	Y	33	Very low	29	Very low	111 Å²	111	112 Å²	112	44%	0.435	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-105.5	-18.9	173.3	-96.7	-114.4	0	0	0	115.3	R49 W533 N534	R49-Y536 VanDerWaalsContact CB-OH 3.29Å; R49-Y536 WeakPolarHBondContact CB-OH 3.13Å; R49-Y536 WeakPolarHBondContact CD-OH 3.41Å; R49-Y536 VanDerWaalsContact NH1-CE2 3.33Å; W533-Y536 PolarHBondContact O-N 3.07Å; N534-Y536 PolarHBondContact O-N 3.16Å
537	N	32.1	Very low	29.1	Very low	98 Å²	98	113.8 Å²	113.8	52%	0.524	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.7	-7.8	-170.4	-75.9	5.5	0	0	0	114.5	N534 N539	N534-N537 PolarHBondContact O-N 2.92Å; N537-N539 PolarHBondContact O-N 2.97Å
538	N	30.7	Very low	29.2	Very low	84 Å²	84	109.3 Å²	109.3	45%	0.449	57%	0.567	S	S	.	*			trans	-81.6	36.2	-177.7	-66.5	0.1	0	0	0	114.2
539	N	31.7	Very low	29.2	Very low	133 Å²	133	108.9 Å²	108.9	71%	0.711	56%	0.558	S	S	*	*			trans	-103.7	74.9	174.1	-128.5	0.7	0	0	0	109.4	N537 S541	N537-N539 PolarHBondContact O-N 2.97Å; N539-S541 PolarHBondContact O-N 3.03Å; N539-S541 VanDerWaalsContact O-N 3.15Å
540	D	30.1	Very low	29.3	Very low	102 Å²	102	103.3 Å²	103.3	55%	0.545	54%	0.539	S	S	.	.			trans	-62.8	111.2	-167.2	-134.7	-27.1	0	0	0	113.2	L542	D540-L542 PolarHBondContact O-N 2.96Å
541	S	29.2	Very low	29.3	Very low	87 Å²	87	101.8 Å²	101.8	61%	0.608	54%	0.536	S	S	*	.	S	Bend	trans	49.5	39.5	141.8	55.8	0	0	0	0	119.6	N539	N539-S541 PolarHBondContact O-N 3.03Å; N539-S541 VanDerWaalsContact O-N 3.15Å
542	L	29.4	Very low	29.4	Very low	91 Å²	91	100.5 Å²	100.5	48%	0.476	53%	0.529	S	S	.	.	S	Bend	trans	-124.1	-1.8	-178.5	-98	158.4	0	0	0	118.8	D540	D540-L542 PolarHBondContact O-N 2.96Å
543	N	29.1	Very low	29.6	Very low	45 Å²	45	104.7 Å²	104.7	24%	0.241	55%	0.545	C	S	.	.	S	Bend	trans	-117.2	-6.1	176.7	-80.1	-18.5	0	0	0	114.8	K545 L546 E749 F751	N543-K545 PolarHBondContact O-N 3.05Å; N543-K545 VanDerWaalsContact O-N 3.14Å; N543-L546 HydrophobicContact CB-CD1 4.3Å; N543-L546 PolarHBondContact O-N 2.91Å; N543-E749 PolarHBondContact ND2-OE2 3.17Å; N543-F751 HydrophobicContact CB-CE2 4.18Å; N543-F751 HydrophobicContact CB-CZ 4.34Å
544	S	28.6	Very low	29.5	Very low	57 Å²	57	100 Å²	100	40%	0.399	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-10.8	170.7	52.6	0	0	0	0	113.9
545	K	31	Very low	29.5	Very low	181 Å²	181	101.8 Å²	101.8	79%	0.787	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	39.2	172.9	-58.8	-164.3	175.7	-163.8	0	112.7	N543 Y547	N543-K545 PolarHBondContact O-N 3.05Å; N543-K545 VanDerWaalsContact O-N 3.14Å; K545-Y547 VanDerWaalsContact C-N 3.31Å; K545-Y547 CarbonylContact C-O 3.53Å
546	L	28.6	Very low	29.3	Very low	85 Å²	85	108.1 Å²	108.1	45%	0.445	58%	0.583	S	S	.	*	S	Bend	trans	-78.1	-17.7	168.7	-98.5	162.2	0	0	0	112.8	N543	N543-L546 HydrophobicContact CB-CD1 4.3Å; N543-L546 PolarHBondContact O-N 2.91Å
547	Y	27.8	Very low	29.1	Very low	105 Å²	105	110 Å²	110	41%	0.412	61%	0.607	S	S	.	*	S	Bend	trans	-100.6	126.2	150.4	-61.9	-59.1	0	0	0	109.2	R333 K545 I549	R333-Y547 WeakPolarHBondContact CD-OH 3.4Å; R333-Y547 HydrophobicContact CG-CE1 4.28Å; R333-Y547 WeakPolarHBondContact CG-OH 3.41Å; K545-Y547 VanDerWaalsContact C-N 3.31Å; K545-Y547 CarbonylContact C-O 3.53Å; Y547-I549 PolarHBondContact O-N 3.14Å
548	P	26.6	Very low	28.9	Very low	97 Å²	97	113.7 Å²	113.7	63%	0.63	63%	0.625	S	S	*	*			trans	-78.6	101.1	161.8	31.6	-27.8	0	0	0	107.8	A550	P548-A550 PolarHBondContact O-N 2.75Å; P548-A550 VanDerWaalsContact O-N 3.14Å
549	I	26	Very low	29	Very low	133 Å²	133	119.2 Å²	119.2	68%	0.682	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-55.9	118.6	152.1	-66.3	164.6	0	0	0	105.4	Y547	Y547-I549 PolarHBondContact O-N 3.14Å
550	A	27.9	Very low	28.8	Very low	55 Å²	55	118 Å²	118	46%	0.455	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-71.7	128.7	166.5	0	0	0	0	0	107	P548 I552	P548-A550 PolarHBondContact O-N 2.75Å; P548-A550 VanDerWaalsContact O-N 3.14Å; A550-I552 VanDerWaalsContact O-CG1 3.26Å; A550-I552 WeakPolarHBondContact O-CG1 3.41Å; A550-I552 PolarHBondContact O-N 3.26Å
551	D	26.5	Very low	28.9	Very low	144 Å²	144	121.5 Å²	121.5	77%	0.77	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-59.2	121.4	-171.3	-52.4	-79.3	0	0	0	111
552	I	29.5	Very low	29	Very low	101 Å²	101	123.8 Å²	123.8	52%	0.518	67%	0.67	S	S	.	*			trans	-115.9	86.9	176.4	-48.6	-157.5	0	0	0	108.6	W213 A550	W213-I552 HydrophobicContact CH2-CD1 4.47Å; W213-I552 HydrophobicContact CH2-CG2 4.01Å; W213-I552 HydrophobicContact CZ2-CB 4.1Å; W213-I552 HydrophobicContact CZ2-CD1 3.76Å; W213-I552 HydrophobicContact CZ2-CG1 3.72Å; W213-I552 HydrophobicContact CZ2-CG2 3.77Å; A550-I552 VanDerWaalsContact O-CG1 3.26Å; A550-I552 WeakPolarHBondContact O-CG1 3.41Å; A550-I552 PolarHBondContact O-N 3.26Å
553	H	30.4	Very low	29	Very low	196 Å²	196	125.9 Å²	125.9	91%	0.907	67%	0.673	S	S	*	*			trans	-103	111.4	158.3	-84.7	-74	0	0	0	107.7
554	G	29.3	Very low	29.3	Very low	64 Å²	64	129.8 Å²	129.8	66%	0.66	69%	0.694	S	S	*	*			trans	167.7	106.2	178.6	0	0	0	0	0	111
555	T	29.1	Very low	29.7	Very low	124 Å²	124	135 Å²	135	76%	0.761	72%	0.717	S	S	*	*			trans	-77.4	150.3	174.4	43.8	0	0	0	0	111.4
556	E	28.8	Very low	29.9	Very low	178 Å²	178	135.6 Å²	135.6	83%	0.832	72%	0.72	S	S	*	*			trans	50.2	106.6	151.9	-67.5	166.9	-156.5	0	0	119
557	T	29.7	Very low	30	Very low	151 Å²	151	138.2 Å²	138.2	93%	0.926	73%	0.734	S	S	*	*			trans	-156.9	88.8	136.9	-8.3	0	0	0	0	111
558	L	26.7	Very low	30.2	Very low	175 Å²	175	136.3 Å²	136.3	92%	0.916	75%	0.746	S	S	*	*			trans	-111.3	97.1	172.9	-117.7	175.1	0	0	0	109.3
559	K	32.3	Very low	30.5	Very low	199 Å²	199	137.7 Å²	137.7	87%	0.865	76%	0.758	S	S	*	*			trans	-171.5	151.8	160.5	-108.7	157.6	-173.4	177.8	0	111.4
560	S	29.2	Very low	30.7	Very low	107 Å²	107	135.7 Å²	135.7	75%	0.748	77%	0.77	S	S	*	*			trans	54.5	105.8	175.6	63.6	0	0	0	0	118.1
561	L	30.9	Very low	30.9	Very low	177 Å²	177	136.8 Å²	136.8	93%	0.927	79%	0.786	S	S	*	*				-153.8	141.6	112.7	-104.5	166.2	0	0	0	108.5
562	N	30.9	Very low	31.1	Very low	134 Å²	134	133.9 Å²	133.9	72%	0.717	79%	0.79	S	S	*	*			trans	-80.4	163.2	-162.3	-67.4	2.8	0	0	0	113.7
563	Y	30.8	Very low	31.2	Very low	136 Å²	136	133 Å²	133	53%	0.533	81%	0.807	S	S	.	*	S	Bend	trans	-96.7	-15.9	-171.3	-174.7	-93.2	0	0	0	113.1	D565 D943	Y563-D565 PolarHBondContact O-N 3.46Å; Y563-D943 HydrophobicContact CE2-CB 4.28Å; Y563-D943 WeakPolarHBondContact OH-CB 3.42Å
564	D	34.2	Very low	31.2	Very low	127 Å²	127	126.9 Å²	126.9	68%	0.679	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-12.5	-164.3	-50.4	-80.9	0	0	0	115.7	F566	D564-F566 VanDerWaalsContact C-N 3.35Å; D564-F566 PolarHBondContact O-N 2.85Å
565	D	37.4	Very low	31.4	Very low	166 Å²	166	131.7 Å²	131.7	89%	0.888	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	1.2	-167.2	-101	-16.7	0	0	0	115.7	Y563	Y563-D565 PolarHBondContact O-N 3.46Å
566	F	34.9	Very low	31.5	Very low	194 Å²	194	134.4 Å²	134.4	85%	0.851	81%	0.811	S	S	*	*	S	Bend	trans	-126.4	-9.2	-174.1	-147.3	-105.9	0	0	0	117.1	D564	D564-F566 VanDerWaalsContact C-N 3.35Å; D564-F566 PolarHBondContact O-N 2.85Å
567	L	32.1	Very low	31.8	Very low	140 Å²	140	131.8 Å²	131.8	73%	0.733	80%	0.803	S	S	*	*	S	Bend	trans	-105.2	51.9	178.5	-69.4	174.4	0	0	0	111.9
568	G	30.4	Very low	31.9	Very low	64 Å²	64	132.8 Å²	132.8	66%	0.66	80%	0.795	S	S	*	*			trans	-125.4	7.6	-157.7	0	0	0	0	0	119.6
569	S	34.2	Very low	32	Very low	126 Å²	126	127.9 Å²	127.9	88%	0.881	79%	0.786	S	S	*	*			trans	-171.7	111	164.6	-89.6	0	0	0	0	114.8
570	G	29.7	Very low	31.9	Very low	91 Å²	91	128.3 Å²	128.3	94%	0.938	79%	0.788	S	S	*	*			trans	-92	116.3	155.5	0	0	0	0	0	110.2
571	G	31.7	Very low	32	Very low	78 Å²	78	129 Å²	129	80%	0.804	78%	0.784	S	S	*	*			trans	-166.3	112.3	179.9	0	0	0	0	0	111
572	G	31.7	Very low	31.9	Very low	83 Å²	83	126.8 Å²	126.8	86%	0.856	77%	0.773	S	S	*	*			trans	-93.2	147.6	-163.1	0	0	0	0	0	116.2
573	G	31.1	Very low	32.1	Very low	83 Å²	83	127.7 Å²	127.7	86%	0.856	78%	0.783	S	S	*	*			trans	92.1	157	145.2	0	0	0	0	0	117.8
574	G	29.6	Very low	32.1	Very low	68 Å²	68	124 Å²	124	70%	0.701	79%	0.786	S	S	*	*			trans	97.4	100.1	160.9	0	0	0	0	0	116.1
575	D	34.7	Very low	31.7	Very low	165 Å²	165	124.8 Å²	124.8	88%	0.882	79%	0.79	S	S	*	*			trans	62.8	147.1	134	-54.5	-20.8	0	0	0	122.9
576	E	31.6	Very low	31.4	Very low	181 Å²	181	121.5 Å²	121.5	85%	0.846	78%	0.78	S	S	*	*			trans	-51.7	136.3	173	-51.9	169.2	166.4	0	0	112.5
577	D	34.4	Very low	31.1	Very low	122 Å²	122	119 Å²	119	65%	0.652	77%	0.773	S	S	*	*				-165	179.5	88.2	-141.3	1.2	0	0	0	117.2
578	K	31.5	Very low	30.9	Very low	173 Å²	173	120.3 Å²	120.3	75%	0.752	77%	0.773	S	S	*	*			trans	-62.6	139.5	-170.5	-49.4	134.4	-169.3	84.3	0	115.7
579	G	28.1	Very low	30.7	Very low	72 Å²	72	122.7 Å²	122.7	74%	0.742	78%	0.779	S	S	*	*				113	113.9	116.9	0	0	0	0	0	119.5
580	F	30.7	Very low	30.4	Very low	207 Å²	207	122.5 Å²	122.5	91%	0.908	78%	0.778	S	S	*	*				-145.1	159.2	129.9	-156.8	-101	0	0	0	110.6
581	D	31.5	Very low	30.6	Very low	122 Å²	122	127.2 Å²	127.2	65%	0.652	77%	0.773	S	S	*	*			trans	-115.3	153.6	-158.7	-90.8	-62.7	0	0	0	115.3
582	N	29.4	Very low	30.7	Very low	130 Å²	130	133.6 Å²	133.6	70%	0.695	78%	0.778	S	S	*	*			trans	41.8	100.7	146.3	-66.8	-62.3	0	0	0	121
583	V	34.8	Very low	31.4	Very low	153 Å²	153	135.2 Å²	135.2	93%	0.927	77%	0.772	S	S	*	*				-132.7	115.3	118.4	-173.5	0	0	0	0	105.5
584	G	29.9	Very low	32.3	Very low	59 Å²	59	136.7 Å²	136.7	61%	0.608	76%	0.764	S	S	*	*			cis	106.3	44.7	49.4	0	0	0	0	0	109.2
585	N	26.6	Very low	33.3	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	76%	0.757	S	S	*	*				63	100	75.3	-176.4	22.3	0	0	0	114.5
586	S	30.3	Very low	34.3	Very low	97 Å²	97	130.8 Å²	130.8	68%	0.678	72%	0.723	S	S	*	*			trans	-163.7	123	147.8	-93.5	0	0	0	0	115.4
587	M	28.8	Very low	35.1	Very low	142 Å²	142	128.2 Å²	128.2	70%	0.7	72%	0.719	S	S	*	*			trans	71.9	133.3	140.8	-61.8	155.3	59.1	0	0	118.3
588	K	28.6	Very low	36.1	Very low	168 Å²	168	124.9 Å²	124.9	73%	0.73	70%	0.697	S	S	*	*			cis	-155.5	127.1	2.3	-120.6	163.1	-172.3	178.7	0	112.8
589	S	25.7	Very low	37.2	Very low	113 Å²	113	118 Å²	118	79%	0.79	67%	0.669	S	S	*	*			trans	39.3	105.7	151.1	61.3	0	0	0	0	120
590	S	28.2	Very low	38.1	Very low	123 Å²	123	122.5 Å²	122.5	86%	0.86	67%	0.668	S	S	*	*			trans	-95.8	145.3	143	-171.3	0	0	0	0	109.7
591	K	33.7	Very low	39.2	Very low	189 Å²	189	116.9 Å²	116.9	82%	0.822	65%	0.654	S	S	*	*			trans	-77.6	132.7	-179.6	-71.2	178.2	178.9	174.7	0	109.9	T593	K591-T593 PolarHBondContact O-N 3.16Å
592	K	34.8	Very low	39.9	Very low	212 Å²	212	119 Å²	119	92%	0.922	66%	0.658	S	S	*	*			trans	-60.4	110.1	166.1	-71.9	-176	177.5	-179.8	0	108.8
593	T	45.4	Very low	40.7	Very low	117 Å²	117	123.2 Å²	123.2	72%	0.718	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-70.2	139.7	171.5	40.7	0	0	0	0	109.8	K591	K591-T593 PolarHBondContact O-N 3.16Å
594	T	49.6	Very low	40.7	Very low	114 Å²	114	125.1 Å²	125.1	70%	0.699	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-65.9	139.5	167.8	30.5	0	0	0	0	109.4
595	P	51	Low	40.8	Very low	84 Å²	84	132.2 Å²	132.2	55%	0.545	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-62.8	142.4	176.5	27.5	-34.3	0	0	0	110
596	P	55.8	Low	41.3	Very low	25 Å²	25	128.8 Å²	128.8	16%	0.162	67%	0.673	C	S	.	*	P	Polyproline II helix	trans	-67.6	148.8	-175.9	24.5	-30.2	0	0	0	111.9	N273 P297 W598 D599	N273-P596 WeakPolarHBondContact OD1-CA 3.32Å; N273-P596 WeakPolarHBondContact OD1-CB 3.34Å; P297-P596 HydrophobicContact CB-CG 3.7Å; P297-P596 HydrophobicContact CG-CG 4.32Å; P596-W598 HydrophobicContact CB-CD2 4.1Å; P596-W598 HydrophobicContact CB-CE3 4.39Å; P596-W598 HydrophobicContact CB-CH2 3.98Å; P596-W598 HydrophobicContact CB-CZ2 3.59Å; P596-W598 HydrophobicContact CB-CZ3 4.38Å; P596-W598 HydrophobicContact CG-CZ2 4.28Å; P596-W598 PolarHBondContact O-N 3.05Å; P596-W598 VanDerWaalsContact O-N 3.1Å; P596-D599 HydrophobicContact CG-CB 4.1Å; P596-D599 VanDerWaalsContact O-CB 3.29Å; P596-D599 WeakPolarHBondContact O-CB 3.48Å; P596-D599 PolarHBondContact O-N 2.85Å
597	V	49.1	Very low	41.2	Very low	127 Å²	127	130.1 Å²	130.1	77%	0.77	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-25.4	-166.3	-179	0	0	0	0	113.2
598	W	54.2	Low	41.4	Very low	52 Å²	52	134.9 Å²	134.9	20%	0.197	69%	0.686	C	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-3.8	174.7	59.6	85.6	0	0	0	114.7	D272 N273 L276 P277 P596 K600	D272-W598 VanDerWaalsContact O-CH2 3.25Å; D272-W598 WeakPolarHBondContact O-CH2 3.37Å; D272-W598 WeakPolarHBondContact O-CZ3 3.24Å; N273-W598 VanDerWaalsContact CA-CZ3 3.48Å; N273-W598 HydrophobicContact CB-CZ3 4.48Å; L276-W598 HydrophobicContact CB-CH2 3.72Å; L276-W598 HydrophobicContact CB-CZ2 4.22Å; L276-W598 HydrophobicContact CB-CZ3 4.1Å; L276-W598 HydrophobicContact CD2-CH2 3.85Å; L276-W598 HydrophobicContact CD2-CZ2 3.43Å; L276-W598 VanDerWaalsContact CD2-CZ2 3.43Å; L276-W598 HydrophobicContact CG-CH2 4.43Å; L276-W598 HydrophobicContact CG-CZ2 4.44Å; P277-W598 HydrophobicContact CG-CE3 3.57Å; P277-W598 HydrophobicContact CG-CZ3 3.62Å; P596-W598 HydrophobicContact CB-CD2 4.1Å; P596-W598 HydrophobicContact CB-CE3 4.39Å; P596-W598 HydrophobicContact CB-CH2 3.98Å; P596-W598 HydrophobicContact CB-CZ2 3.59Å; P596-W598 HydrophobicContact CB-CZ3 4.38Å; P596-W598 HydrophobicContact CG-CZ2 4.28Å; P596-W598 PolarHBondContact O-N 3.05Å; P596-W598 VanDerWaalsContact O-N 3.1Å; W598-K600 VanDerWaalsContact C-N 3.26Å; W598-K600 PolarHBondContact O-N 3.03Å
599	D	54.7	Low	41.4	Very low	30 Å²	30	136.5 Å²	136.5	16%	0.16	69%	0.694	C	S	.	*			trans	-68.3	85.3	175.8	-178.5	9.3	0	0	0	110.5	P596 S601	P596-D599 HydrophobicContact CG-CB 4.1Å; P596-D599 VanDerWaalsContact O-CB 3.29Å; P596-D599 WeakPolarHBondContact O-CB 3.48Å; P596-D599 PolarHBondContact O-N 2.85Å; D599-S601 VanDerWaalsContact C-N 3.28Å; D599-S601 VanDerWaalsContact OD1-CB 3.29Å; D599-S601 WeakPolarHBondContact OD1-CB 3.36Å; D599-S601 PolarHBondContact OD1-N 2.89Å; D599-S601 PolarHBondContact OD1-OG 3.22Å
600	K	47.1	Very low	41.8	Very low	166 Å²	166	136.1 Å²	136.1	72%	0.722	69%	0.691	S	S	*	*			trans	-75.5	-15	175.6	-68.9	174.9	-176.4	174.3	0	112.3	W598 K602 R603	W598-K600 VanDerWaalsContact C-N 3.26Å; W598-K600 PolarHBondContact O-N 3.03Å; K600-K602 VanDerWaalsContact C-N 3.31Å; K600-K602 PolarHBondContact O-N 3.5Å; K600-R603 WeakPolarHBondContact O-CB 3.26Å; K600-R603 PolarHBondContact O-N 3.03Å; K600-R603 VanDerWaalsContact O-N 3.12Å
601	S	54.1	Low	41.8	Very low	88 Å²	88	140.3 Å²	140.3	62%	0.615	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-59.7	-43.1	-175.7	74.8	0	0	0	0	111.3	D599 R603	D599-S601 VanDerWaalsContact C-N 3.28Å; D599-S601 VanDerWaalsContact OD1-CB 3.29Å; D599-S601 WeakPolarHBondContact OD1-CB 3.36Å; D599-S601 PolarHBondContact OD1-N 2.89Å; D599-S601 PolarHBondContact OD1-OG 3.22Å; S601-R603 VanDerWaalsContact C-N 3.27Å; S601-R603 PolarHBondContact O-N 3.2Å
602	K	47	Very low	41.7	Very low	166 Å²	166	136.6 Å²	136.6	72%	0.722	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-80.1	-0.2	-178.4	-63.5	-179.3	-176.1	174.2	0	114.3	K600	K600-K602 VanDerWaalsContact C-N 3.31Å; K600-K602 PolarHBondContact O-N 3.5Å
603	R	45.7	Very low	41.7	Very low	220 Å²	220	137.2 Å²	137.2	83%	0.83	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-83.7	-2.4	-179.8	-104.6	179.6	159.1	-175.6	-7	114.9	K600 S601	K600-R603 WeakPolarHBondContact O-CB 3.26Å; K600-R603 PolarHBondContact O-N 3.03Å; K600-R603 VanDerWaalsContact O-N 3.12Å; S601-R603 VanDerWaalsContact C-N 3.27Å; S601-R603 PolarHBondContact O-N 3.2Å
604	K	34.9	Very low	41.1	Very low	193 Å²	193	140.9 Å²	140.9	84%	0.839	69%	0.694	S	S	*	*	S	Bend	trans	-113.6	72.5	176.1	-80.9	-174.6	175.1	176.9	0	114
605	K	32.2	Very low	40.5	Very low	207 Å²	207	143.3 Å²	143.3	90%	0.9	70%	0.697	S	S	*	*			trans	-161.9	31.7	148.3	-110.3	159.6	-171.6	174.7	0	113.8
606	G	35.8	Very low	40	Very low	72 Å²	72	147.2 Å²	147.2	74%	0.742	71%	0.708	S	S	*	*			trans	-72.2	125.1	169.5	0	0	0	0	0	111.5	R608	G606-R608 PolarHBondContact O-N 3.3Å
607	V	29.5	Very low	39.2	Very low	125 Å²	125	155.4 Å²	155.4	76%	0.758	74%	0.744	S	S	*	*			trans	-69.3	100.2	-171.2	179.9	0	0	0	0	112.2	K609	V607-K609 HydrophobicContact CG1-CB 4.47Å; V607-K609 HydrophobicContact CG1-CD 4.48Å; V607-K609 HydrophobicContact CG1-CG 3.92Å
608	R	32.4	Very low	38.7	Very low	241 Å²	241	155.8 Å²	155.8	91%	0.909	74%	0.738	S	S	*	*			trans	-96.5	79.4	160.8	-87.2	-170.8	166.6	-173.2	-3.6	110.9	G606 S610	G606-R608 PolarHBondContact O-N 3.3Å; R608-S610 VanDerWaalsContact C-N 3.29Å; R608-S610 PolarHBondContact O-N 2.84Å
609	K	28.3	Very low	38.1	Very low	203 Å²	203	161.4 Å²	161.4	88%	0.883	77%	0.766	S	S	*	*			trans	-65.8	88.1	159	-82.2	-179.3	175.4	177.4	0	108.7	V607	V607-K609 HydrophobicContact CG1-CB 4.47Å; V607-K609 HydrophobicContact CG1-CD 4.48Å; V607-K609 HydrophobicContact CG1-CG 3.92Å
610	S	34.2	Very low	37.4	Very low	104 Å²	104	169.5 Å²	169.5	73%	0.727	80%	0.803	S	S	*	*			trans	-141.5	111.1	171.6	-163.3	0	0	0	0	113.1	R608 S612	R608-S610 VanDerWaalsContact C-N 3.29Å; R608-S610 PolarHBondContact O-N 2.84Å; S610-S612 PolarHBondContact O-N 3.38Å; S610-S612 VanDerWaalsContact O-N 3.14Å
611	K	29.1	Very low	36.9	Very low	212 Å²	212	171.8 Å²	171.8	92%	0.922	81%	0.807	S	S	*	*			trans	-19.5	94.6	167.9	-58.6	169.3	178.8	177.9	0	116.8
612	S	31.9	Very low	36.1	Very low	111 Å²	111	174.5 Å²	174.5	78%	0.776	82%	0.815	S	S	*	*			trans	-164	104.2	145.4	-170.1	0	0	0	0	112.4	S610	S610-S612 PolarHBondContact O-N 3.38Å; S610-S612 VanDerWaalsContact O-N 3.14Å
613	R	32.9	Very low	35.6	Very low	224 Å²	224	172 Å²	172	85%	0.845	82%	0.818	S	S	*	*	S	Bend	trans	164.6	-13.6	154.3	-104.8	-176.5	157.6	165.1	-5.6	114.2	Q615	R613-Q615 PolarHBondContact O-N 2.83Å
614	K	34.5	Very low	35.3	Very low	195 Å²	195	168.7 Å²	168.7	85%	0.848	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	24.8	-178.8	-129.4	-178	-173	-174.2	0	115.2
615	Q	36.8	Very low	35.4	Very low	165 Å²	165	167.8 Å²	167.8	77%	0.771	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	-9.9	-175.3	-104.4	173.8	-26	0	0	115.1	R613	R613-Q615 PolarHBondContact O-N 2.83Å
616	Q	39.4	Very low	35.4	Very low	166 Å²	166	161.2 Å²	161.2	78%	0.776	81%	0.81	S	S	*	*	S	Bend	trans	-97.6	0.3	-177.9	-88	177.2	-36.2	0	0	115.8
617	Q	38.9	Very low	35.1	Very low	197 Å²	197	163.2 Å²	163.2	92%	0.921	81%	0.813	S	S	*	*	S	Bend	trans	-129.2	13.2	176.6	-83	-176.5	-17.3	0	0	114.5
618	Q	39.6	Very low	35.3	Very low	134 Å²	134	163.8 Å²	163.8	63%	0.626	81%	0.808	S	S	*	*	S	Bend	trans	-111.4	3.4	173.8	-156	159.5	1.6	0	0	113.5	Q620	Q618-Q620 VanDerWaalsContact C-N 3.26Å; Q618-Q620 PolarHBondContact O-N 3.45Å
619	Q	40.6	Very low	35.4	Very low	171 Å²	171	160.6 Å²	160.6	80%	0.799	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-0.7	177.3	-74.1	-178.1	-36.2	0	0	114.6
620	Q	41.5	Very low	35.7	Very low	199 Å²	199	156.4 Å²	156.4	93%	0.93	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	5	179.3	-78.1	-172.9	-17.9	0	0	115.2	Q618	Q618-Q620 VanDerWaalsContact C-N 3.26Å; Q618-Q620 PolarHBondContact O-N 3.45Å
621	R	36.5	Very low	35.6	Very low	214 Å²	214	157.2 Å²	157.2	81%	0.808	79%	0.788	S	S	*	*	S	Bend	trans	-125.5	-18	-168.1	-162.7	166.9	166.8	126.2	0.5	117.8
622	N	37.4	Very low	35.8	Very low	146 Å²	146	154.8 Å²	154.8	78%	0.781	78%	0.779	S	S	*	*			trans	-118.4	73.5	-178.3	-77.8	31.3	0	0	0	112.5	L624	N622-L624 PolarHBondContact O-N 3.27Å
623	S	34.9	Very low	36	Very low	112 Å²	112	154 Å²	154	78%	0.783	77%	0.774	S	S	*	*			trans	-84.6	97.1	161.9	51.1	0	0	0	0	110.2
624	L	39.6	Very low	36	Very low	152 Å²	152	151.9 Å²	151.9	80%	0.796	77%	0.774	S	S	*	*			trans	178.1	123.8	159.3	-101.1	154.4	0	0	0	110.6	N622	N622-L624 PolarHBondContact O-N 3.27Å
625	L	36.6	Very low	36.1	Very low	173 Å²	173	150.6 Å²	150.6	91%	0.906	78%	0.775	S	S	*	*			trans	65	136.4	164.6	-50.5	155.8	0	0	0	116.6
626	G	32	Very low	35.9	Very low	69 Å²	69	150 Å²	150	71%	0.711	78%	0.777	S	S	*	*			cis	151.2	114.2	-11.5	0	0	0	0	0	113.2
627	S	30.8	Very low	36	Very low	115 Å²	115	146.8 Å²	146.8	80%	0.804	77%	0.77	S	S	*	*			trans	65.9	162.2	173	-75.9	0	0	0	0	116.9
628	E	33.6	Very low	35.9	Very low	137 Å²	137	142.7 Å²	142.7	64%	0.64	76%	0.758	S	S	*	*			cis	-160.2	148.8	4.1	-129.5	170.4	119.1	0	0	112.8
629	K	35.1	Very low	35.8	Very low	173 Å²	173	142.4 Å²	142.4	75%	0.752	76%	0.761	S	S	*	*			trans	52.4	162.6	144	-75.3	168.6	-169.8	162.9	0	122.9
630	V	33.3	Very low	35.6	Very low	115 Å²	115	142.1 Å²	142.1	70%	0.697	76%	0.76	S	S	*	*			cis	-172.3	150.2	-36.2	100.7	0	0	0	0	111.6
631	N	32.5	Very low	35.4	Very low	121 Å²	121	139.6 Å²	139.6	65%	0.647	75%	0.751	S	S	*	*			trans	61.8	162.9	159.9	-69.3	13.2	0	0	0	120.9
632	Q	33.8	Very low	35.4	Very low	161 Å²	161	136.3 Å²	136.3	75%	0.752	75%	0.75	S	S	*	*			cis	-163.4	164.1	-16.1	-112.5	167.9	-34.7	0	0	113.7
633	S	35.1	Very low	35.2	Very low	94 Å²	94	133.2 Å²	133.2	66%	0.657	74%	0.74	S	S	*	*			trans	62.2	118.9	144.8	62.6	0	0	0	0	126.1
634	E	33.9	Very low	35.1	Very low	180 Å²	180	136 Å²	136	84%	0.841	74%	0.74	S	S	*	*				65.9	127.7	125.2	-59.8	179.7	152.7	0	0	124.5
635	I	35.7	Very low	34.9	Very low	169 Å²	169	135.8 Å²	135.8	87%	0.867	74%	0.735	S	S	*	*				-175.3	151.3	105.6	-90.9	165	0	0	0	111.1
636	N	33.3	Very low	34.6	Very low	153 Å²	153	134.9 Å²	134.9	82%	0.818	73%	0.726	S	S	*	*			trans	-97.3	-170.5	-173.4	-106.3	-2	0	0	0	112.2
637	P	40.7	Very low	34.7	Very low	98 Å²	98	139.1 Å²	139.1	64%	0.636	73%	0.733	S	S	*	*			cis	-145.5	-178.2	13.6	44.5	-24.4	0	0	0	119
638	T	38.1	Very low	34.7	Very low	110 Å²	110	138.3 Å²	138.3	68%	0.675	73%	0.727	S	S	*	*			trans	62.2	139.6	149	59.7	0	0	0	0	122.4
639	D	37.7	Very low	34.7	Very low	129 Å²	129	139 Å²	139	69%	0.69	74%	0.735	S	S	*	*			cis	-161.6	158.6	-12.1	-95.1	-21.7	0	0	0	111.8
640	E	36.2	Very low	34.4	Very low	164 Å²	164	135.3 Å²	135.3	77%	0.766	73%	0.731	S	S	*	*			trans	33.7	128.8	147.7	-57.1	178.7	160.2	0	0	121.1
641	I	37.3	Very low	34.4	Very low	146 Å²	146	136.9 Å²	136.9	75%	0.749	74%	0.741	S	S	*	*			cis	74.2	133.9	34.2	-46.6	167.2	0	0	0	109.9
642	D	35.4	Very low	34.3	Very low	146 Å²	146	137.4 Å²	137.4	78%	0.781	75%	0.748	S	S	*	*			cis	-154.4	-162.3	39.1	-139.6	-27.6	0	0	0	115.6
643	S	33.6	Very low	34.2	Very low	81 Å²	81	132.9 Å²	132.9	57%	0.566	75%	0.745	S	S	*	*			trans	-72	-171.8	173.4	62.1	0	0	0	0	114.4
644	E	33.7	Very low	34	Very low	169 Å²	169	135.4 Å²	135.4	79%	0.79	75%	0.749	S	S	*	*			cis	-163.4	177.8	11.3	-148.2	144.8	-134.2	0	0	112.7
645	Q	33.9	Very low	34.1	Very low	149 Å²	149	134 Å²	134	70%	0.696	75%	0.748	S	S	*	*			trans	73.6	114	143.2	-157.5	154.4	24.6	0	0	124
646	E	31.5	Very low	33.8	Very low	154 Å²	154	134.7 Å²	134.7	72%	0.72	74%	0.744	S	S	*	*			trans	46.5	159.4	133.9	-61.2	175.5	136.8	0	0	126.3
647	D	33	Very low	33.8	Very low	158 Å²	158	134.6 Å²	134.6	85%	0.845	74%	0.742	S	S	*	*			trans	86.9	153.9	154.8	-80	-9.6	0	0	0	124
648	S	30.9	Very low	33.4	Very low	97 Å²	97	135.4 Å²	135.4	68%	0.678	75%	0.748	S	S	*	*			trans	-85.5	153.5	-162.4	56	0	0	0	0	114.6
649	D	33.8	Very low	32.8	Very low	151 Å²	151	137 Å²	137	81%	0.807	75%	0.752	S	S	*	*				-169.8	178.3	94.4	-135.8	-43.1	0	0	0	113.6
650	S	29.7	Very low	32.4	Very low	97 Å²	97	139.9 Å²	139.9	68%	0.678	76%	0.761	S	S	*	*			trans	-82.7	159.4	-179.8	62.9	0	0	0	0	114.7
651	V	33.5	Very low	32.3	Very low	147 Å²	147	138.2 Å²	138.2	89%	0.891	76%	0.762	S	S	*	*			trans	-169.4	163	139.2	132.3	0	0	0	0	112
652	V	29.9	Very low	31.7	Very low	132 Å²	132	134.7 Å²	134.7	80%	0.8	76%	0.762	S	S	*	*			trans	-106.7	143.5	-170	174.3	0	0	0	0	113	I654	V652-I654 HydrophobicContact CG1-CG1 4.46Å
653	G	32.3	Very low	31.4	Very low	67 Å²	67	136.9 Å²	136.9	69%	0.691	76%	0.764	S	S	*	*			trans	174.9	91.5	165	0	0	0	0	0	110.4
654	I	30.5	Very low	31.2	Very low	147 Å²	147	138.6 Å²	138.6	75%	0.754	77%	0.772	S	S	*	*				54.6	108.1	88.7	-58.1	177.4	0	0	0	112.8	V652	V652-I654 HydrophobicContact CG1-CG1 4.46Å
655	D	34.8	Very low	30.8	Very low	150 Å²	150	138.3 Å²	138.3	80%	0.802	78%	0.776	S	S	*	*			trans	-147.4	165.4	132	-131.2	-32.8	0	0	0	111.8
656	K	30.5	Very low	30.7	Very low	183 Å²	183	137.1 Å²	137.1	80%	0.796	78%	0.784	S	S	*	*			trans	-114.7	-156.9	-174.8	-66.3	177.7	177.4	173	0	111.5
657	I	34	Very low	30.5	Very low	151 Å²	151	135 Å²	135	77%	0.774	79%	0.786	S	S	*	*			trans	99.3	127.5	164.3	-58.3	154.1	0	0	0	113.6
658	P	30.6	Very low	30.4	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	79%	0.786	S	S	*	*				-135.2	-166.7	-68	38	-16.9	0	0	0	112.7
659	D	26.5	Very low	30.3	Very low	143 Å²	143	135 Å²	135	77%	0.765	79%	0.79	S	S	*	*			trans	-69.4	174.1	167.1	-58.6	-79.8	0	0	0	114
660	H	29	Very low	30	Very low	189 Å²	189	133 Å²	133	88%	0.875	79%	0.787	S	S	*	*			trans	69.6	92.9	171.8	-70.8	-86.2	0	0	0	118.7
661	V	33.3	Very low	30.1	Very low	129 Å²	129	135.8 Å²	135.8	78%	0.782	79%	0.794	S	S	*	*			trans	-129.4	111.8	135.3	-173.1	0	0	0	0	108.4	F663	V661-F663 HydrophobicContact CG1-CD2 3.85Å; V661-F663 HydrophobicContact CG1-CE2 4.07Å
662	G	24.7	Very low	30.1	Very low	73 Å²	73	136.7 Å²	136.7	75%	0.753	79%	0.793	S	S	*	*			trans	-91.9	128.5	168.4	0	0	0	0	0	109.6
663	F	29.9	Very low	30	Very low	191 Å²	191	134.8 Å²	134.8	84%	0.838	79%	0.785	S	S	*	*			trans	-106.8	128.6	171.5	-111.4	-83.6	0	0	0	112.3	V661	V661-F663 HydrophobicContact CG1-CD2 3.85Å; V661-F663 HydrophobicContact CG1-CE2 4.07Å
664	T	30.3	Very low	30	Very low	117 Å²	117	138.9 Å²	138.9	72%	0.718	79%	0.79	S	S	*	*			trans	-57.2	151.8	-172.2	47.7	0	0	0	0	115.1
665	N	25.2	Very low	29.8	Very low	164 Å²	164	140.6 Å²	140.6	88%	0.877	79%	0.792	S	S	*	*			trans	-41.6	137.1	165.8	-58.6	-30.3	0	0	0	112.9
666	S	30.8	Very low	29.7	Very low	123 Å²	123	142.5 Å²	142.5	86%	0.86	80%	0.796	S	S	*	*			trans	-113.6	122.1	149.8	-79.4	0	0	0	0	108.4
667	S	27.3	Very low	29.7	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	79%	0.794	S	S	*	*			trans	-77.8	146.9	-177.3	41.7	0	0	0	0	112.1
668	V	31.7	Very low	29.4	Very low	140 Å²	140	143 Å²	143	85%	0.848	80%	0.8	S	S	*	*			trans	-114.8	122.6	153.6	-179.4	0	0	0	0	106
669	P	29.1	Very low	29.5	Very low	116 Å²	116	145.2 Å²	145.2	75%	0.753	80%	0.801	S	S	*	*			trans	-69	141.3	-172.4	-21.2	33.4	0	0	0	113.5
670	S	26.8	Very low	29.5	Very low	108 Å²	108	144.1 Å²	144.1	76%	0.755	80%	0.804	S	S	*	*			trans	-87.8	126.9	159.1	54.9	0	0	0	0	109.7
671	D	31.3	Very low	29.6	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	80%	0.802	S	S	*	*			trans	-159.7	115.2	154.6	-110.5	-32	0	0	0	112.3
672	I	33.1	Very low	29.4	Very low	166 Å²	166	144.1 Å²	144.1	85%	0.851	81%	0.805	S	S	*	*			trans	-171.5	116.9	135.3	-96.5	158.1	0	0	0	105.4
673	S	27.4	Very low	29.8	Very low	92 Å²	92	145.3 Å²	145.3	64%	0.643	80%	0.8	S	S	*	*			trans	-101.1	128.8	-178.2	-176.8	0	0	0	0	110.3
674	I	32.8	Very low	29.9	Very low	153 Å²	153	143.3 Å²	143.3	79%	0.785	80%	0.798	S	S	*	*			trans	-118.8	122.4	156.1	-61.4	-178.9	0	0	0	106.4
675	K	27.4	Very low	29.8	Very low	184 Å²	184	145.1 Å²	145.1	80%	0.8	80%	0.798	S	S	*	*			trans	-97	124.5	176.8	-64.3	172.8	179.4	173.9	0	108.7
676	E	32.8	Very low	30.4	Very low	190 Å²	190	145.5 Å²	145.5	89%	0.888	80%	0.798	S	S	*	*			trans	-121.2	154.5	150.2	-66.5	-164.5	133.9	0	0	108.2
677	K	30.5	Very low	30.5	Very low	175 Å²	175	146 Å²	146	76%	0.761	79%	0.791	S	S	*	*			trans	-99.9	147.3	-163.9	-62.1	173.8	177.6	176.7	0	111.9
678	D	27	Very low	30.6	Very low	168 Å²	168	144.6 Å²	144.6	90%	0.898	79%	0.794	S	S	*	*			trans	-68.5	126	149.8	-59.3	-70.1	0	0	0	109.7
679	E	32.3	Very low	30.6	Very low	164 Å²	164	142 Å²	142	77%	0.766	80%	0.795	S	S	*	*			trans	-132.8	121.6	159.2	-99.5	175.7	167.5	0	0	109.2
680	S	26.3	Very low	30.6	Very low	120 Å²	120	145.4 Å²	145.4	84%	0.839	80%	0.801	S	S	*	*			trans	-97	123.2	-169.9	56.4	0	0	0	0	112
681	V	31.3	Very low	30.9	Very low	138 Å²	138	147.2 Å²	147.2	84%	0.836	81%	0.807	S	S	*	*			trans	-135.4	106	175.1	-174.2	0	0	0	0	111.6
682	Q	29.3	Very low	30.8	Very low	180 Å²	180	147.9 Å²	147.9	84%	0.841	81%	0.805	S	S	*	*			trans	-86.5	164.6	143.3	-74.6	-170.1	-2.3	0	0	107.4
683	P	33.4	Very low	30.6	Very low	98 Å²	98	151.2 Å²	151.2	64%	0.636	81%	0.807	S	S	*	*			cis	-154.1	-161.1	34.6	40.7	-16.1	0	0	0	117.3
684	N	31.7	Very low	30.6	Very low	149 Å²	149	155.4 Å²	155.4	80%	0.797	81%	0.814	S	S	*	*			trans	89.6	106	152.2	-65.7	-10.3	0	0	0	121.5
685	H	29	Very low	30.2	Very low	154 Å²	154	153.3 Å²	153.3	71%	0.713	81%	0.808	S	S	*	*			trans	-8.7	142.6	132.4	-105.8	-100	0	0	0	118	D687	H685-D687 IonicContact CE1-OD2 3.46Å; H685-D687 PolarHBondContact CE1-OD2 3.49Å; H685-D687 IonicContact ND1-OD2 3.05Å; H685-D687 PolarHBondContact ND1-OD2 3.02Å
686	I	37.4	Very low	30.1	Very low	172 Å²	172	150.3 Å²	150.3	88%	0.882	81%	0.805	S	S	*	*			trans	-150.2	145.8	131.5	-100.6	153.4	0	0	0	107.9
687	D	31.7	Very low	29.8	Very low	134 Å²	134	146.8 Å²	146.8	72%	0.717	80%	0.797	S	S	*	*			trans	-99.1	161.6	-172.7	-86	-83.3	0	0	0	114.6	H685	H685-D687 IonicContact CE1-OD2 3.46Å; H685-D687 PolarHBondContact CE1-OD2 3.49Å; H685-D687 IonicContact ND1-OD2 3.05Å; H685-D687 PolarHBondContact ND1-OD2 3.02Å
688	G	29.4	Very low	29.9	Very low	80 Å²	80	146 Å²	146	83%	0.825	80%	0.801	S	S	*	*			trans	112.5	120.4	146.2	0	0	0	0	0	117.3
689	G	32.2	Very low	30	Very low	85 Å²	85	143.7 Å²	143.7	88%	0.876	79%	0.793	S	S	*	*			trans	168.3	43.9	174.5	0	0	0	0	0	117.7
690	Q	29.4	Very low	30.1	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.883	80%	0.798	S	S	*	*			trans	-78.7	133.9	173.3	-67.9	-177.4	-5.8	0	0	112.6
691	V	33.9	Very low	30.4	Very low	146 Å²	146	143.8 Å²	143.8	89%	0.885	78%	0.784	S	S	*	*			trans	-146.1	141	141	177	0	0	0	0	109.5
692	Q	27.9	Very low	30.5	Very low	169 Å²	169	145.9 Å²	145.9	79%	0.79	78%	0.784	S	S	*	*			trans	-106.4	150.5	171.1	-57.9	169.4	-17.5	0	0	110.4
693	R	29.1	Very low	30.7	Very low	236 Å²	236	142.2 Å²	142.2	89%	0.891	78%	0.778	S	S	*	*				174.3	118.9	122	-97.3	173.5	-179.8	-176.4	0.3	116.2
694	K	26.8	Very low	30.8	Very low	180 Å²	180	142.2 Å²	142.2	78%	0.783	78%	0.781	S	S	*	*				49.1	113.2	114.1	-91.8	-165.8	171.1	-170.1	0	122.5
695	T	25.4	Very low	30.8	Very low	109 Å²	109	142.8 Å²	142.8	67%	0.669	78%	0.783	S	S	*	*				72.8	138.7	120.1	55	0	0	0	0	124.3
696	T	25.5	Very low	31.2	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	78%	0.781	S	S	*	*			trans	75.3	113.2	142.2	43.8	0	0	0	0	121.6
697	T	26.8	Very low	30.9	Very low	116 Å²	116	137.2 Å²	137.2	71%	0.712	77%	0.774	S	S	*	*			trans	31.9	130.9	130.2	55.8	0	0	0	0	120.6
698	D	31.3	Very low	31.1	Very low	159 Å²	159	135.5 Å²	135.5	85%	0.85	77%	0.773	S	S	*	*				-167.3	174.3	102.1	-100.2	-26.3	0	0	0	114.9
699	T	30.2	Very low	31.4	Very low	120 Å²	120	139.8 Å²	139.8	74%	0.736	78%	0.776	S	S	*	*			trans	-93.5	164.4	-170.8	-46.9	0	0	0	0	112.5
700	F	33.6	Very low	31.3	Very low	198 Å²	198	140.4 Å²	140.4	87%	0.868	77%	0.767	S	S	*	*			trans	169.4	160.2	141.9	-110.4	-117.8	0	0	0	111.2
701	V	33.7	Very low	31.5	Very low	88 Å²	88	138.2 Å²	138.2	53%	0.533	77%	0.767	S	S	.	*			cis	-173.6	151.6	-46.4	118	0	0	0	0	111.9
702	E	32	Very low	31.3	Very low	182 Å²	182	138.9 Å²	138.9	85%	0.85	77%	0.765	S	S	*	*			trans	60.6	154.9	162.1	-82.3	175.3	122.9	0	0	121.9
703	S	34.7	Very low	31.6	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	77%	0.772	S	S	*	*			cis	-149.4	-167.8	-7.6	60.7	0	0	0	0	108.3
704	S	35.4	Very low	31.5	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	77%	0.769	S	S	*	*			cis	-155.2	165.4	4.8	34.5	0	0	0	0	107.3
705	L	32.3	Very low	31.8	Very low	160 Å²	160	132.4 Å²	132.4	84%	0.838	77%	0.77	S	S	*	*			cis	79.5	142.3	34.5	-73	173.2	0	0	0	115.8
706	P	36.1	Very low	32	Very low	103 Å²	103	133.1 Å²	133.1	67%	0.669	78%	0.78	S	S	*	*			cis	-144.5	167.6	1.3	42.5	-23.5	0	0	0	119.6
707	S	32.2	Very low	32.3	Very low	106 Å²	106	132.4 Å²	132.4	74%	0.741	78%	0.78	S	S	*	*			trans	58.7	154.3	139.4	60.6	0	0	0	0	122.9
708	S	35.2	Very low	32.4	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	79%	0.789	S	S	*	*			cis	-178.2	150.1	-11.9	51.8	0	0	0	0	111.4
709	L	35.1	Very low	32.4	Very low	170 Å²	170	140.3 Å²	140.3	89%	0.89	79%	0.79	S	S	*	*				178.8	176.5	115.5	-138.3	67	0	0	0	111.3
710	S	31.6	Very low	32.4	Very low	97 Å²	97	140.5 Å²	140.5	68%	0.678	79%	0.793	S	S	*	*			trans	-139.7	160.7	-163.4	59.6	0	0	0	0	115.5
711	T	33.5	Very low	32.1	Very low	144 Å²	144	139.8 Å²	139.8	88%	0.883	80%	0.795	S	S	*	*			trans	-169.3	159.9	132.1	16.2	0	0	0	0	111.7
712	N	28.8	Very low	32.1	Very low	159 Å²	159	144.1 Å²	144.1	85%	0.85	81%	0.806	S	S	*	*			trans	-99.3	149.2	-168.6	-59.8	-34.1	0	0	0	113.8
713	K	33.7	Very low	32	Very low	217 Å²	217	141.2 Å²	141.2	94%	0.943	80%	0.803	S	S	*	*			trans	-156.4	157.9	131.9	-118.4	172.8	-176.5	-179.6	0	112.4
714	S	28.5	Very low	31.6	Very low	117 Å²	117	145.6 Å²	145.6	82%	0.818	81%	0.812	S	S	*	*			trans	-103.9	134.4	-164.4	52.4	0	0	0	0	113.8
715	S	33	Very low	31.2	Very low	116 Å²	116	144 Å²	144	81%	0.811	80%	0.801	S	S	*	*			trans	-152.8	154.6	148	55.8	0	0	0	0	109.2
716	S	29.6	Very low	31.1	Very low	124 Å²	124	143 Å²	143	87%	0.867	79%	0.79	S	S	*	*			trans	-84.4	129	-178.3	-171.9	0	0	0	0	110.3
717	S	30.1	Very low	30.8	Very low	105 Å²	105	145.1 Å²	145.1	73%	0.734	80%	0.795	S	S	*	*			trans	-152.9	120.2	171.2	-84.2	0	0	0	0	113.3
718	R	28.9	Very low	30.6	Very low	242 Å²	242	144.5 Å²	144.5	91%	0.913	79%	0.79	S	S	*	*			trans	15.4	114.4	148.7	-55.3	179.2	-173.7	-178	0.7	116.5
719	K	32.8	Very low	30.2	Very low	199 Å²	199	142.4 Å²	142.4	87%	0.865	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-63.6	143.7	159.4	-64	175.9	-177.5	172.3	0	109	M721	K719-M721 PolarHBondContact O-N 2.98Å
720	P	30	Very low	30	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-68.6	129.4	174.3	28.2	-33.6	0	0	0	110.7
721	M	26.9	Very low	29.8	Very low	183 Å²	183	145.2 Å²	145.2	90%	0.901	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-66.5	143.6	163.4	-81.2	160	59.1	0	0	109.4	K719	K719-M721 PolarHBondContact O-N 2.98Å
722	K	32.9	Very low	29.5	Very low	179 Å²	179	143.2 Å²	143.2	78%	0.778	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-86.7	136.9	165.2	-67	-178.6	177.3	-177.5	0	108	H724	K722-H724 PolarHBondContact O-N 2.95Å
723	P	30.1	Very low	29.5	Very low	121 Å²	121	139.9 Å²	139.9	79%	0.786	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-63.1	134.5	172.1	27.7	-33.6	0	0	0	109.5
724	H	27.5	Very low	29.7	Very low	193 Å²	193	136.1 Å²	136.1	89%	0.894	73%	0.734	S	S	*	*			trans	-133.3	48.8	-177.6	-126.2	-74.6	0	0	0	109.9	K722	K722-H724 PolarHBondContact O-N 2.95Å
725	S	26.8	Very low	30.4	Very low	66 Å²	66	134.7 Å²	134.7	46%	0.462	72%	0.721	S	S	.	*			trans	-123.5	169.8	-177.9	56.6	0	0	0	0	111.6	L727 D870	S725-L727 PolarHBondContact O-N 3.21Å; S725-D870 WeakPolarHBondContact CB-OD2 3.29Å; S725-D870 PolarHBondContact OG-OD2 3.22Å
726	K	30.4	Very low	31.4	Very low	138 Å²	138	134 Å²	134	60%	0.6	71%	0.705	S	S	*	*	S	Bend	trans	55.7	30.3	171.9	-77.4	-177.9	175.1	160.2	0	118.6	D870	K726-D870 VanDerWaalsContact CD-OD1 3.31Å; K726-D870 WeakPolarHBondContact CD-OD1 3.49Å; K726-D870 WeakPolarHBondContact CE-OD1 3.21Å; K726-D870 IonicContact NZ-OD1 3.15Å; K726-D870 PolarHBondContact NZ-OD1 3.05Å
727	L	30.3	Very low	32.9	Very low	148 Å²	148	130.4 Å²	130.4	78%	0.775	68%	0.679	S	S	*	*	S	Bend	trans	-134	4.4	159	-150.5	72.6	0	0	0	114.9	S725	S725-L727 PolarHBondContact O-N 3.21Å
728	S	26	Very low	35.5	Very low	93 Å²	93	126 Å²	126	65%	0.65	65%	0.647	S	S	*	*	S	Bend	trans	-92.9	-43.8	-177.5	-154.7	0	0	0	0	113.4	M730 M731	S728-M730 VanDerWaalsContact C-N 3.28Å; S728-M730 PolarHBondContact O-N 2.67Å; S728-M731 PolarHBondContact O-N 3.17Å
729	S	28.9	Very low	38.3	Very low	55 Å²	55	117.2 Å²	117.2	39%	0.385	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-68.7	-19.7	-172.3	53.6	0	0	0	0	114.9	M731 E872	S729-M731 PolarHBondContact O-N 3.4Å; S729-E872 WeakPolarHBondContact CB-OE1 3.43Å; S729-E872 WeakPolarHBondContact CB-OE2 3.32Å; S729-E872 PolarHBondContact OG-OE1 3.38Å; S729-E872 PolarHBondContact OG-OE2 3.09Å
730	M	29.5	Very low	40.9	Very low	174 Å²	174	111.5 Å²	111.5	86%	0.857	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-75.1	1.2	174.3	-71.8	-167.1	171.6	0	0	114.7	S728	S728-M730 VanDerWaalsContact C-N 3.28Å; S728-M730 PolarHBondContact O-N 2.67Å
731	M	28	Very low	43.9	Very low	153 Å²	153	105.9 Å²	105.9	75%	0.754	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-117.2	-7.4	-177.7	-69.6	-171.9	64.3	0	0	115.6	S728 S729 S733	S728-M731 PolarHBondContact O-N 3.17Å; S729-M731 PolarHBondContact O-N 3.4Å; M731-S733 PolarHBondContact O-N 3.16Å
732	D	26.4	Very low	47	Very low	101 Å²	101	98 Å²	98	54%	0.54	52%	0.523	S	S	.	.			trans	-78.9	16.7	-174.5	-106.2	-57.2	0	0	0	115.7	K734	D732-K734 PolarHBondContact O-N 3.48Å; D732-K734 WeakPolarHBondContact OD1-CE 3.36Å; D732-K734 IonicContact OD1-NZ 3.93Å; D732-K734 PolarHBondContact OD1-NZ 2.89Å
733	S	28.9	Very low	49.9	Very low	89 Å²	89	89.7 Å²	89.7	62%	0.622	49%	0.487	S	S	*	.			trans	-71.8	59.4	156.7	63.8	0	0	0	0	111	M731 T735	M731-S733 PolarHBondContact O-N 3.16Å; S733-T735 PolarHBondContact O-N 2.86Å
734	K	37.5	Very low	53	Low	138 Å²	138	84.8 Å²	84.8	60%	0.6	46%	0.455	S	S	*	.			trans	-47.5	109.8	176.6	-77.1	174.3	178.4	148.5	0	108.9	D732 H736 T775	D732-K734 PolarHBondContact O-N 3.48Å; D732-K734 WeakPolarHBondContact OD1-CE 3.36Å; D732-K734 IonicContact OD1-NZ 3.93Å; D732-K734 PolarHBondContact OD1-NZ 2.89Å; K734-H736 PolarHBondContact O-N 3.06Å; K734-T775 HydrophobicContact CB-CG2 4.01Å; K734-T775 HydrophobicContact CD-CG2 4.42Å
735	T	44.3	Very low	56.1	Low	87 Å²	87	80.1 Å²	80.1	53%	0.534	43%	0.43	S	S	.	.			trans	-63.5	123.5	-171.7	46.2	0	0	0	0	109	S733 C737	S733-T735 PolarHBondContact O-N 2.86Å; T735-C737 WeakPolarHBondContact O-CB 3.32Å; T735-C737 PolarHBondContact O-N 3Å; T735-C737 PolarHBondContact O-SG 2.84Å; T735-C737 VanDerWaalsContact O-SG 3.38Å
736	H	53.3	Low	59.4	Low	102 Å²	102	77.3 Å²	77.3	47%	0.472	41%	0.41	S	S	.	.			trans	-52	104.3	179.7	-68.9	-52.2	0	0	0	110.9	K734 A774	K734-H736 PolarHBondContact O-N 3.06Å; H736-A774 WeakPolarHBondContact ND1-CB 3.32Å
737	C	61.5	Low	62.3	Low	48 Å²	48	71.6 Å²	71.6	32%	0.324	39%	0.387	S	S	.	.			trans	-125.6	31.4	-167	64	0	0	0	0	111.6	T735 Q777	T735-C737 WeakPolarHBondContact O-CB 3.32Å; T735-C737 PolarHBondContact O-N 3Å; T735-C737 PolarHBondContact O-SG 2.84Å; T735-C737 VanDerWaalsContact O-SG 3.38Å; C737-Q777 WeakPolarHBondContact O-CG 3.38Å; C737-Q777 PolarHBondContact O-NE2 3.47Å; C737-Q777 PolarHBondContact SG-NE2 2.94Å
738	T	83.8	Confident	65.1	Low	13 Å²	13	66.2 Å²	66.2	8%	0.08	36%	0.36	C	S	.	.	S	Bend	trans	-94	179.3	177.8	53.9	0	0	0	0	112.8	F751 E752 A774	T738-F751 WeakPolarHBondContact O-CD1 3.4Å; T738-F751 WeakPolarHBondContact OG1-CB 3Å; T738-E752 WeakPolarHBondContact CB-O 3.35Å; T738-E752 WeakPolarHBondContact CG2-O 3.41Å; T738-E752 PolarHBondContact OG1-N 3.49Å; T738-E752 PolarHBondContact OG1-O 3.29Å; T738-A774 WeakPolarHBondContact CG2-O 3.32Å
739	H	87.6	Confident	68	Low	58 Å²	58	65.9 Å²	65.9	27%	0.269	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-72.4	145.9	-177.2	-70.4	73.2	0	0	0	112.2	R479 F751 E752 Q777	R479-H739 PolarHBondContact NE-ND1 2.85Å; R479-H739 PolarHBondContact NH1-CD2 2.97Å; R479-H739 PolarHBondContact NH1-CE1 2.82Å; R479-H739 PolarHBondContact NH1-NE2 3.21Å; H739-F751 CarbonylContact O-C 3.6Å; H739-F751 VanDerWaalsContact O-CA 3.32Å; H739-F751 WeakPolarHBondContact O-CA 3.17Å; H739-E752 HydrophobicContact CB-CG 4.42Å; H739-E752 PolarHBondContact O-N 3.1Å; H739-Q777 PolarHBondContact CE1-O 3.12Å; H739-Q777 VanDerWaalsContact CE1-O 3.24Å
740	V	88.9	Confident	70.9	Confident	78 Å²	78	64.3 Å²	64.3	47%	0.473	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-76.5	126.4	179.4	-179.7	0	0	0	0	110.6	F751	V740-F751 HydrophobicContact CG2-CD1 3.94Å; V740-F751 HydrophobicContact CG2-CE1 3.65Å
741	V	91.8	Very high	73.8	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.042	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-80.7	133.5	-174.7	177.1	0	0	0	0	111.5	V377 C743 K750 E752 S805 Y806	V377-V741 HydrophobicContact CG1-CG1 4.03Å; V741-C743 HydrophobicContact CG1-CB 4.04Å; V741-C743 PolarHBondContact O-N 3.07Å; V741-C743 PolarHBondContact O-SG 2.92Å; V741-K750 HydrophobicContact CB-CB 4.22Å; V741-K750 HydrophobicContact CB-CG 4.23Å; V741-K750 WeakPolarHBondContact CB-O 3.43Å; V741-K750 HydrophobicContact CG2-CG 4.08Å; V741-K750 PolarHBondContact N-O 2.89Å; V741-E752 HydrophobicContact CG2-CB 4.39Å; V741-E752 HydrophobicContact CG2-CG 3.62Å; V741-S805 WeakPolarHBondContact CG2-OG 3.34Å; V741-Y806 HydrophobicContact CG1-CE1 3.93Å; V741-Y806 HydrophobicContact CG1-CE2 4.3Å; V741-Y806 HydrophobicContact CG2-CE2 4.4Å
742	H	93.3	Very high	76.9	Confident	17 Å²	17	51 Å²	51	8%	0.079	27%	0.268	C	S	.	.			trans	-71.7	95.6	167.3	-178.7	-98.2	0	0	0	110.5	C56 Q378 Q389 V440 Y806	C56-H742 PolarHBondContact SG-NE2 3.38Å; C56-H742 VanDerWaalsContact SG-NE2 3.36Å; Q378-H742 PolarHBondContact NE2-O 2.99Å; Q378-H742 PolarHBondContact OE1-O 3.23Å; Q389-H742 PolarHBondContact O-CE1 3.1Å; Q389-H742 PolarHBondContact O-ND1 3.26Å; V440-H742 HydrophobicContact CG1-CB 3.75Å; V440-H742 HydrophobicContact CG2-CB 4.33Å; V440-H742 WeakPolarHBondContact CG2-CD2 3.38Å; H742-Y806 PolarHBondContact N-OH 2.9Å
743	C	94.1	Very high	80	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.034	24%	0.242	C	C	.	.			trans	-134.5	72.4	-176.9	52.7	0	0	0	0	111.1	K59 V377 V741 Y745 F746	K59-C743 WeakPolarHBondContact CD-O 3.38Å; K59-C743 PolarHBondContact NZ-O 3.25Å; K59-C743 PolarHBondContact NZ-SG 3.49Å; V377-C743 HydrophobicContact CG1-CB 3.63Å; V377-C743 WeakPolarHBondContact O-CB 3.45Å; V741-C743 HydrophobicContact CG1-CB 4.04Å; V741-C743 PolarHBondContact O-N 3.07Å; V741-C743 PolarHBondContact O-SG 2.92Å; C743-Y745 VanDerWaalsContact C-N 3.29Å; C743-Y745 PolarHBondContact O-N 3.19Å; C743-F746 HydrophobicContact CB-CB 3.9Å; C743-F746 PolarHBondContact O-N 3.38Å
744	P	93.6	Very high	83.1	Confident	17 Å²	17	42 Å²	42	11%	0.11	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.1	-169.7	14	-27.7	0	0	0	115.6	P55 K59	P55-P744 HydrophobicContact CB-CB 3.63Å; K59-P744 WeakPolarHBondContact CD-O 3.37Å
745	Y	94.2	Very high	85.9	Confident	96 Å²	96	36.1 Å²	36.1	38%	0.376	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-15.5	-175.6	-60.6	-74.6	0	0	0	113.7	P55 H309 A379 C743	P55-Y745 HydrophobicContact CB-CE1 4.3Å; P55-Y745 HydrophobicContact CG-CE1 4.37Å; H309-Y745 PolarHBondContact CE1-O 2.97Å; A379-Y745 HydrophobicContact CB-CD2 4Å; A379-Y745 HydrophobicContact CB-CG 4.03Å; C743-Y745 VanDerWaalsContact C-N 3.29Å; C743-Y745 PolarHBondContact O-N 3.19Å
746	F	94.8	Very high	88.3	Confident	7 Å²	7	32 Å²	32	3%	0.031	16%	0.161	C	C	.	.	S	Bend	trans	-71.6	135.1	178.5	-165.4	-111.8	0	0	0	110.2	K59 I328 P332 V377 C743 V748 K750	K59-F746 WeakPolarHBondContact CD-O 3.46Å; K59-F746 WeakPolarHBondContact CE-O 3.29Å; K59-F746 PolarHBondContact NZ-O 2.86Å; I328-F746 HydrophobicContact CG2-CD2 3.69Å; I328-F746 HydrophobicContact CG2-CE2 3.83Å; I328-F746 WeakPolarHBondContact O-CE2 3.32Å; P332-F746 HydrophobicContact CG-CE2 4.14Å; P332-F746 HydrophobicContact CG-CZ 3.96Å; V377-F746 HydrophobicContact CG2-CD2 4.32Å; V377-F746 HydrophobicContact CG2-CE2 4.28Å; C743-F746 HydrophobicContact CB-CB 3.9Å; C743-F746 PolarHBondContact O-N 3.38Å; F746-V748 HydrophobicContact CD1-CG2 4Å; F746-V748 WeakPolarHBondContact CD1-O 3.5Å; F746-V748 HydrophobicContact CE1-CG2 3.46Å; F746-V748 VanDerWaalsContact CE1-CG2 3.46Å; F746-V748 HydrophobicContact CZ-CG2 4.26Å; F746-V748 PolarHBondContact O-N 3.06Å; F746-K750 HydrophobicContact CD1-CB 4.07Å; F746-K750 HydrophobicContact CE1-CB 4.2Å; F746-K750 HydrophobicContact CE1-CD 4.46Å
747	P	91.2	Very high	90.3	Very high	17 Å²	17	27.1 Å²	27.1	11%	0.11	14%	0.139	C	C	.	.	S	Bend	trans	-73.8	-20.7	-164.4	27.6	-36.3	0	0	0	115.3	Q325 I328 K329	Q325-P747 HydrophobicContact CB-CB 4.04Å; Q325-P747 HydrophobicContact CG-CB 4.23Å; Q325-P747 WeakPolarHBondContact O-CG 3.35Å; I328-P747 HydrophobicContact CB-CG 4.48Å; I328-P747 HydrophobicContact CG2-CG 4.36Å; K329-P747 HydrophobicContact CB-CG 3.71Å
748	V	88.9	Confident	91.9	Very high	36 Å²	36	24.9 Å²	24.9	22%	0.218	12%	0.123	C	C	.	.	S	Bend	trans	-121.5	172	-179.8	-60.9	0	0	0	0	111.2	K59 K329 F746	K59-V748 VanDerWaalsContact CE-O 3.27Å; K59-V748 WeakPolarHBondContact CE-O 3.12Å; K59-V748 PolarHBondContact NZ-O 3.4Å; K329-V748 HydrophobicContact CD-CG1 4.22Å; K329-V748 HydrophobicContact CG-CG1 4.05Å; F746-V748 HydrophobicContact CD1-CG2 4Å; F746-V748 WeakPolarHBondContact CD1-O 3.5Å; F746-V748 HydrophobicContact CE1-CG2 3.46Å; F746-V748 VanDerWaalsContact CE1-CG2 3.46Å; F746-V748 HydrophobicContact CZ-CG2 4.26Å; F746-V748 PolarHBondContact O-N 3.06Å
749	E	87.4	Confident	92.3	Very high	85 Å²	85	24.3 Å²	24.3	40%	0.397	12%	0.12	S	C	.	.			trans	-70.1	133.6	170.2	-59.2	-177.5	141.4	0	0	109.2	I63 N543	I63-E749 HydrophobicContact CD1-CG 3.81Å; N543-E749 PolarHBondContact ND2-OE2 3.17Å
750	K	89.3	Confident	92.5	Very high	23 Å²	23	22.2 Å²	22.2	10%	0.1	11%	0.111	C	C	.	.			trans	-118	138.5	177.3	-179.6	68.7	173.4	73.5	0	108	V377 V741 F746 D804 S805	V377-K750 HydrophobicContact CG1-CG 4.13Å; V377-K750 HydrophobicContact CG2-CD 4.4Å; V377-K750 HydrophobicContact CG2-CG 4.31Å; V741-K750 HydrophobicContact CB-CB 4.22Å; V741-K750 HydrophobicContact CB-CG 4.23Å; V741-K750 WeakPolarHBondContact CB-O 3.43Å; V741-K750 HydrophobicContact CG2-CG 4.08Å; V741-K750 PolarHBondContact N-O 2.89Å; F746-K750 HydrophobicContact CD1-CB 4.07Å; F746-K750 HydrophobicContact CE1-CB 4.2Å; F746-K750 HydrophobicContact CE1-CD 4.46Å; K750-D804 VanDerWaalsContact CE-OD2 3.23Å; K750-D804 WeakPolarHBondContact CE-OD2 3.25Å; K750-D804 IonicContact NZ-OD1 3.78Å; K750-D804 PolarHBondContact NZ-OD1 3.26Å; K750-D804 IonicContact NZ-OD2 3.01Å; K750-D804 PolarHBondContact NZ-OD2 2.92Å; K750-S805 PolarHBondContact NZ-OG 3.34Å
751	F	91.5	Very high	92.4	Very high	47 Å²	47	23 Å²	23	21%	0.206	11%	0.105	C	C	.	.	B	Isolated β-bridge	trans	-109.9	153.6	174.5	-59.1	-91.4	0	0	0	108.8	N543 T738 H739 V740	N543-F751 HydrophobicContact CB-CE2 4.18Å; N543-F751 HydrophobicContact CB-CZ 4.34Å; T738-F751 WeakPolarHBondContact O-CD1 3.4Å; T738-F751 WeakPolarHBondContact OG1-CB 3Å; H739-F751 CarbonylContact O-C 3.6Å; H739-F751 VanDerWaalsContact O-CA 3.32Å; H739-F751 WeakPolarHBondContact O-CA 3.17Å; V740-F751 HydrophobicContact CG2-CD1 3.94Å; V740-F751 HydrophobicContact CG2-CE1 3.65Å
752	E	91.8	Very high	92.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.136	C	C	.	.			trans	-64.8	135.3	-177.3	-72.5	174.3	-166.3	0	0	112	R479 T738 H739 V741 Y806	R479-E752 IonicContact CZ-OE1 2.59Å; R479-E752 IonicContact CZ-OE2 3.46Å; R479-E752 VanDerWaalsContact CZ-OE2 3.31Å; R479-E752 IonicContact NE-OE1 3.16Å; R479-E752 IonicContact NE-OE2 2.63Å; R479-E752 PolarHBondContact NE-OE2 3.29Å; R479-E752 VanDerWaalsContact NH2-CD 3.29Å; R479-E752 IonicContact NH2-OE1 2.75Å; R479-E752 PolarHBondContact NH2-OE1 3.33Å; R479-E752 IonicContact NH2-OE2 2.71Å; R479-E752 PolarHBondContact NH2-OE2 2.82Å; T738-E752 WeakPolarHBondContact CB-O 3.35Å; T738-E752 WeakPolarHBondContact CG2-O 3.41Å; T738-E752 PolarHBondContact OG1-N 3.49Å; T738-E752 PolarHBondContact OG1-O 3.29Å; H739-E752 HydrophobicContact CB-CG 4.42Å; H739-E752 PolarHBondContact O-N 3.1Å; V741-E752 HydrophobicContact CG2-CB 4.39Å; V741-E752 HydrophobicContact CG2-CG 3.62Å; E752-Y806 HydrophobicContact CG-CE2 3.96Å; E752-Y806 WeakPolarHBondContact OE1-CE2 3.41Å
753	G	92.3	Very high	91.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.151	C	C	.	.			trans	-137.2	155.2	172.5	0	0	0	0	0	111.3	I773 D804	G753-I773 CarbonylContact C-O 3.55Å; G753-I773 VanDerWaalsContact CA-O 3.26Å; G753-I773 WeakPolarHBondContact CA-O 3.32Å; G753-D804 WeakPolarHBondContact CA-OD1 3.4Å; G753-D804 PolarHBondContact N-OD1 3.04Å; G753-D804 VanDerWaalsContact N-OD1 3.08Å; G753-D804 PolarHBondContact O-N 3.19Å; G753-D804 VanDerWaalsContact O-N 3.12Å
754	W	94.6	Very high	91.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	134.2	-172.7	-52.4	89	0	0	0	111.7	P445 L447 Y772 I773 V801 R802 C809 F811	P445-W754 HydrophobicContact CB-CH2 4.08Å; P445-W754 HydrophobicContact CB-CZ2 3.87Å; P445-W754 HydrophobicContact CG-CH2 3.66Å; P445-W754 HydrophobicContact CG-CZ2 3.68Å; L447-W754 HydrophobicContact CD1-CD2 3.95Å; L447-W754 HydrophobicContact CD1-CE3 3.69Å; L447-W754 HydrophobicContact CD1-CH2 3.69Å; L447-W754 HydrophobicContact CD1-CZ2 3.94Å; L447-W754 HydrophobicContact CD1-CZ3 3.55Å; L447-W754 HydrophobicContact CD2-CH2 4.28Å; L447-W754 HydrophobicContact CD2-CZ2 4.04Å; L447-W754 HydrophobicContact CG-CH2 3.87Å; L447-W754 HydrophobicContact CG-CZ2 4.12Å; L447-W754 HydrophobicContact CG-CZ3 4.19Å; W754-Y772 WeakPolarHBondContact O-CA 3.21Å; W754-I773 HydrophobicContact CB-CD1 4.22Å; W754-I773 HydrophobicContact CB-CG1 3.78Å; W754-I773 HydrophobicContact CG-CG1 4.44Å; W754-I773 PolarHBondContact N-O 3.48Å; W754-I773 PolarHBondContact O-N 3.49Å; W754-V801 HydrophobicContact CE3-CG1 4.24Å; W754-R802 CarbonylContact C-O 3.57Å; W754-R802 VanDerWaalsContact CA-O 3.29Å; W754-R802 WeakPolarHBondContact CA-O 3.44Å; W754-C809 WeakPolarHBondContact CZ3-O 3.5Å; W754-F811 HydrophobicContact CH2-CE2 4.32Å; W754-F811 HydrophobicContact CZ3-CD2 4.38Å; W754-F811 AromaticContact CZ3-CE2 3.99Å; W754-F811 HydrophobicContact CZ3-CE2 3.99Å
755	W	95.1	Very high	90.9	Very high	15 Å²	15	42 Å²	42	6%	0.057	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.3	173.9	-72.7	99.4	0	0	0	110.4	I339 M370 P770 I771 Y772 V801 R802	I339-W755 HydrophobicContact CD1-CH2 4.13Å; I339-W755 HydrophobicContact CD1-CZ2 3.81Å; I339-W755 HydrophobicContact CG2-CH2 4.33Å; I339-W755 HydrophobicContact CG2-CZ3 4.39Å; M370-W755 HydrophobicContact CE-CB 4.11Å; M370-W755 HydrophobicContact CE-CD2 3.98Å; M370-W755 HydrophobicContact CE-CE3 3.85Å; M370-W755 HydrophobicContact CE-CG 4.13Å; M370-W755 HydrophobicContact CG-CD2 4.35Å; M370-W755 HydrophobicContact CG-CG 4.1Å; M370-W755 HydrophobicContact SD-CB 4.04Å; M370-W755 HydrophobicContact SD-CG 4.21Å; W755-P770 HydrophobicContact CE3-CB 3.83Å; W755-P770 HydrophobicContact CZ3-CB 4.18Å; W755-I771 CarbonylContact C-O 3.59Å; W755-I771 WeakPolarHBondContact CA-O 3.38Å; W755-Y772 AromaticContact CD2-CD2 3.95Å; W755-Y772 HydrophobicContact CD2-CD2 3.95Å; W755-Y772 HydrophobicContact CD2-CG 4.49Å; W755-Y772 AromaticContact CE2-CD2 3.66Å; W755-Y772 HydrophobicContact CG-CD2 4.24Å; W755-Y772 HydrophobicContact CH2-CG 4.5Å; W755-Y772 HydrophobicContact CZ2-CD2 4.05Å; W755-Y772 HydrophobicContact CZ2-CG 4.3Å; W755-Y772 AromaticContact NE1-CD2 3.74Å; W755-V801 CarbonylContact O-C 3.59Å; W755-V801 WeakPolarHBondContact O-CA 3.49Å; W755-R802 HydrophobicContact CB-CB 4.42Å; W755-R802 PolarHBondContact N-O 2.97Å; W755-R802 PolarHBondContact O-N 3.47Å
756	I	95.7	Very high	90.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.2	-170.2	-51.4	178.3	0	0	0	110.3	L477 P770 I771 I773 L782 L784 L799 S800 V801	L477-I756 HydrophobicContact CD1-CD1 3.49Å; L477-I756 VanDerWaalsContact CD1-CD1 3.49Å; I756-P770 WeakPolarHBondContact O-CA 3.39Å; I756-I771 PolarHBondContact N-O 3.07Å; I756-I771 PolarHBondContact O-N 3.27Å; I756-I773 HydrophobicContact CD1-CD1 3.57Å; I756-I773 HydrophobicContact CD1-CG1 3.9Å; I756-L782 HydrophobicContact CD1-CD1 4.39Å; I756-L782 HydrophobicContact CD1-CD2 3.49Å; I756-L782 VanDerWaalsContact CD1-CD2 3.49Å; I756-L782 HydrophobicContact CG2-CD1 4.07Å; I756-L784 HydrophobicContact CG2-CD1 4.11Å; I756-L799 HydrophobicContact CG2-CD1 4Å; I756-S800 WeakPolarHBondContact CA-O 3.15Å; I756-V801 HydrophobicContact CG1-CG1 4.34Å; I756-V801 HydrophobicContact CG1-CG2 4.25Å; I756-V801 HydrophobicContact CG2-CG2 4.08Å
757	Y	95.2	Very high	90.4	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	156.8	-177.2	55.5	-81.6	0	0	0	113.1	L363 E367 M370 A759 L766 P770 S800 R802	L363-Y757 HydrophobicContact CD1-CE2 4.2Å; E367-Y757 WeakPolarHBondContact CG-OH 3.28Å; E367-Y757 PolarHBondContact OE1-OH 2.9Å; M370-Y757 HydrophobicContact CE-CD1 4.18Å; M370-Y757 HydrophobicContact CE-CE1 4.07Å; M370-Y757 HydrophobicContact SD-CD1 4.4Å; M370-Y757 HydrophobicContact SD-CE1 3.7Å; Y757-A759 HydrophobicContact CD2-CB 4.11Å; Y757-A759 HydrophobicContact CE2-CB 4.2Å; Y757-L766 HydrophobicContact CD2-CD1 3.6Å; Y757-L766 HydrophobicContact CE2-CD1 4.41Å; Y757-L766 HydrophobicContact CG-CD1 4.05Å; Y757-P770 HydrophobicContact CD1-CB 4.2Å; Y757-P770 HydrophobicContact CG-CB 4.46Å; Y757-S800 PolarHBondContact N-O 2.99Å; Y757-S800 VanDerWaalsContact N-O 3.12Å; Y757-S800 PolarHBondContact O-N 3.18Å; Y757-R802 HydrophobicContact CE1-CG 4.24Å; Y757-R802 WeakPolarHBondContact OH-CD 3.24Å
758	L	94.6	Very high	90.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136.9	164	-60.1	174.4	0	0	0	110	V473 I767 T768 L784 F786 L799 I815	V473-L758 HydrophobicContact CB-CD1 4.29Å; V473-L758 HydrophobicContact CG2-CD1 3.88Å; L758-I767 HydrophobicContact CB-CB 3.96Å; L758-I767 HydrophobicContact CB-CG2 4.3Å; L758-I767 PolarHBondContact O-N 2.97Å; L758-T768 HydrophobicContact CB-CG2 4.09Å; L758-T768 HydrophobicContact CD1-CG2 3.91Å; L758-T768 HydrophobicContact CG-CG2 4.2Å; L758-T768 PolarHBondContact N-OG1 3.12Å; L758-T768 PolarHBondContact O-N 3.04Å; L758-L784 HydrophobicContact CD1-CB 4.34Å; L758-L784 HydrophobicContact CD2-CD1 4.33Å; L758-L784 HydrophobicContact CG-CD1 3.95Å; L758-F786 HydrophobicContact CD1-CD1 3.56Å; L758-F786 HydrophobicContact CD1-CE1 3.8Å; L758-L799 HydrophobicContact CD2-CB 3.84Å; L758-L799 HydrophobicContact CD2-CD1 3.95Å; L758-L799 HydrophobicContact CD2-CG 4.46Å; L758-I815 HydrophobicContact CD2-CD1 3.69Å; L758-I815 HydrophobicContact CD2-CG1 4.47Å
759	A	93	Very high	90.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	144.2	171.7	0	0	0	0	0	111	L363 Y757 Q765 V798	L363-A759 HydrophobicContact CD1-CB 3.86Å; L363-A759 HydrophobicContact CD2-CB 3.87Å; Y757-A759 HydrophobicContact CD2-CB 4.11Å; Y757-A759 HydrophobicContact CE2-CB 4.2Å; A759-Q765 WeakPolarHBondContact CA-O 3.49Å; A759-V798 PolarHBondContact N-O 2.98Å; A759-V798 PolarHBondContact O-N 3.37Å
760	D	90.5	Very high	90.7	Very high	15 Å²	15	41.7 Å²	41.7	8%	0.08	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.5	165.6	174.2	29.4	0	0	0	109.8	K762 T763 R764 Q765 I767 Y797	D760-K762 VanDerWaalsContact C-N 3.3Å; D760-K762 PolarHBondContact O-N 3.28Å; D760-K762 WeakPolarHBondContact OD1-CB 3.11Å; D760-K762 PolarHBondContact OD1-N 3.33Å; D760-T763 WeakPolarHBondContact CB-OG1 3.24Å; D760-T763 VanDerWaalsContact OD2-CB 3.31Å; D760-T763 WeakPolarHBondContact OD2-CB 2.99Å; D760-T763 VanDerWaalsContact OD2-CG2 3.24Å; D760-T763 WeakPolarHBondContact OD2-CG2 3.45Å; D760-T763 PolarHBondContact OD2-N 2.96Å; D760-T763 PolarHBondContact OD2-OG1 2.74Å; D760-R764 WeakPolarHBondContact O-CA 3.41Å; D760-R764 PolarHBondContact O-N 2.82Å; D760-Q765 PolarHBondContact N-O 3.3Å; D760-Q765 PolarHBondContact O-N 2.9Å; D760-I767 HydrophobicContact CB-CD1 4.31Å; D760-I767 HydrophobicContact CB-CG1 4.49Å; D760-Y797 HydrophobicContact CB-CD1 3.9Å; D760-Y797 HydrophobicContact CB-CE1 3.92Å
761	R	88.5	Confident	90.9	Very high	93 Å²	93	43.6 Å²	43.6	35%	0.351	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.6	178.9	-59.3	-60.5	-176.4	165.2	-4.5	113.1	E367 V798 S800	E367-R761 IonicContact OE1-CZ 2.66Å; E367-R761 VanDerWaalsContact OE1-CZ 3.3Å; E367-R761 IonicContact OE1-NH1 2.78Å; E367-R761 PolarHBondContact OE1-NH1 3.25Å; E367-R761 IonicContact OE1-NH2 2.68Å; E367-R761 PolarHBondContact OE1-NH2 3.28Å; E367-R761 IonicContact OE2-CZ 2.76Å; E367-R761 IonicContact OE2-NH1 2.71Å; E367-R761 PolarHBondContact OE2-NH1 3.44Å; E367-R761 IonicContact OE2-NH2 3.77Å; R761-V798 HydrophobicContact CG-CB 3.98Å; R761-V798 HydrophobicContact CG-CG2 3.57Å; R761-S800 PolarHBondContact NH2-OG 2.98Å
762	K	86.4	Confident	91	Very high	159 Å²	159	45.3 Å²	45.3	69%	0.691	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-58.2	176.5	-60.2	174.7	-179.4	175.1	0	111.1	D760 R764	D760-K762 VanDerWaalsContact C-N 3.3Å; D760-K762 PolarHBondContact O-N 3.28Å; D760-K762 WeakPolarHBondContact OD1-CB 3.11Å; D760-K762 PolarHBondContact OD1-N 3.33Å; K762-R764 VanDerWaalsContact C-N 3.29Å; K762-R764 PolarHBondContact O-N 2.83Å
763	T	84.3	Confident	90.9	Very high	66 Å²	66	46 Å²	46	41%	0.405	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-21.8	175.3	54.7	0	0	0	0	113.2	D760 Q765	D760-T763 WeakPolarHBondContact CB-OG1 3.24Å; D760-T763 VanDerWaalsContact OD2-CB 3.31Å; D760-T763 WeakPolarHBondContact OD2-CB 2.99Å; D760-T763 VanDerWaalsContact OD2-CG2 3.24Å; D760-T763 WeakPolarHBondContact OD2-CG2 3.45Å; D760-T763 PolarHBondContact OD2-N 2.96Å; D760-T763 PolarHBondContact OD2-OG1 2.74Å; T763-Q765 VanDerWaalsContact C-N 3.25Å; T763-Q765 WeakPolarHBondContact OG1-CB 3.27Å; T763-Q765 PolarHBondContact OG1-N 3.39Å
764	R	85.5	Confident	90.8	Very high	135 Å²	135	46.4 Å²	46.4	51%	0.509	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	27.6	-168.4	-51.8	174	177.3	178.5	-1.1	113	Q361 L363 D760 K762	Q361-R764 VanDerWaalsContact OE1-CD 3.27Å; L363-R764 WeakPolarHBondContact CB-O 3.47Å; D760-R764 WeakPolarHBondContact O-CA 3.41Å; D760-R764 PolarHBondContact O-N 2.82Å; K762-R764 VanDerWaalsContact C-N 3.29Å; K762-R764 PolarHBondContact O-N 2.83Å
765	Q	83.8	Confident	90.5	Very high	85 Å²	85	47.9 Å²	47.9	40%	0.397	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	148.6	175.4	-70	171.6	-25.6	0	0	111.3	T359 A759 D760 T763	T359-Q765 PolarHBondContact OG1-NE2 2.84Å; A759-Q765 WeakPolarHBondContact CA-O 3.49Å; D760-Q765 PolarHBondContact N-O 3.3Å; D760-Q765 PolarHBondContact O-N 2.9Å; T763-Q765 VanDerWaalsContact C-N 3.25Å; T763-Q765 WeakPolarHBondContact OG1-CB 3.27Å; T763-Q765 PolarHBondContact OG1-N 3.39Å
766	L	88.8	Confident	90.2	Very high	27 Å²	27	47.2 Å²	47.2	14%	0.141	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129.1	169.3	-176.4	70	0	0	0	107.5	L343 L346 L363 I366 Y757 T768 P770	L343-L766 HydrophobicContact CD2-CD2 3.57Å; L346-L766 HydrophobicContact CD2-CB 4.41Å; L346-L766 HydrophobicContact CD2-CD2 4.48Å; L363-L766 HydrophobicContact CD1-CB 4.48Å; L363-L766 HydrophobicContact CD1-CD1 4.13Å; I366-L766 HydrophobicContact CD1-CD2 4.23Å; Y757-L766 HydrophobicContact CD2-CD1 3.6Å; Y757-L766 HydrophobicContact CE2-CD1 4.41Å; Y757-L766 HydrophobicContact CG-CD1 4.05Å; L766-T768 WeakPolarHBondContact CD1-O 3.37Å; L766-T768 VanDerWaalsContact CG-O 3.27Å; L766-T768 WeakPolarHBondContact CG-O 3.42Å; L766-P770 HydrophobicContact CD2-CG 4.09Å
767	I	90	Very high	89.8	Confident	43 Å²	43	50.3 Å²	50.3	22%	0.221	23%	0.232	C	C	.	.			trans	-94.8	-32.5	-176.4	-58.2	-59.5	0	0	0	111.2	L758 D760 F786 Y797	L758-I767 HydrophobicContact CB-CB 3.96Å; L758-I767 HydrophobicContact CB-CG2 4.3Å; L758-I767 PolarHBondContact O-N 2.97Å; D760-I767 HydrophobicContact CB-CD1 4.31Å; D760-I767 HydrophobicContact CB-CG1 4.49Å; I767-F786 HydrophobicContact CG2-CB 3.67Å; I767-F786 HydrophobicContact CG2-CD1 4.36Å; I767-F786 HydrophobicContact CG2-CD2 3.87Å; I767-F786 HydrophobicContact CG2-CG 3.71Å; I767-Y797 HydrophobicContact CB-CD2 4.44Å; I767-Y797 HydrophobicContact CB-CE2 4.3Å; I767-Y797 HydrophobicContact CD1-CE1 4.04Å; I767-Y797 HydrophobicContact CD1-CE2 4.06Å; I767-Y797 HydrophobicContact CG1-CD1 4.33Å; I767-Y797 HydrophobicContact CG1-CD2 4.01Å; I767-Y797 HydrophobicContact CG1-CE1 4.18Å; I767-Y797 HydrophobicContact CG1-CE2 3.83Å; I767-Y797 HydrophobicContact CG1-CG 4.26Å; I767-Y797 HydrophobicContact CG2-CD2 3.99Å; I767-Y797 HydrophobicContact CG2-CE2 3.6Å
768	T	91.3	Very high	89.6	Confident	12 Å²	12	55.2 Å²	55.2	7%	0.074	26%	0.261	C	S	.	.	S	Bend	trans	-130.5	144.5	176.9	63.5	0	0	0	0	111	L758 L766 L784 R785 F786	L758-T768 HydrophobicContact CB-CG2 4.09Å; L758-T768 HydrophobicContact CD1-CG2 3.91Å; L758-T768 HydrophobicContact CG-CG2 4.2Å; L758-T768 PolarHBondContact N-OG1 3.12Å; L758-T768 PolarHBondContact O-N 3.04Å; L766-T768 WeakPolarHBondContact CD1-O 3.37Å; L766-T768 VanDerWaalsContact CG-O 3.27Å; L766-T768 WeakPolarHBondContact CG-O 3.42Å; T768-L784 HydrophobicContact CG2-CB 4.3Å; T768-R785 WeakPolarHBondContact CG2-O 3.41Å; T768-F786 HydrophobicContact CG2-CB 4Å
769	K	90.3	Very high	89.6	Confident	144 Å²	144	60.2 Å²	60.2	63%	0.626	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-49.9	135.3	166.3	-173.5	177	-179.9	178.7	0	109.6	L343 I771	L343-K769 HydrophobicContact CD1-CG 4.29Å; K769-I771 PolarHBondContact O-N 3.5Å
770	P	93.3	Very high	89.5	Confident	10 Å²	10	62 Å²	62	7%	0.065	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-74.3	123.3	-178	-15	32.2	0	0	0	110.6	L343 M370 W755 I756 Y757 L766	L343-P770 HydrophobicContact CD2-CG 4.44Å; M370-P770 HydrophobicContact CE-CB 3.55Å; M370-P770 HydrophobicContact CE-CG 3.72Å; W755-P770 HydrophobicContact CE3-CB 3.83Å; W755-P770 HydrophobicContact CZ3-CB 4.18Å; I756-P770 WeakPolarHBondContact O-CA 3.39Å; Y757-P770 HydrophobicContact CD1-CB 4.2Å; Y757-P770 HydrophobicContact CG-CB 4.46Å; L766-P770 HydrophobicContact CD2-CG 4.09Å
771	I	93.1	Very high	89.7	Confident	62 Å²	62	66.4 Å²	66.4	32%	0.318	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.1	173.1	-57.1	-172.5	0	0	0	108.2	W755 I756 K769 I773 L782 L784	W755-I771 CarbonylContact C-O 3.59Å; W755-I771 WeakPolarHBondContact CA-O 3.38Å; I756-I771 PolarHBondContact N-O 3.07Å; I756-I771 PolarHBondContact O-N 3.27Å; K769-I771 PolarHBondContact O-N 3.5Å; I771-I773 HydrophobicContact CG2-CG2 4.12Å; I771-L782 HydrophobicContact CD1-CD1 4.45Å; I771-L784 HydrophobicContact CD1-CD2 3.61Å; I771-L784 HydrophobicContact CG1-CD2 3.95Å
772	Y	92.4	Very high	89.9	Confident	84 Å²	84	63 Å²	63	33%	0.329	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.9	170.1	175.9	-103.2	0	0	0	109.7	W754 W755 A774 D804	W754-Y772 WeakPolarHBondContact O-CA 3.21Å; W755-Y772 AromaticContact CD2-CD2 3.95Å; W755-Y772 HydrophobicContact CD2-CD2 3.95Å; W755-Y772 HydrophobicContact CD2-CG 4.49Å; W755-Y772 AromaticContact CE2-CD2 3.66Å; W755-Y772 HydrophobicContact CG-CD2 4.24Å; W755-Y772 HydrophobicContact CH2-CG 4.5Å; W755-Y772 HydrophobicContact CZ2-CD2 4.05Å; W755-Y772 HydrophobicContact CZ2-CG 4.3Å; W755-Y772 AromaticContact NE1-CD2 3.74Å; Y772-A774 HydrophobicContact CE1-CB 3.72Å; Y772-D804 HydrophobicContact CE2-CB 4.31Å; Y772-D804 PolarHBondContact OH-OD2 3.47Å
773	I	91.2	Very high	90.3	Very high	13 Å²	13	59.2 Å²	59.2	7%	0.067	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.9	173.7	60.8	168.8	0	0	0	110.6	L477 G753 W754 I756 I771 L776 E780 L782	L477-I773 HydrophobicContact CD1-CD1 3.76Å; G753-I773 CarbonylContact C-O 3.55Å; G753-I773 VanDerWaalsContact CA-O 3.26Å; G753-I773 WeakPolarHBondContact CA-O 3.32Å; W754-I773 HydrophobicContact CB-CD1 4.22Å; W754-I773 HydrophobicContact CB-CG1 3.78Å; W754-I773 HydrophobicContact CG-CG1 4.44Å; W754-I773 PolarHBondContact N-O 3.48Å; W754-I773 PolarHBondContact O-N 3.49Å; I756-I773 HydrophobicContact CD1-CD1 3.57Å; I756-I773 HydrophobicContact CD1-CG1 3.9Å; I771-I773 HydrophobicContact CG2-CG2 4.12Å; I773-L776 HydrophobicContact CD1-CB 4.34Å; I773-E780 WeakPolarHBondContact CD1-OE2 3.49Å; I773-L782 HydrophobicContact CD1-CD2 4.38Å; I773-L782 HydrophobicContact CG2-CD2 4.45Å
774	A	89.1	Confident	90.7	Very high	9 Å²	9	56.2 Å²	56.2	7%	0.074	27%	0.268	C	S	.	.			trans	-141.3	42.7	177	0	0	0	0	0	110.3	H736 T738 Y772	H736-A774 WeakPolarHBondContact ND1-CB 3.32Å; T738-A774 WeakPolarHBondContact CG2-O 3.32Å; Y772-A774 HydrophobicContact CE1-CB 3.72Å
775	T	88.7	Confident	91.1	Very high	32 Å²	32	56 Å²	56	20%	0.196	27%	0.267	C	S	.	.			trans	-133.3	-22.8	-170.8	24.5	0	0	0	0	113.6	K734 Q777 E780	K734-T775 HydrophobicContact CB-CG2 4.01Å; K734-T775 HydrophobicContact CD-CG2 4.42Å; T775-Q777 PolarHBondContact O-N 3.34Å; T775-E780 VanDerWaalsContact CB-OE1 3.22Å; T775-E780 WeakPolarHBondContact CB-OE1 3.3Å; T775-E780 VanDerWaalsContact OG1-CD 3.32Å; T775-E780 PolarHBondContact OG1-OE1 3.24Å; T775-E780 PolarHBondContact OG1-OE2 2.87Å
776	L	89.5	Confident	91.5	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	25%	0.25	C	S	.	.			trans	-52.4	99.9	177.9	-178.3	58.4	0	0	0	115.5	L447 L477 R479 I773 E780	L447-L776 HydrophobicContact CD2-CD2 3.83Å; L477-L776 HydrophobicContact CB-CD1 4.38Å; L477-L776 HydrophobicContact CB-CD2 4.12Å; L477-L776 HydrophobicContact CD1-CD2 4.29Å; R479-L776 HydrophobicContact CB-CD1 4.17Å; R479-L776 HydrophobicContact CB-CD2 4.23Å; R479-L776 HydrophobicContact CB-CG 4.03Å; I773-L776 HydrophobicContact CD1-CB 4.34Å; L776-E780 VanDerWaalsContact CA-OE2 3.27Å; L776-E780 WeakPolarHBondContact CA-OE2 3.16Å; L776-E780 HydrophobicContact CB-CB 4.38Å; L776-E780 WeakPolarHBondContact CB-OE2 3.21Å; L776-E780 HydrophobicContact CD1-CB 3.75Å; L776-E780 PolarHBondContact N-OE2 3.2Å
777	Q	87.4	Confident	91.6	Very high	65 Å²	65	54.3 Å²	54.3	30%	0.304	26%	0.263	S	S	.	.	S	Bend	trans	-89.9	-58.8	168.7	-70.7	-176.9	26.1	0	0	112	R479 C737 H739 T775	R479-Q777 WeakPolarHBondContact CD-O 3.36Å; C737-Q777 WeakPolarHBondContact O-CG 3.38Å; C737-Q777 PolarHBondContact O-NE2 3.47Å; C737-Q777 PolarHBondContact SG-NE2 2.94Å; H739-Q777 PolarHBondContact CE1-O 3.12Å; H739-Q777 VanDerWaalsContact CE1-O 3.24Å; T775-Q777 PolarHBondContact O-N 3.34Å
778	T	90.6	Very high	91.7	Very high	103 Å²	103	52.4 Å²	52.4	63%	0.632	25%	0.254	S	S	*	.	S	Bend	trans	-130.7	-48.3	-173.3	46.6	0	0	0	0	111.6	K478 R479	K478-T778 CarbonylContact C-O 3.56Å; K478-T778 WeakPolarHBondContact CA-O 3.48Å; R479-T778 PolarHBondContact N-O 3.32Å
779	E	93.1	Very high	91.7	Very high	106 Å²	106	52.4 Å²	52.4	50%	0.495	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138	177.8	-174.3	162	-176.6	0	0	108.8	V476 L477 K478	V476-E779 HydrophobicContact CG1-CG 4.08Å; L477-E779 CarbonylContact O-C 3.56Å; L477-E779 VanDerWaalsContact O-CA 3.26Å; L477-E779 WeakPolarHBondContact O-CA 3.37Å; K478-E779 WeakPolarHBondContact CE-OE1 3.48Å; K478-E779 WeakPolarHBondContact CE-OE2 3.31Å; K478-E779 HydrophobicContact CG-CB 4.38Å; K478-E779 HydrophobicContact CG-CG 4.07Å; K478-E779 IonicContact NZ-OE1 2.62Å; K478-E779 PolarHBondContact NZ-OE1 2.87Å; K478-E779 IonicContact NZ-OE2 2.86Å
780	E	92	Very high	91.6	Very high	39 Å²	39	48 Å²	48	18%	0.182	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	134.6	173.9	-170.6	158.6	-150.8	0	0	109.3	L477 I773 T775 L776	L477-E780 PolarHBondContact N-O 3.48Å; L477-E780 PolarHBondContact O-N 2.8Å; I773-E780 WeakPolarHBondContact CD1-OE2 3.49Å; T775-E780 VanDerWaalsContact CB-OE1 3.22Å; T775-E780 WeakPolarHBondContact CB-OE1 3.3Å; T775-E780 VanDerWaalsContact OG1-CD 3.32Å; T775-E780 PolarHBondContact OG1-OE1 3.24Å; T775-E780 PolarHBondContact OG1-OE2 2.87Å; L776-E780 VanDerWaalsContact CA-OE2 3.27Å; L776-E780 WeakPolarHBondContact CA-OE2 3.16Å; L776-E780 HydrophobicContact CB-CB 4.38Å; L776-E780 WeakPolarHBondContact CB-OE2 3.21Å; L776-E780 HydrophobicContact CD1-CB 3.75Å; L776-E780 PolarHBondContact N-OE2 3.2Å
781	E	93.8	Very high	91.5	Very high	107 Å²	107	52.6 Å²	52.6	50%	0.5	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137	-179.8	-178.4	169.2	-168.7	0	0	109.4	R452 T474 V475 V476	R452-E781 IonicContact CZ-OE1 3.88Å; R452-E781 IonicContact NH1-OE1 2.75Å; R452-E781 PolarHBondContact NH1-OE1 3.45Å; R452-E781 IonicContact NH2-OE1 3.89Å; R452-E781 PolarHBondContact NH2-OE1 2.88Å; R452-E781 VanDerWaalsContact NH2-OE1 3.12Å; T474-E781 HydrophobicContact CG2-CG 3.58Å; T474-E781 WeakPolarHBondContact CG2-OE1 3.15Å; V475-E781 WeakPolarHBondContact O-CA 3.34Å; V476-E781 HydrophobicContact CG2-CB 4.09Å; V476-E781 HydrophobicContact CG2-CG 3.79Å
782	L	93.5	Very high	91.4	Very high	21 Å²	21	52.2 Å²	52.2	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	151.9	-176.4	62.4	109.3	0	0	0	111.4	T474 V475 I756 I771 I773 L784	T474-L782 WeakPolarHBondContact CA-O 3.32Å; V475-L782 HydrophobicContact CB-CD1 4.17Å; V475-L782 HydrophobicContact CB-CG 4.14Å; V475-L782 PolarHBondContact N-O 3.24Å; V475-L782 PolarHBondContact O-N 3.48Å; I756-L782 HydrophobicContact CD1-CD1 4.39Å; I756-L782 HydrophobicContact CD1-CD2 3.49Å; I756-L782 VanDerWaalsContact CD1-CD2 3.49Å; I756-L782 HydrophobicContact CG2-CD1 4.07Å; I771-L782 HydrophobicContact CD1-CD1 4.45Å; I773-L782 HydrophobicContact CD1-CD2 4.38Å; I773-L782 HydrophobicContact CG2-CD2 4.45Å; L782-L784 HydrophobicContact CD1-CD2 3.94Å; L782-L784 HydrophobicContact CD1-CG 4.03Å
783	Q	94	Very high	91.3	Very high	79 Å²	79	49.5 Å²	49.5	37%	0.369	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136.3	178.4	-66.3	-174.4	-8.5	0	0	110.9	T472 T474	T472-Q783 HydrophobicContact CG2-CB 4.01Å; T472-Q783 HydrophobicContact CG2-CG 3.88Å; T474-Q783 HydrophobicContact CG2-CG 4.17Å
784	L	93.6	Very high	91.3	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.016	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118	167.5	-57.8	174.3	0	0	0	107.6	V473 V475 I756 L758 T768 I771 L782 L799	V473-L784 HydrophobicContact CB-CB 4.35Å; V473-L784 PolarHBondContact N-O 2.96Å; V473-L784 PolarHBondContact O-N 3.47Å; V475-L784 HydrophobicContact CG2-CD1 4Å; V475-L784 HydrophobicContact CG2-CG 4.43Å; I756-L784 HydrophobicContact CG2-CD1 4.11Å; L758-L784 HydrophobicContact CD1-CB 4.34Å; L758-L784 HydrophobicContact CD2-CD1 4.33Å; L758-L784 HydrophobicContact CG-CD1 3.95Å; T768-L784 HydrophobicContact CG2-CB 4.3Å; I771-L784 HydrophobicContact CD1-CD2 3.61Å; I771-L784 HydrophobicContact CG1-CD2 3.95Å; L782-L784 HydrophobicContact CD1-CD2 3.94Å; L782-L784 HydrophobicContact CD1-CG 4.03Å; L784-L799 HydrophobicContact CD1-CD1 3.63Å
785	R	93.3	Very high	91.4	Very high	130 Å²	130	59.2 Å²	59.2	49%	0.491	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	138.8	-178.7	-61	-171.2	-177.8	171.3	2.4	111	M470 V471 T472 T768	M470-R785 HydrophobicContact CE-CB 4.14Å; M470-R785 HydrophobicContact SD-CB 3.84Å; V471-R785 WeakPolarHBondContact O-CA 3.18Å; T472-R785 HydrophobicContact CG2-CG 4.48Å; T768-R785 WeakPolarHBondContact CG2-O 3.41Å
786	F	92.2	Very high	91.6	Very high	9 Å²	9	60.7 Å²	60.7	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	150.1	174.8	75.2	-88.7	0	0	0	112.2	V471 V473 L758 I767 T768 Y797 F817	V471-F786 HydrophobicContact CB-CD1 4.17Å; V471-F786 HydrophobicContact CB-CE1 3.74Å; V471-F786 HydrophobicContact CB-CE2 4.13Å; V471-F786 HydrophobicContact CB-CZ 3.72Å; V471-F786 HydrophobicContact CG1-CD1 4.49Å; V471-F786 HydrophobicContact CG1-CE1 3.71Å; V471-F786 HydrophobicContact CG1-CZ 3.8Å; V471-F786 HydrophobicContact CG2-CE2 4.19Å; V471-F786 HydrophobicContact CG2-CZ 4.07Å; V471-F786 PolarHBondContact N-O 3.24Å; V471-F786 PolarHBondContact O-N 2.87Å; V473-F786 HydrophobicContact CG2-CD1 4.23Å; V473-F786 HydrophobicContact CG2-CE1 3.68Å; L758-F786 HydrophobicContact CD1-CD1 3.56Å; L758-F786 HydrophobicContact CD1-CE1 3.8Å; I767-F786 HydrophobicContact CG2-CB 3.67Å; I767-F786 HydrophobicContact CG2-CD1 4.36Å; I767-F786 HydrophobicContact CG2-CD2 3.87Å; I767-F786 HydrophobicContact CG2-CG 3.71Å; T768-F786 HydrophobicContact CG2-CB 4Å; F786-Y797 AromaticContact CD2-CE2 3.95Å; F786-Y797 HydrophobicContact CD2-CE2 3.95Å; F786-Y797 HydrophobicContact CE2-CD2 4.2Å; F786-Y797 AromaticContact CE2-CE2 3.56Å; F786-Y797 HydrophobicContact CE2-CE2 3.56Å; F786-Y797 HydrophobicContact CZ-CD2 4.09Å; F786-Y797 AromaticContact CZ-CE2 3.93Å; F786-Y797 HydrophobicContact CZ-CE2 3.93Å; F786-F817 HydrophobicContact CE2-CE1 4.35Å; F786-F817 HydrophobicContact CE2-CE2 4.06Å; F786-F817 AromaticContact CE2-CZ 3.68Å; F786-F817 HydrophobicContact CE2-CZ 3.68Å; F786-F817 HydrophobicContact CZ-CD1 4.49Å; F786-F817 AromaticContact CZ-CE1 3.9Å; F786-F817 HydrophobicContact CZ-CE1 3.9Å; F786-F817 HydrophobicContact CZ-CE2 4.03Å; F786-F817 AromaticContact CZ-CZ 3.64Å; F786-F817 HydrophobicContact CZ-CZ 3.64Å
787	V	92	Very high	91.8	Very high	69 Å²	69	61.7 Å²	61.7	42%	0.418	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.9	176.4	177.5	0	0	0	0	110.4	F468	F468-V787 HydrophobicContact CB-CG1 4.39Å; F468-V787 HydrophobicContact CD1-CG1 4.43Å
788	A	91.8	Very high	92.2	Very high	2 Å²	2	59.5 Å²	59.5	2%	0.017	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-61.1	136.8	179.7	0	0	0	0	0	112	I465 W466 F468 S469 V471 V819	I465-A788 HydrophobicContact CG2-CB 3.66Å; W466-A788 WeakPolarHBondContact O-CB 3.4Å; F468-A788 WeakPolarHBondContact CA-O 3.38Å; F468-A788 PolarHBondContact N-O 2.87Å; F468-A788 VanDerWaalsContact N-O 3.08Å; S469-A788 VanDerWaalsContact O-CB 3.27Å; S469-A788 WeakPolarHBondContact O-CB 3.42Å; S469-A788 PolarHBondContact O-N 2.62Å; V471-A788 HydrophobicContact CG2-CB 3.95Å; A788-V819 HydrophobicContact CB-CG2 4.4Å
789	P	90.9	Very high	92.4	Very high	12 Å²	12	54.6 Å²	54.6	8%	0.078	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-52.4	141	177.3	-31.4	38.6	0	0	0	113.3	I791 Y795 Y797 F817	P789-I791 VanDerWaalsContact C-N 3.29Å; P789-I791 PolarHBondContact O-N 3.44Å; P789-Y795 HydrophobicContact CB-CD1 4.13Å; P789-Y795 HydrophobicContact CB-CD2 4.29Å; P789-Y795 HydrophobicContact CB-CE1 3.56Å; P789-Y795 HydrophobicContact CB-CE2 3.75Å; P789-Y795 HydrophobicContact CB-CG 4.47Å; P789-Y795 HydrophobicContact CG-CD1 3.78Å; P789-Y795 HydrophobicContact CG-CD2 4.17Å; P789-Y795 HydrophobicContact CG-CE1 3.74Å; P789-Y795 HydrophobicContact CG-CE2 4.13Å; P789-Y795 HydrophobicContact CG-CG 4Å; P789-Y797 VanDerWaalsContact CG-OH 3.25Å; P789-Y797 WeakPolarHBondContact CG-OH 3.49Å; P789-F817 HydrophobicContact CG-CE2 4.43Å; P789-F817 HydrophobicContact CG-CZ 4.27Å
790	P	88.2	Confident	92.5	Very high	52 Å²	52	49.6 Å²	49.6	34%	0.338	25%	0.251	S	S	.	.	S	Bend	trans	-79.1	-12.7	-166.3	34.5	-40.2	0	0	0	113.6	F468 I892	F468-P790 HydrophobicContact CD1-CB 4.38Å; F468-P790 HydrophobicContact CD2-CB 4.36Å; F468-P790 HydrophobicContact CE1-CB 3.71Å; F468-P790 HydrophobicContact CE2-CB 3.68Å; F468-P790 HydrophobicContact CZ-CB 3.31Å; P790-I892 HydrophobicContact CB-CD1 3.65Å; P790-I892 HydrophobicContact CG-CD1 4.34Å
791	I	90.9	Very high	92.7	Very high	106 Å²	106	47.7 Å²	47.7	54%	0.544	24%	0.243	S	C	.	.	S	Bend	trans	-100.9	121.5	176.7	-60.3	172.7	0	0	0	108.7	P789 G793 Y795	P789-I791 VanDerWaalsContact C-N 3.29Å; P789-I791 PolarHBondContact O-N 3.44Å; I791-G793 PolarHBondContact O-N 3.22Å; I791-Y795 VanDerWaalsContact O-CE2 3.31Å; I791-Y795 WeakPolarHBondContact O-CE2 3.4Å; I791-Y795 PolarHBondContact O-OH 3.33Å
792	P	90.9	Very high	92.8	Very high	54 Å²	54	44.8 Å²	44.8	35%	0.351	23%	0.227	S	C	.	.			trans	-53.8	136.2	173.7	-28.3	36.2	0	0	0	113.1	P467 V819 P821	P467-P792 HydrophobicContact CG-CG 4.05Å; P792-V819 CarbonylContact C-O 3.59Å; P792-V819 WeakPolarHBondContact CA-O 3.44Å; P792-P821 HydrophobicContact CB-CB 4.28Å; P792-P821 HydrophobicContact CG-CB 4.07Å
793	G	91.3	Very high	92.9	Very high	27 Å²	27	44 Å²	44	28%	0.278	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	163.5	-179.8	-175	0	0	0	0	0	114.8	I791 Y795 T818 V819	I791-G793 PolarHBondContact O-N 3.22Å; G793-Y795 WeakPolarHBondContact O-CD2 3.23Å; G793-T818 CarbonylContact O-C 3.54Å; G793-T818 WeakPolarHBondContact O-CA 3.49Å; G793-V819 PolarHBondContact N-O 3.18Å; G793-V819 PolarHBondContact O-N 3.5Å
794	Q	91	Very high	92.8	Very high	168 Å²	168	40.4 Å²	40.4	79%	0.785	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	119.4	176.1	-67.6	-173.2	-2.5	0	0	111.1	T818	Q794-T818 HydrophobicContact CG-CG2 4.22Å
795	Y	90.9	Very high	92.9	Very high	58 Å²	58	40.2 Å²	40.2	23%	0.227	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	151.2	-178.2	-69.1	-88.7	0	0	0	111.6	P789 I791 G793 F817 V819	P789-Y795 HydrophobicContact CB-CD1 4.13Å; P789-Y795 HydrophobicContact CB-CD2 4.29Å; P789-Y795 HydrophobicContact CB-CE1 3.56Å; P789-Y795 HydrophobicContact CB-CE2 3.75Å; P789-Y795 HydrophobicContact CB-CG 4.47Å; P789-Y795 HydrophobicContact CG-CD1 3.78Å; P789-Y795 HydrophobicContact CG-CD2 4.17Å; P789-Y795 HydrophobicContact CG-CE1 3.74Å; P789-Y795 HydrophobicContact CG-CE2 4.13Å; P789-Y795 HydrophobicContact CG-CG 4Å; I791-Y795 VanDerWaalsContact O-CE2 3.31Å; I791-Y795 WeakPolarHBondContact O-CE2 3.4Å; I791-Y795 PolarHBondContact O-OH 3.33Å; G793-Y795 WeakPolarHBondContact O-CD2 3.23Å; Y795-F817 HydrophobicContact CD2-CE2 4.29Å; Y795-F817 HydrophobicContact CG-CE2 4.28Å; Y795-F817 HydrophobicContact CG-CZ 4.05Å; Y795-F817 PolarHBondContact N-O 2.79Å; Y795-F817 PolarHBondContact O-N 2.97Å; Y795-V819 HydrophobicContact CD2-CB 4.39Å; Y795-V819 HydrophobicContact CD2-CG2 3.74Å; Y795-V819 HydrophobicContact CE2-CB 4.16Å; Y795-V819 HydrophobicContact CE2-CG2 3.78Å
796	L	93.1	Very high	92.9	Very high	64 Å²	64	34.3 Å²	34.3	34%	0.335	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	95.7	-174.7	179.3	72.8	0	0	0	108.6	C814 I815 R816	L796-C814 HydrophobicContact CD1-CB 3.96Å; L796-I815 WeakPolarHBondContact CA-O 3.01Å; L796-R816 HydrophobicContact CD1-CG 3.67Å
797	Y	94	Very high	92.9	Very high	22 Å²	22	34.3 Å²	34.3	9%	0.086	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	155.1	175	-66.2	-14.5	0	0	0	110.3	D760 I767 F786 P789 I815 F817	D760-Y797 HydrophobicContact CB-CD1 3.9Å; D760-Y797 HydrophobicContact CB-CE1 3.92Å; I767-Y797 HydrophobicContact CB-CD2 4.44Å; I767-Y797 HydrophobicContact CB-CE2 4.3Å; I767-Y797 HydrophobicContact CD1-CE1 4.04Å; I767-Y797 HydrophobicContact CD1-CE2 4.06Å; I767-Y797 HydrophobicContact CG1-CD1 4.33Å; I767-Y797 HydrophobicContact CG1-CD2 4.01Å; I767-Y797 HydrophobicContact CG1-CE1 4.18Å; I767-Y797 HydrophobicContact CG1-CE2 3.83Å; I767-Y797 HydrophobicContact CG1-CG 4.26Å; I767-Y797 HydrophobicContact CG2-CD2 3.99Å; I767-Y797 HydrophobicContact CG2-CE2 3.6Å; F786-Y797 AromaticContact CD2-CE2 3.95Å; F786-Y797 HydrophobicContact CD2-CE2 3.95Å; F786-Y797 HydrophobicContact CE2-CD2 4.2Å; F786-Y797 AromaticContact CE2-CE2 3.56Å; F786-Y797 HydrophobicContact CE2-CE2 3.56Å; F786-Y797 HydrophobicContact CZ-CD2 4.09Å; F786-Y797 AromaticContact CZ-CE2 3.93Å; F786-Y797 HydrophobicContact CZ-CE2 3.93Å; P789-Y797 VanDerWaalsContact CG-OH 3.25Å; P789-Y797 WeakPolarHBondContact CG-OH 3.49Å; Y797-I815 PolarHBondContact N-O 2.89Å; Y797-I815 PolarHBondContact O-N 2.78Å; Y797-F817 HydrophobicContact CD1-CE1 4.45Å; Y797-F817 AromaticContact CD2-CE1 3.57Å; Y797-F817 HydrophobicContact CD2-CE1 3.57Å; Y797-F817 AromaticContact CD2-CZ 3.94Å; Y797-F817 HydrophobicContact CD2-CZ 3.94Å; Y797-F817 AromaticContact CE2-CE1 3.75Å; Y797-F817 HydrophobicContact CE2-CE1 3.75Å; Y797-F817 AromaticContact CE2-CZ 3.6Å; Y797-F817 HydrophobicContact CE2-CZ 3.6Å; Y797-F817 AromaticContact CG-CE1 3.96Å; Y797-F817 HydrophobicContact CG-CE1 3.96Å; Y797-F817 AromaticContact CZ-CZ 3.98Å
798	V	95	Very high	92.7	Very high	19 Å²	19	33.7 Å²	33.7	12%	0.115	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	109.8	178.4	-179.5	0	0	0	0	109.4	A759 R761 S800 T812 E813	A759-V798 PolarHBondContact N-O 2.98Å; A759-V798 PolarHBondContact O-N 3.37Å; R761-V798 HydrophobicContact CG-CB 3.98Å; R761-V798 HydrophobicContact CG-CG2 3.57Å; V798-S800 PolarHBondContact O-N 3.31Å; V798-S800 PolarHBondContact O-OG 3.29Å; V798-T812 HydrophobicContact CG1-CG2 4.23Å; V798-E813 WeakPolarHBondContact CA-O 3.48Å
799	L	95.9	Very high	92.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	116.8	166.5	175.9	57.9	0	0	0	108.1	L449 V475 I756 L758 L784 T812 E813 I815	L449-L799 HydrophobicContact CD1-CD2 3.89Å; L449-L799 HydrophobicContact CD2-CD2 4.25Å; L449-L799 HydrophobicContact CD2-CG 4.48Å; L449-L799 HydrophobicContact CG-CD2 4.49Å; V475-L799 HydrophobicContact CB-CD2 4.49Å; V475-L799 HydrophobicContact CG1-CD2 4Å; V475-L799 HydrophobicContact CG2-CD1 4.09Å; V475-L799 HydrophobicContact CG2-CD2 3.64Å; I756-L799 HydrophobicContact CG2-CD1 4Å; L758-L799 HydrophobicContact CD2-CB 3.84Å; L758-L799 HydrophobicContact CD2-CD1 3.95Å; L758-L799 HydrophobicContact CD2-CG 4.46Å; L784-L799 HydrophobicContact CD1-CD1 3.63Å; L799-T812 CarbonylContact O-C 3.54Å; L799-T812 VanDerWaalsContact O-CA 3.3Å; L799-T812 WeakPolarHBondContact O-CA 3.46Å; L799-E813 PolarHBondContact N-O 2.71Å; L799-E813 PolarHBondContact O-N 2.92Å; L799-I815 HydrophobicContact CB-CD1 3.98Å; L799-I815 HydrophobicContact CB-CG1 4.04Å; L799-I815 HydrophobicContact CD2-CD1 4.26Å
800	S	95.3	Very high	92.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.4	-177	-53.7	0	0	0	0	108.9	I756 Y757 R761 V798	I756-S800 WeakPolarHBondContact CA-O 3.15Å; Y757-S800 PolarHBondContact N-O 2.99Å; Y757-S800 VanDerWaalsContact N-O 3.12Å; Y757-S800 PolarHBondContact O-N 3.18Å; R761-S800 PolarHBondContact NH2-OG 2.98Å; V798-S800 PolarHBondContact O-N 3.31Å; V798-S800 PolarHBondContact O-OG 3.29Å
801	V	95.9	Very high	92.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	109.2	177.7	174.7	0	0	0	0	107.4	L447 L449 L477 W754 W755 I756 F811	L447-V801 HydrophobicContact CD1-CG1 3.96Å; L449-V801 HydrophobicContact CD1-CG2 4.36Å; L449-V801 HydrophobicContact CD2-CG2 4.07Å; L477-V801 HydrophobicContact CD1-CG1 4.14Å; L477-V801 HydrophobicContact CD2-CG1 4.18Å; L477-V801 HydrophobicContact CD2-CG2 4.23Å; W754-V801 HydrophobicContact CE3-CG1 4.24Å; W755-V801 CarbonylContact O-C 3.59Å; W755-V801 WeakPolarHBondContact O-CA 3.49Å; I756-V801 HydrophobicContact CG1-CG1 4.34Å; I756-V801 HydrophobicContact CG1-CG2 4.25Å; I756-V801 HydrophobicContact CG2-CG2 4.08Å; V801-F811 HydrophobicContact CB-CB 4.32Å; V801-F811 PolarHBondContact N-O 2.97Å; V801-F811 PolarHBondContact O-N 3.48Å
802	R	95.3	Very high	92.8	Very high	46 Å²	46	33.7 Å²	33.7	17%	0.174	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.5	-170.2	-56	-161.3	75.8	147.3	1.8	112.3	E367 W754 W755 Y757 D810	E367-R802 IonicContact OE1-NH1 3.94Å; E367-R802 PolarHBondContact OE1-NH1 3.05Å; E367-R802 VanDerWaalsContact OE1-NH1 3.15Å; W754-R802 CarbonylContact C-O 3.57Å; W754-R802 VanDerWaalsContact CA-O 3.29Å; W754-R802 WeakPolarHBondContact CA-O 3.44Å; W755-R802 HydrophobicContact CB-CB 4.42Å; W755-R802 PolarHBondContact N-O 2.97Å; W755-R802 PolarHBondContact O-N 3.47Å; Y757-R802 HydrophobicContact CE1-CG 4.24Å; Y757-R802 WeakPolarHBondContact OH-CD 3.24Å; R802-D810 WeakPolarHBondContact CA-OD1 3.43Å; R802-D810 VanDerWaalsContact CB-OD1 3.25Å; R802-D810 WeakPolarHBondContact CB-OD1 3.38Å; R802-D810 HydrophobicContact CG-CB 4.49Å; R802-D810 IonicContact CZ-OD2 3.36Å; R802-D810 VanDerWaalsContact CZ-OD2 3.29Å; R802-D810 IonicContact NE-OD1 3.46Å; R802-D810 IonicContact NE-OD2 3.25Å; R802-D810 PolarHBondContact NE-OD2 3.14Å; R802-D810 VanDerWaalsContact NE-OD2 3.08Å; R802-D810 IonicContact NH2-OD2 2.69Å; R802-D810 PolarHBondContact NH2-OD2 3.26Å
803	S	94.7	Very high	92.9	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.4	177.4	-168.8	0	0	0	0	111	S805 Y806 C809 D810	S803-S805 PolarHBondContact O-N 2.89Å; S803-S805 PolarHBondContact OG-N 3.3Å; S803-Y806 PolarHBondContact OG-N 2.92Å; S803-C809 WeakPolarHBondContact CB-O 3.45Å; S803-D810 PolarHBondContact N-OD1 3.21Å
804	D	93.6	Very high	93	Very high	4 Å²	4	37 Å²	37	2%	0.021	19%	0.188	C	C	.	.	S	Bend	trans	-81.7	-3.9	170.5	88.3	-27.3	0	0	0	112.9	I373 K750 G753 Y772	I373-D804 CarbonylContact C-O 3.59Å; I373-D804 HydrophobicContact CB-CB 4.47Å; I373-D804 HydrophobicContact CG2-CB 4.17Å; I373-D804 WeakPolarHBondContact CG2-O 3.4Å; K750-D804 VanDerWaalsContact CE-OD2 3.23Å; K750-D804 WeakPolarHBondContact CE-OD2 3.25Å; K750-D804 IonicContact NZ-OD1 3.78Å; K750-D804 PolarHBondContact NZ-OD1 3.26Å; K750-D804 IonicContact NZ-OD2 3.01Å; K750-D804 PolarHBondContact NZ-OD2 2.92Å; G753-D804 WeakPolarHBondContact CA-OD1 3.4Å; G753-D804 PolarHBondContact N-OD1 3.04Å; G753-D804 VanDerWaalsContact N-OD1 3.08Å; G753-D804 PolarHBondContact O-N 3.19Å; G753-D804 VanDerWaalsContact O-N 3.12Å; Y772-D804 HydrophobicContact CE2-CB 4.31Å; Y772-D804 PolarHBondContact OH-OD2 3.47Å
805	S	93.9	Very high	93	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-124.6	-25.3	-161.8	-73.9	0	0	0	0	115	Q378 V741 K750 S803	Q378-S805 PolarHBondContact NE2-O 3.45Å; V741-S805 WeakPolarHBondContact CG2-OG 3.34Å; K750-S805 PolarHBondContact NZ-OG 3.34Å; S803-S805 PolarHBondContact O-N 2.89Å; S803-S805 PolarHBondContact OG-N 3.3Å
806	Y	94.6	Very high	93	Very high	6 Å²	6	35.9 Å²	35.9	2%	0.024	18%	0.176	C	C	.	.			trans	-132.7	134.9	-178.3	-63	-74.4	0	0	0	112	Q389 M444 P445 V741 H742 E752 S803	Q389-Y806 VanDerWaalsContact OE1-CA 3.29Å; M444-Y806 HydrophobicContact CE-CD1 3.86Å; M444-Y806 HydrophobicContact CE-CE1 3.83Å; M444-Y806 HydrophobicContact CG-CD1 4.33Å; M444-Y806 HydrophobicContact CG-CE1 3.79Å; P445-Y806 HydrophobicContact CG-CD2 3.96Å; P445-Y806 HydrophobicContact CG-CE2 3.92Å; V741-Y806 HydrophobicContact CG1-CE1 3.93Å; V741-Y806 HydrophobicContact CG1-CE2 4.3Å; V741-Y806 HydrophobicContact CG2-CE2 4.4Å; H742-Y806 PolarHBondContact N-OH 2.9Å; E752-Y806 HydrophobicContact CG-CE2 3.96Å; E752-Y806 WeakPolarHBondContact OE1-CE2 3.41Å; S803-Y806 PolarHBondContact OG-N 2.92Å
807	M	92.3	Very high	92.8	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.039	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	147.9	167.6	-53.9	-68.8	-77	0	0	109.5	H371 P374 M375 Q378 L380 P386 Q389 C809	H371-M807 WeakPolarHBondContact NE2-CE 3.4Å; P374-M807 HydrophobicContact CB-SD 3.93Å; P374-M807 HydrophobicContact CG-SD 4.16Å; M375-M807 HydrophobicContact CB-SD 4.41Å; M375-M807 HydrophobicContact CG-CE 3.63Å; M375-M807 HydrophobicContact CG-SD 3.79Å; Q378-M807 HydrophobicContact CB-CG 4.32Å; Q378-M807 HydrophobicContact CG-CG 4.37Å; L380-M807 HydrophobicContact CD1-CG 4.08Å; P386-M807 HydrophobicContact CB-CB 4.39Å; Q389-M807 HydrophobicContact CG-CB 4.49Å; Q389-M807 PolarHBondContact NE2-O 2.96Å; M807-C809 PolarHBondContact O-N 2.93Å
808	D	86.4	Confident	92.6	Very high	56 Å²	56	35.8 Å²	35.8	30%	0.299	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	2.7	-173.6	91.1	23.9	0	0	0	117.6	P386 S410 V411 D810	P386-D808 HydrophobicContact CB-CB 3.72Å; P386-D808 WeakPolarHBondContact CB-OD2 3.42Å; P386-D808 HydrophobicContact CG-CB 3.72Å; S410-D808 WeakPolarHBondContact CA-OD2 3.39Å; S410-D808 WeakPolarHBondContact CB-OD2 3.45Å; V411-D808 PolarHBondContact N-OD2 3.21Å; D808-D810 PolarHBondContact O-N 3.37Å
809	C	89.6	Confident	92.5	Very high	6 Å²	6	35 Å²	35	4%	0.041	17%	0.174	C	C	.	.			trans	-99.1	40.2	-177.9	-146	0	0	0	0	113.5	W754 S803 M807 F811	W754-C809 WeakPolarHBondContact CZ3-O 3.5Å; S803-C809 WeakPolarHBondContact CB-O 3.45Å; M807-C809 PolarHBondContact O-N 2.93Å; C809-F811 WeakPolarHBondContact O-CE2 3.28Å
810	D	91.1	Very high	92.1	Very high	52 Å²	52	41.3 Å²	41.3	28%	0.278	20%	0.198	S	C	.	.			trans	-102.5	141	174.9	-65.7	-30.8	0	0	0	110.6	R802 S803 D808	R802-D810 WeakPolarHBondContact CA-OD1 3.43Å; R802-D810 VanDerWaalsContact CB-OD1 3.25Å; R802-D810 WeakPolarHBondContact CB-OD1 3.38Å; R802-D810 HydrophobicContact CG-CB 4.49Å; R802-D810 IonicContact CZ-OD2 3.36Å; R802-D810 VanDerWaalsContact CZ-OD2 3.29Å; R802-D810 IonicContact NE-OD1 3.46Å; R802-D810 IonicContact NE-OD2 3.25Å; R802-D810 PolarHBondContact NE-OD2 3.14Å; R802-D810 VanDerWaalsContact NE-OD2 3.08Å; R802-D810 IonicContact NH2-OD2 2.69Å; R802-D810 PolarHBondContact NH2-OD2 3.26Å; S803-D810 PolarHBondContact N-OD1 3.21Å; D808-D810 PolarHBondContact O-N 3.37Å
811	F	91.6	Very high	91.8	Very high	24 Å²	24	45.7 Å²	45.7	11%	0.105	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.5	-177.3	-56.9	-109.4	0	0	0	109.1	L447 W754 V801 C809	L447-F811 HydrophobicContact CB-CD1 4.24Å; L447-F811 HydrophobicContact CB-CD2 4.39Å; L447-F811 HydrophobicContact CB-CE1 3.75Å; L447-F811 HydrophobicContact CB-CE2 3.95Å; L447-F811 HydrophobicContact CB-CZ 3.6Å; L447-F811 HydrophobicContact CD1-CD2 4.19Å; L447-F811 HydrophobicContact CD1-CE2 4Å; L447-F811 HydrophobicContact CD1-CZ 4.48Å; L447-F811 HydrophobicContact CG-CD2 4.47Å; L447-F811 HydrophobicContact CG-CE2 3.87Å; L447-F811 HydrophobicContact CG-CZ 3.9Å; L447-F811 VanDerWaalsContact O-CE1 3.28Å; L447-F811 WeakPolarHBondContact O-CE1 3.37Å; W754-F811 HydrophobicContact CH2-CE2 4.32Å; W754-F811 HydrophobicContact CZ3-CD2 4.38Å; W754-F811 AromaticContact CZ3-CE2 3.99Å; W754-F811 HydrophobicContact CZ3-CE2 3.99Å; V801-F811 HydrophobicContact CB-CB 4.32Å; V801-F811 PolarHBondContact N-O 2.97Å; V801-F811 PolarHBondContact O-N 3.48Å; C809-F811 WeakPolarHBondContact O-CE2 3.28Å
812	T	92.2	Very high	91.2	Very high	90 Å²	90	47.2 Å²	47.2	55%	0.552	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	125	-179.9	55.7	0	0	0	0	110.5	V798 L799	V798-T812 HydrophobicContact CG1-CG2 4.23Å; L799-T812 CarbonylContact O-C 3.54Å; L799-T812 VanDerWaalsContact O-CA 3.3Å; L799-T812 WeakPolarHBondContact O-CA 3.46Å
813	E	92.6	Very high	90.6	Very high	92 Å²	92	47.1 Å²	47.1	43%	0.43	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	147.8	175.3	-84.2	-62	165.9	0	0	112.2	L449 Y451 V798 L799	L449-E813 HydrophobicContact CD2-CB 3.94Å; L449-E813 HydrophobicContact CD2-CG 3.7Å; L449-E813 HydrophobicContact CG-CG 4.15Å; Y451-E813 HydrophobicContact CE1-CB 4.39Å; V798-E813 WeakPolarHBondContact CA-O 3.48Å; L799-E813 PolarHBondContact N-O 2.71Å; L799-E813 PolarHBondContact O-N 2.92Å
814	C	93.8	Very high	89.8	Confident	60 Å²	60	54.7 Å²	54.7	41%	0.405	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	106.5	-178.5	-76.1	0	0	0	0	110.5	Y451 L796	Y451-C814 PolarHBondContact OH-O 3.36Å; L796-C814 HydrophobicContact CD1-CB 3.96Å
815	I	91.6	Very high	89.2	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.6	172	-57.2	-161.4	0	0	0	109.1	Y451 C453 V473 L758 L796 Y797 L799 F817	Y451-I815 HydrophobicContact CD1-CD1 4.46Å; Y451-I815 HydrophobicContact CD1-CG1 4.28Å; Y451-I815 HydrophobicContact CD2-CD1 3.84Å; Y451-I815 HydrophobicContact CD2-CG1 4.05Å; Y451-I815 HydrophobicContact CE1-CG1 4.06Å; Y451-I815 HydrophobicContact CE2-CB 4.25Å; Y451-I815 HydrophobicContact CE2-CD1 4.12Å; Y451-I815 HydrophobicContact CE2-CG1 3.83Å; Y451-I815 HydrophobicContact CE2-CG2 4.01Å; Y451-I815 HydrophobicContact CG-CD1 4.05Å; Y451-I815 HydrophobicContact CG-CG1 4.28Å; C453-I815 VanDerWaalsContact SG-CG2 3.53Å; V473-I815 HydrophobicContact CG1-CD1 3.44Å; V473-I815 VanDerWaalsContact CG1-CD1 3.44Å; V473-I815 HydrophobicContact CG2-CD1 4.36Å; L758-I815 HydrophobicContact CD2-CD1 3.69Å; L758-I815 HydrophobicContact CD2-CG1 4.47Å; L796-I815 WeakPolarHBondContact CA-O 3.01Å; Y797-I815 PolarHBondContact N-O 2.89Å; Y797-I815 PolarHBondContact O-N 2.78Å; L799-I815 HydrophobicContact CB-CD1 3.98Å; L799-I815 HydrophobicContact CB-CG1 4.04Å; L799-I815 HydrophobicContact CD2-CD1 4.26Å; I815-F817 HydrophobicContact CG2-CD1 4.36Å
816	R	90.6	Very high	88.5	Confident	200 Å²	200	62.6 Å²	62.6	76%	0.755	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.1	174.6	-65.2	-178.1	-175.4	-156.8	1.6	109	L796	L796-R816 HydrophobicContact CD1-CG 3.67Å
817	F	88.7	Confident	87.8	Confident	13 Å²	13	63.6 Å²	63.6	6%	0.057	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	159.7	174.2	66.5	-78.7	0	0	0	109.9	I465 F786 P789 Y795 Y797 I815 V819	I465-F817 HydrophobicContact CD1-CB 3.89Å; I465-F817 HydrophobicContact CD1-CD2 3.97Å; I465-F817 HydrophobicContact CD1-CG 4.3Å; I465-F817 HydrophobicContact CG2-CD2 4.42Å; F786-F817 HydrophobicContact CE2-CE1 4.35Å; F786-F817 HydrophobicContact CE2-CE2 4.06Å; F786-F817 AromaticContact CE2-CZ 3.68Å; F786-F817 HydrophobicContact CE2-CZ 3.68Å; F786-F817 HydrophobicContact CZ-CD1 4.49Å; F786-F817 AromaticContact CZ-CE1 3.9Å; F786-F817 HydrophobicContact CZ-CE1 3.9Å; F786-F817 HydrophobicContact CZ-CE2 4.03Å; F786-F817 AromaticContact CZ-CZ 3.64Å; F786-F817 HydrophobicContact CZ-CZ 3.64Å; P789-F817 HydrophobicContact CG-CE2 4.43Å; P789-F817 HydrophobicContact CG-CZ 4.27Å; Y795-F817 HydrophobicContact CD2-CE2 4.29Å; Y795-F817 HydrophobicContact CG-CE2 4.28Å; Y795-F817 HydrophobicContact CG-CZ 4.05Å; Y795-F817 PolarHBondContact N-O 2.79Å; Y795-F817 PolarHBondContact O-N 2.97Å; Y797-F817 HydrophobicContact CD1-CE1 4.45Å; Y797-F817 AromaticContact CD2-CE1 3.57Å; Y797-F817 HydrophobicContact CD2-CE1 3.57Å; Y797-F817 AromaticContact CD2-CZ 3.94Å; Y797-F817 HydrophobicContact CD2-CZ 3.94Å; Y797-F817 AromaticContact CE2-CE1 3.75Å; Y797-F817 HydrophobicContact CE2-CE1 3.75Å; Y797-F817 AromaticContact CE2-CZ 3.6Å; Y797-F817 HydrophobicContact CE2-CZ 3.6Å; Y797-F817 AromaticContact CG-CE1 3.96Å; Y797-F817 HydrophobicContact CG-CE1 3.96Å; Y797-F817 AromaticContact CZ-CZ 3.98Å; I815-F817 HydrophobicContact CG2-CD1 4.36Å; F817-V819 HydrophobicContact CD2-CG2 4.22Å; F817-V819 HydrophobicContact CE2-CG2 3.9Å
818	T	90.8	Very high	87.2	Confident	70 Å²	70	69 Å²	69	43%	0.429	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	114.2	179.7	-56.2	0	0	0	0	108.3	G793 Q794 R820	G793-T818 CarbonylContact O-C 3.54Å; G793-T818 WeakPolarHBondContact O-CA 3.49Å; Q794-T818 HydrophobicContact CG-CG2 4.22Å; T818-R820 PolarHBondContact O-N 3.48Å
819	V	91.4	Very high	86.9	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.012	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	112.3	167	-178.1	0	0	0	0	106.4	I465 P467 A788 P792 G793 Y795 F817	I465-V819 HydrophobicContact CG2-CG2 4.12Å; I465-V819 CarbonylContact O-C 3.6Å; I465-V819 WeakPolarHBondContact O-CA 3.31Å; P467-V819 HydrophobicContact CB-CG1 4.44Å; P467-V819 HydrophobicContact CG-CG1 3.96Å; A788-V819 HydrophobicContact CB-CG2 4.4Å; P792-V819 CarbonylContact C-O 3.59Å; P792-V819 WeakPolarHBondContact CA-O 3.44Å; G793-V819 PolarHBondContact N-O 3.18Å; G793-V819 PolarHBondContact O-N 3.5Å; Y795-V819 HydrophobicContact CD2-CB 4.39Å; Y795-V819 HydrophobicContact CD2-CG2 3.74Å; Y795-V819 HydrophobicContact CE2-CB 4.16Å; Y795-V819 HydrophobicContact CE2-CG2 3.78Å; F817-V819 HydrophobicContact CD2-CG2 4.22Å; F817-V819 HydrophobicContact CE2-CG2 3.9Å
820	R	89.2	Confident	86.4	Confident	133 Å²	133	71.2 Å²	71.2	50%	0.502	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-79.6	150.9	173.9	-63.5	-173.5	-173.1	160.6	3.5	109.3	S464 I465 P467 T818	S464-R820 VanDerWaalsContact CB-NH1 3.32Å; I465-R820 PolarHBondContact O-N 2.88Å; P467-R820 WeakPolarHBondContact CD-O 3.5Å; T818-R820 PolarHBondContact O-N 3.48Å
821	P	88	Confident	85.9	Confident	92 Å²	92	72.4 Å²	72.4	60%	0.597	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-61.3	147.2	165.4	29	-34.6	0	0	0	109.6	P792	P792-P821 HydrophobicContact CB-CB 4.28Å; P792-P821 HydrophobicContact CG-CB 4.07Å
822	L	83.5	Confident	85.4	Confident	33 Å²	33	77.7 Å²	77.7	17%	0.173	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-61.6	131.3	178.4	-156.1	73.4	0	0	0	109.5	W466 I826 V827 L830	W466-L822 HydrophobicContact CB-CD1 3.77Å; W466-L822 HydrophobicContact CD2-CD1 3.65Å; W466-L822 HydrophobicContact CE3-CD1 3.54Å; W466-L822 HydrophobicContact CG-CD1 3.76Å; W466-L822 HydrophobicContact CZ3-CD1 4.46Å; L822-I826 HydrophobicContact CD1-CG2 4.37Å; L822-I826 HydrophobicContact CD2-CB 4.12Å; L822-I826 HydrophobicContact CD2-CG2 3.77Å; L822-I826 HydrophobicContact CG-CB 4.06Å; L822-I826 HydrophobicContact CG-CG2 4.05Å; L822-V827 HydrophobicContact CB-CG2 3.96Å; L822-V827 HydrophobicContact CD2-CG2 4Å; L822-V827 HydrophobicContact CG-CG2 4.31Å; L822-L830 HydrophobicContact CD2-CD1 3.61Å
823	P	82.2	Confident	84.7	Confident	43 Å²	43	78.3 Å²	78.3	28%	0.279	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-57.7	141.6	178.8	-25.9	34.4	0	0	0	112.2	W466 R825 I826 V827	W466-P823 HydrophobicContact CZ2-CG 4.41Å; P823-R825 VanDerWaalsContact C-N 3.25Å; P823-R825 HydrophobicContact CB-CG 4.16Å; P823-R825 PolarHBondContact O-N 2.59Å; P823-R825 VanDerWaalsContact O-N 3.16Å; P823-I826 HydrophobicContact CB-CG1 4.34Å; P823-I826 HydrophobicContact CG-CD1 4.25Å; P823-I826 PolarHBondContact O-N 2.93Å; P823-V827 PolarHBondContact O-N 3.07Å; P823-V827 VanDerWaalsContact O-N 3.16Å
824	E	79.4	Confident	83.9	Confident	162 Å²	162	76.9 Å²	76.9	76%	0.757	37%	0.366	S	S	*	.	H	α-helix	trans	-53.1	-41.8	-175.6	-65.8	178.2	142.8	0	0	112.2	I826 V827 E828	E824-I826 PolarHBondContact O-N 3.45Å; E824-V827 PolarHBondContact O-N 3.42Å; E824-E828 WeakPolarHBondContact O-CG 3.43Å; E824-E828 PolarHBondContact O-N 2.63Å
825	R	80.1	Confident	83.2	Confident	141 Å²	141	78.8 Å²	78.8	53%	0.532	37%	0.369	S	S	.	.	H	α-helix	trans	-50.4	-32.7	173.7	78.4	-173.5	-176.8	-159.4	-2.2	114.3	D462 P823 I829	D462-R825 IonicContact OD2-NH2 3.19Å; P823-R825 VanDerWaalsContact C-N 3.25Å; P823-R825 HydrophobicContact CB-CG 4.16Å; P823-R825 PolarHBondContact O-N 2.59Å; P823-R825 VanDerWaalsContact O-N 3.16Å; R825-I829 VanDerWaalsContact O-CD1 3.3Å; R825-I829 WeakPolarHBondContact O-CD1 3.43Å; R825-I829 VanDerWaalsContact O-CG1 3.28Å; R825-I829 WeakPolarHBondContact O-CG1 3.18Å; R825-I829 PolarHBondContact O-N 3.13Å
826	I	78.4	Confident	82.4	Confident	29 Å²	29	81.4 Å²	81.4	15%	0.149	39%	0.391	C	S	.	.	H	α-helix	trans	-88.9	-41.2	-178.4	-51.9	-172.6	0	0	0	108.9	W466 L822 P823 E824 E828 I829 L830	W466-I826 HydrophobicContact CE3-CD1 4.22Å; W466-I826 HydrophobicContact CH2-CD1 3.34Å; W466-I826 HydrophobicContact CZ2-CD1 3.9Å; W466-I826 HydrophobicContact CZ3-CD1 3.5Å; L822-I826 HydrophobicContact CD1-CG2 4.37Å; L822-I826 HydrophobicContact CD2-CB 4.12Å; L822-I826 HydrophobicContact CD2-CG2 3.77Å; L822-I826 HydrophobicContact CG-CB 4.06Å; L822-I826 HydrophobicContact CG-CG2 4.05Å; P823-I826 HydrophobicContact CB-CG1 4.34Å; P823-I826 HydrophobicContact CG-CD1 4.25Å; P823-I826 PolarHBondContact O-N 2.93Å; E824-I826 PolarHBondContact O-N 3.45Å; I826-E828 PolarHBondContact O-N 3.18Å; I826-I829 PolarHBondContact O-N 3.36Å; I826-I829 VanDerWaalsContact O-N 3.12Å; I826-L830 HydrophobicContact CG2-CD1 4.31Å; I826-L830 HydrophobicContact CG2-CG 4.17Å; I826-L830 VanDerWaalsContact O-CG 3.32Å; I826-L830 WeakPolarHBondContact O-CG 3.14Å; I826-L830 PolarHBondContact O-N 3.19Å
827	V	79.7	Confident	81.5	Confident	27 Å²	27	75.1 Å²	75.1	16%	0.164	38%	0.382	C	S	.	.	H	α-helix	trans	-56.8	-36.5	172.5	-177.6	0	0	0	0	111.1	L822 P823 E824 K831	L822-V827 HydrophobicContact CB-CG2 3.96Å; L822-V827 HydrophobicContact CD2-CG2 4Å; L822-V827 HydrophobicContact CG-CG2 4.31Å; P823-V827 PolarHBondContact O-N 3.07Å; P823-V827 VanDerWaalsContact O-N 3.16Å; E824-V827 PolarHBondContact O-N 3.42Å; V827-K831 HydrophobicContact CG1-CD 4.45Å; V827-K831 WeakPolarHBondContact O-CB 3.42Å; V827-K831 WeakPolarHBondContact O-CG 3.27Å; V827-K831 PolarHBondContact O-N 2.58Å
828	E	80.6	Confident	80.4	Confident	121 Å²	121	78 Å²	78	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-63.6	-52.4	172.4	-70.6	167.3	158.4	0	0	111.6	E824 I826 L830 K831 E832	E824-E828 WeakPolarHBondContact O-CG 3.43Å; E824-E828 PolarHBondContact O-N 2.63Å; I826-E828 PolarHBondContact O-N 3.18Å; E828-L830 PolarHBondContact O-N 3.48Å; E828-K831 WeakPolarHBondContact O-CB 3.48Å; E828-K831 PolarHBondContact O-N 3.42Å; E828-K831 VanDerWaalsContact O-N 3.12Å; E828-E832 WeakPolarHBondContact O-CG 3.47Å; E828-E832 PolarHBondContact O-N 3.48Å
829	I	80.4	Confident	78.9	Confident	84 Å²	84	81.1 Å²	81.1	43%	0.431	42%	0.418	S	S	.	.	H	α-helix	trans	-58	-43.7	177.7	-68.6	163.8	0	0	0	112.5	R825 I826 K831 E832 Q833	R825-I829 VanDerWaalsContact O-CD1 3.3Å; R825-I829 WeakPolarHBondContact O-CD1 3.43Å; R825-I829 VanDerWaalsContact O-CG1 3.28Å; R825-I829 WeakPolarHBondContact O-CG1 3.18Å; R825-I829 PolarHBondContact O-N 3.13Å; I826-I829 PolarHBondContact O-N 3.36Å; I826-I829 VanDerWaalsContact O-N 3.12Å; I829-K831 VanDerWaalsContact C-N 3.26Å; I829-K831 PolarHBondContact O-N 2.74Å; I829-E832 PolarHBondContact O-N 3.36Å; I829-Q833 WeakPolarHBondContact O-CG 3.46Å; I829-Q833 PolarHBondContact O-N 3.33Å
830	L	78.2	Confident	77.4	Confident	25 Å²	25	88.2 Å²	88.2	13%	0.131	46%	0.455	C	S	.	.	H	α-helix	trans	-67.5	-29.4	-179.9	-60.5	-175.4	0	0	0	112	L822 I826 E828 E834 T886 I890	L822-L830 HydrophobicContact CD2-CD1 3.61Å; I826-L830 HydrophobicContact CG2-CD1 4.31Å; I826-L830 HydrophobicContact CG2-CG 4.17Å; I826-L830 VanDerWaalsContact O-CG 3.32Å; I826-L830 WeakPolarHBondContact O-CG 3.14Å; I826-L830 PolarHBondContact O-N 3.19Å; E828-L830 PolarHBondContact O-N 3.48Å; L830-E834 WeakPolarHBondContact O-CB 3.34Å; L830-E834 PolarHBondContact O-N 3.25Å; L830-T886 HydrophobicContact CB-CG2 4.08Å; L830-T886 HydrophobicContact CD1-CG2 3.93Å; L830-T886 HydrophobicContact CD2-CG2 3.62Å; L830-T886 HydrophobicContact CG-CG2 4.03Å; L830-I890 HydrophobicContact CB-CD1 4.39Å
831	K	80.8	Confident	75.8	Confident	77 Å²	77	89.1 Å²	89.1	34%	0.335	47%	0.47	S	S	.	.	H	α-helix	trans	-75.1	-40.9	172.5	-72.8	-176.3	103.7	-48.5	0	112.3	V827 E828 I829 Q833 E834 E835 I890	V827-K831 HydrophobicContact CG1-CD 4.45Å; V827-K831 WeakPolarHBondContact O-CB 3.42Å; V827-K831 WeakPolarHBondContact O-CG 3.27Å; V827-K831 PolarHBondContact O-N 2.58Å; E828-K831 WeakPolarHBondContact O-CB 3.48Å; E828-K831 PolarHBondContact O-N 3.42Å; E828-K831 VanDerWaalsContact O-N 3.12Å; I829-K831 VanDerWaalsContact C-N 3.26Å; I829-K831 PolarHBondContact O-N 2.74Å; K831-Q833 PolarHBondContact O-N 3.43Å; K831-E834 PolarHBondContact O-N 3.22Å; K831-E835 IonicContact NZ-OE1 3.35Å; K831-E835 PolarHBondContact NZ-OE1 3.44Å; K831-E835 VanDerWaalsContact O-CB 3.25Å; K831-E835 WeakPolarHBondContact O-CB 3.44Å; K831-E835 VanDerWaalsContact O-CG 3.25Å; K831-E835 WeakPolarHBondContact O-CG 3.3Å; K831-E835 PolarHBondContact O-N 3.17Å; K831-I890 HydrophobicContact CG-CD1 4.18Å
832	E	80.5	Confident	74.1	Confident	135 Å²	135	92.2 Å²	92.2	63%	0.631	48%	0.482	S	S	*	.	H	α-helix	trans	-59.2	-33.3	172.1	-70.6	178.1	170.7	0	0	111.3	E828 I829 A836	E828-E832 WeakPolarHBondContact O-CG 3.47Å; E828-E832 PolarHBondContact O-N 3.48Å; I829-E832 PolarHBondContact O-N 3.36Å; E832-A836 WeakPolarHBondContact O-CB 3.3Å; E832-A836 PolarHBondContact O-N 2.95Å
833	Q	78.6	Confident	72.4	Confident	103 Å²	103	98.1 Å²	98.1	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-73.8	-42.5	173.8	-72.4	175.6	-29.6	0	0	113.4	I829 K831 A837	I829-Q833 WeakPolarHBondContact O-CG 3.46Å; I829-Q833 PolarHBondContact O-N 3.33Å; K831-Q833 PolarHBondContact O-N 3.43Å; Q833-A837 WeakPolarHBondContact O-CB 3.36Å; Q833-A837 PolarHBondContact O-N 3Å
834	E	76.4	Confident	70.7	Confident	63 Å²	63	101.9 Å²	101.9	29%	0.294	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-43.7	176.1	-174.8	177.5	-124.7	0	0	111.6	L830 K831 A837 S838 I890	L830-E834 WeakPolarHBondContact O-CB 3.34Å; L830-E834 PolarHBondContact O-N 3.25Å; K831-E834 PolarHBondContact O-N 3.22Å; E834-A837 PolarHBondContact O-N 2.81Å; E834-S838 PolarHBondContact O-N 3.26Å; E834-S838 PolarHBondContact O-OG 2.94Å; E834-I890 HydrophobicContact CB-CD1 4.43Å; E834-I890 VanDerWaalsContact OE2-CD1 3.32Å; E834-I890 WeakPolarHBondContact OE2-CD1 3.43Å
835	E	77.4	Confident	68.9	Low	99 Å²	99	99.1 Å²	99.1	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-64.3	-46.2	177	-70	166.6	-155.8	0	0	110.3	K831 A837 S838 D839	K831-E835 IonicContact NZ-OE1 3.35Å; K831-E835 PolarHBondContact NZ-OE1 3.44Å; K831-E835 VanDerWaalsContact O-CB 3.25Å; K831-E835 WeakPolarHBondContact O-CB 3.44Å; K831-E835 VanDerWaalsContact O-CG 3.25Å; K831-E835 WeakPolarHBondContact O-CG 3.3Å; K831-E835 PolarHBondContact O-N 3.17Å; E835-A837 PolarHBondContact O-N 3.19Å; E835-S838 PolarHBondContact O-N 3.47Å; E835-S838 VanDerWaalsContact O-N 3.13Å; E835-S838 PolarHBondContact O-OG 3.13Å; E835-D839 PolarHBondContact O-N 3.21Å; E835-D839 VanDerWaalsContact O-N 3.14Å
836	A	75.5	Confident	67	Low	58 Å²	58	99.7 Å²	99.7	48%	0.479	55%	0.553	S	S	.	*	H	α-helix	trans	-65.5	-31.6	175.9	0	0	0	0	0	114.2	E832 S838	E832-A836 WeakPolarHBondContact O-CB 3.3Å; E832-A836 PolarHBondContact O-N 2.95Å; A836-S838 VanDerWaalsContact C-N 3.34Å
837	A	72.1	Confident	65.3	Low	67 Å²	67	105 Å²	105	55%	0.554	59%	0.587	S	S	*	*	H	α-helix	trans	-72.3	-28.8	173.3	0	0	0	0	0	112.3	Q833 E834 E835	Q833-A837 WeakPolarHBondContact O-CB 3.36Å; Q833-A837 PolarHBondContact O-N 3Å; E834-A837 PolarHBondContact O-N 2.81Å; E835-A837 PolarHBondContact O-N 3.19Å
838	S	65.2	Low	63.4	Low	74 Å²	74	108.5 Å²	108.5	52%	0.517	61%	0.613	S	S	.	*	H	α-helix	trans	-80.8	-24.9	178.9	67.8	0	0	0	0	114.8	E834 E835 A836	E834-S838 PolarHBondContact O-N 3.26Å; E834-S838 PolarHBondContact O-OG 2.94Å; E835-S838 PolarHBondContact O-N 3.47Å; E835-S838 VanDerWaalsContact O-N 3.13Å; E835-S838 PolarHBondContact O-OG 3.13Å; A836-S838 VanDerWaalsContact C-N 3.34Å
839	D	60.5	Low	61.6	Low	135 Å²	135	107.6 Å²	107.6	72%	0.722	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-18.8	-178.5	-86.8	-9	0	0	0	113.7	E835	E835-D839 PolarHBondContact O-N 3.21Å; E835-D839 VanDerWaalsContact O-N 3.14Å
840	D	58.5	Low	59.5	Low	151 Å²	151	109.3 Å²	109.3	81%	0.807	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-12.8	-176.4	-94	-19.6	0	0	0	114.2
841	D	56.2	Low	57.7	Low	153 Å²	153	114.3 Å²	114.3	82%	0.818	66%	0.662	S	S	*	*	S	Bend	trans	-96.3	-12.2	-170	-103.7	-17.4	0	0	0	115.5
842	D	51.4	Low	55.8	Low	156 Å²	156	115.7 Å²	115.7	83%	0.834	68%	0.677	S	S	*	*	S	Bend	trans	-109.6	3.4	-160.1	-141.3	15.4	0	0	0	115.9
843	D	48.7	Very low	54.1	Low	157 Å²	157	117.5 Å²	117.5	84%	0.84	69%	0.685	S	S	*	*			trans	-124.8	61.1	-172.1	-156.1	11.2	0	0	0	115.8
844	S	46	Very low	52.3	Low	122 Å²	122	119.6 Å²	119.6	85%	0.853	70%	0.7	S	S	*	*			trans	-145.8	114.2	148	72.2	0	0	0	0	113.7
845	S	42.2	Very low	50.7	Low	105 Å²	105	124.5 Å²	124.5	73%	0.734	73%	0.728	S	S	*	*			trans	-143.3	152.1	169.2	58.4	0	0	0	0	110.6
846	D	40.3	Very low	49.1	Very low	152 Å²	152	127 Å²	127	81%	0.813	74%	0.744	S	S	*	*			trans	57.4	117.4	-175.9	-63	-18.8	0	0	0	115.3
847	T	43.1	Very low	47.4	Very low	140 Å²	140	132.5 Å²	132.5	86%	0.859	76%	0.76	S	S	*	*				-158.4	154.8	57.3	39.3	0	0	0	0	114.3
848	S	38.2	Very low	45.9	Very low	101 Å²	101	134.6 Å²	134.6	71%	0.706	77%	0.766	S	S	*	*			trans	-63.8	152.3	-176.3	54.4	0	0	0	0	118.9
849	S	43	Very low	44.6	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	78%	0.778	S	S	*	*			trans	58.9	145.8	140.8	60.8	0	0	0	0	120.1
850	T	37.2	Very low	43.3	Very low	119 Å²	119	137.3 Å²	137.3	73%	0.73	78%	0.783	S	S	*	*			cis	-162.4	177.3	-8.6	30.5	0	0	0	0	105.9
851	D	41	Very low	42.2	Very low	131 Å²	131	138.4 Å²	138.4	70%	0.701	78%	0.784	S	S	*	*			cis	-130.8	167.2	12.8	-91.6	-74.2	0	0	0	108.9
852	T	40.4	Very low	41.2	Very low	106 Å²	106	140.7 Å²	140.7	65%	0.65	79%	0.789	S	S	*	*				75.3	140.4	56.9	-26.3	0	0	0	0	115
853	E	43.5	Very low	40.4	Very low	172 Å²	172	139 Å²	139	80%	0.804	79%	0.785	S	S	*	*			trans	74.1	105.2	-179	-58.5	173.9	-159.5	0	0	114.2
854	D	41	Very low	39.6	Very low	148 Å²	148	135.2 Å²	135.2	79%	0.791	78%	0.783	S	S	*	*				88.1	118.4	55	-69.3	-32.2	0	0	0	113
855	D	44.1	Very low	39	Very low	166 Å²	166	136.6 Å²	136.6	89%	0.888	78%	0.781	S	S	*	*			trans	-171.4	151.3	145.5	-110	-22.8	0	0	0	110.1
856	D	42.4	Very low	38.5	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	79%	0.788	S	S	*	*			trans	-96.9	168.6	-160.4	-70	-72.6	0	0	0	117.1
857	E	41.4	Very low	38.3	Very low	174 Å²	174	138.1 Å²	138.1	81%	0.813	79%	0.785	S	S	*	*				102.6	141.6	126	-121.8	-178	-153.4	0	0	123.5
858	V	39.7	Very low	37.7	Very low	112 Å²	112	137 Å²	137	68%	0.679	78%	0.777	S	S	*	*			trans	74.7	147.1	151.9	-105.6	0	0	0	0	126.3
859	E	38.1	Very low	37.5	Very low	164 Å²	164	138.2 Å²	138.2	77%	0.766	78%	0.775	S	S	*	*			trans	60.9	111.7	163.2	-57.3	-55.8	102.6	0	0	120.2
860	A	32	Very low	36.8	Very low	102 Å²	102	135.8 Å²	135.8	84%	0.843	75%	0.754	S	S	*	*			trans	-109.6	107.3	162.8	0	0	0	0	0	110.3
861	E	37.4	Very low	36.7	Very low	174 Å²	174	135.1 Å²	135.1	81%	0.813	75%	0.745	S	S	*	*			trans	-89.5	119.2	172.8	-71.4	-162	141.2	0	0	111.7	T863	E861-T863 PolarHBondContact O-N 2.83Å
862	E	33.8	Very low	36.2	Very low	201 Å²	201	135.7 Å²	135.7	94%	0.939	74%	0.744	S	S	*	*			trans	-72.8	106	171.9	-67.4	-172.3	138.4	0	0	111.2
863	T	35.5	Very low	36	Very low	121 Å²	121	137 Å²	137	74%	0.742	74%	0.743	S	S	*	*			trans	-126.7	97.2	164	48.7	0	0	0	0	111	E861	E861-T863 PolarHBondContact O-N 2.83Å
864	G	30.6	Very low	35.5	Very low	77 Å²	77	135.7 Å²	135.7	79%	0.794	74%	0.741	S	S	*	*			trans	-67.9	137.4	177.8	0	0	0	0	0	112.6
865	N	34.7	Very low	35.5	Very low	151 Å²	151	132.6 Å²	132.6	81%	0.807	73%	0.729	S	S	*	*			trans	-124.9	122.4	160	-88.8	-59.5	0	0	0	107.9	V867	N865-V867 PolarHBondContact O-N 2.95Å
866	D	32.2	Very low	35.1	Very low	165 Å²	165	130.8 Å²	130.8	88%	0.882	72%	0.72	S	S	*	*			trans	-70.3	118.5	-175.2	-56.6	-63.8	0	0	0	111.7
867	V	34.7	Very low	34.8	Very low	124 Å²	124	128.7 Å²	128.7	75%	0.752	71%	0.707	S	S	*	*			trans	-109.2	107.1	168.2	-180	0	0	0	0	108.2	N865 I869	N865-V867 PolarHBondContact O-N 2.95Å; V867-I869 HydrophobicContact CG1-CG1 4.48Å; V867-I869 PolarHBondContact O-N 3.48Å
868	V	30.1	Very low	34.5	Very low	116 Å²	116	129.2 Å²	129.2	70%	0.703	71%	0.71	S	S	*	*			trans	-72.5	121	178.8	179.9	0	0	0	0	109.5	D870	V868-D870 WeakPolarHBondContact CG1-OD1 3.43Å
869	I	35.5	Very low	34.2	Very low	127 Å²	127	129.1 Å²	129.1	65%	0.651	71%	0.709	S	S	*	*			trans	-116.4	121.9	167.7	-59.1	-178.7	0	0	0	107.9	V867	V867-I869 HydrophobicContact CG1-CG1 4.48Å; V867-I869 PolarHBondContact O-N 3.48Å
870	D	28	Very low	34.1	Very low	52 Å²	52	124.7 Å²	124.7	28%	0.278	69%	0.69	S	S	.	*			trans	-110.7	88.8	177.7	-76.3	4.6	0	0	0	108.6	S725 K726 V868	S725-D870 WeakPolarHBondContact CB-OD2 3.29Å; S725-D870 PolarHBondContact OG-OD2 3.22Å; K726-D870 VanDerWaalsContact CD-OD1 3.31Å; K726-D870 WeakPolarHBondContact CD-OD1 3.49Å; K726-D870 WeakPolarHBondContact CE-OD1 3.21Å; K726-D870 IonicContact NZ-OD1 3.15Å; K726-D870 PolarHBondContact NZ-OD1 3.05Å; V868-D870 WeakPolarHBondContact CG1-OD1 3.43Å
871	N	34.1	Very low	34.4	Very low	104 Å²	104	122 Å²	122	56%	0.556	67%	0.666	S	S	*	*			trans	-116.1	108.4	167.1	-81	15.7	0	0	0	109.5	E873	N871-E873 HydrophobicContact CB-CG 4.16Å; N871-E873 WeakPolarHBondContact CB-OE2 3.1Å; N871-E873 PolarHBondContact ND2-OE1 3.28Å; N871-E873 PolarHBondContact ND2-OE2 2.86Å
872	E	31.3	Very low	34.6	Very low	144 Å²	144	121.5 Å²	121.5	67%	0.673	66%	0.663	S	S	*	*			trans	-98.1	90.9	152.1	-73.2	175.4	145.9	0	0	105	S729	S729-E872 WeakPolarHBondContact CB-OE1 3.43Å; S729-E872 WeakPolarHBondContact CB-OE2 3.32Å; S729-E872 PolarHBondContact OG-OE1 3.38Å; S729-E872 PolarHBondContact OG-OE2 3.09Å
873	E	36.7	Very low	35.1	Very low	134 Å²	134	118.6 Å²	118.6	63%	0.626	65%	0.65	S	S	*	*			trans	-94.3	137	176.4	-78.4	161.8	147.5	0	0	109.2	N871	N871-E873 HydrophobicContact CB-CG 4.16Å; N871-E873 WeakPolarHBondContact CB-OE2 3.1Å; N871-E873 PolarHBondContact ND2-OE1 3.28Å; N871-E873 PolarHBondContact ND2-OE2 2.86Å
874	D	33.2	Very low	35.6	Very low	143 Å²	143	117.5 Å²	117.5	77%	0.765	64%	0.636	S	S	*	*			trans	-61.4	149.3	171.3	-89.3	-62.3	0	0	0	109	D876	D874-D876 PolarHBondContact O-N 3.33Å
875	P	39.4	Very low	36.2	Very low	84 Å²	84	115.4 Å²	115.4	55%	0.545	61%	0.609	S	S	.	*			trans	-64.6	104.5	177.1	26.9	-34	0	0	0	109.1	I877	P875-I877 PolarHBondContact O-N 3.35Å
876	D	35.3	Very low	36.9	Very low	127 Å²	127	109 Å²	109	68%	0.679	58%	0.576	S	S	*	*			trans	-52.3	126.5	-170.6	-76.9	-54.6	0	0	0	111.6	D874 E878	D874-D876 PolarHBondContact O-N 3.33Å; D876-E878 PolarHBondContact O-N 3.02Å
877	I	37.3	Very low	38	Very low	106 Å²	106	106.8 Å²	106.8	54%	0.544	56%	0.56	S	S	.	*			trans	-60.1	125	147.5	-64.1	170.3	0	0	0	103.9	M470 P875 V879	M470-I877 HydrophobicContact CE-CD1 4.36Å; P875-I877 PolarHBondContact O-N 3.35Å; I877-V879 VanDerWaalsContact C-N 3.29Å; I877-V879 VanDerWaalsContact O-CG2 3.28Å; I877-V879 WeakPolarHBondContact O-CG2 3.49Å; I877-V879 PolarHBondContact O-N 3.11Å
878	E	34.1	Very low	38.8	Very low	185 Å²	185	102.5 Å²	102.5	86%	0.864	54%	0.537	S	S	*	.			trans	-56.5	94.4	178.2	-167.1	166.8	-127.3	0	0	109.2	D876 L880	D876-E878 PolarHBondContact O-N 3.02Å; E878-L880 PolarHBondContact O-N 2.81Å
879	V	33.7	Very low	39.5	Very low	111 Å²	111	98 Å²	98	67%	0.673	51%	0.511	S	S	*	.			trans	-75.5	100.4	-179.5	-179	0	0	0	0	104.9	I877 S881	I877-V879 VanDerWaalsContact C-N 3.29Å; I877-V879 VanDerWaalsContact O-CG2 3.28Å; I877-V879 WeakPolarHBondContact O-CG2 3.49Å; I877-V879 PolarHBondContact O-N 3.11Å; V879-S881 PolarHBondContact O-N 3.42Å
880	L	37	Very low	40.5	Very low	70 Å²	70	93 Å²	93	37%	0.366	49%	0.485	S	S	.	.			trans	-35.8	114.3	162	-76.4	164.7	0	0	0	107.2	F468 E878 E884 C885	F468-L880 HydrophobicContact CD1-CD1 4.14Å; F468-L880 HydrophobicContact CE1-CD1 4.21Å; E878-L880 PolarHBondContact O-N 2.81Å; L880-E884 HydrophobicContact CB-CB 4.16Å; L880-E884 HydrophobicContact CD2-CB 3.83Å; L880-C885 VanDerWaalsContact CB-SG 3.52Å; L880-C885 PolarHBondContact O-SG 2.99Å
881	S	38.5	Very low	41.7	Very low	47 Å²	47	91.9 Å²	91.9	33%	0.329	49%	0.486	S	S	.	.			trans	-53	160.3	-176.3	59.4	0	0	0	0	109.9	V879 E883 E884 C885	V879-S881 PolarHBondContact O-N 3.42Å; S881-E883 PolarHBondContact O-N 3.2Å; S881-E884 VanDerWaalsContact CB-OE2 3.26Å; S881-E884 WeakPolarHBondContact CB-OE2 3.33Å; S881-E884 PolarHBondContact N-OE2 3.5Å; S881-E884 PolarHBondContact O-N 3.44Å; S881-E884 VanDerWaalsContact OG-CG 3.26Å; S881-E884 WeakPolarHBondContact OG-CG 3.38Å; S881-E884 PolarHBondContact OG-N 3.13Å; S881-E884 PolarHBondContact OG-OE2 3.44Å; S881-C885 PolarHBondContact O-N 3.02Å
882	Q	41.4	Very low	42.5	Very low	163 Å²	163	88.9 Å²	88.9	76%	0.762	47%	0.47	S	S	*	.	H	α-helix	trans	-56.2	-32.9	-176.9	-161.9	163.4	5.4	0	0	111.1	T886	Q882-T886 WeakPolarHBondContact O-CG2 3.38Å; Q882-T886 PolarHBondContact O-N 3.35Å; Q882-T886 PolarHBondContact O-OG1 3.49Å
883	E	43.3	Very low	43.3	Very low	139 Å²	139	84 Å²	84	65%	0.65	45%	0.45	S	S	*	.	H	α-helix	trans	-68.6	-44.6	171.9	-67.6	159.2	-153.3	0	0	114.1	S881 C885 T886 Q887	S881-E883 PolarHBondContact O-N 3.2Å; E883-C885 VanDerWaalsContact C-N 3.32Å; E883-C885 PolarHBondContact O-N 2.89Å; E883-T886 WeakPolarHBondContact CA-OG1 3.25Å; E883-T886 PolarHBondContact O-N 2.86Å; E883-T886 PolarHBondContact O-OG1 2.86Å; E883-Q887 WeakPolarHBondContact O-CB 3.49Å; E883-Q887 WeakPolarHBondContact O-CG 3.36Å; E883-Q887 PolarHBondContact O-N 3.27Å
884	E	47	Very low	44	Very low	98 Å²	98	84.5 Å²	84.5	46%	0.458	45%	0.452	S	S	.	.	H	α-helix	trans	-67.4	-35	175.2	-69.3	163.3	116	0	0	111.8	L880 S881 A888	L880-E884 HydrophobicContact CB-CB 4.16Å; L880-E884 HydrophobicContact CD2-CB 3.83Å; S881-E884 VanDerWaalsContact CB-OE2 3.26Å; S881-E884 WeakPolarHBondContact CB-OE2 3.33Å; S881-E884 PolarHBondContact N-OE2 3.5Å; S881-E884 PolarHBondContact O-N 3.44Å; S881-E884 VanDerWaalsContact OG-CG 3.26Å; S881-E884 WeakPolarHBondContact OG-CG 3.38Å; S881-E884 PolarHBondContact OG-N 3.13Å; S881-E884 PolarHBondContact OG-OE2 3.44Å; E884-A888 WeakPolarHBondContact O-CB 3.43Å; E884-A888 PolarHBondContact O-N 3.31Å
885	C	42.2	Very low	44.5	Very low	34 Å²	34	83.9 Å²	83.9	23%	0.23	45%	0.445	C	S	.	.	H	α-helix	trans	-64.8	-39.5	172.3	-83.8	0	0	0	0	112.4	L880 S881 E883 S889	L880-C885 VanDerWaalsContact CB-SG 3.52Å; L880-C885 PolarHBondContact O-SG 2.99Å; S881-C885 PolarHBondContact O-N 3.02Å; E883-C885 VanDerWaalsContact C-N 3.32Å; E883-C885 PolarHBondContact O-N 2.89Å; C885-S889 VanDerWaalsContact O-CB 3.27Å; C885-S889 WeakPolarHBondContact O-CB 3.38Å; C885-S889 PolarHBondContact O-N 3.4Å; C885-S889 VanDerWaalsContact O-N 3.08Å; C885-S889 PolarHBondContact O-OG 2.95Å
886	T	50	Low	44.5	Very low	17 Å²	17	82.5 Å²	82.5	10%	0.104	44%	0.437	C	S	.	.	H	α-helix	trans	-68.9	-50.4	175.2	55.1	0	0	0	0	111.1	L830 Q882 E883 A888 S889 I890	L830-T886 HydrophobicContact CB-CG2 4.08Å; L830-T886 HydrophobicContact CD1-CG2 3.93Å; L830-T886 HydrophobicContact CD2-CG2 3.62Å; L830-T886 HydrophobicContact CG-CG2 4.03Å; Q882-T886 WeakPolarHBondContact O-CG2 3.38Å; Q882-T886 PolarHBondContact O-N 3.35Å; Q882-T886 PolarHBondContact O-OG1 3.49Å; E883-T886 WeakPolarHBondContact CA-OG1 3.25Å; E883-T886 PolarHBondContact O-N 2.86Å; E883-T886 PolarHBondContact O-OG1 2.86Å; T886-A888 PolarHBondContact O-N 3.3Å; T886-S889 WeakPolarHBondContact O-CB 3.41Å; T886-S889 PolarHBondContact O-N 3.4Å; T886-S889 VanDerWaalsContact O-N 3.09Å; T886-I890 WeakPolarHBondContact O-CB 3.4Å; T886-I890 VanDerWaalsContact O-CG1 3.3Å; T886-I890 WeakPolarHBondContact O-CG1 3.38Å; T886-I890 PolarHBondContact O-N 3.44Å
887	Q	56.1	Low	45	Very low	117 Å²	117	82.8 Å²	82.8	55%	0.547	43%	0.432	S	S	.	.	H	α-helix	trans	-57.3	-45.7	178.3	-71.5	179.1	14.4	0	0	111.9	E883 S889 I890 G891	E883-Q887 WeakPolarHBondContact O-CB 3.49Å; E883-Q887 WeakPolarHBondContact O-CG 3.36Å; E883-Q887 PolarHBondContact O-N 3.27Å; Q887-S889 VanDerWaalsContact C-N 3.33Å; Q887-S889 PolarHBondContact O-N 3.46Å; Q887-I890 PolarHBondContact O-N 3.04Å; Q887-G891 PolarHBondContact O-N 2.88Å
888	A	50.5	Low	45.2	Very low	34 Å²	34	84.6 Å²	84.6	28%	0.281	44%	0.436	S	S	.	.	H	α-helix	trans	-65	-35.7	177.2	0	0	0	0	0	112.5	F468 E884 T886 I892	F468-A888 HydrophobicContact CE1-CB 4.13Å; F468-A888 HydrophobicContact CE2-CB 4.02Å; F468-A888 HydrophobicContact CZ-CB 3.54Å; E884-A888 WeakPolarHBondContact O-CB 3.43Å; E884-A888 PolarHBondContact O-N 3.31Å; T886-A888 PolarHBondContact O-N 3.3Å; A888-I892 WeakPolarHBondContact O-CD1 3.48Å; A888-I892 VanDerWaalsContact O-CG1 3.31Å; A888-I892 WeakPolarHBondContact O-CG1 3.23Å; A888-I892 PolarHBondContact O-N 3.44Å
889	S	45.1	Very low	45.4	Very low	22 Å²	22	79.1 Å²	79.1	15%	0.154	42%	0.418	C	S	.	.	H	α-helix	trans	-67.7	-44.9	174	-63.7	0	0	0	0	112.1	F468 C885 T886 Q887 I892 V893	F468-S889 WeakPolarHBondContact CD2-OG 3.3Å; C885-S889 VanDerWaalsContact O-CB 3.27Å; C885-S889 WeakPolarHBondContact O-CB 3.38Å; C885-S889 PolarHBondContact O-N 3.4Å; C885-S889 VanDerWaalsContact O-N 3.08Å; C885-S889 PolarHBondContact O-OG 2.95Å; T886-S889 WeakPolarHBondContact O-CB 3.41Å; T886-S889 PolarHBondContact O-N 3.4Å; T886-S889 VanDerWaalsContact O-N 3.09Å; Q887-S889 VanDerWaalsContact C-N 3.33Å; Q887-S889 PolarHBondContact O-N 3.46Å; S889-I892 PolarHBondContact O-N 2.99Å; S889-V893 WeakPolarHBondContact O-CG2 3.43Å; S889-V893 PolarHBondContact O-N 2.91Å
890	I	56	Low	45.7	Very low	21 Å²	21	79.2 Å²	79.2	11%	0.108	41%	0.414	C	S	.	.	H	α-helix	trans	-67.3	-45.2	-177.7	-69.8	170.2	0	0	0	110.6	L830 K831 E834 T886 Q887 I892 V893 E894	L830-I890 HydrophobicContact CB-CD1 4.39Å; K831-I890 HydrophobicContact CG-CD1 4.18Å; E834-I890 HydrophobicContact CB-CD1 4.43Å; E834-I890 VanDerWaalsContact OE2-CD1 3.32Å; E834-I890 WeakPolarHBondContact OE2-CD1 3.43Å; T886-I890 WeakPolarHBondContact O-CB 3.4Å; T886-I890 VanDerWaalsContact O-CG1 3.3Å; T886-I890 WeakPolarHBondContact O-CG1 3.38Å; T886-I890 PolarHBondContact O-N 3.44Å; Q887-I890 PolarHBondContact O-N 3.04Å; I890-I892 PolarHBondContact O-N 3.17Å; I890-V893 WeakPolarHBondContact O-CB 3.41Å; I890-V893 PolarHBondContact O-N 3.46Å; I890-E894 PolarHBondContact O-N 3.04Å
891	G	54.5	Low	46	Very low	29 Å²	29	81.2 Å²	81.2	30%	0.299	43%	0.426	S	S	.	.	H	α-helix	trans	-59.1	-30.7	174.5	0	0	0	0	0	113.8	Q887 Q895	Q887-G891 PolarHBondContact O-N 2.88Å; G891-Q895 WeakPolarHBondContact O-CG 3.37Å; G891-Q895 PolarHBondContact O-N 2.98Å
892	I	50.3	Low	46.1	Very low	41 Å²	41	83.4 Å²	83.4	21%	0.21	43%	0.433	C	S	.	.	H	α-helix	trans	-80.6	-31.1	175.3	-69.6	174.7	0	0	0	112.1	F468 P790 A888 S889 I890 E894 Q895 S896	F468-I892 HydrophobicContact CE2-CD1 4.26Å; F468-I892 HydrophobicContact CZ-CD1 4.07Å; P790-I892 HydrophobicContact CB-CD1 3.65Å; P790-I892 HydrophobicContact CG-CD1 4.34Å; A888-I892 WeakPolarHBondContact O-CD1 3.48Å; A888-I892 VanDerWaalsContact O-CG1 3.31Å; A888-I892 WeakPolarHBondContact O-CG1 3.23Å; A888-I892 PolarHBondContact O-N 3.44Å; S889-I892 PolarHBondContact O-N 2.99Å; I890-I892 PolarHBondContact O-N 3.17Å; I892-E894 VanDerWaalsContact C-N 3.31Å; I892-Q895 PolarHBondContact O-N 3.3Å; I892-S896 WeakPolarHBondContact O-CB 3.17Å; I892-S896 PolarHBondContact O-N 3.32Å; I892-S896 PolarHBondContact O-OG 3.22Å; I892-S896 VanDerWaalsContact O-OG 3.11Å
893	V	48.2	Very low	46.1	Very low	42 Å²	42	81.2 Å²	81.2	26%	0.255	43%	0.426	S	S	.	.	H	α-helix	trans	-64.6	-36.2	169.5	170.3	0	0	0	0	111	S889 I890 S896 K897	S889-V893 WeakPolarHBondContact O-CG2 3.43Å; S889-V893 PolarHBondContact O-N 2.91Å; I890-V893 WeakPolarHBondContact O-CB 3.41Å; I890-V893 PolarHBondContact O-N 3.46Å; V893-S896 PolarHBondContact O-OG 3.4Å; V893-K897 HydrophobicContact CG1-CD 4.31Å; V893-K897 VanDerWaalsContact O-CG 3.31Å; V893-K897 WeakPolarHBondContact O-CG 3.43Å; V893-K897 PolarHBondContact O-N 2.75Å
894	E	50.8	Low	46	Very low	144 Å²	144	78.7 Å²	78.7	67%	0.673	42%	0.424	S	S	*	.	H	α-helix	trans	-68.6	-45.9	171.2	-66.4	-137.7	124.7	0	0	112.8	I890 I892 S896 K897 K898	I890-E894 PolarHBondContact O-N 3.04Å; I892-E894 VanDerWaalsContact C-N 3.31Å; E894-S896 VanDerWaalsContact C-N 3.35Å; E894-S896 PolarHBondContact O-N 3.14Å; E894-K897 PolarHBondContact O-N 2.93Å; E894-K898 PolarHBondContact O-N 3.44Å
895	Q	43.3	Very low	45.7	Very low	130 Å²	130	78.3 Å²	78.3	61%	0.607	43%	0.432	S	S	*	.	H	α-helix	trans	-63.8	-37	178.9	-74.1	-179.1	34.3	0	0	112.8	G891 I892 K898 C899	G891-Q895 WeakPolarHBondContact O-CG 3.37Å; G891-Q895 PolarHBondContact O-N 2.98Å; I892-Q895 PolarHBondContact O-N 3.3Å; Q895-K898 PolarHBondContact O-N 2.86Å; Q895-C899 WeakPolarHBondContact O-CB 3.34Å; Q895-C899 PolarHBondContact O-N 3.21Å; Q895-C899 PolarHBondContact O-SG 2.91Å; Q895-C899 VanDerWaalsContact O-SG 3.34Å
896	S	40.1	Very low	45.5	Very low	56 Å²	56	82.6 Å²	82.6	39%	0.392	45%	0.453	S	S	.	.	H	α-helix	trans	-66	-46.9	175.4	60.5	0	0	0	0	111.8	I892 V893 E894 K898 C899 D900	I892-S896 WeakPolarHBondContact O-CB 3.17Å; I892-S896 PolarHBondContact O-N 3.32Å; I892-S896 PolarHBondContact O-OG 3.22Å; I892-S896 VanDerWaalsContact O-OG 3.11Å; V893-S896 PolarHBondContact O-OG 3.4Å; E894-S896 VanDerWaalsContact C-N 3.35Å; E894-S896 PolarHBondContact O-N 3.14Å; S896-K898 PolarHBondContact O-N 3.3Å; S896-C899 PolarHBondContact O-N 2.91Å; S896-C899 VanDerWaalsContact O-N 3.16Å; S896-D900 PolarHBondContact O-N 3.32Å
897	K	46	Very low	44.9	Very low	132 Å²	132	90 Å²	90	57%	0.574	48%	0.484	S	S	*	.	H	α-helix	trans	-57.2	-33.8	173.2	-73.1	171.5	-178.3	173.9	0	112.7	V893 E894 N901	V893-K897 HydrophobicContact CG1-CD 4.31Å; V893-K897 VanDerWaalsContact O-CG 3.31Å; V893-K897 WeakPolarHBondContact O-CG 3.43Å; V893-K897 PolarHBondContact O-N 2.75Å; E894-K897 PolarHBondContact O-N 2.93Å; K897-N901 PolarHBondContact O-N 2.76Å; K897-N901 PolarHBondContact O-ND2 3.48Å
898	K	41.5	Very low	43.9	Very low	145 Å²	145	91.8 Å²	91.8	63%	0.63	50%	0.497	S	S	*	.	H	α-helix	trans	-71.3	-49.8	174.5	-165.4	170.4	-174.1	171.6	0	111.8	E894 Q895 S896 D900 N901 D902	E894-K898 PolarHBondContact O-N 3.44Å; Q895-K898 PolarHBondContact O-N 2.86Å; S896-K898 PolarHBondContact O-N 3.3Å; K898-D900 VanDerWaalsContact C-N 3.35Å; K898-D900 PolarHBondContact O-N 3.04Å; K898-N901 PolarHBondContact O-N 3.08Å; K898-D902 PolarHBondContact O-N 2.89Å
899	C	37.5	Very low	43.1	Very low	70 Å²	70	96.8 Å²	96.8	47%	0.473	52%	0.519	S	S	.	.	H	α-helix	trans	-59.8	-39	177.6	-74.8	0	0	0	0	113.2	Q895 S896 D902 L903	Q895-C899 WeakPolarHBondContact O-CB 3.34Å; Q895-C899 PolarHBondContact O-N 3.21Å; Q895-C899 PolarHBondContact O-SG 2.91Å; Q895-C899 VanDerWaalsContact O-SG 3.34Å; S896-C899 PolarHBondContact O-N 2.91Å; S896-C899 VanDerWaalsContact O-N 3.16Å; C899-D902 PolarHBondContact O-N 3.24Å; C899-L903 WeakPolarHBondContact O-CB 3.4Å; C899-L903 VanDerWaalsContact O-CD1 3.31Å; C899-L903 WeakPolarHBondContact O-CD1 3.21Å; C899-L903 PolarHBondContact O-N 3.03Å
900	D	41.4	Very low	42.7	Very low	112 Å²	112	102.7 Å²	102.7	60%	0.599	55%	0.547	S	S	*	.	H	α-helix	trans	-67.1	-36.8	177.5	-81.6	-33.9	0	0	0	112.6	S896 K898 S904	S896-D900 PolarHBondContact O-N 3.32Å; K898-D900 VanDerWaalsContact C-N 3.35Å; K898-D900 PolarHBondContact O-N 3.04Å; D900-S904 PolarHBondContact O-N 3.46Å; D900-S904 VanDerWaalsContact O-N 3.08Å
901	N	42.9	Very low	41.4	Very low	113 Å²	113	109 Å²	109	60%	0.604	58%	0.581	S	S	*	*	H	α-helix	trans	-64	-45.6	171.4	-81.4	-66.7	0	0	0	111.1	K897 K898 S904	K897-N901 PolarHBondContact O-N 2.76Å; K897-N901 PolarHBondContact O-ND2 3.48Å; K898-N901 PolarHBondContact O-N 3.08Å; N901-S904 WeakPolarHBondContact O-CB 3.37Å; N901-S904 PolarHBondContact O-N 3.32Å; N901-S904 PolarHBondContact O-OG 3.4Å
902	D	41.3	Very low	40.4	Very low	92 Å²	92	114.5 Å²	114.5	49%	0.492	60%	0.604	S	S	.	*	H	α-helix	trans	-67	-40.5	179.3	-71.8	-31	0	0	0	112.2	K898 C899 S904 S905 N906	K898-D902 PolarHBondContact O-N 2.89Å; C899-D902 PolarHBondContact O-N 3.24Å; D902-S904 VanDerWaalsContact C-N 3.26Å; D902-S904 PolarHBondContact O-N 2.97Å; D902-S905 PolarHBondContact O-N 3.03Å; D902-S905 VanDerWaalsContact O-N 3.1Å; D902-S905 PolarHBondContact O-OG 3.37Å; D902-N906 PolarHBondContact O-N 3.25Å
903	L	40.6	Very low	39.6	Very low	117 Å²	117	121.8 Å²	121.8	61%	0.613	64%	0.637	S	S	*	*	H	α-helix	trans	-66.9	-22.2	174.6	-97.3	71.8	0	0	0	113.5	C899 S905	C899-L903 WeakPolarHBondContact O-CB 3.4Å; C899-L903 VanDerWaalsContact O-CD1 3.31Å; C899-L903 WeakPolarHBondContact O-CD1 3.21Å; C899-L903 PolarHBondContact O-N 3.03Å; L903-S905 VanDerWaalsContact C-N 3.29Å
904	S	41.9	Very low	38.5	Very low	86 Å²	86	123 Å²	123	60%	0.601	66%	0.658	S	S	*	*	H	α-helix	trans	-68	-31.7	171.9	84.4	0	0	0	0	112.1	D900 N901 D902	D900-S904 PolarHBondContact O-N 3.46Å; D900-S904 VanDerWaalsContact O-N 3.08Å; N901-S904 WeakPolarHBondContact O-CB 3.37Å; N901-S904 PolarHBondContact O-N 3.32Å; N901-S904 PolarHBondContact O-OG 3.4Å; D902-S904 VanDerWaalsContact C-N 3.26Å; D902-S904 PolarHBondContact O-N 2.97Å
905	S	40.2	Very low	37.6	Very low	90 Å²	90	124.5 Å²	124.5	63%	0.629	67%	0.665	S	S	*	*	H	α-helix	trans	-93.6	-29.2	-171.8	74.7	0	0	0	0	114.3	D902 L903 K907	D902-S905 PolarHBondContact O-N 3.03Å; D902-S905 VanDerWaalsContact O-N 3.1Å; D902-S905 PolarHBondContact O-OG 3.37Å; L903-S905 VanDerWaalsContact C-N 3.29Å; S905-K907 PolarHBondContact O-N 2.83Å
906	N	37.7	Very low	36.8	Very low	124 Å²	124	129.5 Å²	129.5	66%	0.663	68%	0.678	S	S	*	*			trans	-99.8	20.9	-166.4	-147.8	-1.3	0	0	0	114.7	D902 N908	D902-N906 PolarHBondContact O-N 3.25Å; N906-N908 PolarHBondContact O-N 3.12Å
907	K	37.8	Very low	36.4	Very low	174 Å²	174	134.8 Å²	134.8	76%	0.757	70%	0.702	S	S	*	*			trans	-76.6	20.2	-166	-136.4	162.8	-167.1	157.2	0	116.1	S905	S905-K907 PolarHBondContact O-N 2.83Å
908	N	34.8	Very low	35.6	Very low	154 Å²	154	132 Å²	132	82%	0.824	71%	0.71	S	S	*	*	S	Bend	trans	-137.3	39.5	-169.8	-78.7	-43	0	0	0	113.2	N906	N906-N908 PolarHBondContact O-N 3.12Å
909	N	34.3	Very low	35	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	72%	0.718	S	S	*	*			trans	-158.8	158	170.4	-122.8	-33.4	0	0	0	115.6
910	I	34.9	Very low	34.7	Very low	147 Å²	147	134.4 Å²	134.4	75%	0.754	73%	0.726	S	S	*	*			trans	69.4	81.4	166	-52.3	153.1	0	0	0	115.9
911	D	30.5	Very low	34.1	Very low	152 Å²	152	134.6 Å²	134.6	81%	0.813	73%	0.732	S	S	*	*			trans	-84.2	158.4	135.9	-92.5	-52.6	0	0	0	109.5
912	N	33.3	Very low	33.7	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	74%	0.738	S	S	*	*			trans	78.3	102.5	178.6	-47.2	-86.9	0	0	0	117.1
913	Q	32.3	Very low	33.3	Very low	194 Å²	194	137.1 Å²	137.1	91%	0.907	75%	0.745	S	S	*	*				-162.8	158.4	116.8	-107.4	166	15.4	0	0	111.1
914	G	25.5	Very low	33.2	Very low	67 Å²	67	136.7 Å²	136.7	69%	0.691	74%	0.743	S	S	*	*			trans	-162.3	109.9	-177.4	0	0	0	0	0	112.5
915	E	31.3	Very low	33	Very low	176 Å²	176	136 Å²	136	82%	0.822	73%	0.733	S	S	*	*			trans	-123.1	137.4	174.9	-63.2	178.2	114.5	0	0	107
916	R	27.7	Very low	32.8	Very low	236 Å²	236	139.4 Å²	139.4	89%	0.891	74%	0.744	S	S	*	*			cis	84.4	39.6	25.7	-143.5	-152.1	-52.1	-169.2	8.3	115.9
917	D	31.6	Very low	32.9	Very low	167 Å²	167	135.9 Å²	135.9	89%	0.893	73%	0.725	S	S	*	*			trans	-60.7	135.6	162	-72.6	-27.1	0	0	0	112.3
918	G	29.8	Very low	33.1	Very low	72 Å²	72	132.7 Å²	132.7	74%	0.742	71%	0.713	S	S	*	*			trans	-107.8	152.5	174.5	0	0	0	0	0	112.6	G920	G918-G920 PolarHBondContact O-N 3.15Å
919	Y	28.6	Very low	33.4	Very low	203 Å²	203	134.1 Å²	134.1	80%	0.796	72%	0.715	S	S	*	*			trans	-74.1	108.5	172.9	-86.8	-96.4	0	0	0	110.9
920	G	29.8	Very low	33.5	Very low	63 Å²	63	132.2 Å²	132.2	65%	0.649	71%	0.705	S	S	*	*			trans	-67.8	151.9	160.3	0	0	0	0	0	111.4	G918	G918-G920 PolarHBondContact O-N 3.15Å
921	V	30.1	Very low	33.8	Very low	117 Å²	117	128.3 Å²	128.3	71%	0.709	69%	0.687	S	S	*	*			trans	-125.9	96.6	175.8	179.2	0	0	0	0	108.2
922	D	34.2	Very low	33.9	Very low	138 Å²	138	126.1 Å²	126.1	74%	0.738	68%	0.683	S	S	*	*			trans	-88.9	118.5	178.4	-55.1	-57.5	0	0	0	110.4
923	D	32.7	Very low	33.9	Very low	120 Å²	120	121.4 Å²	121.4	64%	0.642	67%	0.668	S	S	*	*			trans	-96.3	110.4	176.3	-86.2	-45.4	0	0	0	110.2	K291	K291-D923 IonicContact NZ-OD1 3.05Å; K291-D923 PolarHBondContact NZ-OD1 2.67Å
924	D	38.8	Very low	34	Very low	107 Å²	107	117.6 Å²	117.6	57%	0.572	65%	0.65	S	S	*	*			trans	-142.5	103.5	-172.4	-143.7	25.1	0	0	0	107.9	R239	R239-D924 IonicContact CZ-OD2 2.84Å; R239-D924 IonicContact NE-OD2 3.26Å; R239-D924 PolarHBondContact NE-OD2 3.05Å; R239-D924 VanDerWaalsContact NH2-CG 3.27Å; R239-D924 IonicContact NH2-OD1 2.64Å; R239-D924 PolarHBondContact NH2-OD1 3.46Å; R239-D924 IonicContact NH2-OD2 2.84Å; R239-D924 PolarHBondContact NH2-OD2 3.03Å
925	D	37.6	Very low	34.7	Very low	73 Å²	73	118.1 Å²	118.1	39%	0.39	64%	0.636	S	S	.	*			trans	-145.1	13.8	-160.1	-129.9	-0.5	0	0	0	116.1	K250	K250-D925 IonicContact NZ-OD1 3.12Å; K250-D925 PolarHBondContact NZ-OD1 2.93Å
926	D	36.5	Very low	34.8	Very low	160 Å²	160	112.6 Å²	112.6	86%	0.856	62%	0.621	S	S	*	*			trans	-103.7	-9.5	-172.2	-94.6	-42.9	0	0	0	116.6	E928	D926-E928 PolarHBondContact O-N 3.38Å
927	D	39.2	Very low	35.2	Very low	50 Å²	50	106.7 Å²	106.7	27%	0.267	60%	0.604	S	S	.	*			trans	-92.4	16.8	-157.9	-81.3	-61.9	0	0	0	119.1	R239 Q929 N930	R239-D927 IonicContact CZ-OD2 3.09Å; R239-D927 VanDerWaalsContact NH1-CG 3.27Å; R239-D927 IonicContact NH1-OD2 2.72Å; R239-D927 PolarHBondContact NH1-OD2 3.11Å; R239-D927 IonicContact NH2-OD2 2.64Å; R239-D927 PolarHBondContact NH2-OD2 3.1Å; D927-Q929 PolarHBondContact O-N 2.83Å; D927-N930 HydrophobicContact CB-CB 4.4Å; D927-N930 PolarHBondContact O-N 3.23Å; D927-N930 VanDerWaalsContact O-N 3.11Å; D927-N930 VanDerWaalsContact OD1-CB 3.31Å; D927-N930 WeakPolarHBondContact OD1-CB 3.37Å; D927-N930 PolarHBondContact OD1-ND2 2.84Å
928	E	41.8	Very low	35.4	Very low	107 Å²	107	102.5 Å²	102.5	50%	0.5	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	0.4	177	-155.3	177.5	-157.5	0	0	113.7	G295 S296 D926	G295-E928 WeakPolarHBondContact CA-OE1 3.32Å; G295-E928 WeakPolarHBondContact CA-OE2 3.28Å; S296-E928 WeakPolarHBondContact CB-OE1 3.12Å; S296-E928 PolarHBondContact N-OE1 2.87Å; S296-E928 PolarHBondContact N-OE2 3.28Å; S296-E928 PolarHBondContact OG-OE1 2.89Å; D926-E928 PolarHBondContact O-N 3.38Å
929	Q	40.3	Very low	35.6	Very low	185 Å²	185	101.9 Å²	101.9	86%	0.864	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	-11.5	175.2	-68.8	179	7.4	0	0	114.7	D927	D927-Q929 PolarHBondContact O-N 2.83Å
930	N	37.1	Very low	35.9	Very low	98 Å²	98	95.6 Å²	95.6	52%	0.524	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92	-15.8	-177	-104.7	-21	0	0	0	114	D927 C932 G933	D927-N930 HydrophobicContact CB-CB 4.4Å; D927-N930 PolarHBondContact O-N 3.23Å; D927-N930 VanDerWaalsContact O-N 3.11Å; D927-N930 VanDerWaalsContact OD1-CB 3.31Å; D927-N930 WeakPolarHBondContact OD1-CB 3.37Å; D927-N930 PolarHBondContact OD1-ND2 2.84Å; N930-C932 PolarHBondContact O-N 2.64Å; N930-C932 VanDerWaalsContact O-N 3.13Å; N930-G933 PolarHBondContact O-N 3.38Å
931	V	40.1	Very low	36.3	Very low	64 Å²	64	98.4 Å²	98.4	39%	0.388	55%	0.549	S	S	.	.	H	α-helix	trans	-56.8	-33.4	-175.5	-175.1	0	0	0	0	112.5	G933 H934 I935	V931-G933 PolarHBondContact O-N 3.36Å; V931-H934 PolarHBondContact O-N 3.3Å; V931-I935 HydrophobicContact CG1-CD1 4.14Å; V931-I935 HydrophobicContact CG1-CG1 4.48Å; V931-I935 WeakPolarHBondContact O-CG1 3.26Å; V931-I935 PolarHBondContact O-N 2.99Å
932	C	34.2	Very low	36.7	Very low	106 Å²	106	95.3 Å²	95.3	72%	0.716	53%	0.533	S	S	*	.	H	α-helix	trans	-63.2	-23.1	175.2	-67.3	0	0	0	0	114.3	N930	N930-C932 PolarHBondContact O-N 2.64Å; N930-C932 VanDerWaalsContact O-N 3.13Å
933	G	32.6	Very low	36.6	Very low	46 Å²	46	91.1 Å²	91.1	47%	0.474	51%	0.51	S	S	.	.	H	α-helix	trans	-72.7	-48.5	175.8	0	0	0	0	0	112.3	N930 V931 I935 A936	N930-G933 PolarHBondContact O-N 3.38Å; V931-G933 PolarHBondContact O-N 3.36Å; G933-I935 VanDerWaalsContact C-N 3.33Å; G933-I935 PolarHBondContact O-N 3.18Å; G933-A936 WeakPolarHBondContact O-CB 3.32Å; G933-A936 PolarHBondContact O-N 3.03Å
934	H	34.5	Very low	36.6	Very low	114 Å²	114	92.5 Å²	92.5	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-74.8	-20.6	-179.5	-68.5	-66.6	0	0	0	113.8	V931 A936 Q937 L938	V931-H934 PolarHBondContact O-N 3.3Å; H934-A936 PolarHBondContact O-N 2.93Å; H934-Q937 PolarHBondContact CE1-OE1 3.39Å; H934-Q937 PolarHBondContact ND1-OE1 3.41Å; H934-Q937 PolarHBondContact O-N 3.42Å; H934-Q937 VanDerWaalsContact O-N 3.09Å; H934-L938 PolarHBondContact O-N 3.04Å
935	I	40.5	Very low	36.1	Very low	78 Å²	78	95.1 Å²	95.1	40%	0.4	52%	0.524	S	S	.	.	H	α-helix	trans	-56.6	-33.7	169	-75.4	169	0	0	0	111.3	V931 G933 S939	V931-I935 HydrophobicContact CG1-CD1 4.14Å; V931-I935 HydrophobicContact CG1-CG1 4.48Å; V931-I935 WeakPolarHBondContact O-CG1 3.26Å; V931-I935 PolarHBondContact O-N 2.99Å; G933-I935 VanDerWaalsContact C-N 3.33Å; G933-I935 PolarHBondContact O-N 3.18Å; I935-S939 PolarHBondContact O-N 3.28Å; I935-S939 PolarHBondContact O-OG 3.47Å
936	A	33.8	Very low	35.7	Very low	60 Å²	60	97.8 Å²	97.8	50%	0.496	55%	0.547	S	S	.	.	H	α-helix	trans	-71.2	-30.6	176.7	0	0	0	0	0	113.6	G933 H934 S939 S940	G933-A936 WeakPolarHBondContact O-CB 3.32Å; G933-A936 PolarHBondContact O-N 3.03Å; H934-A936 PolarHBondContact O-N 2.93Å; A936-S939 VanDerWaalsContact C-OG 3.29Å; A936-S939 WeakPolarHBondContact CA-OG 3.23Å; A936-S939 PolarHBondContact O-OG 3.32Å; A936-S940 PolarHBondContact O-N 2.87Å; A936-S940 PolarHBondContact O-OG 3.39Å
937	Q	35.5	Very low	35.3	Very low	113 Å²	113	97.1 Å²	97.1	53%	0.528	54%	0.543	S	S	.	.	H	α-helix	trans	-77.6	-33.6	175.4	-67.8	-175.4	-67.1	0	0	112.2	H934 S940 I941	H934-Q937 PolarHBondContact CE1-OE1 3.39Å; H934-Q937 PolarHBondContact ND1-OE1 3.41Å; H934-Q937 PolarHBondContact O-N 3.42Å; H934-Q937 VanDerWaalsContact O-N 3.09Å; Q937-S940 WeakPolarHBondContact CA-OG 3.36Å; Q937-S940 PolarHBondContact O-N 2.93Å; Q937-S940 PolarHBondContact O-OG 2.78Å; Q937-I941 WeakPolarHBondContact O-CG1 3.29Å; Q937-I941 PolarHBondContact O-N 3.08Å
938	L	36.7	Very low	34.7	Very low	79 Å²	79	103.3 Å²	103.3	41%	0.414	57%	0.568	S	S	.	*	H	α-helix	trans	-74.6	-26.4	174.7	-69.1	170.7	0	0	0	112.3	M238 H934 S942	M238-L938 HydrophobicContact CE-CD1 4.09Å; M238-L938 HydrophobicContact CE-CD2 4.32Å; H934-L938 PolarHBondContact O-N 3.04Å; L938-S942 PolarHBondContact O-N 2.94Å; L938-S942 VanDerWaalsContact O-N 3.16Å
939	S	33.9	Very low	33.9	Very low	59 Å²	59	104.7 Å²	104.7	41%	0.413	61%	0.611	S	S	.	*	H	α-helix	trans	-64.3	-46.2	166.8	42	0	0	0	0	111.7	I935 A936 I941 S942	I935-S939 PolarHBondContact O-N 3.28Å; I935-S939 PolarHBondContact O-OG 3.47Å; A936-S939 VanDerWaalsContact C-OG 3.29Å; A936-S939 WeakPolarHBondContact CA-OG 3.23Å; A936-S939 PolarHBondContact O-OG 3.32Å; S939-I941 PolarHBondContact O-N 3.04Å; S939-S942 PolarHBondContact O-N 2.88Å; S939-S942 PolarHBondContact O-OG 2.99Å
940	S	34	Very low	33.6	Very low	70 Å²	70	100.7 Å²	100.7	49%	0.49	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.5	5.6	179.5	60.5	0	0	0	0	115.4	A936 Q937 D943	A936-S940 PolarHBondContact O-N 2.87Å; A936-S940 PolarHBondContact O-OG 3.39Å; Q937-S940 WeakPolarHBondContact CA-OG 3.36Å; Q937-S940 PolarHBondContact O-N 2.93Å; Q937-S940 PolarHBondContact O-OG 2.78Å; S940-D943 WeakPolarHBondContact CA-OD2 3.39Å
941	I	38.9	Very low	33.4	Very low	122 Å²	122	100.8 Å²	100.8	63%	0.626	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	-22.3	169.3	-64.6	168.5	0	0	0	110.1	Q937 S939 D943	Q937-I941 WeakPolarHBondContact O-CG1 3.29Å; Q937-I941 PolarHBondContact O-N 3.08Å; S939-I941 PolarHBondContact O-N 3.04Å; I941-D943 PolarHBondContact O-N 3.45Å
942	S	37.7	Very low	33.1	Very low	53 Å²	53	102.9 Å²	102.9	37%	0.371	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	20.3	169.9	80	0	0	0	0	113.9	L938 S939 K945	L938-S942 PolarHBondContact O-N 2.94Å; L938-S942 VanDerWaalsContact O-N 3.16Å; S939-S942 PolarHBondContact O-N 2.88Å; S939-S942 PolarHBondContact O-OG 2.99Å; S942-K945 VanDerWaalsContact O-CE 3.23Å; S942-K945 WeakPolarHBondContact O-CE 3.44Å; S942-K945 WeakPolarHBondContact O-CG 3.16Å; S942-K945 PolarHBondContact O-NZ 2.54Å
943	D	33	Very low	33	Very low	49 Å²	49	102.7 Å²	102.7	26%	0.262	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.7	-19.8	-163.1	-95.1	4.4	0	0	0	111.8	Y563 S940 I941 K945	Y563-D943 HydrophobicContact CE2-CB 4.28Å; Y563-D943 WeakPolarHBondContact OH-CB 3.42Å; S940-D943 WeakPolarHBondContact CA-OD2 3.39Å; I941-D943 PolarHBondContact O-N 3.45Å; D943-K945 PolarHBondContact O-N 3.25Å
944	N	32.8	Very low	33	Very low	150 Å²	150	106.3 Å²	106.3	80%	0.802	62%	0.617	S	S	*	*			trans	-80	53.8	166.4	-75.9	-4.3	0	0	0	112.6	C946	N944-C946 VanDerWaalsContact C-N 3.27Å; N944-C946 PolarHBondContact O-N 3.16Å
945	K	28.3	Very low	32.9	Very low	161 Å²	161	105.7 Å²	105.7	70%	0.7	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	64.3	178.8	-79.1	179.3	-175.3	108	0	113.5	S942 D943	S942-K945 VanDerWaalsContact O-CE 3.23Å; S942-K945 WeakPolarHBondContact O-CE 3.44Å; S942-K945 WeakPolarHBondContact O-CG 3.16Å; S942-K945 PolarHBondContact O-NZ 2.54Å; D943-K945 PolarHBondContact O-N 3.25Å
946	C	28.9	Very low	32.4	Very low	130 Å²	130	107.7 Å²	107.7	88%	0.878	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.5	7.1	169.5	-82.4	0	0	0	0	114.2	N944	N944-C946 VanDerWaalsContact C-N 3.27Å; N944-C946 PolarHBondContact O-N 3.16Å
947	L	28.1	Very low	32.3	Very low	145 Å²	145	111.4 Å²	111.4	76%	0.759	65%	0.65	S	S	*	*	S	Bend	trans	-126.6	154.7	174.6	-68.2	167.1	0	0	0	109.3
948	F	27.1	Very low	32	Very low	180 Å²	180	111.3 Å²	111.3	79%	0.789	66%	0.66	S	S	*	*			trans	67.4	88.3	-165.1	-50.8	-71.3	0	0	0	114.3
949	G	25.1	Very low	31.6	Very low	137 Å²	137	114.2 Å²	114.2	100%	1.412	68%	0.682	S	S	*	*			trans	-69.6	0	137.4	0	0	0	0	0	110.7

Retrieved 949 of 949 residues in 1475 ms (Link to these results)

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