A0A077Z285_TRITR Loading...

FH2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z285, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,106 aa.

						>A0A077Z285_TRITR|A0A077Z285
MANEDDDSLVVRAYYLNDKDPFATASSSLEPPVGIGFSLSDRSSADVVTKWVDSPKRGALSLEVVCSNLFLFFCRNSRNVVVRTQLSCRVHTIIEKLLNSTGRDLRRILFSLKQIFQDDKDLVHEFVQNDGLACLIKVGAQADQNYQNYILRALGQVMLYVDGMNGVIAHNETIQWLYSLLGSQFRLVVKTALKLLLVFVEYTESNSLLLLAAVYIADRERGAPWNNLMNLLNEECSDTELLIYALTLLNKTLNGVPDQDTYYDIVDALEEQGMEEAIGRLSKLRTPELSEQCRLYETVLAKEDSEETFFSSFNSHVSYLFVAAPSRDGQPVEVEQRPMGRKGSAPKAPAPVGPLEKKRQSNDSQERYGSLQESPQTITGRSSISSLSSGGEQTSKKPILAPPPKLPDFSNLGEPEPSPLSPTGAGSPNTTVKYQQKTTEPEAAGPTTVATTPENDDAPAGTFASALSKAKRGMDKKMAAREPVDARKESDIQWEKAVESLNRPLIVNDLDFTELNDADDKDPLCLARLHEMNQSQQVKPVTSGGMPPPPPPGGVPGPPPPLLAGTPPPPPPSSVGSASGRNLLAAAAGTSPGRSPSPNPPINKDSKTVRLFWKEAQCQVIPGLLDSKGVFWQKLRPVSIDTEKLGSLFVTKTKEMAPKKKEDKRVEIRVLDTKRSNAINIGLTKLPPPRAIKTAIVKFDSSIMNKDCIEKVLSTMLPTMEEREAIMAAQAEHPDIPLGPAEQFLLMLSEIPQLHARLRLWLFMLDYANMEYEVAEPLMDLKLAMEELDKSRTFQQVMATLLSVGNFLNGAEIRGFQIDYLAKVPEVKDTVYKHSLVYHLASIMLENFPDSTDLYSEMGAVARSAKVDFDEVKTNLERMEKDCKASWDYLRQIAKHESHGLKDKISLFLSDCAQRILTLKIIHKRIINRFRKFLLYMGMPQHAVKDTKINAICKTISEFALEYRTCREKIIQQRKRQQDKRERNKTRGKLITDAKNWTHANDVAQWSDKAKAEKKHEELSRVLKTNGKAENSWNFSFPGAKTQLRMNLTEPAESPDDEILDGLVKAATATTGEHPRERRRARQFNRKSLRRTRTLKLVEDQINGNV
					

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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	23.9	Very low	36.1	Very low	233 Å²	233	119.8 Å²	119.8	100%	1.148	66%	0.66	S	S	*	*				0	119.6	0	-66	-171.1	-178.4	0	0	105.5
2	A	28.9	Very low	36.7	Very low	95 Å²	95	121.2 Å²	121.2	79%	0.785	65%	0.648	S	S	*	*			trans	-90.4	107.7	173.6	0	0	0	0	0	106.1
3	N	30.7	Very low	37.4	Very low	141 Å²	141	115.8 Å²	115.8	75%	0.754	63%	0.63	S	S	*	*			trans	-68.8	134.2	153.8	-88.6	-11.9	0	0	0	105.7	D5	N3-D5 PolarHBondContact O-N 3.36Å
4	E	38.3	Very low	37.8	Very low	197 Å²	197	112.2 Å²	112.2	92%	0.921	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-1	-171.2	-81.9	-179.4	140.5	0	0	115.2
5	D	39.5	Very low	38.4	Very low	162 Å²	162	110.3 Å²	110.3	87%	0.866	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	5.6	-172.9	-69.3	-41.2	0	0	0	116	N3	N3-D5 PolarHBondContact O-N 3.36Å
6	D	35.8	Very low	39.2	Very low	128 Å²	128	107.1 Å²	107.1	68%	0.684	57%	0.568	S	S	*	*			trans	-130.9	113.9	177.7	-117.3	-24.9	0	0	0	111.3	S8	D6-S8 PolarHBondContact O-N 3.33Å
7	D	34.9	Very low	39.7	Very low	142 Å²	142	104.6 Å²	104.6	76%	0.759	56%	0.555	S	S	*	*			trans	-66.1	42.6	177.1	-98.4	-22.9	0	0	0	112.9	S38	D7-S38 PolarHBondContact O-OG 2.81Å
8	S	35.7	Very low	40.4	Very low	60 Å²	60	101.3 Å²	101.3	42%	0.42	54%	0.538	S	S	.	.			trans	-101.3	112.1	-179.9	66.3	0	0	0	0	111.6	D6 V10	D6-S8 PolarHBondContact O-N 3.33Å; S8-V10 PolarHBondContact O-N 2.96Å
9	L	39.8	Very low	41	Very low	56 Å²	56	101.4 Å²	101.4	29%	0.293	53%	0.533	S	S	.	.			trans	-89.8	95.5	177.9	-166.2	82.7	0	0	0	110.7	V11 F37 L39	L9-V11 HydrophobicContact CD2-CG2 3.84Å; L9-V11 HydrophobicContact CG-CG2 4.21Å; L9-V11 PolarHBondContact O-N 3.26Å; L9-V11 VanDerWaalsContact O-N 3.1Å; L9-F37 CarbonylContact C-O 3.51Å; L9-F37 PolarHBondContact N-O 2.86Å; L9-L39 HydrophobicContact CB-CB 3.9Å; L9-L39 HydrophobicContact CB-CD1 4.09Å; L9-L39 HydrophobicContact CD2-CB 4.41Å; L9-L39 HydrophobicContact CD2-CD1 3.61Å; L9-L39 HydrophobicContact CG-CD1 4.42Å
10	V	45.2	Very low	41.9	Very low	84 Å²	84	99.1 Å²	99.1	51%	0.509	52%	0.521	S	S	.	.			trans	-68.9	108.7	172	-175.8	0	0	0	0	110.2	S8	S8-V10 PolarHBondContact O-N 2.96Å
11	V	44.2	Very low	42.7	Very low	20 Å²	20	95.6 Å²	95.6	12%	0.121	50%	0.504	C	S	.	.			trans	-102	131.4	173	-179.2	0	0	0	0	108.8	L9 L39 R78 V80	L9-V11 HydrophobicContact CD2-CG2 3.84Å; L9-V11 HydrophobicContact CG-CG2 4.21Å; L9-V11 PolarHBondContact O-N 3.26Å; L9-V11 VanDerWaalsContact O-N 3.1Å; V11-L39 HydrophobicContact CG2-CD1 4.25Å; V11-R78 WeakPolarHBondContact CA-O 3.47Å; V11-R78 WeakPolarHBondContact CG1-O 3.37Å; V11-V80 HydrophobicContact CG1-CB 4.31Å; V11-V80 HydrophobicContact CG1-CG2 3.51Å
12	R	43.9	Very low	44.3	Very low	136 Å²	136	85.2 Å²	85.2	51%	0.513	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	105.8	-179.1	-164.5	176.4	-85.6	175.7	-7.7	109.4	Y14 P32 R78 N79 V80	R12-Y14 HydrophobicContact CB-CE2 4.05Å; R12-Y14 WeakPolarHBondContact CD-OH 3.39Å; R12-Y14 HydrophobicContact CG-CE2 3.76Å; R12-Y14 WeakPolarHBondContact O-CD2 3.43Å; R12-P32 HydrophobicContact CG-CB 3.98Å; R12-R78 PolarHBondContact N-O 3.36Å; R12-N79 WeakPolarHBondContact O-CA 3.34Å; R12-V80 PolarHBondContact O-N 3.49Å
13	A	45.1	Very low	45.5	Very low	51 Å²	51	82.6 Å²	82.6	42%	0.421	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	131.5	176.2	0	0	0	0	0	110.7	V80	A13-V80 CarbonylContact C-O 3.59Å; A13-V80 WeakPolarHBondContact CA-O 3.47Å
14	Y	44	Very low	46.1	Very low	66 Å²	66	80.5 Å²	80.5	26%	0.259	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	115	174.5	-67	-95	0	0	0	107.9	R12 L29 N79 V80 V81 V82	R12-Y14 HydrophobicContact CB-CE2 4.05Å; R12-Y14 WeakPolarHBondContact CD-OH 3.39Å; R12-Y14 HydrophobicContact CG-CE2 3.76Å; R12-Y14 WeakPolarHBondContact O-CD2 3.43Å; Y14-L29 HydrophobicContact CD1-CD2 4.33Å; Y14-N79 HydrophobicContact CD2-CB 4.01Å; Y14-N79 HydrophobicContact CE2-CB 3.78Å; Y14-N79 VanDerWaalsContact CE2-CG 3.47Å; Y14-V80 PolarHBondContact N-O 3.4Å; Y14-V81 WeakPolarHBondContact O-CA 3.13Å; Y14-V82 PolarHBondContact O-N 2.9Å
15	Y	46.3	Very low	46.2	Very low	83 Å²	83	75.9 Å²	75.9	33%	0.325	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	111.7	173.8	-152	-93.8	0	0	0	107.6	N17 K19 L69 V82	Y15-N17 HydrophobicContact CD1-CB 4.2Å; Y15-N17 PolarHBondContact O-N 3.41Å; Y15-K19 WeakPolarHBondContact OH-CE 3.15Å; Y15-L69 HydrophobicContact CE2-CD1 3.82Å; Y15-L69 HydrophobicContact CE2-CD2 3.56Å; Y15-L69 HydrophobicContact CE2-CG 4.39Å; Y15-L69 VanDerWaalsContact OH-CD2 3.3Å; Y15-L69 WeakPolarHBondContact OH-CD2 3.23Å; Y15-V82 HydrophobicContact CD2-CB 3.99Å; Y15-V82 HydrophobicContact CD2-CG1 4.33Å; Y15-V82 HydrophobicContact CE2-CB 4.38Å; Y15-V82 HydrophobicContact CE2-CG1 4.23Å
16	L	51.1	Low	46.1	Very low	59 Å²	59	74 Å²	74	31%	0.309	42%	0.419	S	S	.	.			trans	-75.5	103.8	161.4	-102.9	106.6	0	0	0	105.4	D18 V81 V82 R83	L16-D18 WeakPolarHBondContact CD2-OD1 3.34Å; L16-D18 WeakPolarHBondContact CD2-OD2 3.46Å; L16-D18 PolarHBondContact O-N 3.04Å; L16-V81 HydrophobicContact CD1-CG1 3.42Å; L16-V81 VanDerWaalsContact CD1-CG1 3.42Å; L16-V82 PolarHBondContact N-O 3.42Å; L16-R83 HydrophobicContact CB-CG 3.96Å
17	N	48	Very low	45.9	Very low	65 Å²	65	72.3 Å²	72.3	35%	0.348	42%	0.417	S	S	.	.			trans	-72.8	70.5	173.8	-165.4	15.9	0	0	0	109.5	Y15 K19 S28	Y15-N17 HydrophobicContact CD1-CB 4.2Å; Y15-N17 PolarHBondContact O-N 3.41Å; N17-K19 PolarHBondContact O-N 3.17Å; N17-K19 WeakPolarHBondContact OD1-CB 3.38Å; N17-K19 WeakPolarHBondContact OD1-CG 3.34Å; N17-S28 PolarHBondContact O-OG 3.22Å
18	D	52.9	Low	46.1	Very low	45 Å²	45	67.1 Å²	67.1	24%	0.241	39%	0.392	C	S	.	.			trans	-87.5	19.2	173.7	-63.4	-22	0	0	0	110.5	L16 D20 R83	L16-D18 WeakPolarHBondContact CD2-OD1 3.34Å; L16-D18 WeakPolarHBondContact CD2-OD2 3.46Å; L16-D18 PolarHBondContact O-N 3.04Å; D18-D20 PolarHBondContact O-N 3.29Å; D18-R83 IonicContact OD2-NE 3.38Å
19	K	51.2	Low	46.1	Very low	104 Å²	104	71 Å²	71	45%	0.452	41%	0.407	S	S	.	.	S	Bend	trans	-62.1	-35.5	179.7	-75.7	-172.6	177.1	-178.5	0	111.8	Y15 N17 P21	Y15-K19 WeakPolarHBondContact OH-CE 3.15Å; N17-K19 PolarHBondContact O-N 3.17Å; N17-K19 WeakPolarHBondContact OD1-CB 3.38Å; N17-K19 WeakPolarHBondContact OD1-CG 3.34Å; K19-P21 WeakPolarHBondContact O-CD 3.45Å
20	D	57.9	Low	45.8	Very low	55 Å²	55	76.2 Å²	76.2	29%	0.294	43%	0.43	S	S	.	.			trans	-106.9	100.4	176.8	-168.1	-5.9	0	0	0	110.1	D18 F22 A23 K96	D18-D20 PolarHBondContact O-N 3.29Å; D20-F22 PolarHBondContact O-N 3.15Å; D20-F22 WeakPolarHBondContact OD1-CB 3.2Å; D20-F22 WeakPolarHBondContact OD1-CD2 3.47Å; D20-F22 PolarHBondContact OD1-N 2.83Å; D20-A23 HydrophobicContact CB-CB 3.92Å; D20-A23 WeakPolarHBondContact O-CB 3.48Å; D20-A23 PolarHBondContact O-N 2.9Å; D20-K96 IonicContact OD1-NZ 3.06Å; D20-K96 PolarHBondContact OD1-NZ 3.37Å; D20-K96 IonicContact OD2-NZ 3.05Å; D20-K96 PolarHBondContact OD2-NZ 3.18Å
21	P	58.9	Low	45.2	Very low	26 Å²	26	77.4 Å²	77.4	17%	0.169	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-8.9	177.7	22.5	-28.1	0	0	0	113.2	K19 I93 I115	K19-P21 WeakPolarHBondContact O-CD 3.45Å; P21-I93 HydrophobicContact CB-CD1 4.34Å; P21-I93 HydrophobicContact CB-CG1 4.23Å; P21-I93 HydrophobicContact CG-CD1 4.09Å; P21-I93 HydrophobicContact CG-CG1 3.5Å; P21-I93 VanDerWaalsContact CG-CG1 3.5Å; P21-I115 HydrophobicContact CB-CD1 4.41Å
22	F	58.2	Low	44.7	Very low	15 Å²	15	79.4 Å²	79.4	7%	0.066	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	0.5	176.4	-53.3	-77.9	0	0	0	113.8	D20 I93 K96 R107 I108 I115	D20-F22 PolarHBondContact O-N 3.15Å; D20-F22 WeakPolarHBondContact OD1-CB 3.2Å; D20-F22 WeakPolarHBondContact OD1-CD2 3.47Å; D20-F22 PolarHBondContact OD1-N 2.83Å; F22-I93 HydrophobicContact CE2-CG1 4.27Å; F22-I93 HydrophobicContact CZ-CG1 4.22Å; F22-I93 HydrophobicContact CZ-CG2 4.28Å; F22-K96 HydrophobicContact CD2-CD 3.6Å; F22-K96 HydrophobicContact CE2-CB 4.15Å; F22-K96 HydrophobicContact CE2-CD 3.74Å; F22-R107 PolarHBondContact O-NH2 3.34Å; F22-I108 HydrophobicContact CD1-CB 4.32Å; F22-I108 HydrophobicContact CD1-CG1 4.03Å; F22-I108 HydrophobicContact CD1-CG2 4.43Å; F22-I108 HydrophobicContact CD2-CG1 4.15Å; F22-I108 HydrophobicContact CE1-CB 4.01Å; F22-I108 HydrophobicContact CE1-CG1 4.07Å; F22-I108 HydrophobicContact CE1-CG2 3.66Å; F22-I108 HydrophobicContact CE2-CG1 4.18Å; F22-I108 HydrophobicContact CE2-CG2 4.25Å; F22-I108 HydrophobicContact CG-CG1 4.08Å; F22-I108 HydrophobicContact CZ-CB 4.25Å; F22-I108 HydrophobicContact CZ-CG1 4.15Å; F22-I108 HydrophobicContact CZ-CG2 3.55Å; F22-I115 HydrophobicContact CD1-CD1 3.57Å; F22-I115 HydrophobicContact CE1-CD1 3.33Å; F22-I115 HydrophobicContact CG-CD1 4.44Å; F22-I115 HydrophobicContact CZ-CD1 4.05Å
23	A	54.8	Low	44.3	Very low	40 Å²	40	78.4 Å²	78.4	33%	0.331	46%	0.461	S	S	.	.	S	Bend	trans	-79.1	132.1	175.7	0	0	0	0	0	111	D20 A25	D20-A23 HydrophobicContact CB-CB 3.92Å; D20-A23 WeakPolarHBondContact O-CB 3.48Å; D20-A23 PolarHBondContact O-N 2.9Å; A23-A25 PolarHBondContact O-N 3.5Å
24	T	41.6	Very low	43.7	Very low	96 Å²	96	79.3 Å²	79.3	59%	0.589	48%	0.475	S	S	*	.			trans	-64.1	125.9	177.3	-15	0	0	0	0	109.2	S26 S27	T24-S26 PolarHBondContact O-N 3.27Å; T24-S27 PolarHBondContact O-N 2.89Å
25	A	41.1	Very low	43.2	Very low	101 Å²	101	80.5 Å²	80.5	84%	0.835	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-6.2	-171.9	0	0	0	0	0	116.4	A23	A23-A25 PolarHBondContact O-N 3.5Å
26	S	36.7	Very low	42.4	Very low	122 Å²	122	79 Å²	79	85%	0.853	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-10.7	-176.1	-49.6	0	0	0	0	115.2	T24	T24-S26 PolarHBondContact O-N 3.27Å
27	S	33.5	Very low	41.6	Very low	93 Å²	93	79.7 Å²	79.7	65%	0.65	50%	0.496	S	S	*	.	S	Bend	trans	-114.5	1.7	-172.8	61	0	0	0	0	117.1	T24	T24-S27 PolarHBondContact O-N 2.89Å
28	S	38.2	Very low	40.8	Very low	32 Å²	32	80.6 Å²	80.6	22%	0.224	51%	0.507	C	S	.	.			trans	-102.6	5.9	-166.3	-82.4	0	0	0	0	117.5	N17 E30	N17-S28 PolarHBondContact O-OG 3.22Å; S28-E30 VanDerWaalsContact C-N 3.29Å; S28-E30 PolarHBondContact O-N 2.84Å
29	L	35.7	Very low	40	Very low	142 Å²	142	80 Å²	80	74%	0.743	50%	0.504	S	S	*	.			trans	-86.7	74.2	165.6	-82	152.7	0	0	0	108.9	Y14	Y14-L29 HydrophobicContact CD1-CD2 4.33Å
30	E	32.9	Very low	39.3	Very low	166 Å²	166	79.5 Å²	79.5	78%	0.776	51%	0.513	S	S	*	.			trans	-58.2	141.7	164	-99.3	-169.9	159.2	0	0	109.2	S28	S28-E30 VanDerWaalsContact C-N 3.29Å; S28-E30 PolarHBondContact O-N 2.84Å
31	P	34	Very low	38.3	Very low	108 Å²	108	82.9 Å²	82.9	70%	0.701	53%	0.531	S	S	*	.			trans	-59.2	142	-176.7	23.1	-31.6	0	0	0	110.4	V33	P31-V33 PolarHBondContact O-N 2.81Å
32	P	33.8	Very low	37.2	Very low	62 Å²	62	93.7 Å²	93.7	40%	0.403	57%	0.569	S	S	.	*			trans	-60.7	114	-172.3	24.1	-33.1	0	0	0	109.8	R12 G34	R12-P32 HydrophobicContact CG-CB 3.98Å; P32-G34 VanDerWaalsContact C-N 3.32Å; P32-G34 PolarHBondContact O-N 3.48Å
33	V	34.8	Very low	36.5	Very low	116 Å²	116	96 Å²	96	70%	0.703	59%	0.586	S	S	*	*			trans	-62.8	102.8	161.9	-177.8	0	0	0	0	105.5	P31 I35	P31-V33 PolarHBondContact O-N 2.81Å; V33-I35 VanDerWaalsContact C-N 3.27Å; V33-I35 HydrophobicContact CG1-CD1 4.43Å; V33-I35 HydrophobicContact CG1-CG1 3.88Å; V33-I35 PolarHBondContact O-N 3.08Å
34	G	31.7	Very low	36	Very low	69 Å²	69	96 Å²	96	71%	0.711	59%	0.585	S	S	*	*			trans	-69.1	85.4	-179.8	0	0	0	0	0	109.7	P32 G36	P32-G34 VanDerWaalsContact C-N 3.32Å; P32-G34 PolarHBondContact O-N 3.48Å; G34-G36 PolarHBondContact O-N 2.88Å
35	I	33.6	Very low	35.9	Very low	92 Å²	92	94.5 Å²	94.5	47%	0.472	58%	0.582	S	S	.	*			trans	-86.3	101.3	171	-47.1	177.5	0	0	0	106.7	V33 F37	V33-I35 VanDerWaalsContact C-N 3.27Å; V33-I35 HydrophobicContact CG1-CD1 4.43Å; V33-I35 HydrophobicContact CG1-CG1 3.88Å; V33-I35 PolarHBondContact O-N 3.08Å; I35-F37 HydrophobicContact CB-CD2 4.48Å; I35-F37 HydrophobicContact CB-CE2 3.69Å; I35-F37 HydrophobicContact CB-CZ 3.92Å; I35-F37 HydrophobicContact CG2-CD1 4.49Å; I35-F37 HydrophobicContact CG2-CD2 4.21Å; I35-F37 HydrophobicContact CG2-CE1 3.77Å; I35-F37 HydrophobicContact CG2-CE2 3.44Å; I35-F37 VanDerWaalsContact CG2-CE2 3.44Å; I35-F37 HydrophobicContact CG2-CZ 3.2Å; I35-F37 VanDerWaalsContact O-CD2 3.29Å; I35-F37 WeakPolarHBondContact O-CD2 3.44Å; I35-F37 WeakPolarHBondContact O-CE2 3.31Å
36	G	29.5	Very low	35.9	Very low	51 Å²	51	94.4 Å²	94.4	53%	0.526	57%	0.567	S	S	.	*			trans	-73.4	128.6	173.6	0	0	0	0	0	110.2	G34	G34-G36 PolarHBondContact O-N 2.88Å
37	F	34.4	Very low	36.1	Very low	73 Å²	73	91 Å²	91	32%	0.32	54%	0.541	S	S	.	.			trans	-118.7	144.6	173.9	-63.2	-79.5	0	0	0	109.6	L9 I35 W51	L9-F37 CarbonylContact C-O 3.51Å; L9-F37 PolarHBondContact N-O 2.86Å; I35-F37 HydrophobicContact CB-CD2 4.48Å; I35-F37 HydrophobicContact CB-CE2 3.69Å; I35-F37 HydrophobicContact CB-CZ 3.92Å; I35-F37 HydrophobicContact CG2-CD1 4.49Å; I35-F37 HydrophobicContact CG2-CD2 4.21Å; I35-F37 HydrophobicContact CG2-CE1 3.77Å; I35-F37 HydrophobicContact CG2-CE2 3.44Å; I35-F37 VanDerWaalsContact CG2-CE2 3.44Å; I35-F37 HydrophobicContact CG2-CZ 3.2Å; I35-F37 VanDerWaalsContact O-CD2 3.29Å; I35-F37 WeakPolarHBondContact O-CD2 3.44Å; I35-F37 WeakPolarHBondContact O-CE2 3.31Å; F37-W51 AromaticContact CE1-CE2 3.88Å; F37-W51 HydrophobicContact CE1-CH2 4.17Å; F37-W51 AromaticContact CE1-CZ2 3.52Å; F37-W51 HydrophobicContact CE1-CZ2 3.52Å; F37-W51 AromaticContact CZ-CH2 3.81Å; F37-W51 HydrophobicContact CZ-CH2 3.81Å; F37-W51 AromaticContact CZ-CZ2 3.65Å; F37-W51 HydrophobicContact CZ-CZ2 3.65Å
38	S	32	Very low	36.6	Very low	84 Å²	84	88.4 Å²	88.4	59%	0.587	52%	0.521	S	S	*	.			trans	-95.4	122.9	169	177.4	0	0	0	0	108.5	D7	D7-S38 PolarHBondContact O-OG 2.81Å
39	L	35	Very low	36.8	Very low	34 Å²	34	90.5 Å²	90.5	18%	0.178	53%	0.533	C	S	.	.			trans	-117.8	84	-177.7	-87.7	155.7	0	0	0	107.7	L9 V11 D41 V47	L9-L39 HydrophobicContact CB-CB 3.9Å; L9-L39 HydrophobicContact CB-CD1 4.09Å; L9-L39 HydrophobicContact CD2-CB 4.41Å; L9-L39 HydrophobicContact CD2-CD1 3.61Å; L9-L39 HydrophobicContact CG-CD1 4.42Å; V11-L39 HydrophobicContact CG2-CD1 4.25Å; L39-D41 PolarHBondContact O-N 3.33Å; L39-D41 VanDerWaalsContact O-N 3.12Å; L39-V47 HydrophobicContact CD2-CB 3.74Å; L39-V47 HydrophobicContact CD2-CG1 3.42Å; L39-V47 VanDerWaalsContact CD2-CG1 3.42Å; L39-V47 HydrophobicContact CD2-CG2 4.36Å
40	S	37.3	Very low	37	Very low	92 Å²	92	90.1 Å²	90.1	64%	0.643	53%	0.525	S	S	*	.			trans	-82.2	62.9	169.2	63.8	0	0	0	0	110
41	D	36.1	Very low	37.5	Very low	127 Å²	127	89.4 Å²	89.4	68%	0.679	52%	0.515	S	S	*	.	S	Bend	trans	178.1	136.6	151.6	-98.4	-31.2	0	0	0	112.1	L39 S43	L39-D41 PolarHBondContact O-N 3.33Å; L39-D41 VanDerWaalsContact O-N 3.12Å; D41-S43 PolarHBondContact O-N 3.49Å
42	R	37.4	Very low	37.9	Very low	253 Å²	253	86.6 Å²	86.6	96%	0.955	50%	0.496	S	S	*	.	S	Bend	trans	-69.7	10.2	-165.6	-100.1	-178.5	176.3	-164.1	0.5	116.7
43	S	41.6	Very low	38.2	Very low	62 Å²	62	88.6 Å²	88.6	43%	0.434	50%	0.503	S	S	.	.			trans	-103	69.9	172.8	74	0	0	0	0	111.5	D41 A45 D46 V47	D41-S43 PolarHBondContact O-N 3.49Å; S43-A45 PolarHBondContact O-N 3.12Å; S43-D46 PolarHBondContact O-N 2.91Å; S43-V47 PolarHBondContact O-N 3.03Å
44	S	46	Very low	38.2	Very low	42 Å²	42	86.5 Å²	86.5	29%	0.294	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-19.9	-169.7	-45.2	0	0	0	0	115.7	V48	S44-V48 VanDerWaalsContact O-CG2 3.31Å; S44-V48 WeakPolarHBondContact O-CG2 3.44Å
45	A	39.4	Very low	38.3	Very low	64 Å²	64	86.7 Å²	86.7	53%	0.529	48%	0.482	S	S	.	.	H	α-helix	trans	-75.9	-55.7	176.9	0	0	0	0	0	111.4	S43 V47 V48 T49	S43-A45 PolarHBondContact O-N 3.12Å; A45-V47 VanDerWaalsContact C-N 3.28Å; A45-V47 PolarHBondContact O-N 3.02Å; A45-V48 PolarHBondContact O-N 3.24Å; A45-T49 PolarHBondContact O-N 3.27Å; A45-T49 VanDerWaalsContact O-N 3.13Å; A45-T49 PolarHBondContact O-OG1 3.4Å
46	D	39.6	Very low	38.3	Very low	98 Å²	98	89.9 Å²	89.9	52%	0.524	49%	0.493	S	S	.	.	H	α-helix	trans	-64	-31.4	-175.4	-76.2	-13.6	0	0	0	113.3	S43 K50	S43-D46 PolarHBondContact O-N 2.91Å; D46-K50 WeakPolarHBondContact O-CB 3.25Å; D46-K50 VanDerWaalsContact O-CG 3.28Å; D46-K50 WeakPolarHBondContact O-CG 3.48Å; D46-K50 PolarHBondContact O-N 3.22Å
47	V	42.8	Very low	38.2	Very low	52 Å²	52	99 Å²	99	32%	0.315	51%	0.512	S	S	.	.	H	α-helix	trans	-71.6	-36.9	179	-175.6	0	0	0	0	111.2	L39 S43 A45 W51	L39-V47 HydrophobicContact CD2-CB 3.74Å; L39-V47 HydrophobicContact CD2-CG1 3.42Å; L39-V47 VanDerWaalsContact CD2-CG1 3.42Å; L39-V47 HydrophobicContact CD2-CG2 4.36Å; S43-V47 PolarHBondContact O-N 3.03Å; A45-V47 VanDerWaalsContact C-N 3.28Å; A45-V47 PolarHBondContact O-N 3.02Å; V47-W51 WeakPolarHBondContact O-CB 3.26Å; V47-W51 PolarHBondContact O-N 2.75Å
48	V	43.2	Very low	37.8	Very low	37 Å²	37	99.1 Å²	99.1	22%	0.224	53%	0.533	C	S	.	.	H	α-helix	trans	-69.4	-43.5	176.1	177	0	0	0	0	110.1	S44 A45 W51 V52 L71	S44-V48 VanDerWaalsContact O-CG2 3.31Å; S44-V48 WeakPolarHBondContact O-CG2 3.44Å; A45-V48 PolarHBondContact O-N 3.24Å; V48-W51 PolarHBondContact O-N 3.34Å; V48-V52 VanDerWaalsContact O-CG2 3.31Å; V48-V52 WeakPolarHBondContact O-CG2 3.21Å; V48-V52 PolarHBondContact O-N 2.79Å; V48-L71 HydrophobicContact CG1-CD1 3.93Å
49	T	41.6	Very low	37.5	Very low	76 Å²	76	98.9 Å²	98.9	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-62.5	-45.1	175.3	-18.8	0	0	0	0	111.4	A45 W51 V52 D53	A45-T49 PolarHBondContact O-N 3.27Å; A45-T49 VanDerWaalsContact O-N 3.13Å; A45-T49 PolarHBondContact O-OG1 3.4Å; T49-W51 VanDerWaalsContact C-N 3.31Å; T49-W51 PolarHBondContact O-N 3.02Å; T49-V52 PolarHBondContact O-N 3.43Å; T49-D53 WeakPolarHBondContact O-CB 3.36Å; T49-D53 PolarHBondContact O-N 3.45Å
50	K	40.5	Very low	37.2	Very low	134 Å²	134	105.4 Å²	105.4	58%	0.583	57%	0.57	S	S	*	*	H	α-helix	trans	-66.2	-30.3	175.3	-78.8	179	177.6	174.9	0	113.2	D46 D53 S54	D46-K50 WeakPolarHBondContact O-CB 3.25Å; D46-K50 VanDerWaalsContact O-CG 3.28Å; D46-K50 WeakPolarHBondContact O-CG 3.48Å; D46-K50 PolarHBondContact O-N 3.22Å; K50-D53 CarbonylContact O-C 3.54Å; K50-D53 PolarHBondContact O-N 3.23Å; K50-S54 PolarHBondContact O-N 3.2Å
51	W	42.5	Very low	36.7	Very low	151 Å²	151	104.8 Å²	104.8	57%	0.572	57%	0.566	S	S	*	*	H	α-helix	trans	-70.9	-44	174.8	-175.3	86.2	0	0	0	111.1	F37 V47 V48 T49 D53 S54	F37-W51 AromaticContact CE1-CE2 3.88Å; F37-W51 HydrophobicContact CE1-CH2 4.17Å; F37-W51 AromaticContact CE1-CZ2 3.52Å; F37-W51 HydrophobicContact CE1-CZ2 3.52Å; F37-W51 AromaticContact CZ-CH2 3.81Å; F37-W51 HydrophobicContact CZ-CH2 3.81Å; F37-W51 AromaticContact CZ-CZ2 3.65Å; F37-W51 HydrophobicContact CZ-CZ2 3.65Å; V47-W51 WeakPolarHBondContact O-CB 3.26Å; V47-W51 PolarHBondContact O-N 2.75Å; V48-W51 PolarHBondContact O-N 3.34Å; T49-W51 VanDerWaalsContact C-N 3.31Å; T49-W51 PolarHBondContact O-N 3.02Å; W51-D53 PolarHBondContact O-N 3.43Å; W51-S54 PolarHBondContact O-N 3.28Å; W51-S54 VanDerWaalsContact O-N 3.08Å
52	V	43.6	Very low	36.2	Very low	49 Å²	49	104.2 Å²	104.2	30%	0.297	56%	0.562	S	S	.	*	H	α-helix	trans	-57.9	-36.5	171.4	173.3	0	0	0	0	110.9	V48 T49 C66 L71	V48-V52 VanDerWaalsContact O-CG2 3.31Å; V48-V52 WeakPolarHBondContact O-CG2 3.21Å; V48-V52 PolarHBondContact O-N 2.79Å; T49-V52 PolarHBondContact O-N 3.43Å; V52-C66 HydrophobicContact CG1-CB 4.32Å; V52-L71 HydrophobicContact CG2-CD1 3.7Å
53	D	39.8	Very low	35.6	Very low	104 Å²	104	99 Å²	99	56%	0.556	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	6.2	177.3	-86.4	-29.1	0	0	0	115	T49 K50 W51 K628	T49-D53 WeakPolarHBondContact O-CB 3.36Å; T49-D53 PolarHBondContact O-N 3.45Å; K50-D53 CarbonylContact O-C 3.54Å; K50-D53 PolarHBondContact O-N 3.23Å; W51-D53 PolarHBondContact O-N 3.43Å; D53-K628 WeakPolarHBondContact O-CE 3.39Å; D53-K628 PolarHBondContact O-NZ 3.42Å
54	S	34.9	Very low	35.1	Very low	72 Å²	72	100.8 Å²	100.8	50%	0.503	56%	0.557	S	S	.	*			trans	-85.5	122.9	-176.8	-163.6	0	0	0	0	112.1	K50 W51 K56	K50-S54 PolarHBondContact O-N 3.2Å; W51-S54 PolarHBondContact O-N 3.28Å; W51-S54 VanDerWaalsContact O-N 3.08Å; S54-K56 VanDerWaalsContact C-N 3.3Å; S54-K56 PolarHBondContact O-N 2.93Å
55	P	34	Very low	34.5	Very low	73 Å²	73	101.4 Å²	101.4	47%	0.474	56%	0.559	S	S	.	*			trans	-84.2	0.8	-171.3	32.6	-28.8	0	0	0	114	K628	P55-K628 VanDerWaalsContact CD-CE 3.46Å; P55-K628 HydrophobicContact CG-CD 4.3Å; P55-K628 HydrophobicContact CG-CG 4.15Å
56	K	32.2	Very low	34.2	Very low	160 Å²	160	100.3 Å²	100.3	70%	0.696	55%	0.547	S	S	*	.			trans	-103.9	82.3	-171.8	-68.7	-173.1	-178.7	177.6	0	111	S54	S54-K56 VanDerWaalsContact C-N 3.3Å; S54-K56 PolarHBondContact O-N 2.93Å
57	R	27.9	Very low	34.2	Very low	243 Å²	243	99.3 Å²	99.3	92%	0.917	55%	0.547	S	S	*	.	S	Bend	trans	-174.5	126.6	139	-98.5	160.7	-159.4	-151.9	7.1	108.8
58	G	26.8	Very low	34.1	Very low	75 Å²	75	99.3 Å²	99.3	77%	0.773	55%	0.546	S	S	*	.			trans	-71.8	174	-157.6	0	0	0	0	0	116.7
59	A	25.6	Very low	34	Very low	78 Å²	78	99 Å²	99	65%	0.645	54%	0.543	S	S	*	.	S	Bend	trans	86.2	64.9	172.2	0	0	0	0	0	116.7	S61	A59-S61 PolarHBondContact O-N 3.4Å; A59-S61 PolarHBondContact O-OG 3.24Å
60	L	27.5	Very low	33.9	Very low	171 Å²	171	101.8 Å²	101.8	90%	0.895	55%	0.548	S	S	*	.	S	Bend	trans	43.4	7.7	136.7	-82.7	159.1	0	0	0	121.2
61	S	28.5	Very low	34.1	Very low	80 Å²	80	98.5 Å²	98.5	56%	0.559	54%	0.537	S	S	*	.	S	Bend	trans	-120.9	-24.3	-177.7	52.2	0	0	0	0	112.4	A59 V65	A59-S61 PolarHBondContact O-N 3.4Å; A59-S61 PolarHBondContact O-OG 3.24Å; S61-V65 WeakPolarHBondContact O-CG2 3.03Å
62	L	25.1	Very low	34	Very low	114 Å²	114	97.7 Å²	97.7	60%	0.597	54%	0.538	S	S	*	.	H	α-helix	trans	-83.2	-28.2	178	-90.1	111.7	0	0	0	114.6	V64 V65 C66	L62-V64 PolarHBondContact O-N 2.83Å; L62-V65 PolarHBondContact O-N 3.06Å; L62-C66 PolarHBondContact O-N 3.26Å
63	E	25.2	Very low	34	Very low	145 Å²	145	99.9 Å²	99.9	68%	0.678	54%	0.544	S	S	*	.	H	α-helix	trans	-60.5	-35.4	-178.5	-126.3	-178.1	179.3	0	0	112.2	S67	E63-S67 PolarHBondContact O-OG 2.78Å
64	V	30.7	Very low	34.1	Very low	99 Å²	99	98 Å²	98	60%	0.6	54%	0.537	S	S	*	.	H	α-helix	trans	-75.5	-31.2	177.1	-178	0	0	0	0	111.7	L62 N68	L62-V64 PolarHBondContact O-N 2.83Å; V64-N68 VanDerWaalsContact O-CG 3.29Å; V64-N68 PolarHBondContact O-ND2 2.95Å
65	V	34	Very low	34.6	Very low	54 Å²	54	105.5 Å²	105.5	33%	0.327	56%	0.555	S	S	.	*	H	α-helix	trans	-77.6	-41.7	-177	179	0	0	0	0	111.1	S61 L62 N68 L69	S61-V65 WeakPolarHBondContact O-CG2 3.03Å; L62-V65 PolarHBondContact O-N 3.06Å; V65-N68 PolarHBondContact O-N 3.4Å; V65-L69 HydrophobicContact CG1-CD1 3.7Å; V65-L69 WeakPolarHBondContact O-CD1 3.38Å; V65-L69 WeakPolarHBondContact O-CG 3.42Å
66	C	33.1	Very low	35	Very low	41 Å²	41	109.7 Å²	109.7	28%	0.277	57%	0.573	S	S	.	*	H	α-helix	trans	-69.4	-34.9	-176.1	-67.5	0	0	0	0	113.6	V52 L62 N68 L69	V52-C66 HydrophobicContact CG1-CB 4.32Å; L62-C66 PolarHBondContact O-N 3.26Å; C66-N68 PolarHBondContact O-N 3.4Å; C66-N68 VanDerWaalsContact O-N 3.11Å; C66-L69 PolarHBondContact O-N 2.85Å
67	S	37.8	Very low	35.6	Very low	77 Å²	77	105 Å²	105	54%	0.538	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.3	-14.4	177.1	-50.8	0	0	0	0	113.1	E63 Q85	E63-S67 PolarHBondContact O-OG 2.78Å; S67-Q85 PolarHBondContact O-NE2 2.93Å; S67-Q85 PolarHBondContact O-OE1 3.09Å
68	N	41.2	Very low	36.5	Very low	53 Å²	53	101.4 Å²	101.4	28%	0.283	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	14.6	-171.2	-63.9	-13.5	0	0	0	112.8	V64 V65 C66 T84 Q85 C88	V64-N68 VanDerWaalsContact O-CG 3.29Å; V64-N68 PolarHBondContact O-ND2 2.95Å; V65-N68 PolarHBondContact O-N 3.4Å; C66-N68 PolarHBondContact O-N 3.4Å; C66-N68 VanDerWaalsContact O-N 3.11Å; N68-T84 CarbonylContact O-C 3.42Å; N68-T84 VanDerWaalsContact O-CA 3.3Å; N68-T84 WeakPolarHBondContact O-CA 3.26Å; N68-Q85 PolarHBondContact O-N 3.48Å; N68-C88 PolarHBondContact OD1-SG 3.46Å
69	L	41	Very low	37.3	Very low	31 Å²	31	100 Å²	100	16%	0.162	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.6	-169.2	-72.9	161.9	0	0	0	112.5	Y15 V65 C66 V82 R83	Y15-L69 HydrophobicContact CE2-CD1 3.82Å; Y15-L69 HydrophobicContact CE2-CD2 3.56Å; Y15-L69 HydrophobicContact CE2-CG 4.39Å; Y15-L69 VanDerWaalsContact OH-CD2 3.3Å; Y15-L69 WeakPolarHBondContact OH-CD2 3.23Å; V65-L69 HydrophobicContact CG1-CD1 3.7Å; V65-L69 WeakPolarHBondContact O-CD1 3.38Å; V65-L69 WeakPolarHBondContact O-CG 3.42Å; C66-L69 PolarHBondContact O-N 2.85Å; L69-V82 HydrophobicContact CB-CG1 3.56Å; L69-V82 HydrophobicContact CD1-CG1 3.88Å; L69-V82 HydrophobicContact CD2-CB 4.36Å; L69-V82 HydrophobicContact CD2-CG1 3.37Å; L69-V82 HydrophobicContact CG-CG1 3.75Å; L69-R83 CarbonylContact C-O 3.16Å; L69-R83 VanDerWaalsContact CA-O 3.25Å; L69-R83 WeakPolarHBondContact CA-O 3.36Å
70	F	40.4	Very low	38.3	Very low	133 Å²	133	96.9 Å²	96.9	58%	0.583	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.9	171.1	-123.2	-94.6	0	0	0	109.7	R83 Q85	F70-R83 PolarHBondContact N-O 2.94Å; F70-R83 PolarHBondContact O-N 3.44Å; F70-R83 VanDerWaalsContact O-N 3.07Å; F70-Q85 HydrophobicContact CD2-CG 4.22Å
71	L	43.7	Very low	39.2	Very low	65 Å²	65	90.3 Å²	90.3	34%	0.34	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.1	-179.4	-72.6	171.6	0	0	0	110.9	V48 V52 V80 V82	V48-L71 HydrophobicContact CG1-CD1 3.93Å; V52-L71 HydrophobicContact CG2-CD1 3.7Å; L71-V80 HydrophobicContact CD2-CG1 3.37Å; L71-V82 HydrophobicContact CD2-CB 4.41Å; L71-V82 HydrophobicContact CD2-CG1 4.1Å; L71-V82 HydrophobicContact CD2-CG2 3.82Å
72	F	42.1	Very low	40.2	Very low	135 Å²	135	87.3 Å²	87.3	59%	0.592	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	119	168.3	-101.1	-92.8	0	0	0	110.2	V81	F72-V81 PolarHBondContact N-O 3.16Å; F72-V81 PolarHBondContact O-N 3.11Å
73	F	42	Very low	41.5	Very low	95 Å²	95	87.9 Å²	87.9	42%	0.417	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	103.4	174.2	-159.2	-91.7	0	0	0	109.8	R75 V80	F73-R75 HydrophobicContact CD1-CG 4.16Å; F73-R75 PolarHBondContact O-N 3.41Å; F73-R75 VanDerWaalsContact O-N 3.13Å; F73-V80 HydrophobicContact CD2-CG2 4.05Å; F73-V80 HydrophobicContact CE2-CG2 4.23Å
74	C	41.5	Very low	43.4	Very low	63 Å²	63	81.9 Å²	81.9	43%	0.426	41%	0.407	S	S	.	.			trans	-76.5	97.1	172	-74.9	0	0	0	0	108.7	N76 S77	C74-N76 PolarHBondContact O-N 2.82Å; C74-S77 PolarHBondContact O-N 3Å; C74-S77 VanDerWaalsContact O-N 3.08Å
75	R	45.6	Very low	45.1	Very low	230 Å²	230	80 Å²	80	87%	0.868	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-24.6	-175.6	-73.1	176.9	92.8	152.8	3.2	115	F73	F73-R75 HydrophobicContact CD1-CG 4.16Å; F73-R75 PolarHBondContact O-N 3.41Å; F73-R75 VanDerWaalsContact O-N 3.13Å
76	N	43.4	Very low	46.9	Very low	162 Å²	162	79.8 Å²	79.8	87%	0.866	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-3.4	-175.7	-73	2.7	0	0	0	115.4	C74	C74-N76 PolarHBondContact O-N 2.82Å
77	S	43.8	Very low	48.9	Very low	61 Å²	61	79.6 Å²	79.6	43%	0.427	39%	0.388	S	S	.	.	S	Bend	trans	-141.8	135.5	175	-48.1	0	0	0	0	106.3	C74 N79	C74-S77 PolarHBondContact O-N 3Å; C74-S77 VanDerWaalsContact O-N 3.08Å; S77-N79 WeakPolarHBondContact CB-ND2 3.27Å; S77-N79 PolarHBondContact O-N 2.84Å
78	R	46.5	Very low	50.5	Low	168 Å²	168	77 Å²	77	63%	0.634	37%	0.37	S	S	*	.	S	Bend	trans	-70.5	51.1	179.4	-58.8	174.2	-161.8	156.2	3.7	111	V11 R12	V11-R78 WeakPolarHBondContact CA-O 3.47Å; V11-R78 WeakPolarHBondContact CG1-O 3.37Å; R12-R78 PolarHBondContact N-O 3.36Å
79	N	45.5	Very low	52.3	Low	46 Å²	46	76.6 Å²	76.6	25%	0.246	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.9	-168.6	-64.1	-12.7	0	0	0	107.4	R12 Y14 S77	R12-N79 WeakPolarHBondContact O-CA 3.34Å; Y14-N79 HydrophobicContact CD2-CB 4.01Å; Y14-N79 HydrophobicContact CE2-CB 3.78Å; Y14-N79 VanDerWaalsContact CE2-CG 3.47Å; S77-N79 WeakPolarHBondContact CB-ND2 3.27Å; S77-N79 PolarHBondContact O-N 2.84Å
80	V	45.2	Very low	54.3	Low	11 Å²	11	75.2 Å²	75.2	7%	0.067	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.6	178	170	0	0	0	0	107.1	V11 R12 A13 Y14 L71 F73 V82	V11-V80 HydrophobicContact CG1-CB 4.31Å; V11-V80 HydrophobicContact CG1-CG2 3.51Å; R12-V80 PolarHBondContact O-N 3.49Å; A13-V80 CarbonylContact C-O 3.59Å; A13-V80 WeakPolarHBondContact CA-O 3.47Å; Y14-V80 PolarHBondContact N-O 3.4Å; L71-V80 HydrophobicContact CD2-CG1 3.37Å; F73-V80 HydrophobicContact CD2-CG2 4.05Å; F73-V80 HydrophobicContact CE2-CG2 4.23Å; V80-V82 HydrophobicContact CG1-CG2 4.18Å
81	V	46.7	Very low	56.2	Low	33 Å²	33	73.5 Å²	73.5	20%	0.2	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.5	175.9	-179	0	0	0	0	108.6	Y14 L16 F72 R83	Y14-V81 WeakPolarHBondContact O-CA 3.13Å; L16-V81 HydrophobicContact CD1-CG1 3.42Å; L16-V81 VanDerWaalsContact CD1-CG1 3.42Å; F72-V81 PolarHBondContact N-O 3.16Å; F72-V81 PolarHBondContact O-N 3.11Å; V81-R83 HydrophobicContact CG1-CG 4.42Å
82	V	49.7	Very low	58.1	Low	17 Å²	17	72.2 Å²	72.2	10%	0.103	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.8	-179.6	-157.5	0	0	0	0	108.7	Y14 Y15 L16 L69 L71 V80	Y14-V82 PolarHBondContact O-N 2.9Å; Y15-V82 HydrophobicContact CD2-CB 3.99Å; Y15-V82 HydrophobicContact CD2-CG1 4.33Å; Y15-V82 HydrophobicContact CE2-CB 4.38Å; Y15-V82 HydrophobicContact CE2-CG1 4.23Å; L16-V82 PolarHBondContact N-O 3.42Å; L69-V82 HydrophobicContact CB-CG1 3.56Å; L69-V82 HydrophobicContact CD1-CG1 3.88Å; L69-V82 HydrophobicContact CD2-CB 4.36Å; L69-V82 HydrophobicContact CD2-CG1 3.37Å; L69-V82 HydrophobicContact CG-CG1 3.75Å; L71-V82 HydrophobicContact CD2-CB 4.41Å; L71-V82 HydrophobicContact CD2-CG1 4.1Å; L71-V82 HydrophobicContact CD2-CG2 3.82Å; V80-V82 HydrophobicContact CG1-CG2 4.18Å
83	R	53.2	Low	60.1	Low	126 Å²	126	65.8 Å²	65.8	48%	0.475	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.4	-180	-79.4	-173.6	173.3	166.7	-0.6	112.2	L16 D18 L69 F70 V81	L16-R83 HydrophobicContact CB-CG 3.96Å; D18-R83 IonicContact OD2-NE 3.38Å; L69-R83 CarbonylContact C-O 3.16Å; L69-R83 VanDerWaalsContact CA-O 3.25Å; L69-R83 WeakPolarHBondContact CA-O 3.36Å; F70-R83 PolarHBondContact N-O 2.94Å; F70-R83 PolarHBondContact O-N 3.44Å; F70-R83 VanDerWaalsContact O-N 3.07Å; V81-R83 HydrophobicContact CG1-CG 4.42Å
84	T	64.9	Low	62.2	Low	19 Å²	19	62.3 Å²	62.3	12%	0.117	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	137.7	174.6	-27.5	0	0	0	0	111.3	N68 C88 R89	N68-T84 CarbonylContact O-C 3.42Å; N68-T84 VanDerWaalsContact O-CA 3.3Å; N68-T84 WeakPolarHBondContact O-CA 3.26Å; T84-C88 HydrophobicContact CG2-CB 4.02Å; T84-R89 HydrophobicContact CG2-CG 4.4Å
85	Q	66	Low	64.3	Low	59 Å²	59	65 Å²	65	28%	0.276	31%	0.309	S	S	.	.			trans	-59.8	145.9	174.5	-82.6	-178.5	14	0	0	111.6	S67 N68 F70 S87 C88 R89	S67-Q85 PolarHBondContact O-NE2 2.93Å; S67-Q85 PolarHBondContact O-OE1 3.09Å; N68-Q85 PolarHBondContact O-N 3.48Å; F70-Q85 HydrophobicContact CD2-CG 4.22Å; Q85-S87 PolarHBondContact O-N 2.65Å; Q85-C88 HydrophobicContact CB-CB 4.5Å; Q85-C88 WeakPolarHBondContact O-CB 3.27Å; Q85-C88 PolarHBondContact O-N 3.05Å; Q85-C88 VanDerWaalsContact O-N 3.16Å; Q85-R89 PolarHBondContact O-N 3.4Å; Q85-R89 VanDerWaalsContact O-N 3.07Å
86	L	72.6	Confident	66.2	Low	51 Å²	51	56.9 Å²	56.9	27%	0.267	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-45	-175.6	-168.7	67.8	0	0	0	112.2	C88 R89 V90 D121 L122 E125	L86-C88 VanDerWaalsContact C-N 3.34Å; L86-C88 PolarHBondContact O-N 3.22Å; L86-R89 WeakPolarHBondContact O-CB 3.4Å; L86-R89 PolarHBondContact O-N 3.01Å; L86-R89 VanDerWaalsContact O-N 3.13Å; L86-V90 PolarHBondContact O-N 2.7Å; L86-D121 HydrophobicContact CD1-CB 4.4Å; L86-D121 HydrophobicContact CD2-CB 3.68Å; L86-L122 HydrophobicContact CD1-CB 4.5Å; L86-L122 HydrophobicContact CD1-CD2 3.41Å; L86-L122 VanDerWaalsContact CD1-CD2 3.41Å; L86-L122 HydrophobicContact CD1-CG 3.77Å; L86-L122 HydrophobicContact CG-CD2 4.21Å; L86-E125 HydrophobicContact CB-CG 4.49Å; L86-E125 HydrophobicContact CD2-CB 4.41Å; L86-E125 HydrophobicContact CD2-CG 3.61Å; L86-E125 HydrophobicContact CG-CB 4.38Å; L86-E125 HydrophobicContact CG-CG 3.89Å
87	S	73.3	Confident	68.3	Low	37 Å²	37	49.2 Å²	49.2	26%	0.259	24%	0.239	S	C	.	.	H	α-helix	trans	-58.7	-42.7	175.9	57.6	0	0	0	0	112	Q85 R89 V90 H91	Q85-S87 PolarHBondContact O-N 2.65Å; S87-R89 VanDerWaalsContact C-N 3.34Å; S87-R89 PolarHBondContact O-N 3.45Å; S87-V90 PolarHBondContact O-N 3.32Å; S87-H91 PolarHBondContact O-N 2.66Å; S87-H91 PolarHBondContact O-ND1 2.98Å
88	C	72.6	Confident	70.3	Confident	23 Å²	23	50.1 Å²	50.1	16%	0.155	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-38.4	176.4	-58.1	0	0	0	0	112.2	N68 T84 Q85 L86 H91 T92	N68-C88 PolarHBondContact OD1-SG 3.46Å; T84-C88 HydrophobicContact CG2-CB 4.02Å; Q85-C88 HydrophobicContact CB-CB 4.5Å; Q85-C88 WeakPolarHBondContact O-CB 3.27Å; Q85-C88 PolarHBondContact O-N 3.05Å; Q85-C88 VanDerWaalsContact O-N 3.16Å; L86-C88 VanDerWaalsContact C-N 3.34Å; L86-C88 PolarHBondContact O-N 3.22Å; C88-H91 PolarHBondContact O-N 2.77Å; C88-T92 WeakPolarHBondContact O-CB 3.19Å; C88-T92 PolarHBondContact O-N 2.99Å; C88-T92 PolarHBondContact O-OG1 3Å
89	R	79.3	Confident	72.2	Confident	44 Å²	44	47.5 Å²	47.5	17%	0.166	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-44	175.4	-68.6	172	65.7	-151.9	-2.3	110.7	T84 Q85 L86 S87 T92 I93 D119 L122	T84-R89 HydrophobicContact CG2-CG 4.4Å; Q85-R89 PolarHBondContact O-N 3.4Å; Q85-R89 VanDerWaalsContact O-N 3.07Å; L86-R89 WeakPolarHBondContact O-CB 3.4Å; L86-R89 PolarHBondContact O-N 3.01Å; L86-R89 VanDerWaalsContact O-N 3.13Å; S87-R89 VanDerWaalsContact C-N 3.34Å; S87-R89 PolarHBondContact O-N 3.45Å; R89-T92 WeakPolarHBondContact O-CB 3.38Å; R89-T92 PolarHBondContact O-N 3.35Å; R89-I93 VanDerWaalsContact O-CG1 3.32Å; R89-I93 WeakPolarHBondContact O-CG1 3.44Å; R89-I93 PolarHBondContact O-N 3.48Å; R89-D119 IonicContact CZ-OD2 3.73Å; R89-D119 IonicContact NH1-OD2 3.99Å; R89-D119 PolarHBondContact NH1-OD2 2.94Å; R89-D119 IonicContact NH2-OD2 2.77Å; R89-D119 PolarHBondContact NH2-OD2 3.17Å; R89-D119 VanDerWaalsContact NH2-OD2 3.17Å; R89-L122 HydrophobicContact CB-CD2 4.02Å
90	V	83	Confident	74.1	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-47.1	175.8	168.3	0	0	0	0	112	L86 S87 T92 I93 I94 L122 E125 F126 N129	L86-V90 PolarHBondContact O-N 2.7Å; S87-V90 PolarHBondContact O-N 3.32Å; V90-T92 VanDerWaalsContact C-N 3.27Å; V90-T92 PolarHBondContact O-N 3.37Å; V90-I93 WeakPolarHBondContact O-CB 3.3Å; V90-I93 PolarHBondContact O-N 3.43Å; V90-I93 VanDerWaalsContact O-N 3.09Å; V90-I94 HydrophobicContact CG1-CD1 3.82Å; V90-I94 HydrophobicContact CG1-CG1 4.46Å; V90-I94 WeakPolarHBondContact O-CG1 3.5Å; V90-I94 PolarHBondContact O-N 2.74Å; V90-L122 HydrophobicContact CG2-CD2 3.67Å; V90-E125 HydrophobicContact CB-CB 4.46Å; V90-E125 HydrophobicContact CG2-CB 3.67Å; V90-F126 HydrophobicContact CG1-CB 4.25Å; V90-F126 HydrophobicContact CG1-CD2 4.24Å; V90-F126 HydrophobicContact CG2-CB 4.4Å; V90-N129 HydrophobicContact CG1-CB 4.1Å
91	H	80.5	Confident	75.9	Confident	98 Å²	98	51.4 Å²	51.4	45%	0.454	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-40.2	176.3	-76.5	78.4	0	0	0	111.8	S87 C88 I93 I94 E95 N129	S87-H91 PolarHBondContact O-N 2.66Å; S87-H91 PolarHBondContact O-ND1 2.98Å; C88-H91 PolarHBondContact O-N 2.77Å; H91-I93 VanDerWaalsContact C-N 3.33Å; H91-I93 PolarHBondContact O-N 3.15Å; H91-I94 PolarHBondContact O-N 3.31Å; H91-E95 VanDerWaalsContact O-CB 3.3Å; H91-E95 WeakPolarHBondContact O-CB 3.48Å; H91-E95 PolarHBondContact O-N 3.4Å; H91-N129 PolarHBondContact CE1-OD1 3.49Å
92	T	82.5	Confident	77.7	Confident	37 Å²	37	51.9 Å²	51.9	23%	0.227	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-39.2	175.6	-52.9	0	0	0	0	111.7	C88 R89 V90 K96	C88-T92 WeakPolarHBondContact O-CB 3.19Å; C88-T92 PolarHBondContact O-N 2.99Å; C88-T92 PolarHBondContact O-OG1 3Å; R89-T92 WeakPolarHBondContact O-CB 3.38Å; R89-T92 PolarHBondContact O-N 3.35Å; V90-T92 VanDerWaalsContact C-N 3.27Å; V90-T92 PolarHBondContact O-N 3.37Å; T92-K96 HydrophobicContact CG2-CD 4.3Å; T92-K96 VanDerWaalsContact O-CB 3.29Å; T92-K96 WeakPolarHBondContact O-CB 3.34Å; T92-K96 VanDerWaalsContact O-CG 3.31Å; T92-K96 WeakPolarHBondContact O-CG 3.39Å; T92-K96 PolarHBondContact O-N 3.17Å
93	I	85.3	Confident	79.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-49.6	175.1	-68.9	165.7	0	0	0	110.2	P21 F22 R89 V90 H91 K96 L97 L112 I115 L122 F126	P21-I93 HydrophobicContact CB-CD1 4.34Å; P21-I93 HydrophobicContact CB-CG1 4.23Å; P21-I93 HydrophobicContact CG-CD1 4.09Å; P21-I93 HydrophobicContact CG-CG1 3.5Å; P21-I93 VanDerWaalsContact CG-CG1 3.5Å; F22-I93 HydrophobicContact CE2-CG1 4.27Å; F22-I93 HydrophobicContact CZ-CG1 4.22Å; F22-I93 HydrophobicContact CZ-CG2 4.28Å; R89-I93 VanDerWaalsContact O-CG1 3.32Å; R89-I93 WeakPolarHBondContact O-CG1 3.44Å; R89-I93 PolarHBondContact O-N 3.48Å; V90-I93 WeakPolarHBondContact O-CB 3.3Å; V90-I93 PolarHBondContact O-N 3.43Å; V90-I93 VanDerWaalsContact O-N 3.09Å; H91-I93 VanDerWaalsContact C-N 3.33Å; H91-I93 PolarHBondContact O-N 3.15Å; I93-K96 PolarHBondContact O-N 3.27Å; I93-L97 HydrophobicContact CG2-CD1 3.81Å; I93-L97 HydrophobicContact CG2-CG 4.43Å; I93-L97 WeakPolarHBondContact O-CB 3.33Å; I93-L97 VanDerWaalsContact O-CG 3.28Å; I93-L97 WeakPolarHBondContact O-CG 3.45Å; I93-L97 PolarHBondContact O-N 2.96Å; I93-L112 HydrophobicContact CG2-CD1 3.78Å; I93-I115 HydrophobicContact CD1-CG2 4.08Å; I93-L122 HydrophobicContact CD1-CD1 4.35Å; I93-F126 HydrophobicContact CG2-CE2 4.15Å
94	I	85.6	Confident	80.7	Confident	23 Å²	23	60.2 Å²	60.2	12%	0.118	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-46.8	-178.7	-65.6	169.8	0	0	0	110.9	V90 H91 K96 L97 L98 F126 N129 C134	V90-I94 HydrophobicContact CG1-CD1 3.82Å; V90-I94 HydrophobicContact CG1-CG1 4.46Å; V90-I94 WeakPolarHBondContact O-CG1 3.5Å; V90-I94 PolarHBondContact O-N 2.74Å; H91-I94 PolarHBondContact O-N 3.31Å; I94-K96 VanDerWaalsContact C-N 3.35Å; I94-K96 PolarHBondContact O-N 3.44Å; I94-L97 PolarHBondContact O-N 3.49Å; I94-L98 HydrophobicContact CG2-CD1 4.08Å; I94-L98 WeakPolarHBondContact O-CG 3.29Å; I94-L98 PolarHBondContact O-N 2.95Å; I94-F126 HydrophobicContact CG1-CD2 4.26Å; I94-F126 HydrophobicContact CG1-CE2 3.95Å; I94-N129 HydrophobicContact CD1-CB 4.16Å; I94-N129 VanDerWaalsContact CD1-O 3.23Å; I94-N129 WeakPolarHBondContact CD1-O 3.46Å; I94-C134 HydrophobicContact CG2-CB 4.2Å
95	E	84.9	Confident	81.8	Confident	119 Å²	119	60.2 Å²	60.2	56%	0.556	31%	0.312	S	S	*	.	H	α-helix	trans	-60.6	-44.8	178.5	-173.2	-178.9	-179.1	0	0	111.3	H91 L98 N99	H91-E95 VanDerWaalsContact O-CB 3.3Å; H91-E95 WeakPolarHBondContact O-CB 3.48Å; H91-E95 PolarHBondContact O-N 3.4Å; E95-L98 PolarHBondContact O-N 2.89Å; E95-N99 VanDerWaalsContact CG-ND2 3.3Å; E95-N99 WeakPolarHBondContact CG-ND2 3.2Å; E95-N99 VanDerWaalsContact O-CB 3.3Å; E95-N99 WeakPolarHBondContact O-CB 3.28Å; E95-N99 PolarHBondContact O-N 3.44Å; E95-N99 PolarHBondContact O-ND2 3.47Å
96	K	85.2	Confident	82.7	Confident	59 Å²	59	62 Å²	62	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-65.2	-38.2	176.1	-77.7	-172.9	169.3	-148.4	0	112.6	D20 F22 T92 I93 I94 L98 S100 I108	D20-K96 IonicContact OD1-NZ 3.06Å; D20-K96 PolarHBondContact OD1-NZ 3.37Å; D20-K96 IonicContact OD2-NZ 3.05Å; D20-K96 PolarHBondContact OD2-NZ 3.18Å; F22-K96 HydrophobicContact CD2-CD 3.6Å; F22-K96 HydrophobicContact CE2-CB 4.15Å; F22-K96 HydrophobicContact CE2-CD 3.74Å; T92-K96 HydrophobicContact CG2-CD 4.3Å; T92-K96 VanDerWaalsContact O-CB 3.29Å; T92-K96 WeakPolarHBondContact O-CB 3.34Å; T92-K96 VanDerWaalsContact O-CG 3.31Å; T92-K96 WeakPolarHBondContact O-CG 3.39Å; T92-K96 PolarHBondContact O-N 3.17Å; I93-K96 PolarHBondContact O-N 3.27Å; I94-K96 VanDerWaalsContact C-N 3.35Å; I94-K96 PolarHBondContact O-N 3.44Å; K96-L98 VanDerWaalsContact C-N 3.33Å; K96-L98 PolarHBondContact O-N 2.69Å; K96-S100 WeakPolarHBondContact O-CB 3.22Å; K96-S100 PolarHBondContact O-N 3.03Å; K96-S100 PolarHBondContact O-OG 3.09Å; K96-I108 HydrophobicContact CB-CD1 4.01Å
97	L	87.7	Confident	83.3	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-39.3	176	-78.8	168	0	0	0	112.2	I93 I94 I108 L109 L112 F126 L135	I93-L97 HydrophobicContact CG2-CD1 3.81Å; I93-L97 HydrophobicContact CG2-CG 4.43Å; I93-L97 WeakPolarHBondContact O-CB 3.33Å; I93-L97 VanDerWaalsContact O-CG 3.28Å; I93-L97 WeakPolarHBondContact O-CG 3.45Å; I93-L97 PolarHBondContact O-N 2.96Å; I94-L97 PolarHBondContact O-N 3.49Å; L97-I108 HydrophobicContact CD2-CG2 3.46Å; L97-I108 VanDerWaalsContact CD2-CG2 3.46Å; L97-I108 HydrophobicContact CG-CG2 4.02Å; L97-L109 HydrophobicContact CD2-CD2 3.64Å; L97-L109 HydrophobicContact CD2-CG 4.48Å; L97-L112 HydrophobicContact CD1-CD2 4.19Å; L97-L112 HydrophobicContact CD2-CD2 4.32Å; L97-F126 HydrophobicContact CD1-CE2 4.42Å; L97-L135 HydrophobicContact CD1-CD2 4.22Å
98	L	85.7	Confident	84	Confident	79 Å²	79	64.8 Å²	64.8	41%	0.414	32%	0.318	S	S	.	.	H	α-helix	trans	-78.9	-33.8	-179	-68.8	174.2	0	0	0	113.5	I94 E95 K96 K137 V138	I94-L98 HydrophobicContact CG2-CD1 4.08Å; I94-L98 WeakPolarHBondContact O-CG 3.29Å; I94-L98 PolarHBondContact O-N 2.95Å; E95-L98 PolarHBondContact O-N 2.89Å; K96-L98 VanDerWaalsContact C-N 3.33Å; K96-L98 PolarHBondContact O-N 2.69Å; L98-K137 HydrophobicContact CD2-CD 4.14Å; L98-V138 HydrophobicContact CD2-CG2 4.42Å
99	N	86.2	Confident	84.7	Confident	114 Å²	114	63.8 Å²	63.8	61%	0.61	31%	0.311	S	S	*	.	H	α-helix	trans	-97.1	-17.1	-172.3	-66.6	-28.8	0	0	0	114	E95	E95-N99 VanDerWaalsContact CG-ND2 3.3Å; E95-N99 WeakPolarHBondContact CG-ND2 3.2Å; E95-N99 VanDerWaalsContact O-CB 3.3Å; E95-N99 WeakPolarHBondContact O-CB 3.28Å; E95-N99 PolarHBondContact O-N 3.44Å; E95-N99 PolarHBondContact O-ND2 3.47Å
100	S	85.8	Confident	85	Confident	25 Å²	25	68.4 Å²	68.4	18%	0.175	33%	0.333	C	S	.	.			trans	-84.3	143.3	-178.2	-56.1	0	0	0	0	112	K96 I108	K96-S100 WeakPolarHBondContact O-CB 3.22Å; K96-S100 PolarHBondContact O-N 3.03Å; K96-S100 PolarHBondContact O-OG 3.09Å; S100-I108 WeakPolarHBondContact OG-CD1 3.44Å
101	T	83.7	Confident	85.1	Confident	113 Å²	113	69.9 Å²	69.9	69%	0.693	34%	0.343	S	S	*	.			trans	-134.2	162.6	176.9	59.4	0	0	0	0	111.3	R103 D104	T101-R103 PolarHBondContact O-N 2.93Å; T101-D104 PolarHBondContact O-N 3.15Å
102	G	83.4	Confident	85.6	Confident	43 Å²	43	65.2 Å²	65.2	44%	0.443	32%	0.321	S	S	.	.	H	α-helix	trans	61.6	-129.6	175.2	0	0	0	0	0	114	D104 L105 R106 Y146	G102-D104 VanDerWaalsContact C-N 3.3Å; G102-D104 PolarHBondContact O-N 3.29Å; G102-L105 PolarHBondContact O-N 3.46Å; G102-R106 PolarHBondContact O-N 3.47Å; G102-Y146 PolarHBondContact O-OH 2.85Å
103	R	83.9	Confident	85.9	Confident	215 Å²	215	64.8 Å²	64.8	81%	0.811	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-34.8	-175.4	-174.5	-177.3	-70.3	178.8	-1.2	112.6	T101 R106 R107	T101-R103 PolarHBondContact O-N 2.93Å; R103-R106 WeakPolarHBondContact O-CB 3.37Å; R103-R106 PolarHBondContact O-N 3.43Å; R103-R107 PolarHBondContact O-N 3.09Å; R103-R107 VanDerWaalsContact O-N 3.07Å
104	D	83.4	Confident	86	Confident	104 Å²	104	69.2 Å²	69.2	56%	0.556	34%	0.337	S	S	*	.	H	α-helix	trans	-70.1	-43.3	-177.5	-67.6	-20.8	0	0	0	110.9	T101 G102 R106 R107 I108	T101-D104 PolarHBondContact O-N 3.15Å; G102-D104 VanDerWaalsContact C-N 3.3Å; G102-D104 PolarHBondContact O-N 3.29Å; D104-R106 VanDerWaalsContact C-N 3.29Å; D104-R106 PolarHBondContact O-N 2.93Å; D104-R107 PolarHBondContact O-N 3.37Å; D104-I108 WeakPolarHBondContact O-CG1 3.36Å; D104-I108 PolarHBondContact O-N 2.9Å
105	L	86.4	Confident	86	Confident	18 Å²	18	68.9 Å²	68.9	9%	0.094	34%	0.335	C	S	.	.	H	α-helix	trans	-58.4	-42.7	172.9	-177.5	60.7	0	0	0	111.4	G102 R107 I108 L109 V138 Y146	G102-L105 PolarHBondContact O-N 3.46Å; L105-R107 PolarHBondContact O-N 3.01Å; L105-I108 PolarHBondContact O-N 3.04Å; L105-L109 HydrophobicContact CD1-CD1 4.03Å; L105-L109 HydrophobicContact CD1-CG 3.97Å; L105-L109 HydrophobicContact CD2-CD1 4.47Å; L105-L109 HydrophobicContact CG-CD1 3.87Å; L105-L109 HydrophobicContact CG-CG 4.22Å; L105-L109 WeakPolarHBondContact O-CB 3.36Å; L105-L109 WeakPolarHBondContact O-CG 3.38Å; L105-L109 PolarHBondContact O-N 3.33Å; L105-V138 HydrophobicContact CD1-CG1 4.22Å; L105-V138 HydrophobicContact CD2-CG1 4.3Å; L105-Y146 HydrophobicContact CD2-CD2 4.06Å; L105-Y146 HydrophobicContact CD2-CE2 4.04Å
106	R	85.4	Confident	86.2	Confident	98 Å²	98	63.2 Å²	63.2	37%	0.37	31%	0.309	S	S	.	.	H	α-helix	trans	-59.2	-44.9	176.4	-170.3	175.4	-175.6	104.1	0.1	112.2	G102 R103 D104 F110 Y146 Y149	G102-R106 PolarHBondContact O-N 3.47Å; R103-R106 WeakPolarHBondContact O-CB 3.37Å; R103-R106 PolarHBondContact O-N 3.43Å; D104-R106 VanDerWaalsContact C-N 3.29Å; D104-R106 PolarHBondContact O-N 2.93Å; R106-F110 VanDerWaalsContact O-CB 3.22Å; R106-F110 WeakPolarHBondContact O-CB 3.49Å; R106-F110 PolarHBondContact O-N 3.08Å; R106-Y146 HydrophobicContact CB-CE1 3.58Å; R106-Y146 HydrophobicContact CG-CD1 4.48Å; R106-Y146 HydrophobicContact CG-CE1 3.74Å; R106-Y149 HydrophobicContact CG-CE2 4.11Å; R106-Y149 PolarHBondContact NH2-OH 3.19Å
107	R	86	Confident	86.3	Confident	136 Å²	136	63.2 Å²	63.2	51%	0.513	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-43.4	178.8	-179.5	-179.7	172.1	171.9	-2.4	111.3	F22 R103 D104 L105 S111	F22-R107 PolarHBondContact O-NH2 3.34Å; R103-R107 PolarHBondContact O-N 3.09Å; R103-R107 VanDerWaalsContact O-N 3.07Å; D104-R107 PolarHBondContact O-N 3.37Å; L105-R107 PolarHBondContact O-N 3.01Å; R107-S111 WeakPolarHBondContact O-CB 3.38Å; R107-S111 PolarHBondContact O-N 3.3Å; R107-S111 VanDerWaalsContact O-N 3.1Å; R107-S111 PolarHBondContact O-OG 3.46Å
108	I	87.2	Confident	86	Confident	10 Å²	10	68.8 Å²	68.8	5%	0.051	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-53.8	177.4	-75.1	161.8	0	0	0	110.4	F22 K96 L97 S100 D104 L105 F110 S111 L112	F22-I108 HydrophobicContact CD1-CB 4.32Å; F22-I108 HydrophobicContact CD1-CG1 4.03Å; F22-I108 HydrophobicContact CD1-CG2 4.43Å; F22-I108 HydrophobicContact CD2-CG1 4.15Å; F22-I108 HydrophobicContact CE1-CB 4.01Å; F22-I108 HydrophobicContact CE1-CG1 4.07Å; F22-I108 HydrophobicContact CE1-CG2 3.66Å; F22-I108 HydrophobicContact CE2-CG1 4.18Å; F22-I108 HydrophobicContact CE2-CG2 4.25Å; F22-I108 HydrophobicContact CG-CG1 4.08Å; F22-I108 HydrophobicContact CZ-CB 4.25Å; F22-I108 HydrophobicContact CZ-CG1 4.15Å; F22-I108 HydrophobicContact CZ-CG2 3.55Å; K96-I108 HydrophobicContact CB-CD1 4.01Å; L97-I108 HydrophobicContact CD2-CG2 3.46Å; L97-I108 VanDerWaalsContact CD2-CG2 3.46Å; L97-I108 HydrophobicContact CG-CG2 4.02Å; S100-I108 WeakPolarHBondContact OG-CD1 3.44Å; D104-I108 WeakPolarHBondContact O-CG1 3.36Å; D104-I108 PolarHBondContact O-N 2.9Å; L105-I108 PolarHBondContact O-N 3.04Å; I108-F110 VanDerWaalsContact C-N 3.33Å; I108-F110 PolarHBondContact O-N 3.21Å; I108-S111 PolarHBondContact O-N 3.32Å; I108-S111 VanDerWaalsContact O-N 3.16Å; I108-L112 PolarHBondContact O-N 2.98Å
109	L	88.2	Confident	85.9	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-62	-39.3	-179.2	-71.1	178.4	0	0	0	112.5	L97 L105 S111 L112 Y146 Y149 I150	L97-L109 HydrophobicContact CD2-CD2 3.64Å; L97-L109 HydrophobicContact CD2-CG 4.48Å; L105-L109 HydrophobicContact CD1-CD1 4.03Å; L105-L109 HydrophobicContact CD1-CG 3.97Å; L105-L109 HydrophobicContact CD2-CD1 4.47Å; L105-L109 HydrophobicContact CG-CD1 3.87Å; L105-L109 HydrophobicContact CG-CG 4.22Å; L105-L109 WeakPolarHBondContact O-CB 3.36Å; L105-L109 WeakPolarHBondContact O-CG 3.38Å; L105-L109 PolarHBondContact O-N 3.33Å; L109-S111 VanDerWaalsContact C-N 3.32Å; L109-S111 PolarHBondContact O-N 2.99Å; L109-L112 PolarHBondContact O-N 3.32Å; L109-Y146 HydrophobicContact CD1-CD1 4.14Å; L109-Y146 HydrophobicContact CD1-CD2 4.43Å; L109-Y146 HydrophobicContact CD1-CG 3.81Å; L109-Y149 HydrophobicContact CB-CD2 4.45Å; L109-I150 HydrophobicContact CD1-CD1 4.23Å; L109-I150 HydrophobicContact CD1-CG1 4.16Å; L109-I150 HydrophobicContact CD2-CD1 4.14Å; L109-I150 HydrophobicContact CD2-CG1 3.52Å; L109-I150 HydrophobicContact CG-CG1 4.44Å
110	F	85.4	Confident	85.7	Confident	140 Å²	140	67.6 Å²	67.6	61%	0.614	33%	0.327	S	S	*	.	H	α-helix	trans	-63.9	-38.3	176.7	-174.9	-95.4	0	0	0	112.3	R106 I108 Y149	R106-F110 VanDerWaalsContact O-CB 3.22Å; R106-F110 WeakPolarHBondContact O-CB 3.49Å; R106-F110 PolarHBondContact O-N 3.08Å; I108-F110 VanDerWaalsContact C-N 3.33Å; I108-F110 PolarHBondContact O-N 3.21Å; F110-Y149 HydrophobicContact CD2-CD1 4.3Å; F110-Y149 AromaticContact CD2-CE1 3.83Å; F110-Y149 HydrophobicContact CD2-CE1 3.83Å; F110-Y149 HydrophobicContact CE2-CE1 4.42Å
111	S	85.8	Confident	85.5	Confident	32 Å²	32	70.7 Å²	70.7	22%	0.224	34%	0.342	C	S	.	.	H	α-helix	trans	-80.1	-19.8	-179.1	-49.5	0	0	0	0	112.8	R107 I108 L109 K113 Q114 I115	R107-S111 WeakPolarHBondContact O-CB 3.38Å; R107-S111 PolarHBondContact O-N 3.3Å; R107-S111 VanDerWaalsContact O-N 3.1Å; R107-S111 PolarHBondContact O-OG 3.46Å; I108-S111 PolarHBondContact O-N 3.32Å; I108-S111 VanDerWaalsContact O-N 3.16Å; L109-S111 VanDerWaalsContact C-N 3.32Å; L109-S111 PolarHBondContact O-N 2.99Å; S111-K113 VanDerWaalsContact C-N 3.34Å; S111-K113 PolarHBondContact O-N 2.96Å; S111-Q114 WeakPolarHBondContact O-CB 3.29Å; S111-Q114 PolarHBondContact O-N 3.08Å; S111-I115 WeakPolarHBondContact O-CG1 3.34Å; S111-I115 PolarHBondContact O-N 2.88Å
112	L	89.7	Confident	85.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-38.5	-170.8	-167.2	65.6	0	0	0	113.1	I93 L97 I108 L109 Q114 I115 F116 L135 A153	I93-L112 HydrophobicContact CG2-CD1 3.78Å; L97-L112 HydrophobicContact CD1-CD2 4.19Å; L97-L112 HydrophobicContact CD2-CD2 4.32Å; I108-L112 PolarHBondContact O-N 2.98Å; L109-L112 PolarHBondContact O-N 3.32Å; L112-Q114 VanDerWaalsContact C-N 3.34Å; L112-Q114 PolarHBondContact O-N 3.32Å; L112-I115 PolarHBondContact O-N 3.04Å; L112-F116 HydrophobicContact CD1-CD2 4.5Å; L112-F116 HydrophobicContact CD1-CE2 3.82Å; L112-F116 HydrophobicContact CD1-CZ 3.92Å; L112-F116 HydrophobicContact CD2-CE2 4Å; L112-F116 HydrophobicContact CG-CD2 4.13Å; L112-F116 HydrophobicContact CG-CE2 3.59Å; L112-F116 HydrophobicContact CG-CZ 4.2Å; L112-F116 WeakPolarHBondContact O-CD2 3.38Å; L112-F116 PolarHBondContact O-N 3.29Å; L112-L135 HydrophobicContact CD2-CD2 3.67Å; L112-A153 HydrophobicContact CB-CB 4.13Å; L112-A153 HydrophobicContact CD2-CB 3.87Å; L112-A153 HydrophobicContact CG-CB 3.98Å
113	K	89.1	Confident	85.9	Confident	29 Å²	29	63.3 Å²	63.3	13%	0.126	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-49.5	172.9	-175.6	-162.4	172.1	-170	0	110.8	S111 I115 F116 Q117 R152 Q156 D1057	S111-K113 VanDerWaalsContact C-N 3.34Å; S111-K113 PolarHBondContact O-N 2.96Å; K113-I115 VanDerWaalsContact C-N 3.34Å; K113-I115 PolarHBondContact O-N 3.22Å; K113-F116 PolarHBondContact O-N 3.37Å; K113-Q117 PolarHBondContact O-N 3.01Å; K113-Q117 VanDerWaalsContact O-N 3.14Å; K113-R152 HydrophobicContact CD-CB 4.47Å; K113-Q156 HydrophobicContact CG-CB 4.14Å; K113-D1057 IonicContact NZ-OD1 2.94Å; K113-D1057 PolarHBondContact NZ-OD1 3.4Å
114	Q	87.7	Confident	86	Confident	92 Å²	92	56.2 Å²	56.2	43%	0.43	26%	0.264	S	S	.	.	H	α-helix	trans	-64.7	-39.2	-177.8	-169.3	65.2	47.1	0	0	111.5	S111 L112 F116 Q117 D118	S111-Q114 WeakPolarHBondContact O-CB 3.29Å; S111-Q114 PolarHBondContact O-N 3.08Å; L112-Q114 VanDerWaalsContact C-N 3.34Å; L112-Q114 PolarHBondContact O-N 3.32Å; Q114-F116 PolarHBondContact O-N 3.32Å; Q114-Q117 WeakPolarHBondContact O-CB 3.45Å; Q114-Q117 PolarHBondContact O-N 3.22Å; Q114-Q117 VanDerWaalsContact O-N 3.1Å; Q114-D118 PolarHBondContact NE2-OD1 3.41Å; Q114-D118 WeakPolarHBondContact O-CB 3.27Å; Q114-D118 VanDerWaalsContact O-CG 3.27Å; Q114-D118 PolarHBondContact O-N 3.23Å
115	I	85.1	Confident	86.1	Confident	16 Å²	16	53.5 Å²	53.5	8%	0.082	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-45.6	179.4	-68.6	166.3	0	0	0	111.5	P21 F22 I93 S111 L112 K113 Q117 D118 D119 L122	P21-I115 HydrophobicContact CB-CD1 4.41Å; F22-I115 HydrophobicContact CD1-CD1 3.57Å; F22-I115 HydrophobicContact CE1-CD1 3.33Å; F22-I115 HydrophobicContact CG-CD1 4.44Å; F22-I115 HydrophobicContact CZ-CD1 4.05Å; I93-I115 HydrophobicContact CD1-CG2 4.08Å; S111-I115 WeakPolarHBondContact O-CG1 3.34Å; S111-I115 PolarHBondContact O-N 2.88Å; L112-I115 PolarHBondContact O-N 3.04Å; K113-I115 VanDerWaalsContact C-N 3.34Å; K113-I115 PolarHBondContact O-N 3.22Å; I115-Q117 VanDerWaalsContact C-N 3.26Å; I115-Q117 PolarHBondContact O-N 3.33Å; I115-D118 PolarHBondContact O-N 2.89Å; I115-D119 PolarHBondContact O-N 3.09Å; I115-L122 HydrophobicContact CG2-CD1 3.53Å
116	F	89.2	Confident	86.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-70.8	-22.2	176.2	-65.8	-44.8	0	0	0	113.3	L112 K113 Q114 L122 V123 F126 A153 Q156 V157 Y160	L112-F116 HydrophobicContact CD1-CD2 4.5Å; L112-F116 HydrophobicContact CD1-CE2 3.82Å; L112-F116 HydrophobicContact CD1-CZ 3.92Å; L112-F116 HydrophobicContact CD2-CE2 4Å; L112-F116 HydrophobicContact CG-CD2 4.13Å; L112-F116 HydrophobicContact CG-CE2 3.59Å; L112-F116 HydrophobicContact CG-CZ 4.2Å; L112-F116 WeakPolarHBondContact O-CD2 3.38Å; L112-F116 PolarHBondContact O-N 3.29Å; K113-F116 PolarHBondContact O-N 3.37Å; Q114-F116 PolarHBondContact O-N 3.32Å; F116-L122 HydrophobicContact CD1-CB 4.48Å; F116-V123 HydrophobicContact CB-CG2 3.92Å; F116-V123 HydrophobicContact CD1-CG2 3.82Å; F116-V123 HydrophobicContact CG-CG2 4.13Å; F116-F126 HydrophobicContact CE1-CB 3.94Å; F116-F126 HydrophobicContact CE1-CD1 4.07Å; F116-F126 HydrophobicContact CE1-CD2 4.01Å; F116-F126 AromaticContact CE1-CG 3.74Å; F116-F126 HydrophobicContact CE1-CG 3.74Å; F116-F126 HydrophobicContact CE2-CE1 4.38Å; F116-F126 HydrophobicContact CZ-CB 4.35Å; F116-F126 AromaticContact CZ-CD1 3.64Å; F116-F126 HydrophobicContact CZ-CD1 3.64Å; F116-F126 AromaticContact CZ-CD2 3.76Å; F116-F126 HydrophobicContact CZ-CD2 3.76Å; F116-F126 AromaticContact CZ-CE1 3.75Å; F116-F126 HydrophobicContact CZ-CE1 3.75Å; F116-F126 AromaticContact CZ-CE2 3.88Å; F116-F126 HydrophobicContact CZ-CE2 3.88Å; F116-F126 AromaticContact CZ-CG 3.64Å; F116-F126 HydrophobicContact CZ-CG 3.64Å; F116-F126 AromaticContact CZ-CZ 3.86Å; F116-F126 HydrophobicContact CZ-CZ 3.86Å; F116-A153 HydrophobicContact CD2-CB 4.48Å; F116-Q156 HydrophobicContact CB-CG 3.94Å; F116-V157 HydrophobicContact CD2-CG2 3.59Å; F116-V157 HydrophobicContact CE2-CG2 3.69Å; F116-V157 HydrophobicContact CG-CG2 4.04Å; F116-V157 HydrophobicContact CZ-CG2 4.24Å; F116-Y160 VanDerWaalsContact O-CE2 3.26Å; F116-Y160 WeakPolarHBondContact O-CE2 3.44Å; F116-Y160 PolarHBondContact O-OH 3.19Å
117	Q	87.2	Confident	86.6	Confident	59 Å²	59	49.4 Å²	49.4	28%	0.276	23%	0.234	S	C	.	.	H	α-helix	trans	-77.7	-40.4	175	-172.4	174.1	-1.1	0	0	111.8	K113 Q114 I115 Q156 Y160	K113-Q117 PolarHBondContact O-N 3.01Å; K113-Q117 VanDerWaalsContact O-N 3.14Å; Q114-Q117 WeakPolarHBondContact O-CB 3.45Å; Q114-Q117 PolarHBondContact O-N 3.22Å; Q114-Q117 VanDerWaalsContact O-N 3.1Å; I115-Q117 VanDerWaalsContact C-N 3.26Å; I115-Q117 PolarHBondContact O-N 3.33Å; Q117-Q156 HydrophobicContact CB-CG 4.23Å; Q117-Y160 PolarHBondContact O-OH 3.47Å
118	D	81.7	Confident	86.7	Confident	119 Å²	119	48.6 Å²	48.6	64%	0.636	24%	0.237	S	C	*	.	H	α-helix	trans	-74.7	-29.4	-176.8	-69.2	-14.5	0	0	0	112.5	Q114 I115	Q114-D118 PolarHBondContact NE2-OD1 3.41Å; Q114-D118 WeakPolarHBondContact O-CB 3.27Å; Q114-D118 VanDerWaalsContact O-CG 3.27Å; Q114-D118 PolarHBondContact O-N 3.23Å; I115-D118 PolarHBondContact O-N 2.89Å
119	D	82.8	Confident	86.6	Confident	34 Å²	34	50.5 Å²	50.5	18%	0.182	25%	0.247	C	C	.	.			trans	-136.4	92.1	-174.6	-166.9	-17.7	0	0	0	111.1	R89 I115 D121 L122	R89-D119 IonicContact CZ-OD2 3.73Å; R89-D119 IonicContact NH1-OD2 3.99Å; R89-D119 PolarHBondContact NH1-OD2 2.94Å; R89-D119 IonicContact NH2-OD2 2.77Å; R89-D119 PolarHBondContact NH2-OD2 3.17Å; R89-D119 VanDerWaalsContact NH2-OD2 3.17Å; I115-D119 PolarHBondContact O-N 3.09Å; D119-D121 PolarHBondContact O-N 3.44Å; D119-D121 PolarHBondContact OD1-N 2.98Å; D119-L122 HydrophobicContact CB-CB 4.48Å; D119-L122 HydrophobicContact CB-CD1 3.79Å; D119-L122 HydrophobicContact CB-CG 3.98Å; D119-L122 WeakPolarHBondContact O-CB 3.43Å; D119-L122 PolarHBondContact O-N 3.48Å
120	K	81.9	Confident	86.6	Confident	135 Å²	135	56 Å²	56	59%	0.587	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.9	-179.6	68.7	-179.8	-175.7	174.6	0	113.1	L122 V123 Y160	K120-L122 VanDerWaalsContact C-N 3.25Å; K120-L122 PolarHBondContact O-N 2.97Å; K120-V123 WeakPolarHBondContact O-CB 3.39Å; K120-V123 PolarHBondContact O-N 3.33Å; K120-V123 VanDerWaalsContact O-N 3.14Å; K120-Y160 HydrophobicContact CB-CD1 4.18Å; K120-Y160 HydrophobicContact CB-CE1 3.67Å
121	D	82.8	Confident	86.8	Confident	90 Å²	90	49.3 Å²	49.3	48%	0.481	25%	0.247	S	C	.	.	H	α-helix	trans	-71.8	-27.2	-175.4	-60.9	-25.3	0	0	0	110	L86 D119 V123 H124 E125	L86-D121 HydrophobicContact CD1-CB 4.4Å; L86-D121 HydrophobicContact CD2-CB 3.68Å; D119-D121 PolarHBondContact O-N 3.44Å; D119-D121 PolarHBondContact OD1-N 2.98Å; D121-V123 PolarHBondContact O-N 3.2Å; D121-H124 PolarHBondContact O-N 2.87Å; D121-E125 PolarHBondContact O-N 3.17Å
122	L	84.9	Confident	87.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-31.1	172.2	-76	176.3	0	0	0	112.5	L86 R89 V90 I93 I115 F116 D119 K120 F126	L86-L122 HydrophobicContact CD1-CB 4.5Å; L86-L122 HydrophobicContact CD1-CD2 3.41Å; L86-L122 VanDerWaalsContact CD1-CD2 3.41Å; L86-L122 HydrophobicContact CD1-CG 3.77Å; L86-L122 HydrophobicContact CG-CD2 4.21Å; R89-L122 HydrophobicContact CB-CD2 4.02Å; V90-L122 HydrophobicContact CG2-CD2 3.67Å; I93-L122 HydrophobicContact CD1-CD1 4.35Å; I115-L122 HydrophobicContact CG2-CD1 3.53Å; F116-L122 HydrophobicContact CD1-CB 4.48Å; D119-L122 HydrophobicContact CB-CB 4.48Å; D119-L122 HydrophobicContact CB-CD1 3.79Å; D119-L122 HydrophobicContact CB-CG 3.98Å; D119-L122 WeakPolarHBondContact O-CB 3.43Å; D119-L122 PolarHBondContact O-N 3.48Å; K120-L122 VanDerWaalsContact C-N 3.25Å; K120-L122 PolarHBondContact O-N 2.97Å; L122-F126 WeakPolarHBondContact O-CB 3.33Å; L122-F126 PolarHBondContact O-N 2.93Å
123	V	89.7	Confident	87.3	Confident	1 Å²	1	50 Å²	50	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-44.9	-175.8	179.2	0	0	0	0	110.9	F116 K120 D121 F126 V127 V157 Y160	F116-V123 HydrophobicContact CB-CG2 3.92Å; F116-V123 HydrophobicContact CD1-CG2 3.82Å; F116-V123 HydrophobicContact CG-CG2 4.13Å; K120-V123 WeakPolarHBondContact O-CB 3.39Å; K120-V123 PolarHBondContact O-N 3.33Å; K120-V123 VanDerWaalsContact O-N 3.14Å; D121-V123 PolarHBondContact O-N 3.2Å; V123-F126 PolarHBondContact O-N 3.5Å; V123-V127 WeakPolarHBondContact O-CG2 3.39Å; V123-V127 PolarHBondContact O-N 3.07Å; V123-V157 HydrophobicContact CG1-CB 4.36Å; V123-V157 HydrophobicContact CG1-CG1 3.9Å; V123-V157 HydrophobicContact CG1-CG2 4.36Å; V123-Y160 HydrophobicContact CB-CD2 4.22Å; V123-Y160 HydrophobicContact CG1-CD2 4.13Å; V123-Y160 HydrophobicContact CG2-CD2 3.67Å; V123-Y160 HydrophobicContact CG2-CE2 3.78Å; V123-Y160 HydrophobicContact CG2-CG 4.45Å
124	H	87.6	Confident	87.4	Confident	65 Å²	65	49 Å²	49	30%	0.301	25%	0.25	S	C	.	.	H	α-helix	trans	-60.2	-51	177.2	172.3	-92.9	0	0	0	111.4	D121 F126 V127 Q128 D162	D121-H124 PolarHBondContact O-N 2.87Å; H124-F126 VanDerWaalsContact C-N 3.34Å; H124-F126 PolarHBondContact O-N 2.6Å; H124-V127 PolarHBondContact O-N 3.31Å; H124-Q128 PolarHBondContact CE1-NE2 2.98Å; H124-Q128 PolarHBondContact NE2-NE2 3.35Å; H124-Q128 WeakPolarHBondContact O-CG 3.44Å; H124-Q128 PolarHBondContact O-N 3.13Å; H124-Q128 VanDerWaalsContact O-N 3.12Å; H124-D162 HydrophobicContact CB-CB 4.01Å; H124-D162 IonicContact CD2-OD1 3.99Å; H124-D162 IonicContact CD2-OD2 3.93Å
125	E	85.1	Confident	87.7	Confident	48 Å²	48	44.8 Å²	44.8	22%	0.224	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-36.1	177.4	-77	-70	154.7	0	0	112.4	L86 V90 D121 Q128 N129	L86-E125 HydrophobicContact CB-CG 4.49Å; L86-E125 HydrophobicContact CD2-CB 4.41Å; L86-E125 HydrophobicContact CD2-CG 3.61Å; L86-E125 HydrophobicContact CG-CB 4.38Å; L86-E125 HydrophobicContact CG-CG 3.89Å; V90-E125 HydrophobicContact CB-CB 4.46Å; V90-E125 HydrophobicContact CG2-CB 3.67Å; D121-E125 PolarHBondContact O-N 3.17Å; E125-Q128 PolarHBondContact O-N 2.64Å; E125-N129 PolarHBondContact O-N 3.23Å; E125-N129 VanDerWaalsContact O-N 3.1Å; E125-N129 PolarHBondContact O-ND2 2.84Å; E125-N129 PolarHBondContact OE2-ND2 3.29Å
126	F	91	Very high	88	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-42.3	178.1	-177.9	-97.7	0	0	0	112.3	V90 I93 I94 L97 F116 L122 V123 H124 G131 L135	V90-F126 HydrophobicContact CG1-CB 4.25Å; V90-F126 HydrophobicContact CG1-CD2 4.24Å; V90-F126 HydrophobicContact CG2-CB 4.4Å; I93-F126 HydrophobicContact CG2-CE2 4.15Å; I94-F126 HydrophobicContact CG1-CD2 4.26Å; I94-F126 HydrophobicContact CG1-CE2 3.95Å; L97-F126 HydrophobicContact CD1-CE2 4.42Å; F116-F126 HydrophobicContact CE1-CB 3.94Å; F116-F126 HydrophobicContact CE1-CD1 4.07Å; F116-F126 HydrophobicContact CE1-CD2 4.01Å; F116-F126 AromaticContact CE1-CG 3.74Å; F116-F126 HydrophobicContact CE1-CG 3.74Å; F116-F126 HydrophobicContact CE2-CE1 4.38Å; F116-F126 HydrophobicContact CZ-CB 4.35Å; F116-F126 AromaticContact CZ-CD1 3.64Å; F116-F126 HydrophobicContact CZ-CD1 3.64Å; F116-F126 AromaticContact CZ-CD2 3.76Å; F116-F126 HydrophobicContact CZ-CD2 3.76Å; F116-F126 AromaticContact CZ-CE1 3.75Å; F116-F126 HydrophobicContact CZ-CE1 3.75Å; F116-F126 AromaticContact CZ-CE2 3.88Å; F116-F126 HydrophobicContact CZ-CE2 3.88Å; F116-F126 AromaticContact CZ-CG 3.64Å; F116-F126 HydrophobicContact CZ-CG 3.64Å; F116-F126 AromaticContact CZ-CZ 3.86Å; F116-F126 HydrophobicContact CZ-CZ 3.86Å; L122-F126 WeakPolarHBondContact O-CB 3.33Å; L122-F126 PolarHBondContact O-N 2.93Å; V123-F126 PolarHBondContact O-N 3.5Å; H124-F126 VanDerWaalsContact C-N 3.34Å; H124-F126 PolarHBondContact O-N 2.6Å; F126-G131 WeakPolarHBondContact CE1-O 3.5Å; F126-G131 VanDerWaalsContact CZ-CA 3.42Å; F126-G131 WeakPolarHBondContact CZ-O 3.45Å; F126-G131 VanDerWaalsContact O-CA 3.24Å; F126-G131 WeakPolarHBondContact O-CA 3.28Å; F126-G131 PolarHBondContact O-N 3.36Å; F126-L135 HydrophobicContact CE1-CD1 3.81Å; F126-L135 HydrophobicContact CE1-CG 4.19Å; F126-L135 HydrophobicContact CZ-CD1 3.99Å; F126-L135 HydrophobicContact CZ-CD2 4.36Å; F126-L135 HydrophobicContact CZ-CG 3.9Å
127	V	91.4	Very high	88.1	Confident	29 Å²	29	51.3 Å²	51.3	18%	0.176	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-43.5	174.7	168.7	0	0	0	0	111.3	V123 H124 N129 D130 L132 V157	V123-V127 WeakPolarHBondContact O-CG2 3.39Å; V123-V127 PolarHBondContact O-N 3.07Å; H124-V127 PolarHBondContact O-N 3.31Å; V127-N129 VanDerWaalsContact C-N 3.29Å; V127-N129 PolarHBondContact O-N 3.41Å; V127-D130 PolarHBondContact O-N 3.44Å; V127-L132 HydrophobicContact CG2-CD1 4.31Å; V127-L132 HydrophobicContact CG2-CG 4.37Å; V127-V157 HydrophobicContact CG2-CG1 4.41Å
128	Q	86.9	Confident	88.3	Confident	120 Å²	120	49.3 Å²	49.3	56%	0.561	25%	0.251	S	S	*	.	H	α-helix	trans	-67.2	-26	-177.8	-74.1	-168.8	-7.8	0	0	114.2	H124 E125	H124-Q128 PolarHBondContact CE1-NE2 2.98Å; H124-Q128 PolarHBondContact NE2-NE2 3.35Å; H124-Q128 WeakPolarHBondContact O-CG 3.44Å; H124-Q128 PolarHBondContact O-N 3.13Å; H124-Q128 VanDerWaalsContact O-N 3.12Å; E125-Q128 PolarHBondContact O-N 2.64Å
129	N	85.8	Confident	88.7	Confident	49 Å²	49	43.6 Å²	43.6	26%	0.262	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	35.4	-179.1	-67.6	-84.7	0	0	0	112.6	V90 H91 I94 E125 V127 G131	V90-N129 HydrophobicContact CG1-CB 4.1Å; H91-N129 PolarHBondContact CE1-OD1 3.49Å; I94-N129 HydrophobicContact CD1-CB 4.16Å; I94-N129 VanDerWaalsContact CD1-O 3.23Å; I94-N129 WeakPolarHBondContact CD1-O 3.46Å; E125-N129 PolarHBondContact O-N 3.23Å; E125-N129 VanDerWaalsContact O-N 3.1Å; E125-N129 PolarHBondContact O-ND2 2.84Å; E125-N129 PolarHBondContact OE2-ND2 3.29Å; V127-N129 VanDerWaalsContact C-N 3.29Å; V127-N129 PolarHBondContact O-N 3.41Å; N129-G131 PolarHBondContact O-N 3.25Å; N129-G131 VanDerWaalsContact O-N 3.14Å
130	D	87.7	Confident	89	Confident	118 Å²	118	45.2 Å²	45.2	63%	0.631	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	26	178.3	-65.6	-39	0	0	0	115.1	V127 L132 A133 C134	V127-D130 PolarHBondContact O-N 3.44Å; D130-L132 VanDerWaalsContact C-N 3.27Å; D130-L132 PolarHBondContact O-N 2.85Å; D130-A133 HydrophobicContact CB-CB 4.43Å; D130-A133 PolarHBondContact O-N 3.15Å; D130-C134 PolarHBondContact O-N 3.24Å
131	G	90.6	Very high	89.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-32.8	179.4	0	0	0	0	0	113.4	F126 N129 C134 L135	F126-G131 WeakPolarHBondContact CE1-O 3.5Å; F126-G131 VanDerWaalsContact CZ-CA 3.42Å; F126-G131 WeakPolarHBondContact CZ-O 3.45Å; F126-G131 VanDerWaalsContact O-CA 3.24Å; F126-G131 WeakPolarHBondContact O-CA 3.28Å; F126-G131 PolarHBondContact O-N 3.36Å; N129-G131 PolarHBondContact O-N 3.25Å; N129-G131 VanDerWaalsContact O-N 3.14Å; G131-C134 WeakPolarHBondContact O-CB 3.31Å; G131-C134 PolarHBondContact O-N 3.49Å; G131-L135 PolarHBondContact O-N 3Å
132	L	93.1	Very high	89.4	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-43.6	175.6	-64.8	-179.6	0	0	0	111.9	V127 D130 C134 L135 I136 L154 V157 V167 H170	V127-L132 HydrophobicContact CG2-CD1 4.31Å; V127-L132 HydrophobicContact CG2-CG 4.37Å; D130-L132 VanDerWaalsContact C-N 3.27Å; D130-L132 PolarHBondContact O-N 2.85Å; L132-C134 VanDerWaalsContact C-N 3.25Å; L132-C134 PolarHBondContact O-N 3.4Å; L132-L135 PolarHBondContact O-N 2.88Å; L132-L135 VanDerWaalsContact O-N 3.13Å; L132-I136 WeakPolarHBondContact O-CG1 3.43Å; L132-I136 PolarHBondContact O-N 3.01Å; L132-I136 VanDerWaalsContact O-N 3.09Å; L132-L154 HydrophobicContact CD2-CD1 3.85Å; L132-V157 HydrophobicContact CD2-CG1 4.35Å; L132-V167 HydrophobicContact CD1-CG2 4Å; L132-V167 HydrophobicContact CD2-CG2 4.39Å; L132-H170 HydrophobicContact CD1-CB 4.1Å
133	A	92.7	Very high	89.6	Confident	39 Å²	39	46.6 Å²	46.6	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-60.7	-38.3	175.5	0	0	0	0	0	111.4	D130 I136 K137	D130-A133 HydrophobicContact CB-CB 4.43Å; D130-A133 PolarHBondContact O-N 3.15Å; A133-I136 PolarHBondContact O-N 3.3Å; A133-K137 WeakPolarHBondContact O-CB 3.43Å; A133-K137 PolarHBondContact O-N 2.84Å
134	C	91.1	Very high	89.7	Confident	8 Å²	8	50.3 Å²	50.3	5%	0.054	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-46.5	173	-179.8	0	0	0	0	112.1	I94 D130 G131 L132 I136 K137 V138	I94-C134 HydrophobicContact CG2-CB 4.2Å; D130-C134 PolarHBondContact O-N 3.24Å; G131-C134 WeakPolarHBondContact O-CB 3.31Å; G131-C134 PolarHBondContact O-N 3.49Å; L132-C134 VanDerWaalsContact C-N 3.25Å; L132-C134 PolarHBondContact O-N 3.4Å; C134-I136 PolarHBondContact O-N 2.95Å; C134-K137 PolarHBondContact O-N 3.17Å; C134-V138 WeakPolarHBondContact O-CG2 3.45Å; C134-V138 PolarHBondContact O-N 2.69Å
135	L	92.9	Very high	89.7	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-42.7	178.9	-71	179.4	0	0	0	112.6	L97 L112 F126 G131 L132 G139 I150	L97-L135 HydrophobicContact CD1-CD2 4.22Å; L112-L135 HydrophobicContact CD2-CD2 3.67Å; F126-L135 HydrophobicContact CE1-CD1 3.81Å; F126-L135 HydrophobicContact CE1-CG 4.19Å; F126-L135 HydrophobicContact CZ-CD1 3.99Å; F126-L135 HydrophobicContact CZ-CD2 4.36Å; F126-L135 HydrophobicContact CZ-CG 3.9Å; G131-L135 PolarHBondContact O-N 3Å; L132-L135 PolarHBondContact O-N 2.88Å; L132-L135 VanDerWaalsContact O-N 3.13Å; L135-G139 PolarHBondContact O-N 2.75Å; L135-I150 HydrophobicContact CB-CG2 4.05Å; L135-I150 HydrophobicContact CD2-CG2 4.25Å
136	I	92.2	Very high	90	Very high	26 Å²	26	49.7 Å²	49.7	13%	0.133	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-45.2	177.7	-61.9	169.1	0	0	0	110.4	L132 A133 C134 V138 G139 A140 E172 T173 W176	L132-I136 WeakPolarHBondContact O-CG1 3.43Å; L132-I136 PolarHBondContact O-N 3.01Å; L132-I136 VanDerWaalsContact O-N 3.09Å; A133-I136 PolarHBondContact O-N 3.3Å; C134-I136 PolarHBondContact O-N 2.95Å; I136-V138 VanDerWaalsContact C-N 3.33Å; I136-V138 PolarHBondContact O-N 3.39Å; I136-G139 PolarHBondContact O-N 2.9Å; I136-A140 VanDerWaalsContact O-CB 3.31Å; I136-A140 WeakPolarHBondContact O-CB 3.13Å; I136-A140 PolarHBondContact O-N 3.42Å; I136-E172 HydrophobicContact CD1-CB 4.01Å; I136-T173 VanDerWaalsContact CD1-CA 3.43Å; I136-W176 HydrophobicContact CG1-CB 4.33Å; I136-W176 HydrophobicContact CG1-CD2 4.31Å; I136-W176 HydrophobicContact CG1-CE3 4.12Å; I136-W176 HydrophobicContact CG1-CG 4.42Å; I136-W176 HydrophobicContact CG2-CB 3.95Å; I136-W176 HydrophobicContact CG2-CD2 4.28Å; I136-W176 HydrophobicContact CG2-CG 3.83Å
137	K	90.9	Very high	90.1	Very high	128 Å²	128	50.8 Å²	50.8	56%	0.557	27%	0.27	S	S	*	.	H	α-helix	trans	-59.6	-44.6	-179.7	-175	178	178.2	-177.8	0	111.6	L98 A133 C134	L98-K137 HydrophobicContact CD2-CD 4.14Å; A133-K137 WeakPolarHBondContact O-CB 3.43Å; A133-K137 PolarHBondContact O-N 2.84Å; C134-K137 PolarHBondContact O-N 3.17Å
138	V	90.8	Very high	90.1	Very high	16 Å²	16	50.6 Å²	50.6	10%	0.097	27%	0.267	C	S	.	.	H	α-helix	trans	-66.9	-45.8	174.9	178.2	0	0	0	0	110	L98 L105 C134 I136 A140 Q141 A142 I150	L98-V138 HydrophobicContact CD2-CG2 4.42Å; L105-V138 HydrophobicContact CD1-CG1 4.22Å; L105-V138 HydrophobicContact CD2-CG1 4.3Å; C134-V138 WeakPolarHBondContact O-CG2 3.45Å; C134-V138 PolarHBondContact O-N 2.69Å; I136-V138 VanDerWaalsContact C-N 3.33Å; I136-V138 PolarHBondContact O-N 3.39Å; V138-A140 PolarHBondContact O-N 2.97Å; V138-Q141 PolarHBondContact O-N 3.37Å; V138-A142 WeakPolarHBondContact O-CB 3.47Å; V138-A142 PolarHBondContact O-N 3.42Å; V138-I150 HydrophobicContact CB-CD1 4.34Å; V138-I150 HydrophobicContact CG1-CD1 3.98Å
139	G	90.2	Very high	90.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-35.7	-177.8	0	0	0	0	0	114.7	L135 I136 Q141 A142 Q147 I150	L135-G139 PolarHBondContact O-N 2.75Å; I136-G139 PolarHBondContact O-N 2.9Å; G139-Q141 VanDerWaalsContact C-N 3.28Å; G139-Q141 PolarHBondContact O-N 3.44Å; G139-A142 PolarHBondContact O-N 3.22Å; G139-Q147 WeakPolarHBondContact O-CG 3.39Å; G139-Q147 PolarHBondContact O-NE2 3.45Å; G139-I150 VanDerWaalsContact CA-CD1 3.47Å
140	A	89.1	Confident	90.7	Very high	67 Å²	67	44.6 Å²	44.6	55%	0.554	24%	0.236	S	C	*	.	H	α-helix	trans	-68.2	-27	177.1	0	0	0	0	0	112.8	I136 V138	I136-A140 VanDerWaalsContact O-CB 3.31Å; I136-A140 WeakPolarHBondContact O-CB 3.13Å; I136-A140 PolarHBondContact O-N 3.42Å; V138-A140 PolarHBondContact O-N 2.97Å
141	Q	87	Confident	91	Very high	166 Å²	166	39 Å²	39	78%	0.776	21%	0.206	S	C	*	.	H	α-helix	trans	-99.4	-4.3	178.5	-60.5	179.6	9.3	0	0	112.8	V138 G139	V138-Q141 PolarHBondContact O-N 3.37Å; G139-Q141 VanDerWaalsContact C-N 3.28Å; G139-Q141 PolarHBondContact O-N 3.44Å
142	A	87.8	Confident	91.1	Very high	18 Å²	18	42.9 Å²	42.9	15%	0.149	22%	0.221	C	C	.	.	S	Bend	trans	-90.4	158	-170.4	0	0	0	0	0	113.2	V138 G139 Y146 Q147	V138-A142 WeakPolarHBondContact O-CB 3.47Å; V138-A142 PolarHBondContact O-N 3.42Å; G139-A142 PolarHBondContact O-N 3.22Å; A142-Y146 HydrophobicContact CB-CD2 4.3Å; A142-Q147 HydrophobicContact CB-CG 4.22Å; A142-Q147 PolarHBondContact O-NE2 2.87Å
143	D	88.8	Confident	91.1	Very high	70 Å²	70	42.6 Å²	42.6	37%	0.374	22%	0.219	S	C	.	.			trans	-73.5	172.2	170.5	79.2	-0.7	0	0	0	111.9	N145 Y146 Q147	D143-N145 PolarHBondContact O-N 2.74Å; D143-N145 VanDerWaalsContact O-N 3.15Å; D143-N145 WeakPolarHBondContact OD1-CB 3.44Å; D143-N145 PolarHBondContact OD1-N 3.34Å; D143-N145 PolarHBondContact OD2-ND2 3.42Å; D143-Y146 PolarHBondContact O-N 2.59Å; D143-Y146 WeakPolarHBondContact OD1-CB 3.23Å; D143-Y146 VanDerWaalsContact OD1-CG 3.26Å; D143-Y146 PolarHBondContact OD1-N 2.85Å; D143-Q147 WeakPolarHBondContact O-CB 3.26Å; D143-Q147 VanDerWaalsContact O-CG 3.31Å; D143-Q147 WeakPolarHBondContact O-CG 3.19Å; D143-Q147 PolarHBondContact O-N 3.48Å
144	Q	90.8	Very high	91.1	Very high	79 Å²	79	41 Å²	41	37%	0.369	21%	0.205	S	C	.	.	H	α-helix	trans	-56.4	-31.1	178.9	61.1	172.6	-26.2	0	0	114.4	N148 F185 V188	Q144-N148 WeakPolarHBondContact O-CB 3.38Å; Q144-N148 PolarHBondContact O-N 2.89Å; Q144-F185 HydrophobicContact CB-CB 4.05Å; Q144-F185 HydrophobicContact CB-CD1 3.93Å; Q144-F185 HydrophobicContact CB-CD2 3.56Å; Q144-F185 HydrophobicContact CB-CE1 4.2Å; Q144-F185 HydrophobicContact CB-CE2 3.87Å; Q144-F185 HydrophobicContact CB-CG 3.56Å; Q144-F185 HydrophobicContact CB-CZ 4.17Å; Q144-F185 VanDerWaalsContact CD-CE1 3.45Å; Q144-F185 HydrophobicContact CG-CD1 4.16Å; Q144-F185 HydrophobicContact CG-CE1 4.15Å; Q144-F185 HydrophobicContact CG-CG 4.3Å; Q144-F185 HydrophobicContact CG-CZ 4.34Å; Q144-V188 HydrophobicContact CB-CG2 4.17Å
145	N	88.5	Confident	91.2	Very high	62 Å²	62	40.7 Å²	40.7	33%	0.332	20%	0.204	S	C	.	.	H	α-helix	trans	-75.5	-45.5	-176.3	-62.4	-62.9	0	0	0	109.9	D143 N148 Y149	D143-N145 PolarHBondContact O-N 2.74Å; D143-N145 VanDerWaalsContact O-N 3.15Å; D143-N145 WeakPolarHBondContact OD1-CB 3.44Å; D143-N145 PolarHBondContact OD1-N 3.34Å; D143-N145 PolarHBondContact OD2-ND2 3.42Å; N145-N148 PolarHBondContact O-N 3.27Å; N145-Y149 HydrophobicContact CB-CE2 4.43Å; N145-Y149 WeakPolarHBondContact O-CD2 3.21Å; N145-Y149 PolarHBondContact O-N 3.2Å
146	Y	90.7	Very high	91.3	Very high	38 Å²	38	41.5 Å²	41.5	15%	0.149	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-41.6	176.7	-68.3	-5	0	0	0	110.9	G102 L105 R106 L109 A142 D143 N148 Y149 I150	G102-Y146 PolarHBondContact O-OH 2.85Å; L105-Y146 HydrophobicContact CD2-CD2 4.06Å; L105-Y146 HydrophobicContact CD2-CE2 4.04Å; R106-Y146 HydrophobicContact CB-CE1 3.58Å; R106-Y146 HydrophobicContact CG-CD1 4.48Å; R106-Y146 HydrophobicContact CG-CE1 3.74Å; L109-Y146 HydrophobicContact CD1-CD1 4.14Å; L109-Y146 HydrophobicContact CD1-CD2 4.43Å; L109-Y146 HydrophobicContact CD1-CG 3.81Å; A142-Y146 HydrophobicContact CB-CD2 4.3Å; D143-Y146 PolarHBondContact O-N 2.59Å; D143-Y146 WeakPolarHBondContact OD1-CB 3.23Å; D143-Y146 VanDerWaalsContact OD1-CG 3.26Å; D143-Y146 PolarHBondContact OD1-N 2.85Å; Y146-N148 VanDerWaalsContact C-N 3.31Å; Y146-N148 PolarHBondContact O-N 2.8Å; Y146-Y149 HydrophobicContact CD1-CD2 4.22Å; Y146-Y149 PolarHBondContact O-N 3.3Å; Y146-I150 WeakPolarHBondContact O-CD1 3.49Å; Y146-I150 VanDerWaalsContact O-CG1 3.22Å; Y146-I150 WeakPolarHBondContact O-CG1 3.46Å; Y146-I150 PolarHBondContact O-N 3.18Å
147	Q	92.9	Very high	91.2	Very high	24 Å²	24	40.3 Å²	40.3	11%	0.112	20%	0.201	C	C	.	.	H	α-helix	trans	-55.5	-46.9	171.2	-75.7	178.3	-11.1	0	0	111.3	G139 A142 D143 Y149 I150 L151 V188	G139-Q147 WeakPolarHBondContact O-CG 3.39Å; G139-Q147 PolarHBondContact O-NE2 3.45Å; A142-Q147 HydrophobicContact CB-CG 4.22Å; A142-Q147 PolarHBondContact O-NE2 2.87Å; D143-Q147 WeakPolarHBondContact O-CB 3.26Å; D143-Q147 VanDerWaalsContact O-CG 3.31Å; D143-Q147 WeakPolarHBondContact O-CG 3.19Å; D143-Q147 PolarHBondContact O-N 3.48Å; Q147-Y149 PolarHBondContact O-N 3.02Å; Q147-I150 PolarHBondContact O-N 3.09Å; Q147-L151 VanDerWaalsContact O-CG 3.27Å; Q147-L151 WeakPolarHBondContact O-CG 3.37Å; Q147-L151 PolarHBondContact O-N 3.44Å; Q147-V188 HydrophobicContact CB-CG1 4.31Å; Q147-V188 HydrophobicContact CB-CG2 4.32Å
148	N	90.8	Very high	91.3	Very high	24 Å²	24	34.5 Å²	34.5	13%	0.128	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-46.9	176.1	-174.3	-18.9	0	0	0	112.1	Q144 N145 Y146 I150 L151 R152 L187	Q144-N148 WeakPolarHBondContact O-CB 3.38Å; Q144-N148 PolarHBondContact O-N 2.89Å; N145-N148 PolarHBondContact O-N 3.27Å; Y146-N148 VanDerWaalsContact C-N 3.31Å; Y146-N148 PolarHBondContact O-N 2.8Å; N148-I150 VanDerWaalsContact C-N 3.29Å; N148-I150 PolarHBondContact O-N 3.37Å; N148-L151 PolarHBondContact O-N 3.37Å; N148-L151 VanDerWaalsContact O-N 3.16Å; N148-R152 WeakPolarHBondContact O-CG 3.28Å; N148-R152 PolarHBondContact O-N 2.84Å; N148-L187 WeakPolarHBondContact ND2-CD2 3.41Å; N148-L187 VanDerWaalsContact ND2-CG 3.28Å; N148-L187 WeakPolarHBondContact ND2-CG 3.14Å
149	Y	92.1	Very high	91.3	Very high	44 Å²	44	36.4 Å²	36.4	17%	0.173	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-40	176.2	-62.1	-39.7	0	0	0	112.9	R106 L109 F110 N145 Y146 Q147 R152 A153	R106-Y149 HydrophobicContact CG-CE2 4.11Å; R106-Y149 PolarHBondContact NH2-OH 3.19Å; L109-Y149 HydrophobicContact CB-CD2 4.45Å; F110-Y149 HydrophobicContact CD2-CD1 4.3Å; F110-Y149 AromaticContact CD2-CE1 3.83Å; F110-Y149 HydrophobicContact CD2-CE1 3.83Å; F110-Y149 HydrophobicContact CE2-CE1 4.42Å; N145-Y149 HydrophobicContact CB-CE2 4.43Å; N145-Y149 WeakPolarHBondContact O-CD2 3.21Å; N145-Y149 PolarHBondContact O-N 3.2Å; Y146-Y149 HydrophobicContact CD1-CD2 4.22Å; Y146-Y149 PolarHBondContact O-N 3.3Å; Q147-Y149 PolarHBondContact O-N 3.02Å; Y149-R152 PolarHBondContact O-N 3.5Å; Y149-A153 PolarHBondContact O-N 3.15Å
150	I	93.4	Very high	91.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-45.1	175.3	-67.7	164.1	0	0	0	110.6	L109 L135 V138 G139 Y146 Q147 N148 R152 A153 L154 W176	L109-I150 HydrophobicContact CD1-CD1 4.23Å; L109-I150 HydrophobicContact CD1-CG1 4.16Å; L109-I150 HydrophobicContact CD2-CD1 4.14Å; L109-I150 HydrophobicContact CD2-CG1 3.52Å; L109-I150 HydrophobicContact CG-CG1 4.44Å; L135-I150 HydrophobicContact CB-CG2 4.05Å; L135-I150 HydrophobicContact CD2-CG2 4.25Å; V138-I150 HydrophobicContact CB-CD1 4.34Å; V138-I150 HydrophobicContact CG1-CD1 3.98Å; G139-I150 VanDerWaalsContact CA-CD1 3.47Å; Y146-I150 WeakPolarHBondContact O-CD1 3.49Å; Y146-I150 VanDerWaalsContact O-CG1 3.22Å; Y146-I150 WeakPolarHBondContact O-CG1 3.46Å; Y146-I150 PolarHBondContact O-N 3.18Å; Q147-I150 PolarHBondContact O-N 3.09Å; N148-I150 VanDerWaalsContact C-N 3.29Å; N148-I150 PolarHBondContact O-N 3.37Å; I150-R152 VanDerWaalsContact C-N 3.3Å; I150-R152 PolarHBondContact O-N 2.89Å; I150-A153 PolarHBondContact O-N 2.91Å; I150-L154 WeakPolarHBondContact O-CB 3.2Å; I150-L154 PolarHBondContact O-N 2.76Å; I150-W176 HydrophobicContact CB-CH2 4.33Å; I150-W176 HydrophobicContact CG2-CH2 3.61Å; I150-W176 HydrophobicContact CG2-CZ3 4.02Å
151	L	94.7	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-37.1	177.4	-68.5	173	0	0	0	111.9	Q147 N148 L154 G155 W176 L177 L180 V188 T191 A192 L195	Q147-L151 VanDerWaalsContact O-CG 3.27Å; Q147-L151 WeakPolarHBondContact O-CG 3.37Å; Q147-L151 PolarHBondContact O-N 3.44Å; N148-L151 PolarHBondContact O-N 3.37Å; N148-L151 VanDerWaalsContact O-N 3.16Å; L151-L154 PolarHBondContact O-N 2.74Å; L151-G155 PolarHBondContact O-N 2.78Å; L151-W176 HydrophobicContact CD2-CH2 4.09Å; L151-W176 HydrophobicContact CD2-CZ3 3.92Å; L151-W176 HydrophobicContact CG-CH2 4.47Å; L151-L177 HydrophobicContact CD2-CD2 3.45Å; L151-L177 VanDerWaalsContact CD2-CD2 3.45Å; L151-L180 HydrophobicContact CD1-CD1 4.11Å; L151-L180 HydrophobicContact CD2-CD1 3.77Å; L151-L180 HydrophobicContact CG-CD1 4.31Å; L151-V188 HydrophobicContact CD1-CG1 3.86Å; L151-T191 HydrophobicContact CB-CG2 3.65Å; L151-T191 HydrophobicContact CD1-CG2 4.13Å; L151-A192 HydrophobicContact CD1-CB 4.44Å; L151-L195 HydrophobicContact CB-CD1 4.15Å; L151-L195 HydrophobicContact CD2-CD1 3.83Å; L151-L195 WeakPolarHBondContact O-CD1 3.45Å
152	R	92.6	Very high	91.6	Very high	82 Å²	82	35.7 Å²	35.7	31%	0.309	18%	0.177	S	C	.	.	H	α-helix	trans	-66.2	-40	174.7	-67.5	-175.6	75.1	156.4	7.4	112.3	K113 N148 Y149 I150 G155 Q156 D1057	K113-R152 HydrophobicContact CD-CB 4.47Å; N148-R152 WeakPolarHBondContact O-CG 3.28Å; N148-R152 PolarHBondContact O-N 2.84Å; Y149-R152 PolarHBondContact O-N 3.5Å; I150-R152 VanDerWaalsContact C-N 3.3Å; I150-R152 PolarHBondContact O-N 2.89Å; R152-G155 PolarHBondContact O-N 3.41Å; R152-Q156 PolarHBondContact O-N 3.4Å; R152-Q156 VanDerWaalsContact O-N 3.14Å; R152-D1057 IonicContact CZ-OD1 3.94Å; R152-D1057 IonicContact CZ-OD2 3.97Å; R152-D1057 IonicContact NE-OD1 2.71Å; R152-D1057 IonicContact NH2-OD1 2.68Å; R152-D1057 PolarHBondContact NH2-OD1 3.08Å; R152-D1057 IonicContact NH2-OD2 2.91Å; R152-D1057 PolarHBondContact NH2-OD2 2.57Å
153	A	92.2	Very high	91.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.6	-42	174	0	0	0	0	0	111.6	L112 F116 Y149 I150 G155 Q156 V157	L112-A153 HydrophobicContact CB-CB 4.13Å; L112-A153 HydrophobicContact CD2-CB 3.87Å; L112-A153 HydrophobicContact CG-CB 3.98Å; F116-A153 HydrophobicContact CD2-CB 4.48Å; Y149-A153 PolarHBondContact O-N 3.15Å; I150-A153 PolarHBondContact O-N 2.91Å; A153-G155 VanDerWaalsContact C-N 3.33Å; A153-G155 PolarHBondContact O-N 2.66Å; A153-Q156 WeakPolarHBondContact O-CB 3.34Å; A153-Q156 PolarHBondContact O-N 2.91Å; A153-Q156 VanDerWaalsContact O-N 3.16Å; A153-V157 WeakPolarHBondContact O-CG2 3.35Å; A153-V157 PolarHBondContact O-N 3.43Å
154	L	94	Very high	92	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-63.1	-39.4	175.7	-175.6	62.6	0	0	0	111.7	L132 I150 L151 Q156 V157 M158 V167 T173 W176 L177 L195	L132-L154 HydrophobicContact CD2-CD1 3.85Å; I150-L154 WeakPolarHBondContact O-CB 3.2Å; I150-L154 PolarHBondContact O-N 2.76Å; L151-L154 PolarHBondContact O-N 2.74Å; L154-Q156 VanDerWaalsContact C-N 3.31Å; L154-Q156 PolarHBondContact O-N 3.41Å; L154-V157 WeakPolarHBondContact O-CB 3.46Å; L154-V157 PolarHBondContact O-N 3.03Å; L154-M158 HydrophobicContact CG-SD 4.32Å; L154-M158 WeakPolarHBondContact O-CG 3.25Å; L154-M158 PolarHBondContact O-N 3.01Å; L154-V167 HydrophobicContact CD1-CG2 4.13Å; L154-T173 HydrophobicContact CD1-CG2 4.17Å; L154-T173 HydrophobicContact CD2-CG2 3.85Å; L154-W176 HydrophobicContact CD2-CZ3 4.33Å; L154-L177 HydrophobicContact CD2-CD1 4.22Å; L154-L177 HydrophobicContact CD2-CD2 4Å; L154-L177 HydrophobicContact CD2-CG 4.28Å; L154-L195 HydrophobicContact CB-CD1 4.34Å; L154-L195 HydrophobicContact CD2-CD1 4.15Å; L154-L195 HydrophobicContact CG-CD1 4.33Å
155	G	93.2	Very high	92.1	Very high	3 Å²	3	31.3 Å²	31.3	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-42	172.1	0	0	0	0	0	112.5	L151 R152 A153 M158 L159	L151-G155 PolarHBondContact O-N 2.78Å; R152-G155 PolarHBondContact O-N 3.41Å; A153-G155 VanDerWaalsContact C-N 3.33Å; A153-G155 PolarHBondContact O-N 2.66Å; G155-M158 PolarHBondContact O-N 3.09Å; G155-L159 WeakPolarHBondContact O-CG 3.26Å; G155-L159 PolarHBondContact O-N 2.91Å
156	Q	93.8	Very high	92.4	Very high	21 Å²	21	28.6 Å²	28.6	10%	0.098	14%	0.141	C	C	.	.	H	α-helix	trans	-64.4	-39.8	174.8	-171.9	60.3	47.2	0	0	112.2	K113 F116 Q117 R152 A153 L154 L159 Y160	K113-Q156 HydrophobicContact CG-CB 4.14Å; F116-Q156 HydrophobicContact CB-CG 3.94Å; Q117-Q156 HydrophobicContact CB-CG 4.23Å; R152-Q156 PolarHBondContact O-N 3.4Å; R152-Q156 VanDerWaalsContact O-N 3.14Å; A153-Q156 WeakPolarHBondContact O-CB 3.34Å; A153-Q156 PolarHBondContact O-N 2.91Å; A153-Q156 VanDerWaalsContact O-N 3.16Å; L154-Q156 VanDerWaalsContact C-N 3.31Å; L154-Q156 PolarHBondContact O-N 3.41Å; Q156-L159 PolarHBondContact O-N 2.98Å; Q156-Y160 HydrophobicContact CG-CE2 4.35Å; Q156-Y160 VanDerWaalsContact O-CD2 3.24Å; Q156-Y160 WeakPolarHBondContact O-CD2 3.25Å; Q156-Y160 WeakPolarHBondContact O-CE2 3.28Å
157	V	91.9	Very high	92.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.9	-45.7	175.2	168	0	0	0	0	110.7	F116 V123 V127 L132 A153 L154 L159 Y160 G163	F116-V157 HydrophobicContact CD2-CG2 3.59Å; F116-V157 HydrophobicContact CE2-CG2 3.69Å; F116-V157 HydrophobicContact CG-CG2 4.04Å; F116-V157 HydrophobicContact CZ-CG2 4.24Å; V123-V157 HydrophobicContact CG1-CB 4.36Å; V123-V157 HydrophobicContact CG1-CG1 3.9Å; V123-V157 HydrophobicContact CG1-CG2 4.36Å; V127-V157 HydrophobicContact CG2-CG1 4.41Å; L132-V157 HydrophobicContact CD2-CG1 4.35Å; A153-V157 WeakPolarHBondContact O-CG2 3.35Å; A153-V157 PolarHBondContact O-N 3.43Å; L154-V157 WeakPolarHBondContact O-CB 3.46Å; L154-V157 PolarHBondContact O-N 3.03Å; V157-L159 PolarHBondContact O-N 3.2Å; V157-Y160 PolarHBondContact O-N 3.4Å; V157-Y160 VanDerWaalsContact O-N 3.13Å; V157-G163 WeakPolarHBondContact O-CA 3.26Å
158	M	92.3	Very high	92.6	Very high	6 Å²	6	27.7 Å²	27.7	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-65.6	-17.2	-178.4	-72.8	175.6	67.4	0	0	114.7	L154 G155 Y160 M164 V167 L195 V198 F199	L154-M158 HydrophobicContact CG-SD 4.32Å; L154-M158 WeakPolarHBondContact O-CG 3.25Å; L154-M158 PolarHBondContact O-N 3.01Å; G155-M158 PolarHBondContact O-N 3.09Å; M158-Y160 VanDerWaalsContact C-N 3.25Å; M158-Y160 PolarHBondContact O-N 3.01Å; M158-M164 HydrophobicContact CB-CE 4Å; M158-M164 HydrophobicContact CE-CE 3.63Å; M158-M164 HydrophobicContact CE-SD 4.05Å; M158-M164 HydrophobicContact CG-CE 4.42Å; M158-V167 HydrophobicContact CG-CG2 3.97Å; M158-L195 WeakPolarHBondContact CE-O 3.34Å; M158-L195 HydrophobicContact SD-CB 4.2Å; M158-L195 HydrophobicContact SD-CD2 4.2Å; M158-V198 HydrophobicContact CE-CG1 4.42Å; M158-F199 HydrophobicContact CE-CB 3.72Å; M158-F199 HydrophobicContact CE-CD2 4.42Å
159	L	91.2	Very high	92.6	Very high	56 Å²	56	30.8 Å²	30.8	29%	0.293	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-19.5	174.8	-68.5	176.1	0	0	0	113	G155 Q156 V157 I1059 L1063	G155-L159 WeakPolarHBondContact O-CG 3.26Å; G155-L159 PolarHBondContact O-N 2.91Å; Q156-L159 PolarHBondContact O-N 2.98Å; V157-L159 PolarHBondContact O-N 3.2Å; L159-I1059 HydrophobicContact CD1-CG2 4.27Å; L159-I1059 HydrophobicContact CD2-CG2 3.95Å; L159-L1063 HydrophobicContact CD2-CD1 3.41Å; L159-L1063 VanDerWaalsContact CD2-CD1 3.41Å
160	Y	91.6	Very high	92.6	Very high	54 Å²	54	30.4 Å²	30.4	21%	0.212	17%	0.167	C	C	.	.	S	Bend	trans	-96	140.6	176.9	-58.7	-75.9	0	0	0	110.6	F116 Q117 K120 V123 Q156 V157 M158 D162 G163 M164	F116-Y160 VanDerWaalsContact O-CE2 3.26Å; F116-Y160 WeakPolarHBondContact O-CE2 3.44Å; F116-Y160 PolarHBondContact O-OH 3.19Å; Q117-Y160 PolarHBondContact O-OH 3.47Å; K120-Y160 HydrophobicContact CB-CD1 4.18Å; K120-Y160 HydrophobicContact CB-CE1 3.67Å; V123-Y160 HydrophobicContact CB-CD2 4.22Å; V123-Y160 HydrophobicContact CG1-CD2 4.13Å; V123-Y160 HydrophobicContact CG2-CD2 3.67Å; V123-Y160 HydrophobicContact CG2-CE2 3.78Å; V123-Y160 HydrophobicContact CG2-CG 4.45Å; Q156-Y160 HydrophobicContact CG-CE2 4.35Å; Q156-Y160 VanDerWaalsContact O-CD2 3.24Å; Q156-Y160 WeakPolarHBondContact O-CD2 3.25Å; Q156-Y160 WeakPolarHBondContact O-CE2 3.28Å; V157-Y160 PolarHBondContact O-N 3.4Å; V157-Y160 VanDerWaalsContact O-N 3.13Å; M158-Y160 VanDerWaalsContact C-N 3.25Å; M158-Y160 PolarHBondContact O-N 3.01Å; Y160-D162 VanDerWaalsContact C-N 3.31Å; Y160-D162 PolarHBondContact O-N 2.97Å; Y160-G163 WeakPolarHBondContact O-CA 3.49Å; Y160-G163 PolarHBondContact O-N 2.89Å; Y160-M164 PolarHBondContact O-N 3.35Å
161	V	90.7	Very high	92.5	Very high	86 Å²	86	32.4 Å²	32.4	52%	0.521	18%	0.178	S	C	.	.	H	α-helix	trans	-55.2	-45.7	-178.8	175.8	0	0	0	0	111.6	G163 M164 N165	V161-G163 VanDerWaalsContact C-N 3.32Å; V161-G163 PolarHBondContact O-N 3.46Å; V161-M164 PolarHBondContact O-N 3.01Å; V161-N165 WeakPolarHBondContact CG1-ND2 3.41Å; V161-N165 WeakPolarHBondContact O-CB 3.29Å; V161-N165 PolarHBondContact O-N 3.33Å; V161-N165 PolarHBondContact O-ND2 2.86Å
162	D	89.1	Confident	92.4	Very high	79 Å²	79	37.1 Å²	37.1	42%	0.422	20%	0.2	S	C	.	.	H	α-helix	trans	-65	-36.7	178	-61.4	-43.7	0	0	0	112.3	H124 Y160 G166	H124-D162 HydrophobicContact CB-CB 4.01Å; H124-D162 IonicContact CD2-OD1 3.99Å; H124-D162 IonicContact CD2-OD2 3.93Å; Y160-D162 VanDerWaalsContact C-N 3.31Å; Y160-D162 PolarHBondContact O-N 2.97Å; D162-G166 PolarHBondContact O-N 3.43Å
163	G	92.6	Very high	92.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.3	-47.6	175.9	0	0	0	0	0	112.5	V157 Y160 V161 G166 V167	V157-G163 WeakPolarHBondContact O-CA 3.26Å; Y160-G163 WeakPolarHBondContact O-CA 3.49Å; Y160-G163 PolarHBondContact O-N 2.89Å; V161-G163 VanDerWaalsContact C-N 3.32Å; V161-G163 PolarHBondContact O-N 3.46Å; G163-G166 WeakPolarHBondContact O-CA 3.45Å; G163-G166 PolarHBondContact O-N 3.05Å; G163-V167 WeakPolarHBondContact O-CG2 3.38Å; G163-V167 PolarHBondContact O-N 2.87Å
164	M	93.6	Very high	92.6	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-46.3	175.6	-177.1	61.4	79	0	0	111.6	M158 Y160 V161 G166 V167 I168 V198 F199 Y202	M158-M164 HydrophobicContact CB-CE 4Å; M158-M164 HydrophobicContact CE-CE 3.63Å; M158-M164 HydrophobicContact CE-SD 4.05Å; M158-M164 HydrophobicContact CG-CE 4.42Å; Y160-M164 PolarHBondContact O-N 3.35Å; V161-M164 PolarHBondContact O-N 3.01Å; M164-G166 PolarHBondContact O-N 3.33Å; M164-V167 PolarHBondContact O-N 2.97Å; M164-V167 VanDerWaalsContact O-N 3.08Å; M164-I168 HydrophobicContact CG-CD1 4.05Å; M164-I168 HydrophobicContact CG-CG1 4.49Å; M164-I168 VanDerWaalsContact O-CG1 3.27Å; M164-I168 WeakPolarHBondContact O-CG1 3.27Å; M164-I168 PolarHBondContact O-N 3.48Å; M164-V198 HydrophobicContact CE-CG1 4.07Å; M164-F199 HydrophobicContact SD-CD2 3.84Å; M164-F199 HydrophobicContact SD-CE2 4.48Å; M164-Y202 HydrophobicContact CB-CE1 4.37Å; M164-Y202 HydrophobicContact CB-CE2 4.43Å; M164-Y202 HydrophobicContact CE-CD2 4.26Å; M164-Y202 HydrophobicContact CE-CG 4.06Å; M164-Y202 HydrophobicContact CG-CD1 3.39Å; M164-Y202 HydrophobicContact CG-CD2 3.88Å; M164-Y202 HydrophobicContact CG-CE1 3.5Å; M164-Y202 HydrophobicContact CG-CE2 3.98Å; M164-Y202 HydrophobicContact CG-CG 3.58Å; M164-Y202 HydrophobicContact SD-CD1 4.24Å; M164-Y202 HydrophobicContact SD-CG 4.17Å
165	N	93.2	Very high	92.6	Very high	72 Å²	72	35 Å²	35	39%	0.385	19%	0.194	S	C	.	.	H	α-helix	trans	-60	-36.2	174.9	-71.8	-24.2	0	0	0	111.9	V161 I168 A169	V161-N165 WeakPolarHBondContact CG1-ND2 3.41Å; V161-N165 WeakPolarHBondContact O-CB 3.29Å; V161-N165 PolarHBondContact O-N 3.33Å; V161-N165 PolarHBondContact O-ND2 2.86Å; N165-I168 PolarHBondContact O-N 3.25Å; N165-A169 WeakPolarHBondContact O-CB 3.39Å; N165-A169 PolarHBondContact O-N 3.42Å
166	G	92.9	Very high	92.7	Very high	6 Å²	6	35.7 Å²	35.7	6%	0.062	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-47.4	170.4	0	0	0	0	0	113.7	D162 G163 M164 A169 H170	D162-G166 PolarHBondContact O-N 3.43Å; G163-G166 WeakPolarHBondContact O-CA 3.45Å; G163-G166 PolarHBondContact O-N 3.05Å; M164-G166 PolarHBondContact O-N 3.33Å; G166-A169 PolarHBondContact O-N 3.32Å; G166-H170 VanDerWaalsContact O-CB 3.31Å; G166-H170 WeakPolarHBondContact O-CB 3.2Å; G166-H170 PolarHBondContact O-N 2.96Å; G166-H170 VanDerWaalsContact O-N 3.08Å
167	V	94.7	Very high	92.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-39.8	176.7	175.4	0	0	0	0	111.3	L132 L154 M158 G163 M164 A169 H170 T173 I174 F199	L132-V167 HydrophobicContact CD1-CG2 4Å; L132-V167 HydrophobicContact CD2-CG2 4.39Å; L154-V167 HydrophobicContact CD1-CG2 4.13Å; M158-V167 HydrophobicContact CG-CG2 3.97Å; G163-V167 WeakPolarHBondContact O-CG2 3.38Å; G163-V167 PolarHBondContact O-N 2.87Å; M164-V167 PolarHBondContact O-N 2.97Å; M164-V167 VanDerWaalsContact O-N 3.08Å; V167-A169 VanDerWaalsContact C-N 3.28Å; V167-A169 PolarHBondContact O-N 2.68Å; V167-H170 CarbonylContact O-C 3.57Å; V167-H170 PolarHBondContact O-N 3.38Å; V167-H170 VanDerWaalsContact O-N 3.12Å; V167-T173 HydrophobicContact CG1-CG2 4.04Å; V167-T173 HydrophobicContact CG2-CG2 4.39Å; V167-I174 HydrophobicContact CG1-CG1 4.39Å; V167-F199 HydrophobicContact CG1-CD2 3.98Å; V167-F199 HydrophobicContact CG1-CE2 4.01Å
168	I	92.9	Very high	92.9	Very high	43 Å²	43	34.8 Å²	34.8	22%	0.221	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-40.3	174.2	-68.9	170.7	0	0	0	111	M164 N165 H170 F199 Y202 T203 N206 L209	M164-I168 HydrophobicContact CG-CD1 4.05Å; M164-I168 HydrophobicContact CG-CG1 4.49Å; M164-I168 VanDerWaalsContact O-CG1 3.27Å; M164-I168 WeakPolarHBondContact O-CG1 3.27Å; M164-I168 PolarHBondContact O-N 3.48Å; N165-I168 PolarHBondContact O-N 3.25Å; I168-H170 VanDerWaalsContact C-N 3.31Å; I168-F199 HydrophobicContact CB-CE2 4.5Å; I168-F199 HydrophobicContact CG1-CE2 3.66Å; I168-F199 HydrophobicContact CG1-CZ 4.31Å; I168-Y202 HydrophobicContact CD1-CD1 3.86Å; I168-Y202 HydrophobicContact CD1-CE1 3.84Å; I168-T203 HydrophobicContact CD1-CG2 4.36Å; I168-N206 WeakPolarHBondContact CG1-OD1 3.29Å; I168-L209 HydrophobicContact CB-CD1 4.45Å; I168-L209 HydrophobicContact CG2-CD1 3.7Å
169	A	92.4	Very high	92.9	Very high	89 Å²	89	37.1 Å²	37.1	74%	0.736	21%	0.208	S	C	*	.	H	α-helix	trans	-76.6	-15	177.9	0	0	0	0	0	113.9	N165 G166 V167	N165-A169 WeakPolarHBondContact O-CB 3.39Å; N165-A169 PolarHBondContact O-N 3.42Å; G166-A169 PolarHBondContact O-N 3.32Å; V167-A169 VanDerWaalsContact C-N 3.28Å; V167-A169 PolarHBondContact O-N 2.68Å
170	H	92.3	Very high	93	Very high	35 Å²	35	34.9 Å²	34.9	16%	0.162	20%	0.196	C	C	.	.			trans	-116.2	80.2	-173.4	-164.2	-97.4	0	0	0	111.8	L132 G166 V167 I168 E172 T173	L132-H170 HydrophobicContact CD1-CB 4.1Å; G166-H170 VanDerWaalsContact O-CB 3.31Å; G166-H170 WeakPolarHBondContact O-CB 3.2Å; G166-H170 PolarHBondContact O-N 2.96Å; G166-H170 VanDerWaalsContact O-N 3.08Å; V167-H170 CarbonylContact O-C 3.57Å; V167-H170 PolarHBondContact O-N 3.38Å; V167-H170 VanDerWaalsContact O-N 3.12Å; I168-H170 VanDerWaalsContact C-N 3.31Å; H170-E172 IonicContact CD2-OE2 2.69Å; H170-E172 IonicContact CE1-OE2 3.06Å; H170-E172 IonicContact CG-OE2 2.66Å; H170-E172 IonicContact ND1-OE2 3.6Å; H170-E172 IonicContact NE2-OE2 3.17Å; H170-E172 PolarHBondContact O-N 2.98Å; H170-E172 VanDerWaalsContact O-N 3.13Å; H170-T173 PolarHBondContact ND1-N 3.49Å; H170-T173 PolarHBondContact ND1-OG1 3.4Å; H170-T173 WeakPolarHBondContact O-CB 3.35Å; H170-T173 PolarHBondContact O-N 3.31Å; H170-T173 PolarHBondContact O-OG1 2.94Å
171	N	90.1	Very high	93	Very high	42 Å²	42	32.4 Å²	32.4	23%	0.225	19%	0.187	C	C	.	.	H	α-helix	trans	-56.7	-31	-174.4	-172.7	24	0	0	0	113.4	T173 I174 Q175	N171-T173 PolarHBondContact O-N 3.43Å; N171-I174 PolarHBondContact O-N 3.27Å; N171-I174 VanDerWaalsContact O-N 3.08Å; N171-Q175 PolarHBondContact ND2-NE2 3.18Å; N171-Q175 VanDerWaalsContact ND2-NE2 3.11Å; N171-Q175 WeakPolarHBondContact O-CG 3.3Å; N171-Q175 PolarHBondContact O-N 3.26Å
172	E	93.1	Very high	93	Very high	100 Å²	100	30.6 Å²	30.6	47%	0.467	19%	0.186	S	C	.	.	H	α-helix	trans	-58.9	-31.5	176.2	-64.5	77.8	-175	0	0	112	I136 H170 Q175 W176	I136-E172 HydrophobicContact CD1-CB 4.01Å; H170-E172 IonicContact CD2-OE2 2.69Å; H170-E172 IonicContact CE1-OE2 3.06Å; H170-E172 IonicContact CG-OE2 2.66Å; H170-E172 IonicContact ND1-OE2 3.6Å; H170-E172 IonicContact NE2-OE2 3.17Å; H170-E172 PolarHBondContact O-N 2.98Å; H170-E172 VanDerWaalsContact O-N 3.13Å; E172-Q175 PolarHBondContact O-N 3.43Å; E172-W176 WeakPolarHBondContact O-CB 3.44Å; E172-W176 PolarHBondContact O-N 2.87Å
173	T	94.9	Very high	93	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-43.5	175.7	-54.4	0	0	0	0	110.7	I136 L154 V167 H170 N171 W176 L177	I136-T173 VanDerWaalsContact CD1-CA 3.43Å; L154-T173 HydrophobicContact CD1-CG2 4.17Å; L154-T173 HydrophobicContact CD2-CG2 3.85Å; V167-T173 HydrophobicContact CG1-CG2 4.04Å; V167-T173 HydrophobicContact CG2-CG2 4.39Å; H170-T173 PolarHBondContact ND1-N 3.49Å; H170-T173 PolarHBondContact ND1-OG1 3.4Å; H170-T173 WeakPolarHBondContact O-CB 3.35Å; H170-T173 PolarHBondContact O-N 3.31Å; H170-T173 PolarHBondContact O-OG1 2.94Å; N171-T173 PolarHBondContact O-N 3.43Å; T173-W176 PolarHBondContact O-N 2.9Å; T173-L177 HydrophobicContact CG2-CD1 4.4Å; T173-L177 WeakPolarHBondContact O-CG 3.38Å; T173-L177 PolarHBondContact O-N 2.83Å
174	I	94.9	Very high	92.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69.6	-41.4	-178.8	-51.9	164.2	0	0	0	109.7	V167 N171 W176 L177 Y178 L196 F199 L209 L210 A213	V167-I174 HydrophobicContact CG1-CG1 4.39Å; N171-I174 PolarHBondContact O-N 3.27Å; N171-I174 VanDerWaalsContact O-N 3.08Å; I174-W176 VanDerWaalsContact C-N 3.33Å; I174-W176 PolarHBondContact O-N 3.07Å; I174-L177 PolarHBondContact O-N 3.47Å; I174-Y178 WeakPolarHBondContact O-CB 3.47Å; I174-Y178 PolarHBondContact O-N 3.07Å; I174-L196 HydrophobicContact CG2-CD2 4.25Å; I174-F199 HydrophobicContact CD1-CE1 3.61Å; I174-F199 HydrophobicContact CD1-CE2 3.9Å; I174-F199 HydrophobicContact CD1-CZ 3.2Å; I174-F199 HydrophobicContact CG1-CE1 4.05Å; I174-F199 HydrophobicContact CG1-CE2 4.21Å; I174-F199 HydrophobicContact CG1-CZ 3.86Å; I174-F199 HydrophobicContact CG2-CE1 4.26Å; I174-L209 HydrophobicContact CD1-CB 3.95Å; I174-L210 HydrophobicContact CG2-CB 4.43Å; I174-L210 HydrophobicContact CG2-CD1 3.77Å; I174-A213 HydrophobicContact CB-CB 3.95Å; I174-A213 HydrophobicContact CG2-CB 3.61Å
175	Q	93.7	Very high	92.6	Very high	41 Å²	41	40.9 Å²	40.9	19%	0.192	23%	0.233	C	C	.	.	H	α-helix	trans	-59.7	-43.9	173.7	-68	170.6	35.5	0	0	111.5	N171 E172 Y178 S179 A213	N171-Q175 PolarHBondContact ND2-NE2 3.18Å; N171-Q175 VanDerWaalsContact ND2-NE2 3.11Å; N171-Q175 WeakPolarHBondContact O-CG 3.3Å; N171-Q175 PolarHBondContact O-N 3.26Å; E172-Q175 PolarHBondContact O-N 3.43Å; Q175-Y178 PolarHBondContact O-N 3Å; Q175-S179 WeakPolarHBondContact O-CB 3.27Å; Q175-S179 PolarHBondContact O-N 2.94Å; Q175-A213 HydrophobicContact CB-CB 4.46Å; Q175-A213 HydrophobicContact CG-CB 3.69Å
176	W	94.1	Very high	92.4	Very high	17 Å²	17	42.5 Å²	42.5	6%	0.064	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-47.4	177.2	-178.7	60.9	0	0	0	111.3	I136 I150 L151 L154 E172 T173 I174 Y178 S179 L180	I136-W176 HydrophobicContact CG1-CB 4.33Å; I136-W176 HydrophobicContact CG1-CD2 4.31Å; I136-W176 HydrophobicContact CG1-CE3 4.12Å; I136-W176 HydrophobicContact CG1-CG 4.42Å; I136-W176 HydrophobicContact CG2-CB 3.95Å; I136-W176 HydrophobicContact CG2-CD2 4.28Å; I136-W176 HydrophobicContact CG2-CG 3.83Å; I150-W176 HydrophobicContact CB-CH2 4.33Å; I150-W176 HydrophobicContact CG2-CH2 3.61Å; I150-W176 HydrophobicContact CG2-CZ3 4.02Å; L151-W176 HydrophobicContact CD2-CH2 4.09Å; L151-W176 HydrophobicContact CD2-CZ3 3.92Å; L151-W176 HydrophobicContact CG-CH2 4.47Å; L154-W176 HydrophobicContact CD2-CZ3 4.33Å; E172-W176 WeakPolarHBondContact O-CB 3.44Å; E172-W176 PolarHBondContact O-N 2.87Å; T173-W176 PolarHBondContact O-N 2.9Å; I174-W176 VanDerWaalsContact C-N 3.33Å; I174-W176 PolarHBondContact O-N 3.07Å; W176-Y178 VanDerWaalsContact C-N 3.32Å; W176-Y178 PolarHBondContact O-N 3.12Å; W176-S179 PolarHBondContact O-N 3.1Å; W176-S179 VanDerWaalsContact O-N 3.09Å; W176-S179 PolarHBondContact O-OG 3.45Å; W176-L180 HydrophobicContact CD2-CD1 4.08Å; W176-L180 HydrophobicContact CE3-CD1 4.28Å; W176-L180 HydrophobicContact CH2-CD1 3.99Å; W176-L180 HydrophobicContact CZ2-CD1 3.77Å; W176-L180 HydrophobicContact CZ2-CD2 4.43Å; W176-L180 HydrophobicContact CZ3-CD1 4.25Å; W176-L180 WeakPolarHBondContact O-CG 3.41Å; W176-L180 PolarHBondContact O-N 2.93Å
177	L	96.1	Very high	92.2	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-44	175.7	-75.3	174.7	0	0	0	112.4	L151 L154 T173 I174 L180 A192 L195 L196	L151-L177 HydrophobicContact CD2-CD2 3.45Å; L151-L177 VanDerWaalsContact CD2-CD2 3.45Å; L154-L177 HydrophobicContact CD2-CD1 4.22Å; L154-L177 HydrophobicContact CD2-CD2 4Å; L154-L177 HydrophobicContact CD2-CG 4.28Å; T173-L177 HydrophobicContact CG2-CD1 4.4Å; T173-L177 WeakPolarHBondContact O-CG 3.38Å; T173-L177 PolarHBondContact O-N 2.83Å; I174-L177 PolarHBondContact O-N 3.47Å; L177-L180 PolarHBondContact O-N 3.36Å; L177-A192 HydrophobicContact CD2-CB 4.42Å; L177-L195 HydrophobicContact CD1-CB 4.27Å; L177-L195 HydrophobicContact CD2-CB 4.23Å; L177-L195 HydrophobicContact CD2-CD1 3.87Å; L177-L196 HydrophobicContact CB-CD1 4.39Å; L177-L196 HydrophobicContact CB-CD2 3.73Å; L177-L196 HydrophobicContact CB-CG 3.99Å; L177-L196 HydrophobicContact CD1-CD2 4.16Å
178	Y	94.7	Very high	92.1	Very high	1 Å²	1	47.4 Å²	47.4	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-66.5	-37.4	175.7	177.4	-101.7	0	0	0	112.5	I174 Q175 W176 L180 L181 V214 A217 D218 W225 N226 N227	I174-Y178 WeakPolarHBondContact O-CB 3.47Å; I174-Y178 PolarHBondContact O-N 3.07Å; Q175-Y178 PolarHBondContact O-N 3Å; W176-Y178 VanDerWaalsContact C-N 3.32Å; W176-Y178 PolarHBondContact O-N 3.12Å; Y178-L180 VanDerWaalsContact C-N 3.27Å; Y178-L180 PolarHBondContact O-N 3.03Å; Y178-L181 HydrophobicContact CD2-CD1 3.79Å; Y178-L181 HydrophobicContact CE2-CD1 4.12Å; Y178-L181 VanDerWaalsContact O-CB 3.27Å; Y178-L181 WeakPolarHBondContact O-CB 3.41Å; Y178-L181 WeakPolarHBondContact O-CG 3.06Å; Y178-L181 PolarHBondContact O-N 3.2Å; Y178-L181 VanDerWaalsContact O-N 3.15Å; Y178-V214 HydrophobicContact CD1-CG2 4.21Å; Y178-V214 HydrophobicContact CD2-CG2 3.69Å; Y178-V214 HydrophobicContact CE1-CB 4.34Å; Y178-V214 HydrophobicContact CE1-CG1 4.12Å; Y178-V214 HydrophobicContact CE1-CG2 4.17Å; Y178-V214 HydrophobicContact CE2-CG1 4.37Å; Y178-V214 HydrophobicContact CE2-CG2 3.67Å; Y178-V214 HydrophobicContact CG-CG2 3.97Å; Y178-A217 HydrophobicContact CD1-CB 3.65Å; Y178-A217 HydrophobicContact CE1-CB 4.07Å; Y178-D218 VanDerWaalsContact CE1-OD2 3.32Å; Y178-D218 WeakPolarHBondContact CE1-OD2 3.29Å; Y178-D218 PolarHBondContact OH-OD2 3.02Å; Y178-W225 WeakPolarHBondContact OH-CA 3.39Å; Y178-W225 PolarHBondContact OH-N 3.24Å; Y178-N226 PolarHBondContact OH-N 2.94Å; Y178-N227 HydrophobicContact CE1-CB 4.49Å; Y178-N227 HydrophobicContact CE2-CB 4.37Å; Y178-N227 PolarHBondContact O-ND2 3.44Å; Y178-N227 PolarHBondContact OH-N 3.24Å
179	S	91.9	Very high	92.2	Very high	55 Å²	55	45.5 Å²	45.5	39%	0.385	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-32.1	177.1	79.1	0	0	0	0	112.6	Q175 W176 L181 G182	Q175-S179 WeakPolarHBondContact O-CB 3.27Å; Q175-S179 PolarHBondContact O-N 2.94Å; W176-S179 PolarHBondContact O-N 3.1Å; W176-S179 VanDerWaalsContact O-N 3.09Å; W176-S179 PolarHBondContact O-OG 3.45Å; S179-L181 PolarHBondContact O-N 2.78Å; S179-G182 PolarHBondContact O-N 3.28Å; S179-G182 VanDerWaalsContact O-N 3.17Å
180	L	93.3	Very high	92.2	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.042	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-67.8	-15.5	177.1	-68.6	174.5	0	0	0	113.2	L151 W176 L177 Y178 G182 S183 V188 A192	L151-L180 HydrophobicContact CD1-CD1 4.11Å; L151-L180 HydrophobicContact CD2-CD1 3.77Å; L151-L180 HydrophobicContact CG-CD1 4.31Å; W176-L180 HydrophobicContact CD2-CD1 4.08Å; W176-L180 HydrophobicContact CE3-CD1 4.28Å; W176-L180 HydrophobicContact CH2-CD1 3.99Å; W176-L180 HydrophobicContact CZ2-CD1 3.77Å; W176-L180 HydrophobicContact CZ2-CD2 4.43Å; W176-L180 HydrophobicContact CZ3-CD1 4.25Å; W176-L180 WeakPolarHBondContact O-CG 3.41Å; W176-L180 PolarHBondContact O-N 2.93Å; L177-L180 PolarHBondContact O-N 3.36Å; Y178-L180 VanDerWaalsContact C-N 3.27Å; Y178-L180 PolarHBondContact O-N 3.03Å; L180-G182 PolarHBondContact O-N 3.38Å; L180-S183 WeakPolarHBondContact O-CB 3.45Å; L180-S183 PolarHBondContact O-N 2.96Å; L180-S183 VanDerWaalsContact O-N 3.11Å; L180-V188 HydrophobicContact CB-CG1 4.27Å; L180-V188 HydrophobicContact CD1-CG1 4.27Å; L180-V188 HydrophobicContact CD2-CG1 3.95Å; L180-V188 HydrophobicContact CG-CG1 4.4Å; L180-A192 HydrophobicContact CB-CB 3.92Å; L180-A192 HydrophobicContact CD1-CB 4.41Å
181	L	92.5	Very high	92.2	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-65.6	-25.8	172.9	-58.2	-170.2	0	0	0	112.6	Y178 S179 S183 V189 A192 L193 L196 N227 L231	Y178-L181 HydrophobicContact CD2-CD1 3.79Å; Y178-L181 HydrophobicContact CE2-CD1 4.12Å; Y178-L181 VanDerWaalsContact O-CB 3.27Å; Y178-L181 WeakPolarHBondContact O-CB 3.41Å; Y178-L181 WeakPolarHBondContact O-CG 3.06Å; Y178-L181 PolarHBondContact O-N 3.2Å; Y178-L181 VanDerWaalsContact O-N 3.15Å; S179-L181 PolarHBondContact O-N 2.78Å; L181-S183 VanDerWaalsContact C-N 3.27Å; L181-S183 PolarHBondContact O-N 3.06Å; L181-V189 HydrophobicContact CD2-CG1 4.32Å; L181-A192 HydrophobicContact CD2-CB 4.11Å; L181-L193 HydrophobicContact CD1-CD2 4.3Å; L181-L193 HydrophobicContact CD2-CB 4.49Å; L181-L193 HydrophobicContact CD2-CD1 4.42Å; L181-L193 HydrophobicContact CD2-CD2 3.99Å; L181-L193 HydrophobicContact CD2-CG 3.59Å; L181-L196 HydrophobicContact CD1-CD1 3.93Å; L181-L196 HydrophobicContact CD2-CD1 4.27Å; L181-L196 HydrophobicContact CG-CD1 4.23Å; L181-N227 HydrophobicContact CB-CB 3.87Å; L181-L231 HydrophobicContact CB-CD1 4.04Å
182	G	89.3	Confident	92.4	Very high	49 Å²	49	40.4 Å²	40.4	51%	0.505	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-85.4	8.5	173.3	0	0	0	0	0	114.3	S179 L180	S179-G182 PolarHBondContact O-N 3.28Å; S179-G182 VanDerWaalsContact O-N 3.17Å; L180-G182 PolarHBondContact O-N 3.38Å
183	S	90.1	Very high	92.5	Very high	29 Å²	29	35.7 Å²	35.7	20%	0.203	19%	0.187	C	C	.	.			trans	-72.7	143.8	-179.9	-175.8	0	0	0	0	111.8	L180 L181 F185 V189	L180-S183 WeakPolarHBondContact O-CB 3.45Å; L180-S183 PolarHBondContact O-N 2.96Å; L180-S183 VanDerWaalsContact O-N 3.11Å; L181-S183 VanDerWaalsContact C-N 3.27Å; L181-S183 PolarHBondContact O-N 3.06Å; S183-F185 PolarHBondContact O-N 3.41Å; S183-F185 WeakPolarHBondContact OG-CD2 3.37Å; S183-F185 PolarHBondContact OG-N 3.02Å; S183-V189 VanDerWaalsContact O-CG2 3.31Å; S183-V189 WeakPolarHBondContact O-CG2 3.16Å
184	Q	88.1	Confident	92.5	Very high	186 Å²	186	37.1 Å²	37.1	87%	0.869	19%	0.193	S	C	*	.	S	Bend	trans	-69.6	-11.5	173.1	-61.5	-177.1	11.7	0	0	112.6
185	F	89.9	Confident	92.6	Very high	82 Å²	82	37.1 Å²	37.1	36%	0.36	19%	0.193	S	C	.	.			trans	-98.4	97.8	-174.2	-55.3	-65.1	0	0	0	111	Q144 S183 L187 V188 V189	Q144-F185 HydrophobicContact CB-CB 4.05Å; Q144-F185 HydrophobicContact CB-CD1 3.93Å; Q144-F185 HydrophobicContact CB-CD2 3.56Å; Q144-F185 HydrophobicContact CB-CE1 4.2Å; Q144-F185 HydrophobicContact CB-CE2 3.87Å; Q144-F185 HydrophobicContact CB-CG 3.56Å; Q144-F185 HydrophobicContact CB-CZ 4.17Å; Q144-F185 VanDerWaalsContact CD-CE1 3.45Å; Q144-F185 HydrophobicContact CG-CD1 4.16Å; Q144-F185 HydrophobicContact CG-CE1 4.15Å; Q144-F185 HydrophobicContact CG-CG 4.3Å; Q144-F185 HydrophobicContact CG-CZ 4.34Å; S183-F185 PolarHBondContact O-N 3.41Å; S183-F185 WeakPolarHBondContact OG-CD2 3.37Å; S183-F185 PolarHBondContact OG-N 3.02Å; F185-L187 PolarHBondContact O-N 3.33Å; F185-V188 HydrophobicContact CB-CB 4.21Å; F185-V188 HydrophobicContact CB-CG2 3.89Å; F185-V188 WeakPolarHBondContact O-CA 3.43Å; F185-V188 WeakPolarHBondContact O-CB 3.41Å; F185-V188 PolarHBondContact O-N 3.15Å; F185-V189 PolarHBondContact O-N 3.07Å; F185-V189 VanDerWaalsContact O-N 3.1Å
186	R	88.8	Confident	92.7	Very high	105 Å²	105	35.1 Å²	35.1	40%	0.396	18%	0.184	S	C	.	.	H	α-helix	trans	-52.9	-33.8	-175.5	-72.5	-171.8	174.6	160.1	0.6	114.7	V189 K190 E234	R186-V189 PolarHBondContact O-N 2.72Å; R186-K190 WeakPolarHBondContact O-CB 3.39Å; R186-K190 PolarHBondContact O-N 2.97Å; R186-E234 IonicContact CZ-OE1 2.8Å; R186-E234 IonicContact NH2-OE1 3.63Å; R186-E234 PolarHBondContact NH2-OE1 2.92Å
187	L	88.5	Confident	92.7	Very high	108 Å²	108	34.3 Å²	34.3	57%	0.565	18%	0.181	S	C	*	.	H	α-helix	trans	-66.8	-37.2	177.5	-174.7	59.3	0	0	0	112.4	N148 F185 T191	N148-L187 WeakPolarHBondContact ND2-CD2 3.41Å; N148-L187 VanDerWaalsContact ND2-CG 3.28Å; N148-L187 WeakPolarHBondContact ND2-CG 3.14Å; F185-L187 PolarHBondContact O-N 3.33Å; L187-T191 WeakPolarHBondContact O-CB 3.32Å; L187-T191 PolarHBondContact O-N 3.4Å; L187-T191 VanDerWaalsContact O-N 3.1Å; L187-T191 PolarHBondContact O-OG1 3.48Å
188	V	92.7	Very high	92.6	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-68.5	-45.4	174.7	-179.9	0	0	0	0	109.6	Q144 Q147 L151 L180 F185 K190 T191 A192	Q144-V188 HydrophobicContact CB-CG2 4.17Å; Q147-V188 HydrophobicContact CB-CG1 4.31Å; Q147-V188 HydrophobicContact CB-CG2 4.32Å; L151-V188 HydrophobicContact CD1-CG1 3.86Å; L180-V188 HydrophobicContact CB-CG1 4.27Å; L180-V188 HydrophobicContact CD1-CG1 4.27Å; L180-V188 HydrophobicContact CD2-CG1 3.95Å; L180-V188 HydrophobicContact CG-CG1 4.4Å; F185-V188 HydrophobicContact CB-CB 4.21Å; F185-V188 HydrophobicContact CB-CG2 3.89Å; F185-V188 WeakPolarHBondContact O-CA 3.43Å; F185-V188 WeakPolarHBondContact O-CB 3.41Å; F185-V188 PolarHBondContact O-N 3.15Å; V188-K190 PolarHBondContact O-N 3.49Å; V188-T191 PolarHBondContact O-N 3.23Å; V188-A192 WeakPolarHBondContact O-CB 3.45Å; V188-A192 PolarHBondContact O-N 3.24Å
189	V	93.8	Very high	92.7	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-57.9	-49.8	176.1	-179.8	0	0	0	0	111.1	L181 S183 F185 R186 T191 A192 L193 L231 L241	L181-V189 HydrophobicContact CD2-CG1 4.32Å; S183-V189 VanDerWaalsContact O-CG2 3.31Å; S183-V189 WeakPolarHBondContact O-CG2 3.16Å; F185-V189 PolarHBondContact O-N 3.07Å; F185-V189 VanDerWaalsContact O-N 3.1Å; R186-V189 PolarHBondContact O-N 2.72Å; V189-T191 VanDerWaalsContact C-N 3.32Å; V189-T191 PolarHBondContact O-N 2.88Å; V189-A192 PolarHBondContact O-N 2.88Å; V189-L193 HydrophobicContact CG1-CD1 4.09Å; V189-L193 WeakPolarHBondContact O-CB 3.13Å; V189-L193 PolarHBondContact O-N 3.25Å; V189-L231 HydrophobicContact CG1-CD1 3.64Å; V189-L231 HydrophobicContact CG1-CD2 3.78Å; V189-L231 HydrophobicContact CG1-CG 4.38Å; V189-L241 HydrophobicContact CG1-CD1 4.11Å
190	K	92.4	Very high	92.7	Very high	41 Å²	41	32.5 Å²	32.5	18%	0.178	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-42.8	-179.9	-170.1	169.7	-173.5	164	0	111.3	R186 V188 K194 D238 E240 L241 Y244	R186-K190 WeakPolarHBondContact O-CB 3.39Å; R186-K190 PolarHBondContact O-N 2.97Å; V188-K190 PolarHBondContact O-N 3.49Å; K190-K194 WeakPolarHBondContact O-CG 3.46Å; K190-K194 PolarHBondContact O-N 3.34Å; K190-K194 VanDerWaalsContact O-N 3.1Å; K190-D238 IonicContact NZ-OD2 2.92Å; K190-E240 WeakPolarHBondContact CE-OE2 3.46Å; K190-E240 IonicContact NZ-OE2 2.65Å; K190-E240 PolarHBondContact NZ-OE2 2.78Å; K190-L241 HydrophobicContact CB-CD1 3.89Å; K190-L241 HydrophobicContact CG-CD1 4.25Å; K190-Y244 HydrophobicContact CG-CD2 4.41Å; K190-Y244 HydrophobicContact CG-CE2 4.29Å
191	T	92.8	Very high	92.6	Very high	19 Å²	19	36.2 Å²	36.2	12%	0.117	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-41.8	179.3	-48.9	0	0	0	0	111.3	L151 L187 V188 V189 L193 K194 L195	L151-T191 HydrophobicContact CB-CG2 3.65Å; L151-T191 HydrophobicContact CD1-CG2 4.13Å; L187-T191 WeakPolarHBondContact O-CB 3.32Å; L187-T191 PolarHBondContact O-N 3.4Å; L187-T191 VanDerWaalsContact O-N 3.1Å; L187-T191 PolarHBondContact O-OG1 3.48Å; V188-T191 PolarHBondContact O-N 3.23Å; V189-T191 VanDerWaalsContact C-N 3.32Å; V189-T191 PolarHBondContact O-N 2.88Å; T191-L193 PolarHBondContact O-N 3.06Å; T191-K194 WeakPolarHBondContact O-CB 3.4Å; T191-K194 PolarHBondContact O-N 3.46Å; T191-L195 WeakPolarHBondContact O-CG 3.45Å; T191-L195 PolarHBondContact O-N 2.93Å; T191-L195 VanDerWaalsContact O-N 3.11Å
192	A	95.5	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-42.2	175.7	0	0	0	0	0	112.2	L151 L177 L180 L181 V188 V189 K194 L195 L196	L151-A192 HydrophobicContact CD1-CB 4.44Å; L177-A192 HydrophobicContact CD2-CB 4.42Å; L180-A192 HydrophobicContact CB-CB 3.92Å; L180-A192 HydrophobicContact CD1-CB 4.41Å; L181-A192 HydrophobicContact CD2-CB 4.11Å; V188-A192 WeakPolarHBondContact O-CB 3.45Å; V188-A192 PolarHBondContact O-N 3.24Å; V189-A192 PolarHBondContact O-N 2.88Å; A192-K194 PolarHBondContact O-N 3.37Å; A192-L195 PolarHBondContact O-N 2.73Å; A192-L196 WeakPolarHBondContact O-CG 3.35Å; A192-L196 PolarHBondContact O-N 2.83Å
193	L	94.9	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-45.8	173.4	-86.5	164	0	0	0	112.4	L181 V189 T191 L195 L196 L197 L231 L241 A245 L248	L181-L193 HydrophobicContact CD1-CD2 4.3Å; L181-L193 HydrophobicContact CD2-CB 4.49Å; L181-L193 HydrophobicContact CD2-CD1 4.42Å; L181-L193 HydrophobicContact CD2-CD2 3.99Å; L181-L193 HydrophobicContact CD2-CG 3.59Å; V189-L193 HydrophobicContact CG1-CD1 4.09Å; V189-L193 WeakPolarHBondContact O-CB 3.13Å; V189-L193 PolarHBondContact O-N 3.25Å; T191-L193 PolarHBondContact O-N 3.06Å; L193-L195 VanDerWaalsContact C-N 3.31Å; L193-L195 PolarHBondContact O-N 3.46Å; L193-L196 PolarHBondContact O-N 2.85Å; L193-L197 WeakPolarHBondContact O-CG 3.38Å; L193-L197 PolarHBondContact O-N 3.12Å; L193-L231 HydrophobicContact CD1-CD1 4.25Å; L193-L241 HydrophobicContact CD1-CD1 3.48Å; L193-L241 VanDerWaalsContact CD1-CD1 3.48Å; L193-L241 HydrophobicContact CD1-CG 4.16Å; L193-A245 HydrophobicContact CD1-CB 4.43Å; L193-A245 HydrophobicContact CD2-CB 4.28Å; L193-L248 HydrophobicContact CD2-CD2 3.88Å
194	K	95	Very high	92.3	Very high	31 Å²	31	45.3 Å²	45.3	14%	0.135	21%	0.211	C	C	.	.	H	α-helix	trans	-57.3	-45.5	177	-75.5	-174.8	176.9	-171.7	0	111.4	K190 T191 A192 L197 V198 Y244 D1061 V1064	K190-K194 WeakPolarHBondContact O-CG 3.46Å; K190-K194 PolarHBondContact O-N 3.34Å; K190-K194 VanDerWaalsContact O-N 3.1Å; T191-K194 WeakPolarHBondContact O-CB 3.4Å; T191-K194 PolarHBondContact O-N 3.46Å; A192-K194 PolarHBondContact O-N 3.37Å; K194-L197 PolarHBondContact O-N 3.02Å; K194-V198 WeakPolarHBondContact O-CG2 3.45Å; K194-V198 PolarHBondContact O-N 3.39Å; K194-V198 VanDerWaalsContact O-N 3.09Å; K194-Y244 HydrophobicContact CG-CD2 4.39Å; K194-Y244 HydrophobicContact CG-CE2 4.22Å; K194-D1061 IonicContact NZ-OD1 3.36Å; K194-D1061 PolarHBondContact NZ-OD1 3.06Å; K194-D1061 IonicContact NZ-OD2 3.54Å; K194-V1064 HydrophobicContact CB-CG2 3.62Å; K194-V1064 HydrophobicContact CD-CG2 4.2Å; K194-V1064 HydrophobicContact CG-CB 4.45Å; K194-V1064 HydrophobicContact CG-CG1 4.01Å; K194-V1064 HydrophobicContact CG-CG2 3.72Å
195	L	95.9	Very high	92.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-42.6	178.2	-63	-177.8	0	0	0	112.3	L151 L154 M158 L177 T191 A192 L193 L197 V198 F199 L1060	L151-L195 HydrophobicContact CB-CD1 4.15Å; L151-L195 HydrophobicContact CD2-CD1 3.83Å; L151-L195 WeakPolarHBondContact O-CD1 3.45Å; L154-L195 HydrophobicContact CB-CD1 4.34Å; L154-L195 HydrophobicContact CD2-CD1 4.15Å; L154-L195 HydrophobicContact CG-CD1 4.33Å; M158-L195 WeakPolarHBondContact CE-O 3.34Å; M158-L195 HydrophobicContact SD-CB 4.2Å; M158-L195 HydrophobicContact SD-CD2 4.2Å; L177-L195 HydrophobicContact CD1-CB 4.27Å; L177-L195 HydrophobicContact CD2-CB 4.23Å; L177-L195 HydrophobicContact CD2-CD1 3.87Å; T191-L195 WeakPolarHBondContact O-CG 3.45Å; T191-L195 PolarHBondContact O-N 2.93Å; T191-L195 VanDerWaalsContact O-N 3.11Å; A192-L195 PolarHBondContact O-N 2.73Å; L193-L195 VanDerWaalsContact C-N 3.31Å; L193-L195 PolarHBondContact O-N 3.46Å; L195-L197 VanDerWaalsContact C-N 3.31Å; L195-L197 PolarHBondContact O-N 3.47Å; L195-V198 PolarHBondContact O-N 3.1Å; L195-F199 WeakPolarHBondContact O-CB 3.34Å; L195-F199 PolarHBondContact O-N 3.04Å; L195-L1060 HydrophobicContact CD2-CD1 4.13Å; L195-L1060 HydrophobicContact CD2-CD2 4.23Å
196	L	96.4	Very high	92.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-38.1	176.4	-73	173.6	0	0	0	112.3	I174 L177 L181 A192 L193 F199 V200 L210 L248	I174-L196 HydrophobicContact CG2-CD2 4.25Å; L177-L196 HydrophobicContact CB-CD1 4.39Å; L177-L196 HydrophobicContact CB-CD2 3.73Å; L177-L196 HydrophobicContact CB-CG 3.99Å; L177-L196 HydrophobicContact CD1-CD2 4.16Å; L181-L196 HydrophobicContact CD1-CD1 3.93Å; L181-L196 HydrophobicContact CD2-CD1 4.27Å; L181-L196 HydrophobicContact CG-CD1 4.23Å; A192-L196 WeakPolarHBondContact O-CG 3.35Å; A192-L196 PolarHBondContact O-N 2.83Å; L193-L196 PolarHBondContact O-N 2.85Å; L196-F199 WeakPolarHBondContact O-CB 3.37Å; L196-F199 PolarHBondContact O-N 2.89Å; L196-V200 WeakPolarHBondContact O-CG2 3.41Å; L196-V200 PolarHBondContact O-N 3.17Å; L196-L210 HydrophobicContact CD2-CD1 3.89Å; L196-L248 HydrophobicContact CB-CD1 3.93Å; L196-L248 HydrophobicContact CB-CD2 3.76Å; L196-L248 HydrophobicContact CD1-CD2 3.94Å
197	L	95	Very high	92.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62	-48.5	173.7	-79.8	168.8	0	0	0	111.6	L193 K194 L195 F199 V200 E201 Y244 T247 L248 V1064 A1067 T1068	L193-L197 WeakPolarHBondContact O-CG 3.38Å; L193-L197 PolarHBondContact O-N 3.12Å; K194-L197 PolarHBondContact O-N 3.02Å; L195-L197 VanDerWaalsContact C-N 3.31Å; L195-L197 PolarHBondContact O-N 3.47Å; L197-F199 VanDerWaalsContact C-N 3.25Å; L197-F199 PolarHBondContact O-N 2.91Å; L197-V200 PolarHBondContact O-N 3.31Å; L197-E201 VanDerWaalsContact O-CB 3.27Å; L197-E201 WeakPolarHBondContact O-CB 3.49Å; L197-E201 PolarHBondContact O-N 2.88Å; L197-Y244 HydrophobicContact CD1-CD1 4.07Å; L197-Y244 HydrophobicContact CD1-CG 4.09Å; L197-T247 HydrophobicContact CD2-CG2 3.76Å; L197-L248 HydrophobicContact CD2-CB 3.84Å; L197-L248 HydrophobicContact CD2-CD1 4.2Å; L197-L248 HydrophobicContact CG-CB 4.25Å; L197-L248 HydrophobicContact CG-CD1 4.39Å; L197-V1064 HydrophobicContact CD1-CG1 4.31Å; L197-A1067 HydrophobicContact CB-CB 4.49Å; L197-T1068 HydrophobicContact CD1-CG2 4.11Å
198	V	93.7	Very high	92.8	Very high	11 Å²	11	29 Å²	29	7%	0.067	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-35.9	177.2	174.2	0	0	0	0	111.4	M158 M164 K194 L195 Y202 L1060 L1063 V1064	M158-V198 HydrophobicContact CE-CG1 4.42Å; M164-V198 HydrophobicContact CE-CG1 4.07Å; K194-V198 WeakPolarHBondContact O-CG2 3.45Å; K194-V198 PolarHBondContact O-N 3.39Å; K194-V198 VanDerWaalsContact O-N 3.09Å; L195-V198 PolarHBondContact O-N 3.1Å; V198-Y202 PolarHBondContact O-N 3.43Å; V198-L1060 HydrophobicContact CG2-CD1 3.88Å; V198-L1063 HydrophobicContact CG1-CD1 4.2Å; V198-L1063 HydrophobicContact CG2-CB 3.93Å; V198-V1064 HydrophobicContact CG2-CG2 3.96Å
199	F	95.7	Very high	92.8	Very high	1 Å²	1	31.5 Å²	31.5	0%	0.004	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-50.5	175.2	178.8	-104.9	0	0	0	112.3	M158 M164 V167 I168 I174 L195 L196 L197 E201 Y202 N206 L209	M158-F199 HydrophobicContact CE-CB 3.72Å; M158-F199 HydrophobicContact CE-CD2 4.42Å; M164-F199 HydrophobicContact SD-CD2 3.84Å; M164-F199 HydrophobicContact SD-CE2 4.48Å; V167-F199 HydrophobicContact CG1-CD2 3.98Å; V167-F199 HydrophobicContact CG1-CE2 4.01Å; I168-F199 HydrophobicContact CB-CE2 4.5Å; I168-F199 HydrophobicContact CG1-CE2 3.66Å; I168-F199 HydrophobicContact CG1-CZ 4.31Å; I174-F199 HydrophobicContact CD1-CE1 3.61Å; I174-F199 HydrophobicContact CD1-CE2 3.9Å; I174-F199 HydrophobicContact CD1-CZ 3.2Å; I174-F199 HydrophobicContact CG1-CE1 4.05Å; I174-F199 HydrophobicContact CG1-CE2 4.21Å; I174-F199 HydrophobicContact CG1-CZ 3.86Å; I174-F199 HydrophobicContact CG2-CE1 4.26Å; L195-F199 WeakPolarHBondContact O-CB 3.34Å; L195-F199 PolarHBondContact O-N 3.04Å; L196-F199 WeakPolarHBondContact O-CB 3.37Å; L196-F199 PolarHBondContact O-N 2.89Å; L197-F199 VanDerWaalsContact C-N 3.25Å; L197-F199 PolarHBondContact O-N 2.91Å; F199-E201 VanDerWaalsContact C-N 3.34Å; F199-Y202 PolarHBondContact O-N 3.06Å; F199-N206 HydrophobicContact CD1-CB 3.95Å; F199-N206 HydrophobicContact CE1-CB 3.53Å; F199-N206 WeakPolarHBondContact CE1-O 3.37Å; F199-N206 HydrophobicContact CE2-CB 4.31Å; F199-N206 WeakPolarHBondContact CE2-ND2 3.24Å; F199-N206 HydrophobicContact CG-CB 4.49Å; F199-N206 HydrophobicContact CZ-CB 3.7Å; F199-N206 WeakPolarHBondContact O-CB 3.43Å; F199-N206 PolarHBondContact O-ND2 3.04Å; F199-L209 HydrophobicContact CE1-CB 4.24Å; F199-L209 HydrophobicContact CZ-CB 4.11Å; F199-L209 HydrophobicContact CZ-CD1 4.09Å
200	V	93.1	Very high	92.9	Very high	7 Å²	7	31.5 Å²	31.5	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-68.3	-34.7	-179	172.1	0	0	0	0	111.7	L196 L197 Y202 S207 L210 L248 K251	L196-V200 WeakPolarHBondContact O-CG2 3.41Å; L196-V200 PolarHBondContact O-N 3.17Å; L197-V200 PolarHBondContact O-N 3.31Å; V200-Y202 VanDerWaalsContact C-N 3.3Å; V200-Y202 PolarHBondContact O-N 3.07Å; V200-S207 WeakPolarHBondContact CG1-OG 3.35Å; V200-L210 HydrophobicContact CG2-CB 4.33Å; V200-L210 HydrophobicContact CG2-CD2 3.56Å; V200-L248 HydrophobicContact CB-CD1 4.36Å; V200-L248 HydrophobicContact CG2-CD1 3.85Å; V200-K251 HydrophobicContact CG1-CB 3.88Å
201	E	90.6	Very high	92.8	Very high	86 Å²	86	30.2 Å²	30.2	40%	0.402	16%	0.155	S	C	.	.	H	α-helix	trans	-68.6	-28.3	178.5	-169.9	66.7	174.6	0	0	113.2	L197 F199 T203 K251 A1067	L197-E201 VanDerWaalsContact O-CB 3.27Å; L197-E201 WeakPolarHBondContact O-CB 3.49Å; L197-E201 PolarHBondContact O-N 2.88Å; F199-E201 VanDerWaalsContact C-N 3.34Å; E201-T203 PolarHBondContact O-N 3.25Å; E201-K251 IonicContact OE1-NZ 3.92Å; E201-K251 PolarHBondContact OE1-NZ 3.45Å; E201-K251 WeakPolarHBondContact OE2-CD 3.38Å; E201-K251 WeakPolarHBondContact OE2-CE 3.43Å; E201-K251 IonicContact OE2-NZ 3.81Å; E201-K251 PolarHBondContact OE2-NZ 2.88Å; E201-A1067 HydrophobicContact CB-CB 4.26Å; E201-A1067 HydrophobicContact CG-CB 4.16Å
202	Y	92.1	Very high	92.7	Very high	102 Å²	102	31.3 Å²	31.3	40%	0.4	17%	0.165	S	C	.	.	H	α-helix	trans	-63.7	-41.4	-174.5	-179.3	-101.5	0	0	0	113.4	M164 I168 V198 F199 V200	M164-Y202 HydrophobicContact CB-CE1 4.37Å; M164-Y202 HydrophobicContact CB-CE2 4.43Å; M164-Y202 HydrophobicContact CE-CD2 4.26Å; M164-Y202 HydrophobicContact CE-CG 4.06Å; M164-Y202 HydrophobicContact CG-CD1 3.39Å; M164-Y202 HydrophobicContact CG-CD2 3.88Å; M164-Y202 HydrophobicContact CG-CE1 3.5Å; M164-Y202 HydrophobicContact CG-CE2 3.98Å; M164-Y202 HydrophobicContact CG-CG 3.58Å; M164-Y202 HydrophobicContact SD-CD1 4.24Å; M164-Y202 HydrophobicContact SD-CG 4.17Å; I168-Y202 HydrophobicContact CD1-CD1 3.86Å; I168-Y202 HydrophobicContact CD1-CE1 3.84Å; V198-Y202 PolarHBondContact O-N 3.43Å; F199-Y202 PolarHBondContact O-N 3.06Å; V200-Y202 VanDerWaalsContact C-N 3.3Å; V200-Y202 PolarHBondContact O-N 3.07Å
203	T	88.8	Confident	92.6	Very high	50 Å²	50	31.3 Å²	31.3	31%	0.307	17%	0.165	S	C	.	.			trans	-153.5	141.5	172.5	178.5	0	0	0	0	110.3	I168 E201 S205 N206	I168-T203 HydrophobicContact CD1-CG2 4.36Å; E201-T203 PolarHBondContact O-N 3.25Å; T203-S205 VanDerWaalsContact CG2-OG 3.26Å; T203-S205 WeakPolarHBondContact CG2-OG 3.24Å; T203-S205 PolarHBondContact O-N 3.48Å; T203-S205 VanDerWaalsContact O-N 3.12Å; T203-S205 PolarHBondContact OG1-OG 3.09Å; T203-N206 HydrophobicContact CG2-CB 4.06Å; T203-N206 WeakPolarHBondContact CG2-ND2 3.33Å; T203-N206 WeakPolarHBondContact CG2-OD1 3.49Å; T203-N206 VanDerWaalsContact O-CB 3.23Å; T203-N206 WeakPolarHBondContact O-CB 3.07Å; T203-N206 PolarHBondContact O-N 3.09Å
204	E	84.6	Confident	92.4	Very high	119 Å²	119	31.3 Å²	31.3	56%	0.556	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-32.8	-179.2	-59.7	179.6	175.8	0	0	112.8	N206 S207 R1076	E204-N206 PolarHBondContact O-N 3.08Å; E204-S207 WeakPolarHBondContact O-CB 3.44Å; E204-S207 PolarHBondContact O-N 3.37Å; E204-S207 PolarHBondContact O-OG 3.39Å; E204-R1076 IonicContact OE1-NH1 3.64Å; E204-R1076 IonicContact OE2-CZ 3.55Å; E204-R1076 IonicContact OE2-NH1 2.81Å; E204-R1076 PolarHBondContact OE2-NH1 2.99Å; E204-R1076 IonicContact OE2-NH2 2.75Å; E204-R1076 PolarHBondContact OE2-NH2 3.42Å
205	S	87.8	Confident	92.2	Very high	68 Å²	68	34.6 Å²	34.6	48%	0.476	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.7	177.4	56.4	0	0	0	0	113.3	T203 S207 L208	T203-S205 VanDerWaalsContact CG2-OG 3.26Å; T203-S205 WeakPolarHBondContact CG2-OG 3.24Å; T203-S205 PolarHBondContact O-N 3.48Å; T203-S205 VanDerWaalsContact O-N 3.12Å; T203-S205 PolarHBondContact OG1-OG 3.09Å; S205-S207 PolarHBondContact O-N 3.41Å; S205-L208 PolarHBondContact O-N 3.42Å
206	N	93.9	Very high	91.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.9	-24.2	178.2	-74.8	-0.7	0	0	0	112.2	I168 F199 T203 E204 L208 L209 L210	I168-N206 WeakPolarHBondContact CG1-OD1 3.29Å; F199-N206 HydrophobicContact CD1-CB 3.95Å; F199-N206 HydrophobicContact CE1-CB 3.53Å; F199-N206 WeakPolarHBondContact CE1-O 3.37Å; F199-N206 HydrophobicContact CE2-CB 4.31Å; F199-N206 WeakPolarHBondContact CE2-ND2 3.24Å; F199-N206 HydrophobicContact CG-CB 4.49Å; F199-N206 HydrophobicContact CZ-CB 3.7Å; F199-N206 WeakPolarHBondContact O-CB 3.43Å; F199-N206 PolarHBondContact O-ND2 3.04Å; T203-N206 HydrophobicContact CG2-CB 4.06Å; T203-N206 WeakPolarHBondContact CG2-ND2 3.33Å; T203-N206 WeakPolarHBondContact CG2-OD1 3.49Å; T203-N206 VanDerWaalsContact O-CB 3.23Å; T203-N206 WeakPolarHBondContact O-CB 3.07Å; T203-N206 PolarHBondContact O-N 3.09Å; E204-N206 PolarHBondContact O-N 3.08Å; N206-L208 PolarHBondContact O-N 3.24Å; N206-L209 PolarHBondContact O-N 3.33Å; N206-L209 VanDerWaalsContact O-N 3.12Å; N206-L210 PolarHBondContact O-N 2.69Å
207	S	92.6	Very high	91.3	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-38.3	171.4	-63.6	0	0	0	0	111.9	V200 E204 S205 L210 L211	V200-S207 WeakPolarHBondContact CG1-OG 3.35Å; E204-S207 WeakPolarHBondContact O-CB 3.44Å; E204-S207 PolarHBondContact O-N 3.37Å; E204-S207 PolarHBondContact O-OG 3.39Å; S205-S207 PolarHBondContact O-N 3.41Å; S207-L210 PolarHBondContact O-N 3.29Å; S207-L211 WeakPolarHBondContact O-CB 3.43Å; S207-L211 PolarHBondContact O-N 2.98Å
208	L	91.7	Very high	90.9	Very high	69 Å²	69	40.3 Å²	40.3	36%	0.361	21%	0.212	S	C	.	.	H	α-helix	trans	-72.2	-33	177.4	-61.5	179.5	0	0	0	112.4	S205 N206 L211 A212 P257	S205-L208 PolarHBondContact O-N 3.42Å; N206-L208 PolarHBondContact O-N 3.24Å; L208-L211 WeakPolarHBondContact O-CB 3.42Å; L208-L211 PolarHBondContact O-N 3.05Å; L208-A212 PolarHBondContact O-N 3.29Å; L208-P257 HydrophobicContact CD1-CG 4.43Å
209	L	93.3	Very high	90.1	Very high	54 Å²	54	50 Å²	50	28%	0.283	25%	0.247	S	C	.	.	H	α-helix	trans	-69.2	-41.7	174.6	-62.8	177.7	0	0	0	111.1	I168 I174 F199 N206 L211 A212 A213	I168-L209 HydrophobicContact CB-CD1 4.45Å; I168-L209 HydrophobicContact CG2-CD1 3.7Å; I174-L209 HydrophobicContact CD1-CB 3.95Å; F199-L209 HydrophobicContact CE1-CB 4.24Å; F199-L209 HydrophobicContact CZ-CB 4.11Å; F199-L209 HydrophobicContact CZ-CD1 4.09Å; N206-L209 PolarHBondContact O-N 3.33Å; N206-L209 VanDerWaalsContact O-N 3.12Å; L209-L211 VanDerWaalsContact C-N 3.34Å; L209-A212 PolarHBondContact O-N 3.18Å; L209-A213 WeakPolarHBondContact O-CB 3.23Å; L209-A213 PolarHBondContact O-N 3.45Å
210	L	94.7	Very high	88.6	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-43.6	172	179.9	57	0	0	0	111	I174 L196 V200 N206 S207 A212 A213 V214 L248 T252	I174-L210 HydrophobicContact CG2-CB 4.43Å; I174-L210 HydrophobicContact CG2-CD1 3.77Å; L196-L210 HydrophobicContact CD2-CD1 3.89Å; V200-L210 HydrophobicContact CG2-CB 4.33Å; V200-L210 HydrophobicContact CG2-CD2 3.56Å; N206-L210 PolarHBondContact O-N 2.69Å; S207-L210 PolarHBondContact O-N 3.29Å; L210-A212 PolarHBondContact O-N 2.91Å; L210-A213 WeakPolarHBondContact O-CB 3.43Å; L210-A213 PolarHBondContact O-N 3.19Å; L210-A213 VanDerWaalsContact O-N 3.15Å; L210-V214 HydrophobicContact CD1-CG2 4.16Å; L210-V214 HydrophobicContact CG-CG2 4.36Å; L210-V214 VanDerWaalsContact O-CG2 3.28Å; L210-V214 WeakPolarHBondContact O-CG2 3.46Å; L210-V214 PolarHBondContact O-N 3.27Å; L210-L248 HydrophobicContact CD2-CD1 3.83Å; L210-L248 HydrophobicContact CD2-CD2 4.45Å; L210-L248 HydrophobicContact CD2-CG 4.23Å; L210-T252 HydrophobicContact CD2-CG2 4.33Å; L210-T252 WeakPolarHBondContact CD2-OG1 3.04Å
211	L	91.4	Very high	87.4	Confident	15 Å²	15	67.2 Å²	67.2	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-57.3	-48.3	175.8	-177.5	64.9	0	0	0	111.8	S207 L208 L209 A213 V214 Y215 W225 T261 I265	S207-L211 WeakPolarHBondContact O-CB 3.43Å; S207-L211 PolarHBondContact O-N 2.98Å; L208-L211 WeakPolarHBondContact O-CB 3.42Å; L208-L211 PolarHBondContact O-N 3.05Å; L209-L211 VanDerWaalsContact C-N 3.34Å; L211-A213 VanDerWaalsContact C-N 3.31Å; L211-A213 PolarHBondContact O-N 3.26Å; L211-V214 PolarHBondContact O-N 2.96Å; L211-Y215 HydrophobicContact CD1-CD2 3.92Å; L211-Y215 HydrophobicContact CD1-CE2 3.63Å; L211-Y215 HydrophobicContact CG-CD2 4.01Å; L211-Y215 HydrophobicContact CG-CE2 3.98Å; L211-Y215 WeakPolarHBondContact O-CD2 3.27Å; L211-Y215 PolarHBondContact O-N 3.43Å; L211-W225 HydrophobicContact CD1-CZ2 4.04Å; L211-T261 HydrophobicContact CD2-CG2 3.46Å; L211-T261 VanDerWaalsContact CD2-CG2 3.46Å; L211-I265 HydrophobicContact CD1-CD1 3.53Å; L211-I265 HydrophobicContact CD1-CG1 3.66Å; L211-I265 HydrophobicContact CD2-CD1 3.91Å; L211-I265 HydrophobicContact CG-CD1 4.35Å
212	A	91.3	Very high	86.3	Confident	41 Å²	41	66.6 Å²	66.6	34%	0.339	34%	0.336	S	S	.	.	H	α-helix	trans	-59.6	-42.3	176	0	0	0	0	0	111.6	L208 L209 L210 Y215 I216	L208-A212 PolarHBondContact O-N 3.29Å; L209-A212 PolarHBondContact O-N 3.18Å; L210-A212 PolarHBondContact O-N 2.91Å; A212-Y215 PolarHBondContact O-N 2.99Å; A212-I216 WeakPolarHBondContact O-CD1 3.49Å; A212-I216 VanDerWaalsContact O-CG1 3.23Å; A212-I216 WeakPolarHBondContact O-CG1 3.34Å; A212-I216 PolarHBondContact O-N 3.1Å; A212-I216 VanDerWaalsContact O-N 3.13Å
213	A	91.9	Very high	85.7	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.8	-42.7	177.1	0	0	0	0	0	112.7	I174 Q175 L209 L210 L211 I216 A217	I174-A213 HydrophobicContact CB-CB 3.95Å; I174-A213 HydrophobicContact CG2-CB 3.61Å; Q175-A213 HydrophobicContact CB-CB 4.46Å; Q175-A213 HydrophobicContact CG-CB 3.69Å; L209-A213 WeakPolarHBondContact O-CB 3.23Å; L209-A213 PolarHBondContact O-N 3.45Å; L210-A213 WeakPolarHBondContact O-CB 3.43Å; L210-A213 PolarHBondContact O-N 3.19Å; L210-A213 VanDerWaalsContact O-N 3.15Å; L211-A213 VanDerWaalsContact C-N 3.31Å; L211-A213 PolarHBondContact O-N 3.26Å; A213-I216 PolarHBondContact O-N 2.88Å; A213-A217 VanDerWaalsContact O-CB 3.28Å; A213-A217 WeakPolarHBondContact O-CB 3.28Å; A213-A217 PolarHBondContact O-N 3.34Å
214	V	92	Very high	85.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-49	176.2	171.3	0	0	0	0	110.8	Y178 L210 L211 I216 A217 D218 P224 W225	Y178-V214 HydrophobicContact CD1-CG2 4.21Å; Y178-V214 HydrophobicContact CD2-CG2 3.69Å; Y178-V214 HydrophobicContact CE1-CB 4.34Å; Y178-V214 HydrophobicContact CE1-CG1 4.12Å; Y178-V214 HydrophobicContact CE1-CG2 4.17Å; Y178-V214 HydrophobicContact CE2-CG1 4.37Å; Y178-V214 HydrophobicContact CE2-CG2 3.67Å; Y178-V214 HydrophobicContact CG-CG2 3.97Å; L210-V214 HydrophobicContact CD1-CG2 4.16Å; L210-V214 HydrophobicContact CG-CG2 4.36Å; L210-V214 VanDerWaalsContact O-CG2 3.28Å; L210-V214 WeakPolarHBondContact O-CG2 3.46Å; L210-V214 PolarHBondContact O-N 3.27Å; L211-V214 PolarHBondContact O-N 2.96Å; V214-I216 VanDerWaalsContact C-N 3.29Å; V214-I216 PolarHBondContact O-N 3.43Å; V214-A217 PolarHBondContact O-N 3.36Å; V214-D218 WeakPolarHBondContact O-CB 3.47Å; V214-D218 PolarHBondContact O-N 3.03Å; V214-P224 HydrophobicContact CG1-CB 4.1Å; V214-W225 HydrophobicContact CG1-CD2 4.05Å; V214-W225 HydrophobicContact CG1-CG 4.08Å; V214-W225 HydrophobicContact CG2-CE3 4.47Å; V214-W225 HydrophobicContact CG2-CH2 4.39Å; V214-W225 HydrophobicContact CG2-CZ2 4.45Å; V214-W225 HydrophobicContact CG2-CZ3 4.39Å
215	Y	88.8	Confident	85.9	Confident	101 Å²	101	56.3 Å²	56.3	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-61.4	-36.3	179.4	-90.7	-73.6	0	0	0	113.1	L211 A212 R219 P224	L211-Y215 HydrophobicContact CD1-CD2 3.92Å; L211-Y215 HydrophobicContact CD1-CE2 3.63Å; L211-Y215 HydrophobicContact CG-CD2 4.01Å; L211-Y215 HydrophobicContact CG-CE2 3.98Å; L211-Y215 WeakPolarHBondContact O-CD2 3.27Å; L211-Y215 PolarHBondContact O-N 3.43Å; A212-Y215 PolarHBondContact O-N 2.99Å; Y215-R219 WeakPolarHBondContact O-CB 3.45Å; Y215-R219 PolarHBondContact O-N 3.06Å; Y215-P224 HydrophobicContact CD1-CB 4.23Å; Y215-P224 HydrophobicContact CE1-CB 4.1Å; Y215-P224 HydrophobicContact CE1-CG 4.01Å
216	I	87.9	Confident	86	Confident	84 Å²	84	54.8 Å²	54.8	43%	0.431	28%	0.282	S	S	.	.	H	α-helix	trans	-72.6	-46.3	177.2	-62.9	166.8	0	0	0	110	A212 A213 V214 R219	A212-I216 WeakPolarHBondContact O-CD1 3.49Å; A212-I216 VanDerWaalsContact O-CG1 3.23Å; A212-I216 WeakPolarHBondContact O-CG1 3.34Å; A212-I216 PolarHBondContact O-N 3.1Å; A212-I216 VanDerWaalsContact O-N 3.13Å; A213-I216 PolarHBondContact O-N 2.88Å; V214-I216 VanDerWaalsContact C-N 3.29Å; V214-I216 PolarHBondContact O-N 3.43Å; I216-R219 WeakPolarHBondContact O-CB 3.48Å; I216-R219 PolarHBondContact O-N 3.29Å
217	A	86.8	Confident	85.8	Confident	32 Å²	32	55.3 Å²	55.3	26%	0.264	28%	0.284	S	S	.	.	H	α-helix	trans	-66.5	-39.1	-176.3	0	0	0	0	0	113.2	Y178 A213 V214	Y178-A217 HydrophobicContact CD1-CB 3.65Å; Y178-A217 HydrophobicContact CE1-CB 4.07Å; A213-A217 VanDerWaalsContact O-CB 3.28Å; A213-A217 WeakPolarHBondContact O-CB 3.28Å; A213-A217 PolarHBondContact O-N 3.34Å; V214-A217 PolarHBondContact O-N 3.36Å
218	D	86.2	Confident	85.7	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	1.5	-179.1	-73.6	-26.7	0	0	0	113.6	Y178 V214 E220 R221 G222 W225 N226	Y178-D218 VanDerWaalsContact CE1-OD2 3.32Å; Y178-D218 WeakPolarHBondContact CE1-OD2 3.29Å; Y178-D218 PolarHBondContact OH-OD2 3.02Å; V214-D218 WeakPolarHBondContact O-CB 3.47Å; V214-D218 PolarHBondContact O-N 3.03Å; D218-E220 PolarHBondContact O-N 2.87Å; D218-R221 PolarHBondContact O-N 3.39Å; D218-G222 PolarHBondContact O-N 2.97Å; D218-G222 VanDerWaalsContact O-N 3.15Å; D218-W225 PolarHBondContact OD2-N 3.28Å; D218-N226 PolarHBondContact OD2-N 3.47Å
219	R	77.7	Confident	85.6	Confident	214 Å²	214	52 Å²	52	81%	0.808	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.4	-178.1	-163.4	176.7	175.5	-169.9	-1.7	113.2	Y215 I216	Y215-R219 WeakPolarHBondContact O-CB 3.45Å; Y215-R219 PolarHBondContact O-N 3.06Å; I216-R219 WeakPolarHBondContact O-CB 3.48Å; I216-R219 PolarHBondContact O-N 3.29Å
220	E	63.1	Low	85.4	Confident	194 Å²	194	53.2 Å²	53.2	91%	0.907	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-21.8	177.1	-62.7	-171	163.2	0	0	113.8	D218	D218-E220 PolarHBondContact O-N 2.87Å
221	R	69	Low	85.1	Confident	176 Å²	176	53.9 Å²	53.9	66%	0.664	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-10	-174.6	-65.8	-179.4	-179.9	-99.9	0.7	113.5	D218 A223	D218-R221 PolarHBondContact O-N 3.39Å; R221-A223 PolarHBondContact O-N 3.25Å
222	G	67.6	Low	84.9	Confident	72 Å²	72	53.3 Å²	53.3	74%	0.742	27%	0.274	S	S	*	.	S	Bend	trans	98.8	-40.4	166.6	0	0	0	0	0	115.1	D218	D218-G222 PolarHBondContact O-N 2.97Å; D218-G222 VanDerWaalsContact O-N 3.15Å
223	A	79.6	Confident	84.6	Confident	31 Å²	31	53.4 Å²	53.4	26%	0.256	27%	0.269	S	S	.	.	S	Bend	trans	-118.1	127.5	178.6	0	0	0	0	0	111	R221 N226 Q272	R221-A223 PolarHBondContact O-N 3.25Å; A223-N226 WeakPolarHBondContact O-CB 3.17Å; A223-Q272 HydrophobicContact CB-CG 4.17Å
224	P	86.9	Confident	84.1	Confident	23 Å²	23	58.1 Å²	58.1	15%	0.149	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	151.9	175	30.8	-34.4	0	0	0	109.8	V214 Y215 N226 A268 Q272	V214-P224 HydrophobicContact CG1-CB 4.1Å; Y215-P224 HydrophobicContact CD1-CB 4.23Å; Y215-P224 HydrophobicContact CE1-CB 4.1Å; Y215-P224 HydrophobicContact CE1-CG 4.01Å; P224-N226 VanDerWaalsContact C-N 3.28Å; P224-N226 PolarHBondContact O-N 3.16Å; P224-A268 HydrophobicContact CG-CB 3.75Å; P224-Q272 PolarHBondContact O-NE2 2.95Å
225	W	90.1	Very high	83	Confident	1 Å²	1	67 Å²	67	0%	0.004	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	8.6	-178.3	-55.2	92.3	0	0	0	115.5	Y178 L211 V214 D218 N227 L228 M229 L249 T252 I265 L269	Y178-W225 WeakPolarHBondContact OH-CA 3.39Å; Y178-W225 PolarHBondContact OH-N 3.24Å; L211-W225 HydrophobicContact CD1-CZ2 4.04Å; V214-W225 HydrophobicContact CG1-CD2 4.05Å; V214-W225 HydrophobicContact CG1-CG 4.08Å; V214-W225 HydrophobicContact CG2-CE3 4.47Å; V214-W225 HydrophobicContact CG2-CH2 4.39Å; V214-W225 HydrophobicContact CG2-CZ2 4.45Å; V214-W225 HydrophobicContact CG2-CZ3 4.39Å; D218-W225 PolarHBondContact OD2-N 3.28Å; W225-N227 VanDerWaalsContact C-N 3.34Å; W225-N227 PolarHBondContact O-N 3.04Å; W225-L228 HydrophobicContact CE3-CB 4.33Å; W225-L228 HydrophobicContact CE3-CD1 4.07Å; W225-L228 HydrophobicContact CZ3-CD1 4.02Å; W225-L228 PolarHBondContact O-N 3.19Å; W225-L228 VanDerWaalsContact O-N 3.11Å; W225-M229 PolarHBondContact O-N 3.19Å; W225-L249 HydrophobicContact CD2-CD1 4.18Å; W225-L249 HydrophobicContact CE3-CD1 3.7Å; W225-L249 HydrophobicContact CH2-CD1 4.19Å; W225-L249 HydrophobicContact CZ3-CD1 3.71Å; W225-T252 HydrophobicContact CH2-CG2 3.63Å; W225-T252 HydrophobicContact CZ2-CG2 4.07Å; W225-I265 HydrophobicContact CZ2-CG2 4.18Å; W225-L269 HydrophobicContact CB-CD2 3.62Å; W225-L269 HydrophobicContact CD2-CD2 4.41Å; W225-L269 HydrophobicContact CG-CD2 3.85Å
226	N	89.7	Confident	81.9	Confident	36 Å²	36	63 Å²	63	19%	0.193	32%	0.319	C	S	.	.	H	α-helix	trans	-58.3	-41.1	-176	173	68.3	0	0	0	113.3	Y178 D218 A223 P224 L228 M229 N230	Y178-N226 PolarHBondContact OH-N 2.94Å; D218-N226 PolarHBondContact OD2-N 3.47Å; A223-N226 WeakPolarHBondContact O-CB 3.17Å; P224-N226 VanDerWaalsContact C-N 3.28Å; P224-N226 PolarHBondContact O-N 3.16Å; N226-L228 VanDerWaalsContact C-N 3.32Å; N226-L228 PolarHBondContact O-N 3.35Å; N226-M229 PolarHBondContact O-N 2.93Å; N226-N230 PolarHBondContact ND2-ND2 3.38Å; N226-N230 WeakPolarHBondContact O-CB 3.38Å; N226-N230 PolarHBondContact O-N 3.46Å; N226-N230 PolarHBondContact O-ND2 3.34Å; N226-N230 PolarHBondContact OD1-ND2 3.02Å
227	N	88.9	Confident	80.9	Confident	11 Å²	11	64.1 Å²	64.1	6%	0.059	33%	0.334	C	S	.	.	H	α-helix	trans	-64.6	-40	178.9	-64.8	-28.6	0	0	0	111.7	Y178 L181 W225 L231	Y178-N227 HydrophobicContact CE1-CB 4.49Å; Y178-N227 HydrophobicContact CE2-CB 4.37Å; Y178-N227 PolarHBondContact O-ND2 3.44Å; Y178-N227 PolarHBondContact OH-N 3.24Å; L181-N227 HydrophobicContact CB-CB 3.87Å; W225-N227 VanDerWaalsContact C-N 3.34Å; W225-N227 PolarHBondContact O-N 3.04Å; N227-L231 WeakPolarHBondContact O-CG 3.28Å; N227-L231 PolarHBondContact O-N 3.37Å
228	L	91	Very high	80.7	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-72.3	-41.3	180	-164.8	146.1	0	0	0	111.1	W225 N226 N230 L231 L232 A245 L248 L249	W225-L228 HydrophobicContact CE3-CB 4.33Å; W225-L228 HydrophobicContact CE3-CD1 4.07Å; W225-L228 HydrophobicContact CZ3-CD1 4.02Å; W225-L228 PolarHBondContact O-N 3.19Å; W225-L228 VanDerWaalsContact O-N 3.11Å; N226-L228 VanDerWaalsContact C-N 3.32Å; N226-L228 PolarHBondContact O-N 3.35Å; L228-N230 PolarHBondContact O-N 3.16Å; L228-L231 WeakPolarHBondContact O-CB 3.34Å; L228-L231 PolarHBondContact O-N 2.98Å; L228-L232 HydrophobicContact CD2-CD1 3.67Å; L228-L232 HydrophobicContact CD2-CG 4.16Å; L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 2.91Å; L228-L232 VanDerWaalsContact O-N 3.08Å; L228-A245 HydrophobicContact CG-CB 4.49Å; L228-L248 HydrophobicContact CD1-CD2 4.1Å; L228-L248 HydrophobicContact CD1-CG 4.49Å; L228-L249 HydrophobicContact CD2-CB 4.11Å; L228-L249 HydrophobicContact CD2-CD1 4.18Å; L228-L249 HydrophobicContact CD2-CD2 4.21Å; L228-L249 HydrophobicContact CD2-CG 4.42Å
229	M	89.6	Confident	80.7	Confident	1 Å²	1	67 Å²	67	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-63.7	-38.8	175.2	-77.1	-55.3	-58.6	0	0	112.5	W225 N226 L231 L232 N233 L269 Q272 M274 A277	W225-M229 PolarHBondContact O-N 3.19Å; N226-M229 PolarHBondContact O-N 2.93Å; M229-L231 VanDerWaalsContact C-N 3.31Å; M229-L231 PolarHBondContact O-N 3.42Å; M229-L232 PolarHBondContact O-N 3.48Å; M229-L232 HydrophobicContact SD-CD1 4.32Å; M229-N233 WeakPolarHBondContact O-CB 3.3Å; M229-N233 VanDerWaalsContact O-CG 3.29Å; M229-N233 PolarHBondContact O-N 2.93Å; M229-N233 PolarHBondContact O-ND2 3.47Å; M229-L269 HydrophobicContact CG-CD2 3.98Å; M229-L269 HydrophobicContact SD-CD2 3.84Å; M229-Q272 HydrophobicContact CB-CB 4.27Å; M229-Q272 HydrophobicContact CE-CB 4.14Å; M229-Q272 WeakPolarHBondContact CE-O 3.38Å; M229-Q272 HydrophobicContact CG-CB 3.9Å; M229-M274 HydrophobicContact CE-CB 4.16Å; M229-M274 HydrophobicContact CE-SD 4.1Å; M229-M274 HydrophobicContact SD-CB 4.42Å; M229-M274 HydrophobicContact SD-SD 3.64Å; M229-M274 VanDerWaalsContact SD-SD 3.64Å; M229-A277 HydrophobicContact CE-CB 4.41Å
230	N	88.7	Confident	81.1	Confident	80 Å²	80	61.1 Å²	61.1	43%	0.428	33%	0.329	S	S	.	.	H	α-helix	trans	-61.2	-40.7	173.9	-74.3	-40.7	0	0	0	111.7	N226 L228 L232 N233 E234	N226-N230 PolarHBondContact ND2-ND2 3.38Å; N226-N230 WeakPolarHBondContact O-CB 3.38Å; N226-N230 PolarHBondContact O-N 3.46Å; N226-N230 PolarHBondContact O-ND2 3.34Å; N226-N230 PolarHBondContact OD1-ND2 3.02Å; L228-N230 PolarHBondContact O-N 3.16Å; N230-L232 PolarHBondContact O-N 2.81Å; N230-N233 PolarHBondContact O-N 2.7Å; N230-E234 WeakPolarHBondContact O-CB 3.4Å; N230-E234 PolarHBondContact O-N 3.46Å
231	L	89.2	Confident	82.4	Confident	16 Å²	16	52.1 Å²	52.1	8%	0.084	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-37.7	175.7	-69	173.5	0	0	0	113.1	L181 V189 L193 N227 L228 M229 L241 L242	L181-L231 HydrophobicContact CB-CD1 4.04Å; V189-L231 HydrophobicContact CG1-CD1 3.64Å; V189-L231 HydrophobicContact CG1-CD2 3.78Å; V189-L231 HydrophobicContact CG1-CG 4.38Å; L193-L231 HydrophobicContact CD1-CD1 4.25Å; N227-L231 WeakPolarHBondContact O-CG 3.28Å; N227-L231 PolarHBondContact O-N 3.37Å; L228-L231 WeakPolarHBondContact O-CB 3.34Å; L228-L231 PolarHBondContact O-N 2.98Å; M229-L231 VanDerWaalsContact C-N 3.31Å; M229-L231 PolarHBondContact O-N 3.42Å; L231-L241 HydrophobicContact CD2-CD2 4.44Å; L231-L242 VanDerWaalsContact O-CD2 3.29Å; L231-L242 WeakPolarHBondContact O-CD2 3.41Å
232	L	87.6	Confident	83.4	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-75	-29.9	176.7	-64.8	179.2	0	0	0	112.5	L228 M229 N230 L242 A245 L246 L249 M274 A277 L281	L228-L232 HydrophobicContact CD2-CD1 3.67Å; L228-L232 HydrophobicContact CD2-CG 4.16Å; L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 2.91Å; L228-L232 VanDerWaalsContact O-N 3.08Å; M229-L232 PolarHBondContact O-N 3.48Å; M229-L232 HydrophobicContact SD-CD1 4.32Å; N230-L232 PolarHBondContact O-N 2.81Å; L232-L242 HydrophobicContact CD2-CD2 4.47Å; L232-A245 HydrophobicContact CD2-CB 3.82Å; L232-A245 HydrophobicContact CG-CB 4.43Å; L232-L246 HydrophobicContact CD1-CD1 4.46Å; L232-L246 HydrophobicContact CD2-CB 4.25Å; L232-L249 HydrophobicContact CD1-CD2 4.46Å; L232-M274 HydrophobicContact CD1-CE 4.13Å; L232-M274 HydrophobicContact CD1-SD 4.06Å; L232-A277 HydrophobicContact CB-CB 4.47Å; L232-L281 HydrophobicContact CB-CD1 4.44Å; L232-L281 HydrophobicContact CD2-CD1 3.98Å
233	N	85.2	Confident	84.5	Confident	44 Å²	44	41.4 Å²	41.4	24%	0.235	23%	0.226	C	C	.	.	H	α-helix	trans	-84.9	-28.1	-178.5	-78.1	-31.1	0	0	0	113.4	M229 N230 Q272 A277 R280	M229-N233 WeakPolarHBondContact O-CB 3.3Å; M229-N233 VanDerWaalsContact O-CG 3.29Å; M229-N233 PolarHBondContact O-N 2.93Å; M229-N233 PolarHBondContact O-ND2 3.47Å; N230-N233 PolarHBondContact O-N 2.7Å; N233-Q272 PolarHBondContact ND2-O 2.83Å; N233-A277 WeakPolarHBondContact OD1-CB 3.36Å; N233-R280 PolarHBondContact O-NH1 2.87Å; N233-R280 PolarHBondContact OD1-NH2 3.49Å
234	E	80.2	Confident	85.1	Confident	99 Å²	99	41.2 Å²	41.2	46%	0.463	22%	0.219	S	C	.	.	S	Bend	trans	-63.3	139.6	177.4	-164	-177.8	145.1	0	0	110.5	R186 N230 C236	R186-E234 IonicContact CZ-OE1 2.8Å; R186-E234 IonicContact NH2-OE1 3.63Å; R186-E234 PolarHBondContact NH2-OE1 2.92Å; N230-E234 WeakPolarHBondContact O-CB 3.4Å; N230-E234 PolarHBondContact O-N 3.46Å; E234-C236 PolarHBondContact O-N 2.84Å
235	E	70.1	Confident	85.4	Confident	186 Å²	186	40.1 Å²	40.1	87%	0.869	21%	0.212	S	C	*	.			trans	-70.7	72.1	169.9	-69.2	-174.2	170	0	0	109.5
236	C	64.7	Low	85.5	Confident	17 Å²	17	40.1 Å²	40.1	12%	0.115	21%	0.212	C	C	.	.			trans	-82.4	128.3	-179.8	-168.6	0	0	0	0	110.2	E234 D238 L242	E234-C236 PolarHBondContact O-N 2.84Å; C236-D238 VanDerWaalsContact C-N 3.25Å; C236-D238 PolarHBondContact O-N 3.33Å; C236-D238 PolarHBondContact SG-N 3.19Å; C236-D238 VanDerWaalsContact SG-N 3.4Å; C236-L242 HydrophobicContact CB-CD2 4.29Å; C236-L242 HydrophobicContact CB-CG 4.43Å
237	S	67.3	Low	85.7	Confident	107 Å²	107	38.4 Å²	38.4	75%	0.748	20%	0.203	S	C	*	.	S	Bend	trans	-74.7	-13	172.3	49.7	0	0	0	0	113.6	T239	S237-T239 PolarHBondContact O-N 2.9Å
238	D	82.8	Confident	85.9	Confident	44 Å²	44	38 Å²	38	24%	0.235	20%	0.2	C	C	.	.			trans	-90.9	95.5	179.6	-169.8	-15.1	0	0	0	110.6	K190 C236 E240 L241 L242	K190-D238 IonicContact NZ-OD2 2.92Å; C236-D238 VanDerWaalsContact C-N 3.25Å; C236-D238 PolarHBondContact O-N 3.33Å; C236-D238 PolarHBondContact SG-N 3.19Å; C236-D238 VanDerWaalsContact SG-N 3.4Å; D238-E240 VanDerWaalsContact C-N 3.26Å; D238-E240 PolarHBondContact O-N 3.03Å; D238-E240 WeakPolarHBondContact OD1-CB 3.43Å; D238-E240 PolarHBondContact OD1-N 3.03Å; D238-L241 HydrophobicContact CB-CB 3.97Å; D238-L241 WeakPolarHBondContact O-CB 3.06Å; D238-L241 PolarHBondContact O-N 2.63Å; D238-L241 PolarHBondContact OD1-N 3.4Å; D238-L242 PolarHBondContact O-N 3.07Å
239	T	85.1	Confident	86	Confident	54 Å²	54	38 Å²	38	33%	0.331	20%	0.2	S	C	.	.	H	α-helix	trans	-63.5	-29.7	178.1	51.3	0	0	0	0	113	S237 L241 L242 I243 T286	S237-T239 PolarHBondContact O-N 2.9Å; T239-L241 VanDerWaalsContact C-N 3.35Å; T239-L242 PolarHBondContact O-N 3.37Å; T239-I243 VanDerWaalsContact O-CG1 3.29Å; T239-I243 WeakPolarHBondContact O-CG1 3.16Å; T239-I243 PolarHBondContact O-N 3.28Å; T239-T286 HydrophobicContact CG2-CG2 4.09Å
240	E	86.7	Confident	86.2	Confident	90 Å²	90	38.4 Å²	38.4	42%	0.421	20%	0.203	S	C	.	.	H	α-helix	trans	-67.9	-39.2	177.6	-65.4	-175.2	169.2	0	0	111.1	K190 D238 L242 I243 Y244	K190-E240 WeakPolarHBondContact CE-OE2 3.46Å; K190-E240 IonicContact NZ-OE2 2.65Å; K190-E240 PolarHBondContact NZ-OE2 2.78Å; D238-E240 VanDerWaalsContact C-N 3.26Å; D238-E240 PolarHBondContact O-N 3.03Å; D238-E240 WeakPolarHBondContact OD1-CB 3.43Å; D238-E240 PolarHBondContact OD1-N 3.03Å; E240-L242 VanDerWaalsContact C-N 3.28Å; E240-L242 PolarHBondContact O-N 3.49Å; E240-I243 WeakPolarHBondContact O-CB 3.33Å; E240-I243 PolarHBondContact O-N 3.43Å; E240-Y244 HydrophobicContact CB-CE2 4.35Å; E240-Y244 VanDerWaalsContact O-CG 3.27Å; E240-Y244 PolarHBondContact O-N 2.88Å
241	L	89.7	Confident	86.3	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-59.3	-42.9	176.8	-168.3	71	0	0	0	111.3	V189 K190 L193 L231 D238 T239 Y244 A245	V189-L241 HydrophobicContact CG1-CD1 4.11Å; K190-L241 HydrophobicContact CB-CD1 3.89Å; K190-L241 HydrophobicContact CG-CD1 4.25Å; L193-L241 HydrophobicContact CD1-CD1 3.48Å; L193-L241 VanDerWaalsContact CD1-CD1 3.48Å; L193-L241 HydrophobicContact CD1-CG 4.16Å; L231-L241 HydrophobicContact CD2-CD2 4.44Å; D238-L241 HydrophobicContact CB-CB 3.97Å; D238-L241 WeakPolarHBondContact O-CB 3.06Å; D238-L241 PolarHBondContact O-N 2.63Å; D238-L241 PolarHBondContact OD1-N 3.4Å; T239-L241 VanDerWaalsContact C-N 3.35Å; L241-Y244 PolarHBondContact O-N 3.49Å; L241-A245 WeakPolarHBondContact O-CB 3.48Å; L241-A245 PolarHBondContact O-N 2.76Å
242	L	90.3	Very high	86.5	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-40.4	176.5	-63	172.3	0	0	0	111.7	L231 L232 C236 D238 T239 E240 A245 L246 L281 L284 L289	L231-L242 VanDerWaalsContact O-CD2 3.29Å; L231-L242 WeakPolarHBondContact O-CD2 3.41Å; L232-L242 HydrophobicContact CD2-CD2 4.47Å; C236-L242 HydrophobicContact CB-CD2 4.29Å; C236-L242 HydrophobicContact CB-CG 4.43Å; D238-L242 PolarHBondContact O-N 3.07Å; T239-L242 PolarHBondContact O-N 3.37Å; E240-L242 VanDerWaalsContact C-N 3.28Å; E240-L242 PolarHBondContact O-N 3.49Å; L242-A245 PolarHBondContact O-N 3.4Å; L242-L246 WeakPolarHBondContact O-CB 3.36Å; L242-L246 PolarHBondContact O-N 2.96Å; L242-L281 HydrophobicContact CB-CD2 4.32Å; L242-L281 HydrophobicContact CD1-CD2 3.72Å; L242-L281 HydrophobicContact CD2-CD2 4.03Å; L242-L281 HydrophobicContact CG-CD2 4.24Å; L242-L284 HydrophobicContact CD1-CD1 3.94Å; L242-L289 HydrophobicContact CB-CD1 4.13Å; L242-L289 HydrophobicContact CB-CD2 4.49Å
243	I	90.3	Very high	86.6	Confident	19 Å²	19	34.8 Å²	34.8	10%	0.097	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-46.6	174.6	-68.5	162.6	0	0	0	110.3	T239 E240 L246 T247 E288 L289 T1068	T239-I243 VanDerWaalsContact O-CG1 3.29Å; T239-I243 WeakPolarHBondContact O-CG1 3.16Å; T239-I243 PolarHBondContact O-N 3.28Å; E240-I243 WeakPolarHBondContact O-CB 3.33Å; E240-I243 PolarHBondContact O-N 3.43Å; I243-L246 PolarHBondContact O-N 2.85Å; I243-T247 WeakPolarHBondContact O-CB 3.47Å; I243-T247 PolarHBondContact O-N 3.22Å; I243-T247 PolarHBondContact O-OG1 3.12Å; I243-E288 HydrophobicContact CD1-CB 3.91Å; I243-L289 HydrophobicContact CG1-CB 3.92Å; I243-L289 HydrophobicContact CG1-CD1 4.04Å; I243-T1068 HydrophobicContact CG2-CG2 4.42Å
244	Y	92.8	Very high	86.8	Confident	28 Å²	28	34.2 Å²	34.2	11%	0.11	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-43.4	-179.9	-61.9	-19.6	0	0	0	112.3	K190 K194 L197 E240 L241 L248 V1064 T1068	K190-Y244 HydrophobicContact CG-CD2 4.41Å; K190-Y244 HydrophobicContact CG-CE2 4.29Å; K194-Y244 HydrophobicContact CG-CD2 4.39Å; K194-Y244 HydrophobicContact CG-CE2 4.22Å; L197-Y244 HydrophobicContact CD1-CD1 4.07Å; L197-Y244 HydrophobicContact CD1-CG 4.09Å; E240-Y244 HydrophobicContact CB-CE2 4.35Å; E240-Y244 VanDerWaalsContact O-CG 3.27Å; E240-Y244 PolarHBondContact O-N 2.88Å; L241-Y244 PolarHBondContact O-N 3.49Å; Y244-L248 WeakPolarHBondContact O-CB 3.3Å; Y244-L248 PolarHBondContact O-N 3Å; Y244-V1064 HydrophobicContact CD1-CG1 4.17Å; Y244-V1064 HydrophobicContact CE1-CG1 3.66Å; Y244-V1064 HydrophobicContact CE2-CG1 4.44Å; Y244-T1068 HydrophobicContact CD1-CG2 3.55Å; Y244-T1068 HydrophobicContact CE1-CG2 3.78Å
245	A	93.5	Very high	87.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-47	177.2	0	0	0	0	0	112	L193 L228 L232 L241 L242 L248 L249	L193-A245 HydrophobicContact CD1-CB 4.43Å; L193-A245 HydrophobicContact CD2-CB 4.28Å; L228-A245 HydrophobicContact CG-CB 4.49Å; L232-A245 HydrophobicContact CD2-CB 3.82Å; L232-A245 HydrophobicContact CG-CB 4.43Å; L241-A245 WeakPolarHBondContact O-CB 3.48Å; L241-A245 PolarHBondContact O-N 2.76Å; L242-A245 PolarHBondContact O-N 3.4Å; A245-L248 PolarHBondContact O-N 2.87Å; A245-L249 PolarHBondContact O-N 3.25Å; A245-L249 VanDerWaalsContact O-N 3.15Å
246	L	92.6	Very high	88	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-70.9	-36.8	-179.8	-170.9	58.8	0	0	0	112.4	L232 L242 I243 L249 N250 M274 L289 Q292 C293	L232-L246 HydrophobicContact CD1-CD1 4.46Å; L232-L246 HydrophobicContact CD2-CB 4.25Å; L242-L246 WeakPolarHBondContact O-CB 3.36Å; L242-L246 PolarHBondContact O-N 2.96Å; I243-L246 PolarHBondContact O-N 2.85Å; L246-L249 HydrophobicContact CD1-CD2 4.33Å; L246-L249 WeakPolarHBondContact O-CB 3.44Å; L246-L249 PolarHBondContact O-N 3.29Å; L246-N250 WeakPolarHBondContact O-CB 3.47Å; L246-N250 PolarHBondContact O-N 3Å; L246-M274 HydrophobicContact CD1-CE 3.61Å; L246-L289 HydrophobicContact CD2-CD1 4.08Å; L246-Q292 HydrophobicContact CB-CB 4.43Å; L246-Q292 HydrophobicContact CD2-CB 3.61Å; L246-Q292 HydrophobicContact CG-CB 3.91Å; L246-C293 HydrophobicContact CD2-CB 4.49Å; L246-C293 VanDerWaalsContact CD2-SG 3.59Å
247	T	92.8	Very high	88.9	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-44.4	174.4	-57.2	0	0	0	0	110.9	L197 I243 L249 N250 K251 Q292 A1067 T1068	L197-T247 HydrophobicContact CD2-CG2 3.76Å; I243-T247 WeakPolarHBondContact O-CB 3.47Å; I243-T247 PolarHBondContact O-N 3.22Å; I243-T247 PolarHBondContact O-OG1 3.12Å; T247-L249 VanDerWaalsContact C-N 3.28Å; T247-L249 PolarHBondContact O-N 2.92Å; T247-N250 PolarHBondContact O-N 3.45Å; T247-K251 HydrophobicContact CG2-CD 4.25Å; T247-K251 HydrophobicContact CG2-CG 4.47Å; T247-K251 WeakPolarHBondContact O-CB 3.23Å; T247-K251 PolarHBondContact O-N 3.28Å; T247-Q292 PolarHBondContact OG1-NE2 3.49Å; T247-A1067 VanDerWaalsContact CG2-O 3.31Å; T247-A1067 WeakPolarHBondContact CG2-O 3.22Å; T247-T1068 HydrophobicContact CG2-CG2 4.02Å
248	L	94.5	Very high	89.5	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-60.2	-42.9	178.4	180	64.4	0	0	0	110.8	L193 L196 L197 V200 L210 L228 Y244 A245 T252	L193-L248 HydrophobicContact CD2-CD2 3.88Å; L196-L248 HydrophobicContact CB-CD1 3.93Å; L196-L248 HydrophobicContact CB-CD2 3.76Å; L196-L248 HydrophobicContact CD1-CD2 3.94Å; L197-L248 HydrophobicContact CD2-CB 3.84Å; L197-L248 HydrophobicContact CD2-CD1 4.2Å; L197-L248 HydrophobicContact CG-CB 4.25Å; L197-L248 HydrophobicContact CG-CD1 4.39Å; V200-L248 HydrophobicContact CB-CD1 4.36Å; V200-L248 HydrophobicContact CG2-CD1 3.85Å; L210-L248 HydrophobicContact CD2-CD1 3.83Å; L210-L248 HydrophobicContact CD2-CD2 4.45Å; L210-L248 HydrophobicContact CD2-CG 4.23Å; L228-L248 HydrophobicContact CD1-CD2 4.1Å; L228-L248 HydrophobicContact CD1-CG 4.49Å; Y244-L248 WeakPolarHBondContact O-CB 3.3Å; Y244-L248 PolarHBondContact O-N 3Å; A245-L248 PolarHBondContact O-N 2.87Å; L248-T252 WeakPolarHBondContact O-CB 3.35Å; L248-T252 PolarHBondContact O-N 2.9Å; L248-T252 PolarHBondContact O-OG1 3.37Å
249	L	93.5	Very high	89.6	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.6	-51.5	176.4	-171.5	66.8	0	0	0	111.6	W225 L228 L232 A245 L246 T247 K251 T252 L253 L269 M274 Y296	W225-L249 HydrophobicContact CD2-CD1 4.18Å; W225-L249 HydrophobicContact CE3-CD1 3.7Å; W225-L249 HydrophobicContact CH2-CD1 4.19Å; W225-L249 HydrophobicContact CZ3-CD1 3.71Å; L228-L249 HydrophobicContact CD2-CB 4.11Å; L228-L249 HydrophobicContact CD2-CD1 4.18Å; L228-L249 HydrophobicContact CD2-CD2 4.21Å; L228-L249 HydrophobicContact CD2-CG 4.42Å; L232-L249 HydrophobicContact CD1-CD2 4.46Å; A245-L249 PolarHBondContact O-N 3.25Å; A245-L249 VanDerWaalsContact O-N 3.15Å; L246-L249 HydrophobicContact CD1-CD2 4.33Å; L246-L249 WeakPolarHBondContact O-CB 3.44Å; L246-L249 PolarHBondContact O-N 3.29Å; T247-L249 VanDerWaalsContact C-N 3.28Å; T247-L249 PolarHBondContact O-N 2.92Å; L249-K251 PolarHBondContact O-N 3.21Å; L249-T252 PolarHBondContact O-N 2.8Å; L249-L253 HydrophobicContact CG-CD1 4.21Å; L249-L253 WeakPolarHBondContact O-CB 3.4Å; L249-L253 WeakPolarHBondContact O-CG 3.13Å; L249-L253 PolarHBondContact O-N 3.21Å; L249-L269 HydrophobicContact CD1-CD1 3.78Å; L249-L269 HydrophobicContact CD1-CD2 3.94Å; L249-L269 HydrophobicContact CD2-CD1 4.08Å; L249-L269 HydrophobicContact CD2-CD2 4.34Å; L249-L269 HydrophobicContact CG-CD1 4.26Å; L249-M274 HydrophobicContact CD2-CE 3.33Å; L249-M274 HydrophobicContact CD2-SD 4.07Å; L249-Y296 HydrophobicContact CD2-CE2 4.48Å
250	N	92.4	Very high	89.5	Confident	10 Å²	10	17.4 Å²	17.4	5%	0.053	9%	0.093	C	C	.	.	H	α-helix	trans	-59.7	-45.3	-179.2	-76.3	-18.7	0	0	0	112.1	L246 T247 L253 N254 Q292 L295 Y296	L246-N250 WeakPolarHBondContact O-CB 3.47Å; L246-N250 PolarHBondContact O-N 3Å; T247-N250 PolarHBondContact O-N 3.45Å; N250-L253 PolarHBondContact O-N 2.96Å; N250-N254 WeakPolarHBondContact O-CB 3.31Å; N250-N254 PolarHBondContact O-N 2.77Å; N250-Q292 PolarHBondContact ND2-O 2.95Å; N250-Q292 PolarHBondContact ND2-OE1 3.07Å; N250-L295 HydrophobicContact CB-CD2 4.15Å; N250-Y296 WeakPolarHBondContact OD1-CB 3.5Å
251	K	91.8	Very high	89.5	Confident	17 Å²	17	14.8 Å²	14.8	7%	0.074	8%	0.083	C	C	.	.	H	α-helix	trans	-65.7	-41.2	177	-76.4	-172.3	170.5	-74.3	0	112.6	V200 E201 T247 L249 L253 N254 G255 A1067 E1073	V200-K251 HydrophobicContact CG1-CB 3.88Å; E201-K251 IonicContact OE1-NZ 3.92Å; E201-K251 PolarHBondContact OE1-NZ 3.45Å; E201-K251 WeakPolarHBondContact OE2-CD 3.38Å; E201-K251 WeakPolarHBondContact OE2-CE 3.43Å; E201-K251 IonicContact OE2-NZ 3.81Å; E201-K251 PolarHBondContact OE2-NZ 2.88Å; T247-K251 HydrophobicContact CG2-CD 4.25Å; T247-K251 HydrophobicContact CG2-CG 4.47Å; T247-K251 WeakPolarHBondContact O-CB 3.23Å; T247-K251 PolarHBondContact O-N 3.28Å; L249-K251 PolarHBondContact O-N 3.21Å; K251-L253 VanDerWaalsContact C-N 3.35Å; K251-L253 PolarHBondContact O-N 3.32Å; K251-N254 PolarHBondContact O-N 2.85Å; K251-G255 PolarHBondContact O-N 3.17Å; K251-A1067 WeakPolarHBondContact CE-O 3.28Å; K251-E1073 IonicContact NZ-OE1 2.66Å; K251-E1073 PolarHBondContact NZ-OE1 3.32Å
252	T	92.2	Very high	89.5	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.8	-44.5	177.3	-51.3	0	0	0	0	110.7	L210 W225 L248 L249 N254 G255	L210-T252 HydrophobicContact CD2-CG2 4.33Å; L210-T252 WeakPolarHBondContact CD2-OG1 3.04Å; W225-T252 HydrophobicContact CH2-CG2 3.63Å; W225-T252 HydrophobicContact CZ2-CG2 4.07Å; L248-T252 WeakPolarHBondContact O-CB 3.35Å; L248-T252 PolarHBondContact O-N 2.9Å; L248-T252 PolarHBondContact O-OG1 3.37Å; L249-T252 PolarHBondContact O-N 2.8Å; T252-N254 PolarHBondContact O-N 3.37Å; T252-G255 PolarHBondContact O-N 3.36Å
253	L	90.9	Very high	89.4	Confident	6 Å²	6	14.5 Å²	14.5	3%	0.031	8%	0.081	C	C	.	.	H	α-helix	trans	-59.7	-45.2	173.5	-75.6	174	0	0	0	111.1	L249 N250 K251 G255 V256 Y262 I265 V266 L269 Y296 R1078	L249-L253 HydrophobicContact CG-CD1 4.21Å; L249-L253 WeakPolarHBondContact O-CB 3.4Å; L249-L253 WeakPolarHBondContact O-CG 3.13Å; L249-L253 PolarHBondContact O-N 3.21Å; N250-L253 PolarHBondContact O-N 2.96Å; K251-L253 VanDerWaalsContact C-N 3.35Å; K251-L253 PolarHBondContact O-N 3.32Å; L253-G255 VanDerWaalsContact C-N 3.26Å; L253-G255 PolarHBondContact O-N 2.97Å; L253-V256 PolarHBondContact O-N 3.45Å; L253-Y262 HydrophobicContact CB-CD2 4.46Å; L253-Y262 HydrophobicContact CB-CE2 4.22Å; L253-Y262 HydrophobicContact CD2-CD2 3.93Å; L253-Y262 HydrophobicContact CD2-CE2 3.98Å; L253-Y262 HydrophobicContact CG-CE2 4.49Å; L253-I265 HydrophobicContact CD2-CB 3.93Å; L253-I265 HydrophobicContact CD2-CD1 4.28Å; L253-I265 HydrophobicContact CD2-CG2 3.51Å; L253-V266 HydrophobicContact CD2-CG2 4.24Å; L253-L269 HydrophobicContact CD1-CD1 4.37Å; L253-Y296 HydrophobicContact CD1-CD2 4Å; L253-Y296 HydrophobicContact CD1-CE2 3.79Å; L253-R1078 PolarHBondContact O-NH1 3.05Å; L253-R1078 PolarHBondContact O-NH2 2.8Å
254	N	89	Confident	89.3	Confident	32 Å²	32	16.9 Å²	16.9	17%	0.171	9%	0.094	C	C	.	.	H	α-helix	trans	-63.1	-31.2	179.9	-159.6	20.1	0	0	0	112.9	N250 K251 T252 V256 E1073	N250-N254 WeakPolarHBondContact O-CB 3.31Å; N250-N254 PolarHBondContact O-N 2.77Å; K251-N254 PolarHBondContact O-N 2.85Å; T252-N254 PolarHBondContact O-N 3.37Å; N254-V256 VanDerWaalsContact C-N 3.31Å; N254-V256 PolarHBondContact O-N 2.97Å; N254-E1073 PolarHBondContact ND2-OE2 3.01Å
255	G	87.6	Confident	89.2	Confident	10 Å²	10	15.6 Å²	15.6	10%	0.103	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-8.4	177.5	0	0	0	0	0	116.3	K251 T252 L253 P257	K251-G255 PolarHBondContact O-N 3.17Å; T252-G255 PolarHBondContact O-N 3.36Å; L253-G255 VanDerWaalsContact C-N 3.26Å; L253-G255 PolarHBondContact O-N 2.97Å; G255-P257 WeakPolarHBondContact O-CD 3.33Å
256	V	88.2	Confident	89	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.089	C	C	.	.			trans	-77	118.2	-179.6	179.3	0	0	0	0	111.5	L253 N254 D258 T261 I265 R1078	L253-V256 PolarHBondContact O-N 3.45Å; N254-V256 VanDerWaalsContact C-N 3.31Å; N254-V256 PolarHBondContact O-N 2.97Å; V256-D258 WeakPolarHBondContact CG1-O 3.3Å; V256-D258 PolarHBondContact O-N 2.68Å; V256-T261 HydrophobicContact CG1-CG2 3.77Å; V256-I265 HydrophobicContact CG2-CD1 3.81Å; V256-R1078 PolarHBondContact O-NH1 2.91Å
257	P	82.4	Confident	88.8	Confident	62 Å²	62	16.9 Å²	16.9	40%	0.403	10%	0.096	S	C	.	.			trans	-77.2	-23.6	-173.6	30	-33.9	0	0	0	114	L208 G255 R1079	L208-P257 HydrophobicContact CD1-CG 4.43Å; G255-P257 WeakPolarHBondContact O-CD 3.33Å; P257-R1079 PolarHBondContact O-N 3.29Å
258	D	81.3	Confident	88.6	Confident	46 Å²	46	17.4 Å²	17.4	25%	0.246	10%	0.1	C	C	.	.	B	Isolated β-bridge	trans	-111	142.3	-172.8	68.2	-73.2	0	0	0	112.9	V256 D260 T261 Y262	V256-D258 WeakPolarHBondContact CG1-O 3.3Å; V256-D258 PolarHBondContact O-N 2.68Å; D258-D260 PolarHBondContact O-N 3.32Å; D258-T261 VanDerWaalsContact CG-OG1 3.24Å; D258-T261 WeakPolarHBondContact OD1-CB 3.41Å; D258-T261 PolarHBondContact OD1-OG1 2.77Å; D258-T261 WeakPolarHBondContact OD2-CB 3.47Å; D258-T261 PolarHBondContact OD2-N 3.36Å; D258-T261 PolarHBondContact OD2-OG1 2.79Å; D258-Y262 PolarHBondContact O-N 3.19Å
259	Q	83.4	Confident	88.4	Confident	9 Å²	9	17.3 Å²	17.3	4%	0.042	10%	0.1	C	C	.	.	H	α-helix	trans	-71.5	-31.4	-174.8	-154.5	-175.6	22	0	0	112.9	Y262 Y263 E303 R1078 R1079	Q259-Y262 PolarHBondContact O-N 2.93Å; Q259-Y263 HydrophobicContact CG-CD2 3.91Å; Q259-Y263 HydrophobicContact CG-CE2 3.55Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.44Å; Q259-Y263 PolarHBondContact O-N 3.41Å; Q259-E303 PolarHBondContact NE2-OE2 3.5Å; Q259-R1078 HydrophobicContact CB-CB 4.4Å; Q259-R1079 PolarHBondContact N-O 3.34Å
260	D	84	Confident	88.2	Confident	26 Å²	26	17.7 Å²	17.7	14%	0.139	10%	0.102	C	C	.	.	H	α-helix	trans	-65.6	-47.8	-179.1	-83.5	-6.9	0	0	0	110.8	D258 Y262 Y263 D264 R1082 R1086	D258-D260 PolarHBondContact O-N 3.32Å; D260-Y262 VanDerWaalsContact C-N 3.34Å; D260-Y262 PolarHBondContact O-N 3.38Å; D260-Y263 PolarHBondContact O-N 3.25Å; D260-D264 VanDerWaalsContact O-CG 3.28Å; D260-D264 PolarHBondContact O-N 2.87Å; D260-R1082 IonicContact OD2-CZ 3.87Å; D260-R1082 IonicContact OD2-NE 2.76Å; D260-R1082 PolarHBondContact OD2-NE 3.01Å; D260-R1082 IonicContact OD2-NH2 2.83Å; D260-R1086 PolarHBondContact O-NH1 3.05Å
261	T	87.3	Confident	88	Confident	36 Å²	36	24 Å²	24	22%	0.221	13%	0.131	C	C	.	.	H	α-helix	trans	-65.2	-37	176.1	-58.1	0	0	0	0	111.8	L211 V256 D258 Y263 D264 I265	L211-T261 HydrophobicContact CD2-CG2 3.46Å; L211-T261 VanDerWaalsContact CD2-CG2 3.46Å; V256-T261 HydrophobicContact CG1-CG2 3.77Å; D258-T261 VanDerWaalsContact CG-OG1 3.24Å; D258-T261 WeakPolarHBondContact OD1-CB 3.41Å; D258-T261 PolarHBondContact OD1-OG1 2.77Å; D258-T261 WeakPolarHBondContact OD2-CB 3.47Å; D258-T261 PolarHBondContact OD2-N 3.36Å; D258-T261 PolarHBondContact OD2-OG1 2.79Å; T261-Y263 PolarHBondContact O-N 3.13Å; T261-D264 PolarHBondContact O-N 3.37Å; T261-I265 HydrophobicContact CG2-CD1 4.07Å; T261-I265 WeakPolarHBondContact O-CD1 3.4Å; T261-I265 VanDerWaalsContact O-CG1 3.29Å; T261-I265 WeakPolarHBondContact O-CG1 3.35Å; T261-I265 PolarHBondContact O-N 3.22Å
262	Y	89.9	Confident	87.8	Confident	2 Å²	2	25 Å²	25	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-57.7	-49.7	173.9	172.2	-97.2	0	0	0	111	L253 D258 Q259 D260 D264 I265 V266 V299 L300 E303	L253-Y262 HydrophobicContact CB-CD2 4.46Å; L253-Y262 HydrophobicContact CB-CE2 4.22Å; L253-Y262 HydrophobicContact CD2-CD2 3.93Å; L253-Y262 HydrophobicContact CD2-CE2 3.98Å; L253-Y262 HydrophobicContact CG-CE2 4.49Å; D258-Y262 PolarHBondContact O-N 3.19Å; Q259-Y262 PolarHBondContact O-N 2.93Å; D260-Y262 VanDerWaalsContact C-N 3.34Å; D260-Y262 PolarHBondContact O-N 3.38Å; Y262-D264 PolarHBondContact O-N 3.26Å; Y262-I265 PolarHBondContact O-N 3.06Å; Y262-V266 HydrophobicContact CD1-CG2 4.27Å; Y262-V266 HydrophobicContact CD2-CG2 4.32Å; Y262-V266 HydrophobicContact CE1-CG2 3.8Å; Y262-V266 HydrophobicContact CE2-CG2 3.85Å; Y262-V266 WeakPolarHBondContact O-CG2 3.15Å; Y262-V266 PolarHBondContact O-N 3.41Å; Y262-V299 HydrophobicContact CE2-CG1 4.28Å; Y262-L300 HydrophobicContact CE1-CD1 4.45Å; Y262-L300 WeakPolarHBondContact OH-CA 3.38Å; Y262-E303 HydrophobicContact CD1-CG 4.25Å; Y262-E303 HydrophobicContact CE1-CB 3.92Å; Y262-E303 HydrophobicContact CE1-CG 3.74Å
263	Y	88.1	Confident	87.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.2	-34.5	177.4	-75.7	-58.6	0	0	0	113	Q259 D260 T261 I265 V266 D267 E303 D304 R1086	Q259-Y263 HydrophobicContact CG-CD2 3.91Å; Q259-Y263 HydrophobicContact CG-CE2 3.55Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.44Å; Q259-Y263 PolarHBondContact O-N 3.41Å; D260-Y263 PolarHBondContact O-N 3.25Å; T261-Y263 PolarHBondContact O-N 3.13Å; Y263-I265 VanDerWaalsContact C-N 3.28Å; Y263-I265 PolarHBondContact O-N 2.92Å; Y263-V266 PolarHBondContact O-N 2.89Å; Y263-D267 WeakPolarHBondContact O-CB 3.49Å; Y263-D267 PolarHBondContact O-N 3.38Å; Y263-E303 VanDerWaalsContact OH-C 3.29Å; Y263-E303 PolarHBondContact OH-O 3.41Å; Y263-D304 PolarHBondContact OH-OD1 3.34Å; Y263-R1086 VanDerWaalsContact CB-CZ 3.46Å; Y263-R1086 HydrophobicContact CD2-CB 4.18Å; Y263-R1086 HydrophobicContact CD2-CG 3.93Å; Y263-R1086 HydrophobicContact CE2-CB 4.32Å; Y263-R1086 HydrophobicContact CE2-CG 4.44Å; Y263-R1086 WeakPolarHBondContact CE2-O 3.49Å; Y263-R1086 HydrophobicContact CG-CG 4.27Å; Y263-R1086 VanDerWaalsContact CZ-O 3.29Å; Y263-R1086 PolarHBondContact OH-O 3.38Å
264	D	87.1	Confident	87.6	Confident	69 Å²	69	25.8 Å²	25.8	37%	0.369	15%	0.146	S	C	.	.	H	α-helix	trans	-61	-38.6	174.6	-70.3	-18.2	0	0	0	111.9	D260 T261 Y262 A268 R1086	D260-D264 VanDerWaalsContact O-CG 3.28Å; D260-D264 PolarHBondContact O-N 2.87Å; T261-D264 PolarHBondContact O-N 3.37Å; Y262-D264 PolarHBondContact O-N 3.26Å; D264-A268 WeakPolarHBondContact O-CB 3.35Å; D264-A268 PolarHBondContact O-N 2.95Å; D264-R1086 IonicContact OD1-CZ 3.08Å; D264-R1086 IonicContact OD1-NH1 2.68Å; D264-R1086 PolarHBondContact OD1-NH1 3.2Å; D264-R1086 IonicContact OD1-NH2 3.94Å; D264-R1086 PolarHBondContact OD1-NH2 2.92Å
265	I	90.1	Very high	87.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-71	-50.5	175.9	-62.3	161.4	0	0	0	110.6	L211 W225 L253 V256 T261 Y262 Y263 D267 A268 L269	L211-I265 HydrophobicContact CD1-CD1 3.53Å; L211-I265 HydrophobicContact CD1-CG1 3.66Å; L211-I265 HydrophobicContact CD2-CD1 3.91Å; L211-I265 HydrophobicContact CG-CD1 4.35Å; W225-I265 HydrophobicContact CZ2-CG2 4.18Å; L253-I265 HydrophobicContact CD2-CB 3.93Å; L253-I265 HydrophobicContact CD2-CD1 4.28Å; L253-I265 HydrophobicContact CD2-CG2 3.51Å; V256-I265 HydrophobicContact CG2-CD1 3.81Å; T261-I265 HydrophobicContact CG2-CD1 4.07Å; T261-I265 WeakPolarHBondContact O-CD1 3.4Å; T261-I265 VanDerWaalsContact O-CG1 3.29Å; T261-I265 WeakPolarHBondContact O-CG1 3.35Å; T261-I265 PolarHBondContact O-N 3.22Å; Y262-I265 PolarHBondContact O-N 3.06Å; Y263-I265 VanDerWaalsContact C-N 3.28Å; Y263-I265 PolarHBondContact O-N 2.92Å; I265-D267 VanDerWaalsContact C-N 3.34Å; I265-D267 PolarHBondContact O-N 3.48Å; I265-A268 PolarHBondContact O-N 3.36Å; I265-L269 HydrophobicContact CG2-CD1 3.79Å; I265-L269 HydrophobicContact CG2-CG 4.3Å; I265-L269 VanDerWaalsContact O-CG 3.27Å; I265-L269 WeakPolarHBondContact O-CG 3.4Å; I265-L269 PolarHBondContact O-N 3.26Å
266	V	90	Very high	87.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-46.7	-179.9	170.5	0	0	0	0	110.6	L253 Y262 Y263 A268 L269 E270 L300	L253-V266 HydrophobicContact CD2-CG2 4.24Å; Y262-V266 HydrophobicContact CD1-CG2 4.27Å; Y262-V266 HydrophobicContact CD2-CG2 4.32Å; Y262-V266 HydrophobicContact CE1-CG2 3.8Å; Y262-V266 HydrophobicContact CE2-CG2 3.85Å; Y262-V266 WeakPolarHBondContact O-CG2 3.15Å; Y262-V266 PolarHBondContact O-N 3.41Å; Y263-V266 PolarHBondContact O-N 2.89Å; V266-A268 VanDerWaalsContact C-N 3.29Å; V266-A268 PolarHBondContact O-N 3.02Å; V266-L269 WeakPolarHBondContact O-CB 3.39Å; V266-L269 PolarHBondContact O-N 2.91Å; V266-L269 VanDerWaalsContact O-N 3.09Å; V266-E270 HydrophobicContact CG1-CG 4.04Å; V266-E270 VanDerWaalsContact O-CG 3.3Å; V266-E270 WeakPolarHBondContact O-CG 3.42Å; V266-E270 PolarHBondContact O-N 3.3Å; V266-L300 HydrophobicContact CG1-CD1 3.79Å
267	D	88.7	Confident	87.4	Confident	27 Å²	27	34.4 Å²	34.4	14%	0.144	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-42	178.7	-67.6	-20.5	0	0	0	110.9	Y263 I265 L269 E270 E271 R1086 L1089	Y263-D267 WeakPolarHBondContact O-CB 3.49Å; Y263-D267 PolarHBondContact O-N 3.38Å; I265-D267 VanDerWaalsContact C-N 3.34Å; I265-D267 PolarHBondContact O-N 3.48Å; D267-L269 PolarHBondContact O-N 3.17Å; D267-E270 PolarHBondContact O-N 2.88Å; D267-E271 WeakPolarHBondContact O-CG 3.28Å; D267-E271 PolarHBondContact O-N 3.03Å; D267-R1086 IonicContact OD2-CZ 2.65Å; D267-R1086 IonicContact OD2-NE 2.8Å; D267-R1086 IonicContact OD2-NH2 2.95Å; D267-R1086 PolarHBondContact OD2-NH2 2.94Å; D267-L1089 HydrophobicContact CB-CB 4.33Å; D267-L1089 VanDerWaalsContact OD1-CB 3.25Å; D267-L1089 WeakPolarHBondContact OD1-CB 3.4Å; D267-L1089 PolarHBondContact OD1-N 3.06Å
268	A	88	Confident	87.6	Confident	12 Å²	12	31.7 Å²	31.7	10%	0.099	16%	0.164	C	C	.	.	H	α-helix	trans	-66	-34.1	175.9	0	0	0	0	0	113.5	P224 D264 I265 V266 Q272	P224-A268 HydrophobicContact CG-CB 3.75Å; D264-A268 WeakPolarHBondContact O-CB 3.35Å; D264-A268 PolarHBondContact O-N 2.95Å; I265-A268 PolarHBondContact O-N 3.36Å; V266-A268 VanDerWaalsContact C-N 3.29Å; V266-A268 PolarHBondContact O-N 3.02Å; A268-Q272 PolarHBondContact O-NE2 3.15Å
269	L	91.4	Very high	87.8	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-71	-43.4	174.4	-66.5	164.7	0	0	0	111.2	W225 M229 L249 L253 I265 V266 D267 E271 Q272 G273 M274 Y296	W225-L269 HydrophobicContact CB-CD2 3.62Å; W225-L269 HydrophobicContact CD2-CD2 4.41Å; W225-L269 HydrophobicContact CG-CD2 3.85Å; M229-L269 HydrophobicContact CG-CD2 3.98Å; M229-L269 HydrophobicContact SD-CD2 3.84Å; L249-L269 HydrophobicContact CD1-CD1 3.78Å; L249-L269 HydrophobicContact CD1-CD2 3.94Å; L249-L269 HydrophobicContact CD2-CD1 4.08Å; L249-L269 HydrophobicContact CD2-CD2 4.34Å; L249-L269 HydrophobicContact CG-CD1 4.26Å; L253-L269 HydrophobicContact CD1-CD1 4.37Å; I265-L269 HydrophobicContact CG2-CD1 3.79Å; I265-L269 HydrophobicContact CG2-CG 4.3Å; I265-L269 VanDerWaalsContact O-CG 3.27Å; I265-L269 WeakPolarHBondContact O-CG 3.4Å; I265-L269 PolarHBondContact O-N 3.26Å; V266-L269 WeakPolarHBondContact O-CB 3.39Å; V266-L269 PolarHBondContact O-N 2.91Å; V266-L269 VanDerWaalsContact O-N 3.09Å; D267-L269 PolarHBondContact O-N 3.17Å; L269-E271 VanDerWaalsContact C-N 3.32Å; L269-E271 PolarHBondContact O-N 3.31Å; L269-Q272 CarbonylContact O-C 3.47Å; L269-Q272 WeakPolarHBondContact O-CA 3.11Å; L269-Q272 PolarHBondContact O-N 3.49Å; L269-G273 PolarHBondContact O-N 3.01Å; L269-M274 HydrophobicContact CB-CB 4.01Å; L269-M274 HydrophobicContact CB-CG 4.28Å; L269-M274 WeakPolarHBondContact O-CB 3.46Å; L269-M274 PolarHBondContact O-N 3.38Å; L269-M274 VanDerWaalsContact O-N 3.16Å; L269-Y296 HydrophobicContact CD1-CE2 4.48Å
270	E	88.4	Confident	87.9	Confident	8 Å²	8	34.3 Å²	34.3	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-33.8	178.4	-66.3	-53.9	155.3	0	0	112.1	V266 D267 Q272 G273 E275 Y296 L1089	V266-E270 HydrophobicContact CG1-CG 4.04Å; V266-E270 VanDerWaalsContact O-CG 3.3Å; V266-E270 WeakPolarHBondContact O-CG 3.42Å; V266-E270 PolarHBondContact O-N 3.3Å; D267-E270 PolarHBondContact O-N 2.88Å; E270-Q272 PolarHBondContact O-N 3.24Å; E270-G273 PolarHBondContact O-N 3.35Å; E270-E275 PolarHBondContact OE2-N 3.33Å; E270-Y296 PolarHBondContact OE1-OH 3.08Å; E270-L1089 HydrophobicContact CB-CD2 4.47Å
271	E	87.7	Confident	88.1	Confident	143 Å²	143	33.4 Å²	33.4	67%	0.668	18%	0.175	S	C	*	.	H	α-helix	trans	-62.6	-26.5	170.7	-78	-177.2	178.9	0	0	113.1	D267 L269 L1089	D267-E271 WeakPolarHBondContact O-CG 3.28Å; D267-E271 PolarHBondContact O-N 3.03Å; L269-E271 VanDerWaalsContact C-N 3.32Å; L269-E271 PolarHBondContact O-N 3.31Å; E271-L1089 HydrophobicContact CG-CD2 3.71Å
272	Q	89	Confident	87.9	Confident	36 Å²	36	34.2 Å²	34.2	17%	0.168	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	8	177.5	-69.9	173.6	88.7	0	0	113.8	A223 P224 M229 N233 A268 L269 E270	A223-Q272 HydrophobicContact CB-CG 4.17Å; P224-Q272 PolarHBondContact O-NE2 2.95Å; M229-Q272 HydrophobicContact CB-CB 4.27Å; M229-Q272 HydrophobicContact CE-CB 4.14Å; M229-Q272 WeakPolarHBondContact CE-O 3.38Å; M229-Q272 HydrophobicContact CG-CB 3.9Å; N233-Q272 PolarHBondContact ND2-O 2.83Å; A268-Q272 PolarHBondContact O-NE2 3.15Å; L269-Q272 CarbonylContact O-C 3.47Å; L269-Q272 WeakPolarHBondContact O-CA 3.11Å; L269-Q272 PolarHBondContact O-N 3.49Å; E270-Q272 PolarHBondContact O-N 3.24Å
273	G	88	Confident	87.5	Confident	24 Å²	24	41.8 Å²	41.8	25%	0.247	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	31.6	174.7	0	0	0	0	0	115	L269 E270 E275 E276 A277	L269-G273 PolarHBondContact O-N 3.01Å; E270-G273 PolarHBondContact O-N 3.35Å; G273-E275 VanDerWaalsContact C-N 3.33Å; G273-E275 PolarHBondContact O-N 3.03Å; G273-E276 PolarHBondContact O-N 3.14Å; G273-A277 PolarHBondContact O-N 3.5Å
274	M	89.9	Confident	87.2	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.1	-42.3	177.3	-170.2	63.9	-177.6	0	0	113.4	M229 L232 L246 L249 L269 E276 A277 I278 Y296	M229-M274 HydrophobicContact CE-CB 4.16Å; M229-M274 HydrophobicContact CE-SD 4.1Å; M229-M274 HydrophobicContact SD-CB 4.42Å; M229-M274 HydrophobicContact SD-SD 3.64Å; M229-M274 VanDerWaalsContact SD-SD 3.64Å; L232-M274 HydrophobicContact CD1-CE 4.13Å; L232-M274 HydrophobicContact CD1-SD 4.06Å; L246-M274 HydrophobicContact CD1-CE 3.61Å; L249-M274 HydrophobicContact CD2-CE 3.33Å; L249-M274 HydrophobicContact CD2-SD 4.07Å; L269-M274 HydrophobicContact CB-CB 4.01Å; L269-M274 HydrophobicContact CB-CG 4.28Å; L269-M274 WeakPolarHBondContact O-CB 3.46Å; L269-M274 PolarHBondContact O-N 3.38Å; L269-M274 VanDerWaalsContact O-N 3.16Å; M274-E276 VanDerWaalsContact C-N 3.35Å; M274-E276 PolarHBondContact O-N 2.92Å; M274-A277 WeakPolarHBondContact O-CB 3.12Å; M274-A277 PolarHBondContact O-N 3.31Å; M274-I278 HydrophobicContact CE-CD1 3.74Å; M274-I278 HydrophobicContact CE-CG1 3.77Å; M274-I278 HydrophobicContact CG-CD1 3.92Å; M274-I278 HydrophobicContact CG-CG1 4.31Å; M274-I278 WeakPolarHBondContact O-CG1 3.38Å; M274-I278 PolarHBondContact O-N 2.83Å; M274-I278 HydrophobicContact SD-CD1 4.47Å; M274-I278 HydrophobicContact SD-CG1 4.38Å; M274-Y296 HydrophobicContact CE-CD2 4.01Å; M274-Y296 HydrophobicContact CE-CE2 3.93Å; M274-Y296 HydrophobicContact CE-CG 4.41Å; M274-Y296 HydrophobicContact CG-CE1 4.16Å; M274-Y296 HydrophobicContact CG-CE2 4.21Å; M274-Y296 WeakPolarHBondContact CG-OH 3.46Å
275	E	86.4	Confident	86.5	Confident	88 Å²	88	53.5 Å²	53.5	41%	0.411	26%	0.261	S	S	.	.	H	α-helix	trans	-54.8	-46.4	173.9	173.7	168.2	-142.7	0	0	113	E270 G273 G279 R1090	E270-E275 PolarHBondContact OE2-N 3.33Å; G273-E275 VanDerWaalsContact C-N 3.33Å; G273-E275 PolarHBondContact O-N 3.03Å; E275-G279 PolarHBondContact O-N 3.23Å; E275-R1090 IonicContact OE1-CZ 3.79Å; E275-R1090 IonicContact OE1-NE 3.03Å; E275-R1090 PolarHBondContact OE1-NE 3.44Å; E275-R1090 IonicContact OE1-NH2 3.36Å; E275-R1090 PolarHBondContact OE1-NH2 2.68Å; E275-R1090 IonicContact OE2-NE 3.39Å
276	E	86.7	Confident	86	Confident	135 Å²	135	55 Å²	55	63%	0.631	27%	0.27	S	S	*	.	H	α-helix	trans	-68.7	-37.9	178.5	-173.4	176.9	-179.8	0	0	111.4	G273 M274 G279 R280	G273-E276 PolarHBondContact O-N 3.14Å; M274-E276 VanDerWaalsContact C-N 3.35Å; M274-E276 PolarHBondContact O-N 2.92Å; E276-G279 PolarHBondContact O-N 3.46Å; E276-R280 WeakPolarHBondContact O-CG 3.3Å; E276-R280 PolarHBondContact O-N 2.95Å
277	A	87.5	Confident	85.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-52.5	174.6	0	0	0	0	0	111.1	M229 L232 N233 G273 M274 G279 R280 L281	M229-A277 HydrophobicContact CE-CB 4.41Å; L232-A277 HydrophobicContact CB-CB 4.47Å; N233-A277 WeakPolarHBondContact OD1-CB 3.36Å; G273-A277 PolarHBondContact O-N 3.5Å; M274-A277 WeakPolarHBondContact O-CB 3.12Å; M274-A277 PolarHBondContact O-N 3.31Å; A277-G279 VanDerWaalsContact C-N 3.32Å; A277-G279 PolarHBondContact O-N 3.28Å; A277-R280 PolarHBondContact O-N 3.38Å; A277-R280 VanDerWaalsContact O-N 3.1Å; A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 WeakPolarHBondContact O-CG 3.49Å; A277-L281 PolarHBondContact O-N 3.07Å
278	I	87.5	Confident	85.4	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-59.8	-42.9	178.3	-68.1	173.1	0	0	0	111.3	M274 R280 L281 S282 C293 Y296 E297	M274-I278 HydrophobicContact CE-CD1 3.74Å; M274-I278 HydrophobicContact CE-CG1 3.77Å; M274-I278 HydrophobicContact CG-CD1 3.92Å; M274-I278 HydrophobicContact CG-CG1 4.31Å; M274-I278 WeakPolarHBondContact O-CG1 3.38Å; M274-I278 PolarHBondContact O-N 2.83Å; M274-I278 HydrophobicContact SD-CD1 4.47Å; M274-I278 HydrophobicContact SD-CG1 4.38Å; I278-R280 VanDerWaalsContact C-N 3.28Å; I278-R280 PolarHBondContact O-N 2.81Å; I278-L281 PolarHBondContact O-N 3.28Å; I278-S282 VanDerWaalsContact O-CB 3.3Å; I278-S282 WeakPolarHBondContact O-CB 3.47Å; I278-S282 PolarHBondContact O-N 2.99Å; I278-S282 PolarHBondContact O-OG 3.2Å; I278-C293 HydrophobicContact CG2-CB 4.01Å; I278-Y296 HydrophobicContact CD1-CD1 3.06Å; I278-Y296 HydrophobicContact CD1-CD2 4.47Å; I278-Y296 HydrophobicContact CD1-CE1 3.31Å; I278-Y296 HydrophobicContact CD1-CG 3.71Å; I278-Y296 HydrophobicContact CG1-CD1 4.5Å; I278-E297 HydrophobicContact CG2-CG 4.2Å
279	G	85.7	Confident	85.2	Confident	32 Å²	32	62.6 Å²	62.6	33%	0.33	31%	0.31	S	S	.	.	H	α-helix	trans	-62.5	-33.1	177.1	0	0	0	0	0	113.3	E275 E276 A277 K283	E275-G279 PolarHBondContact O-N 3.23Å; E276-G279 PolarHBondContact O-N 3.46Å; A277-G279 VanDerWaalsContact C-N 3.32Å; A277-G279 PolarHBondContact O-N 3.28Å; G279-K283 WeakPolarHBondContact O-CD 3.31Å; G279-K283 WeakPolarHBondContact O-CE 3.47Å; G279-K283 WeakPolarHBondContact O-CG 3.43Å
280	R	85.6	Confident	84.9	Confident	79 Å²	79	64.5 Å²	64.5	30%	0.298	32%	0.323	S	S	.	.	H	α-helix	trans	-75.9	-46.9	172.8	-75	-174.9	-68.4	137.7	-4	112.1	N233 E276 A277 I278 S282 K283	N233-R280 PolarHBondContact O-NH1 2.87Å; N233-R280 PolarHBondContact OD1-NH2 3.49Å; E276-R280 WeakPolarHBondContact O-CG 3.3Å; E276-R280 PolarHBondContact O-N 2.95Å; A277-R280 PolarHBondContact O-N 3.38Å; A277-R280 VanDerWaalsContact O-N 3.1Å; I278-R280 VanDerWaalsContact C-N 3.28Å; I278-R280 PolarHBondContact O-N 2.81Å; R280-S282 VanDerWaalsContact C-N 3.33Å; R280-S282 PolarHBondContact O-N 3.31Å; R280-K283 WeakPolarHBondContact O-CB 3.34Å; R280-K283 PolarHBondContact O-N 3.38Å
281	L	86.2	Confident	84.8	Confident	6 Å²	6	66.9 Å²	66.9	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-62	-39.7	-178.9	-66.8	172	0	0	0	112	L232 L242 A277 I278 K283 L284 L289	L232-L281 HydrophobicContact CB-CD1 4.44Å; L232-L281 HydrophobicContact CD2-CD1 3.98Å; L242-L281 HydrophobicContact CB-CD2 4.32Å; L242-L281 HydrophobicContact CD1-CD2 3.72Å; L242-L281 HydrophobicContact CD2-CD2 4.03Å; L242-L281 HydrophobicContact CG-CD2 4.24Å; A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 WeakPolarHBondContact O-CG 3.49Å; A277-L281 PolarHBondContact O-N 3.07Å; I278-L281 PolarHBondContact O-N 3.28Å; L281-K283 PolarHBondContact O-N 3.46Å; L281-K283 VanDerWaalsContact O-N 3.16Å; L281-L284 HydrophobicContact CD2-CD1 4.1Å; L281-L284 WeakPolarHBondContact O-CB 3.32Å; L281-L284 PolarHBondContact O-N 3.45Å; L281-L284 VanDerWaalsContact O-N 3.08Å; L281-L289 HydrophobicContact CB-CD2 4.17Å; L281-L289 HydrophobicContact CB-CG 4.4Å; L281-L289 HydrophobicContact CD2-CD2 4.17Å
282	S	83.8	Confident	84.8	Confident	53 Å²	53	60.5 Å²	60.5	37%	0.371	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-62.2	-21.9	175.8	-59.1	0	0	0	0	113.3	I278 R280 C293	I278-S282 VanDerWaalsContact O-CB 3.3Å; I278-S282 WeakPolarHBondContact O-CB 3.47Å; I278-S282 PolarHBondContact O-N 2.99Å; I278-S282 PolarHBondContact O-OG 3.2Å; R280-S282 VanDerWaalsContact C-N 3.33Å; R280-S282 PolarHBondContact O-N 3.31Å; S282-C293 WeakPolarHBondContact OG-CB 3.48Å
283	K	82.5	Confident	84.8	Confident	162 Å²	162	58.9 Å²	58.9	70%	0.704	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-80.9	-15.7	177.4	-67.7	167.9	-175.5	172.4	0	113.3	G279 R280 L281 R285	G279-K283 WeakPolarHBondContact O-CD 3.31Å; G279-K283 WeakPolarHBondContact O-CE 3.47Å; G279-K283 WeakPolarHBondContact O-CG 3.43Å; R280-K283 WeakPolarHBondContact O-CB 3.34Å; R280-K283 PolarHBondContact O-N 3.38Å; L281-K283 PolarHBondContact O-N 3.46Å; L281-K283 VanDerWaalsContact O-N 3.16Å; K283-R285 PolarHBondContact O-N 3.21Å
284	L	81.3	Confident	84.8	Confident	89 Å²	89	63.7 Å²	63.7	47%	0.466	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-71.6	-8.3	-178.7	-65.4	173.2	0	0	0	113.4	L242 L281 T286 L289	L242-L284 HydrophobicContact CD1-CD1 3.94Å; L281-L284 HydrophobicContact CD2-CD1 4.1Å; L281-L284 WeakPolarHBondContact O-CB 3.32Å; L281-L284 PolarHBondContact O-N 3.45Å; L281-L284 VanDerWaalsContact O-N 3.08Å; L284-T286 VanDerWaalsContact C-N 3.26Å; L284-T286 PolarHBondContact O-N 3.48Å; L284-L289 HydrophobicContact CB-CD2 4.36Å; L284-L289 HydrophobicContact CD1-CD2 4.01Å
285	R	71.2	Confident	84.7	Confident	226 Å²	226	65 Å²	65	85%	0.853	32%	0.315	S	S	*	.			trans	56.3	25.9	173.4	-63.6	-172.2	-180	-172.9	0.3	115.8	K283	K283-R285 PolarHBondContact O-N 3.21Å
286	T	80.8	Confident	84.8	Confident	30 Å²	30	60.9 Å²	60.9	18%	0.184	30%	0.296	C	S	.	.			trans	-87.1	129.5	166.3	46.5	0	0	0	0	109.6	T239 L284 E288 L289 S290	T239-T286 HydrophobicContact CG2-CG2 4.09Å; L284-T286 VanDerWaalsContact C-N 3.26Å; L284-T286 PolarHBondContact O-N 3.48Å; T286-E288 PolarHBondContact O-N 3.11Å; T286-L289 PolarHBondContact O-N 3.49Å; T286-L289 WeakPolarHBondContact OG1-CB 3.46Å; T286-S290 VanDerWaalsContact O-CB 3.31Å; T286-S290 WeakPolarHBondContact O-CB 3.43Å; T286-S290 PolarHBondContact O-N 3.04Å; T286-S290 PolarHBondContact O-OG 3.05Å
287	P	82.2	Confident	84.9	Confident	90 Å²	90	57.2 Å²	57.2	58%	0.584	28%	0.279	S	S	*	.	H	α-helix	trans	-65.1	-39.7	-171.4	20.8	-26.7	0	0	0	112.3	S290 E291	P287-S290 PolarHBondContact O-N 3.04Å; P287-E291 WeakPolarHBondContact O-CB 3.37Å; P287-E291 PolarHBondContact O-N 3.47Å
288	E	82.8	Confident	84.8	Confident	110 Å²	110	59.9 Å²	59.9	51%	0.514	30%	0.295	S	S	.	.	H	α-helix	trans	-66.8	-43.5	179.6	-63	74.9	-162.7	0	0	112	I243 T286 E291 Q292	I243-E288 HydrophobicContact CD1-CB 3.91Å; T286-E288 PolarHBondContact O-N 3.11Å; E288-E291 PolarHBondContact O-N 3.33Å; E288-Q292 WeakPolarHBondContact O-CG 3.45Å; E288-Q292 PolarHBondContact O-N 3.4Å
289	L	85.4	Confident	84.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-41.4	177.6	-174.2	62.8	0	0	0	111.1	L242 I243 L246 L281 L284 T286 E291 Q292 C293	L242-L289 HydrophobicContact CB-CD1 4.13Å; L242-L289 HydrophobicContact CB-CD2 4.49Å; I243-L289 HydrophobicContact CG1-CB 3.92Å; I243-L289 HydrophobicContact CG1-CD1 4.04Å; L246-L289 HydrophobicContact CD2-CD1 4.08Å; L281-L289 HydrophobicContact CB-CD2 4.17Å; L281-L289 HydrophobicContact CB-CG 4.4Å; L281-L289 HydrophobicContact CD2-CD2 4.17Å; L284-L289 HydrophobicContact CB-CD2 4.36Å; L284-L289 HydrophobicContact CD1-CD2 4.01Å; T286-L289 PolarHBondContact O-N 3.49Å; T286-L289 WeakPolarHBondContact OG1-CB 3.46Å; L289-E291 VanDerWaalsContact C-N 3.27Å; L289-E291 PolarHBondContact O-N 2.78Å; L289-Q292 PolarHBondContact O-N 3.4Å; L289-C293 PolarHBondContact O-N 2.96Å; L289-C293 PolarHBondContact O-SG 2.77Å; L289-C293 VanDerWaalsContact O-SG 3.35Å
290	S	85	Confident	84.7	Confident	39 Å²	39	59.2 Å²	59.2	27%	0.273	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-37.5	177.9	-61	0	0	0	0	111.3	T286 P287 C293 R294	T286-S290 VanDerWaalsContact O-CB 3.31Å; T286-S290 WeakPolarHBondContact O-CB 3.43Å; T286-S290 PolarHBondContact O-N 3.04Å; T286-S290 PolarHBondContact O-OG 3.05Å; P287-S290 PolarHBondContact O-N 3.04Å; S290-C293 PolarHBondContact O-N 2.73Å; S290-R294 WeakPolarHBondContact O-CB 3.08Å; S290-R294 PolarHBondContact O-N 3.33Å
291	E	86.1	Confident	84.5	Confident	59 Å²	59	58.2 Å²	58.2	28%	0.276	29%	0.293	S	S	.	.	H	α-helix	trans	-67.4	-40.5	174.6	-176.3	63.2	-176.2	0	0	112.1	P287 E288 L289 R294 L295 T1070	P287-E291 WeakPolarHBondContact O-CB 3.37Å; P287-E291 PolarHBondContact O-N 3.47Å; E288-E291 PolarHBondContact O-N 3.33Å; L289-E291 VanDerWaalsContact C-N 3.27Å; L289-E291 PolarHBondContact O-N 2.78Å; E291-R294 WeakPolarHBondContact O-CB 3.41Å; E291-R294 PolarHBondContact O-N 3.38Å; E291-R294 IonicContact OE1-CZ 2.82Å; E291-R294 IonicContact OE1-NE 2.84Å; E291-R294 PolarHBondContact OE1-NE 2.78Å; E291-R294 IonicContact OE1-NH2 2.7Å; E291-R294 PolarHBondContact OE1-NH2 2.92Å; E291-R294 IonicContact OE2-CZ 3.74Å; E291-R294 IonicContact OE2-NE 2.75Å; E291-R294 PolarHBondContact OE2-NE 3.32Å; E291-R294 IonicContact OE2-NH2 2.63Å; E291-L295 WeakPolarHBondContact O-CB 3.32Å; E291-L295 PolarHBondContact O-N 2.94Å; E291-T1070 HydrophobicContact CB-CG2 4.44Å; E291-T1070 HydrophobicContact CG-CG2 3.68Å
292	Q	88	Confident	84.2	Confident	8 Å²	8	62 Å²	62	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-37.9	174	-70.1	-64.5	-21	0	0	112.3	L246 T247 N250 E288 L289 L295 Y296	L246-Q292 HydrophobicContact CB-CB 4.43Å; L246-Q292 HydrophobicContact CD2-CB 3.61Å; L246-Q292 HydrophobicContact CG-CB 3.91Å; T247-Q292 PolarHBondContact OG1-NE2 3.49Å; N250-Q292 PolarHBondContact ND2-O 2.95Å; N250-Q292 PolarHBondContact ND2-OE1 3.07Å; E288-Q292 WeakPolarHBondContact O-CG 3.45Å; E288-Q292 PolarHBondContact O-N 3.4Å; L289-Q292 PolarHBondContact O-N 3.4Å; Q292-L295 PolarHBondContact O-N 2.98Å; Q292-Y296 PolarHBondContact O-N 3.44Å
293	C	88.8	Confident	84	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.014	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-45.1	171.2	-70.5	0	0	0	0	111.3	L246 I278 S282 L289 S290 L295 Y296 E297	L246-C293 HydrophobicContact CD2-CB 4.49Å; L246-C293 VanDerWaalsContact CD2-SG 3.59Å; I278-C293 HydrophobicContact CG2-CB 4.01Å; S282-C293 WeakPolarHBondContact OG-CB 3.48Å; L289-C293 PolarHBondContact O-N 2.96Å; L289-C293 PolarHBondContact O-SG 2.77Å; L289-C293 VanDerWaalsContact O-SG 3.35Å; S290-C293 PolarHBondContact O-N 2.73Å; C293-L295 VanDerWaalsContact C-N 3.31Å; C293-L295 PolarHBondContact O-N 3.49Å; C293-Y296 PolarHBondContact O-N 3.14Å; C293-E297 WeakPolarHBondContact O-CG 3.49Å; C293-E297 PolarHBondContact O-N 3Å; C293-E297 VanDerWaalsContact O-N 3.17Å
294	R	87.5	Confident	83.8	Confident	126 Å²	126	53.1 Å²	53.1	48%	0.475	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-39.5	177.5	-168.2	-170.1	70.8	75.2	-3.6	111.5	S290 E291 E297 T298	S290-R294 WeakPolarHBondContact O-CB 3.08Å; S290-R294 PolarHBondContact O-N 3.33Å; E291-R294 WeakPolarHBondContact O-CB 3.41Å; E291-R294 PolarHBondContact O-N 3.38Å; E291-R294 IonicContact OE1-CZ 2.82Å; E291-R294 IonicContact OE1-NE 2.84Å; E291-R294 PolarHBondContact OE1-NE 2.78Å; E291-R294 IonicContact OE1-NH2 2.7Å; E291-R294 PolarHBondContact OE1-NH2 2.92Å; E291-R294 IonicContact OE2-CZ 3.74Å; E291-R294 IonicContact OE2-NE 2.75Å; E291-R294 PolarHBondContact OE2-NE 3.32Å; E291-R294 IonicContact OE2-NH2 2.63Å; R294-E297 PolarHBondContact O-N 2.98Å; R294-T298 PolarHBondContact NH1-OG1 2.66Å; R294-T298 VanDerWaalsContact O-CB 3.26Å; R294-T298 WeakPolarHBondContact O-CB 3.36Å; R294-T298 PolarHBondContact O-N 3.19Å; R294-T298 PolarHBondContact O-OG1 3.2Å
295	L	86.7	Confident	83.1	Confident	26 Å²	26	51 Å²	51	14%	0.136	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-49.3	178.5	-178.2	62.8	0	0	0	111.2	N250 E291 Q292 C293 E297 T298 V299	N250-L295 HydrophobicContact CB-CD2 4.15Å; E291-L295 WeakPolarHBondContact O-CB 3.32Å; E291-L295 PolarHBondContact O-N 2.94Å; Q292-L295 PolarHBondContact O-N 2.98Å; C293-L295 VanDerWaalsContact C-N 3.31Å; C293-L295 PolarHBondContact O-N 3.49Å; L295-E297 PolarHBondContact O-N 2.89Å; L295-T298 PolarHBondContact O-N 2.89Å; L295-V299 HydrophobicContact CD1-CG2 4.21Å; L295-V299 WeakPolarHBondContact O-CG2 3.48Å; L295-V299 PolarHBondContact O-N 3.42Å
296	Y	89.5	Confident	82.2	Confident	3 Å²	3	45.4 Å²	45.4	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-54.4	-52.1	175.8	-179.8	-86.1	0	0	0	111.3	L249 N250 L253 L269 E270 M274 I278 Q292 C293 T298 V299 L300	L249-Y296 HydrophobicContact CD2-CE2 4.48Å; N250-Y296 WeakPolarHBondContact OD1-CB 3.5Å; L253-Y296 HydrophobicContact CD1-CD2 4Å; L253-Y296 HydrophobicContact CD1-CE2 3.79Å; L269-Y296 HydrophobicContact CD1-CE2 4.48Å; E270-Y296 PolarHBondContact OE1-OH 3.08Å; M274-Y296 HydrophobicContact CE-CD2 4.01Å; M274-Y296 HydrophobicContact CE-CE2 3.93Å; M274-Y296 HydrophobicContact CE-CG 4.41Å; M274-Y296 HydrophobicContact CG-CE1 4.16Å; M274-Y296 HydrophobicContact CG-CE2 4.21Å; M274-Y296 WeakPolarHBondContact CG-OH 3.46Å; I278-Y296 HydrophobicContact CD1-CD1 3.06Å; I278-Y296 HydrophobicContact CD1-CD2 4.47Å; I278-Y296 HydrophobicContact CD1-CE1 3.31Å; I278-Y296 HydrophobicContact CD1-CG 3.71Å; I278-Y296 HydrophobicContact CG1-CD1 4.5Å; Q292-Y296 PolarHBondContact O-N 3.44Å; C293-Y296 PolarHBondContact O-N 3.14Å; Y296-T298 PolarHBondContact O-N 3.22Å; Y296-V299 PolarHBondContact O-N 2.77Å; Y296-L300 HydrophobicContact CE1-CD2 4.02Å; Y296-L300 WeakPolarHBondContact O-CB 3.42Å; Y296-L300 PolarHBondContact O-N 3.29Å
297	E	88.8	Confident	80.4	Confident	58 Å²	58	50.4 Å²	50.4	27%	0.271	26%	0.262	S	S	.	.	H	α-helix	trans	-64	-38.8	-178.6	-70.7	-73.2	-169.6	0	0	112.3	I278 C293 R294 L295 A301 R1090	I278-E297 HydrophobicContact CG2-CG 4.2Å; C293-E297 WeakPolarHBondContact O-CG 3.49Å; C293-E297 PolarHBondContact O-N 3Å; C293-E297 VanDerWaalsContact O-N 3.17Å; R294-E297 PolarHBondContact O-N 2.98Å; L295-E297 PolarHBondContact O-N 2.89Å; E297-A301 WeakPolarHBondContact O-CB 3.37Å; E297-A301 PolarHBondContact O-N 2.8Å; E297-R1090 IonicContact OE1-CZ 3.19Å; E297-R1090 IonicContact OE1-NH1 2.79Å; E297-R1090 PolarHBondContact OE1-NH1 3.26Å; E297-R1090 IonicContact OE1-NH2 2.77Å; E297-R1090 IonicContact OE2-CZ 4Å; E297-R1090 IonicContact OE2-NH1 3.87Å; E297-R1090 PolarHBondContact OE2-NH1 3.5Å
298	T	85.8	Confident	77.9	Confident	56 Å²	56	51.4 Å²	51.4	34%	0.344	27%	0.267	S	S	.	.	H	α-helix	trans	-66.7	-42.9	179.3	-57.1	0	0	0	0	111.3	R294 L295 Y296 K302	R294-T298 PolarHBondContact NH1-OG1 2.66Å; R294-T298 VanDerWaalsContact O-CB 3.26Å; R294-T298 WeakPolarHBondContact O-CB 3.36Å; R294-T298 PolarHBondContact O-N 3.19Å; R294-T298 PolarHBondContact O-OG1 3.2Å; L295-T298 PolarHBondContact O-N 2.89Å; Y296-T298 PolarHBondContact O-N 3.22Å; T298-K302 WeakPolarHBondContact O-CB 3.46Å; T298-K302 PolarHBondContact O-N 3.39Å
299	V	85.5	Confident	75.3	Confident	17 Å²	17	55 Å²	55	10%	0.103	28%	0.281	C	S	.	.	H	α-helix	trans	-66.4	-45.6	178.3	175	0	0	0	0	110.2	Y262 L295 Y296 A301 K302 E303 P1075	Y262-V299 HydrophobicContact CE2-CG1 4.28Å; L295-V299 HydrophobicContact CD1-CG2 4.21Å; L295-V299 WeakPolarHBondContact O-CG2 3.48Å; L295-V299 PolarHBondContact O-N 3.42Å; Y296-V299 PolarHBondContact O-N 2.77Å; V299-A301 PolarHBondContact O-N 3.28Å; V299-K302 PolarHBondContact O-N 2.65Å; V299-E303 HydrophobicContact CG1-CG 4.48Å; V299-E303 WeakPolarHBondContact O-CG 3.47Å; V299-E303 PolarHBondContact O-N 3.43Å; V299-P1075 HydrophobicContact CG2-CB 4.3Å; V299-P1075 HydrophobicContact CG2-CG 4.24Å
300	L	85.3	Confident	72.6	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-60.7	-44.8	177.3	-176.2	59	0	0	0	112	Y262 V266 Y296 K302 E303 D304	Y262-L300 HydrophobicContact CE1-CD1 4.45Å; Y262-L300 WeakPolarHBondContact OH-CA 3.38Å; V266-L300 HydrophobicContact CG1-CD1 3.79Å; Y296-L300 HydrophobicContact CE1-CD2 4.02Å; Y296-L300 WeakPolarHBondContact O-CB 3.42Å; Y296-L300 PolarHBondContact O-N 3.29Å; L300-K302 VanDerWaalsContact C-N 3.35Å; L300-K302 PolarHBondContact O-N 3.38Å; L300-E303 PolarHBondContact O-N 3Å; L300-D304 WeakPolarHBondContact O-CB 3.24Å; L300-D304 PolarHBondContact O-N 3.03Å
301	A	82.3	Confident	69.9	Low	59 Å²	59	66.7 Å²	66.7	49%	0.488	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-38.7	178	0	0	0	0	0	112.7	E297 V299 S305	E297-A301 WeakPolarHBondContact O-CB 3.37Å; E297-A301 PolarHBondContact O-N 2.8Å; V299-A301 PolarHBondContact O-N 3.28Å; A301-S305 WeakPolarHBondContact O-CB 3.5Å; A301-S305 PolarHBondContact O-N 3.38Å; A301-S305 VanDerWaalsContact O-N 3.12Å
302	K	78.7	Confident	67.3	Low	84 Å²	84	69.4 Å²	69.4	37%	0.365	37%	0.365	S	S	.	.	H	α-helix	trans	-66.9	-45.6	176	-170.9	-168.9	176.1	-179.3	0	111.4	T298 V299 L300 D304 S305 P1075	T298-K302 WeakPolarHBondContact O-CB 3.46Å; T298-K302 PolarHBondContact O-N 3.39Å; V299-K302 PolarHBondContact O-N 2.65Å; L300-K302 VanDerWaalsContact C-N 3.35Å; L300-K302 PolarHBondContact O-N 3.38Å; K302-D304 VanDerWaalsContact C-N 3.27Å; K302-D304 PolarHBondContact O-N 3.27Å; K302-S305 WeakPolarHBondContact O-CB 3.24Å; K302-S305 PolarHBondContact O-N 3.13Å; K302-S305 PolarHBondContact O-OG 3.44Å; K302-P1075 HydrophobicContact CD-CB 3.35Å; K302-P1075 HydrophobicContact CD-CG 3.95Å; K302-P1075 PolarHBondContact NZ-O 3.48Å
303	E	79	Confident	64.4	Low	18 Å²	18	78.4 Å²	78.4	8%	0.084	40%	0.404	C	S	.	.	H	α-helix	trans	-62.6	-36.4	179.1	-73.2	-70.3	173.7	0	0	112.2	Q259 Y262 Y263 V299 L300 S305 R1078	Q259-E303 PolarHBondContact NE2-OE2 3.5Å; Y262-E303 HydrophobicContact CD1-CG 4.25Å; Y262-E303 HydrophobicContact CE1-CB 3.92Å; Y262-E303 HydrophobicContact CE1-CG 3.74Å; Y263-E303 VanDerWaalsContact OH-C 3.29Å; Y263-E303 PolarHBondContact OH-O 3.41Å; V299-E303 HydrophobicContact CG1-CG 4.48Å; V299-E303 WeakPolarHBondContact O-CG 3.47Å; V299-E303 PolarHBondContact O-N 3.43Å; L300-E303 PolarHBondContact O-N 3Å; E303-S305 VanDerWaalsContact C-N 3.31Å; E303-R1078 VanDerWaalsContact OE1-CD 3.32Å; E303-R1078 WeakPolarHBondContact OE1-CD 3.23Å; E303-R1078 IonicContact OE1-NE 2.73Å; E303-R1078 PolarHBondContact OE1-NE 3.36Å
304	D	79.5	Confident	61.4	Low	12 Å²	12	85 Å²	85	6%	0.064	44%	0.439	C	S	.	.	H	α-helix	trans	-74.5	-19.2	175.1	-84.9	-27.1	0	0	0	112.4	Y263 L300 K302 S1088 R1091	Y263-D304 PolarHBondContact OH-OD1 3.34Å; L300-D304 WeakPolarHBondContact O-CB 3.24Å; L300-D304 PolarHBondContact O-N 3.03Å; K302-D304 VanDerWaalsContact C-N 3.27Å; K302-D304 PolarHBondContact O-N 3.27Å; D304-S1088 PolarHBondContact OD1-N 3.32Å; D304-S1088 PolarHBondContact OD1-OG 3.34Å; D304-S1088 PolarHBondContact OD2-OG 3.47Å; D304-R1091 PolarHBondContact O-NH1 2.96Å
305	S	66	Low	58.5	Low	44 Å²	44	83.6 Å²	83.6	31%	0.308	45%	0.449	S	S	.	.	S	Bend	trans	-71.1	136.9	-173.1	72.9	0	0	0	0	113.6	A301 K302 E303 E307	A301-S305 WeakPolarHBondContact O-CB 3.5Å; A301-S305 PolarHBondContact O-N 3.38Å; A301-S305 VanDerWaalsContact O-N 3.12Å; K302-S305 WeakPolarHBondContact O-CB 3.24Å; K302-S305 PolarHBondContact O-N 3.13Å; K302-S305 PolarHBondContact O-OG 3.44Å; E303-S305 VanDerWaalsContact C-N 3.31Å; S305-E307 PolarHBondContact O-N 3.45Å
306	E	53.6	Low	55.8	Low	109 Å²	109	91.2 Å²	91.2	51%	0.509	48%	0.483	S	S	.	.			trans	-84.5	90.5	179.9	-69.4	179	-170.3	0	0	109.7	T308 K1087	E306-T308 VanDerWaalsContact C-N 3.27Å; E306-T308 PolarHBondContact O-N 3.48Å; E306-T308 PolarHBondContact O-OG1 3.2Å; E306-K1087 IonicContact OE1-NZ 2.72Å; E306-K1087 PolarHBondContact OE1-NZ 3.03Å
307	E	41.3	Very low	52.7	Low	134 Å²	134	95.8 Å²	95.8	63%	0.626	51%	0.511	S	S	*	.			trans	-69.2	92.9	164.9	-78.6	-169.6	174.5	0	0	109.2	S305	S305-E307 PolarHBondContact O-N 3.45Å
308	T	31.3	Very low	49.6	Very low	112 Å²	112	98.3 Å²	98.3	69%	0.687	54%	0.535	S	S	*	.			trans	-73.1	120.8	173.4	3.1	0	0	0	0	108.5	E306 F310	E306-T308 VanDerWaalsContact C-N 3.27Å; E306-T308 PolarHBondContact O-N 3.48Å; E306-T308 PolarHBondContact O-OG1 3.2Å; T308-F310 PolarHBondContact O-N 3.33Å
309	F	28	Very low	46.7	Very low	184 Å²	184	105.3 Å²	105.3	81%	0.807	56%	0.557	S	S	*	*			trans	-68.5	89.5	-175.2	-157.8	-90.9	0	0	0	111.4
310	F	27.4	Very low	43.7	Very low	193 Å²	193	112 Å²	112	85%	0.846	59%	0.591	S	S	*	*			trans	-136.4	67.1	162	-74.4	-74.2	0	0	0	109.5	T308 S312	T308-F310 PolarHBondContact O-N 3.33Å; F310-S312 PolarHBondContact O-N 3.02Å
311	S	27.9	Very low	40.9	Very low	93 Å²	93	121.5 Å²	121.5	65%	0.65	63%	0.633	S	S	*	*			trans	-84	111.3	165.5	61.7	0	0	0	0	109.7	F313	S311-F313 PolarHBondContact O-N 3.11Å
312	S	31.6	Very low	38.3	Very low	116 Å²	116	124.4 Å²	124.4	81%	0.811	64%	0.644	S	S	*	*			trans	-41.8	112.3	167.8	-167.8	0	0	0	0	112.3	F310	F310-S312 PolarHBondContact O-N 3.02Å
313	F	28.9	Very low	35.6	Very low	196 Å²	196	125 Å²	125	86%	0.86	67%	0.665	S	S	*	*			trans	-139.4	90.2	161.9	-118.6	-88	0	0	0	110.4	S311	S311-F313 PolarHBondContact O-N 3.11Å
314	N	25.5	Very low	33.2	Very low	140 Å²	140	128.7 Å²	128.7	75%	0.749	70%	0.698	S	S	*	*				51.5	138.1	126.5	-137.2	1.3	0	0	0	122
315	S	25.9	Very low	30.9	Very low	97 Å²	97	134 Å²	134	68%	0.678	73%	0.733	S	S	*	*			trans	86	109.3	157.2	71.4	0	0	0	0	119.2	V317	S315-V317 PolarHBondContact O-N 3.47Å
316	H	29.9	Very low	28.9	Very low	187 Å²	187	137.2 Å²	137.2	87%	0.866	76%	0.756	S	S	*	*			trans	-29	103.7	152.6	-82.6	-78.6	0	0	0	113.1
317	V	25	Very low	27.8	Very low	99 Å²	99	143.8 Å²	143.8	60%	0.6	78%	0.776	S	S	*	*			trans	-134.6	99.6	148.5	-171.7	0	0	0	0	107.2	S315 Y319	S315-V317 PolarHBondContact O-N 3.47Å; V317-Y319 HydrophobicContact CB-CD2 4.24Å; V317-Y319 HydrophobicContact CB-CE2 4.34Å; V317-Y319 HydrophobicContact CG1-CD2 3.49Å; V317-Y319 VanDerWaalsContact CG1-CD2 3.49Å; V317-Y319 HydrophobicContact CG1-CE2 3.38Å; V317-Y319 HydrophobicContact CG1-CG 4.45Å; V317-Y319 PolarHBondContact O-N 3.13Å
318	S	23.3	Very low	27.1	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	79%	0.787	S	S	*	*			trans	-60.6	83	167.7	-59.1	0	0	0	0	109.4	L320	S318-L320 PolarHBondContact O-N 2.9Å
319	Y	24.6	Very low	27	Very low	203 Å²	203	143.4 Å²	143.4	80%	0.796	79%	0.792	S	S	*	*			trans	-79.8	100.5	161.7	-88.4	-75.4	0	0	0	108.3	V317 F321	V317-Y319 HydrophobicContact CB-CD2 4.24Å; V317-Y319 HydrophobicContact CB-CE2 4.34Å; V317-Y319 HydrophobicContact CG1-CD2 3.49Å; V317-Y319 VanDerWaalsContact CG1-CD2 3.49Å; V317-Y319 HydrophobicContact CG1-CE2 3.38Å; V317-Y319 HydrophobicContact CG1-CG 4.45Å; V317-Y319 PolarHBondContact O-N 3.13Å; Y319-F321 PolarHBondContact O-N 3.04Å
320	L	23.2	Very low	27	Very low	158 Å²	158	143.6 Å²	143.6	83%	0.827	80%	0.796	S	S	*	*			trans	-40.3	99.5	155.8	-78.5	151.3	0	0	0	110.1	S318	S318-L320 PolarHBondContact O-N 2.9Å
321	F	26.4	Very low	27.2	Very low	204 Å²	204	140.4 Å²	140.4	90%	0.895	79%	0.794	S	S	*	*			trans	-105	98.8	156.1	-132.5	-94.3	0	0	0	107.1	Y319 A323	Y319-F321 PolarHBondContact O-N 3.04Å; F321-A323 PolarHBondContact O-N 3.38Å
322	V	27.5	Very low	27.2	Very low	120 Å²	120	142.4 Å²	142.4	73%	0.727	80%	0.802	S	S	*	*			trans	-57.2	120.5	173.3	170.9	0	0	0	0	108.1	A324	V322-A324 PolarHBondContact O-N 2.96Å
323	A	22.6	Very low	26.8	Very low	97 Å²	97	145.9 Å²	145.9	80%	0.802	81%	0.806	S	S	*	*			trans	-59	125.2	172.6	0	0	0	0	0	110.5	F321	F321-A323 PolarHBondContact O-N 3.38Å
324	A	26.7	Very low	26.8	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	81%	0.805	S	S	*	*			trans	-115.3	134	156.1	0	0	0	0	0	107.4	V322	V322-A324 PolarHBondContact O-N 2.96Å
325	P	32.8	Very low	26.8	Very low	123 Å²	123	143.1 Å²	143.1	80%	0.799	80%	0.8	S	S	*	*			trans	-90.2	152.2	-152.9	34.4	-33	0	0	0	113.9
326	S	23.4	Very low	26.6	Very low	112 Å²	112	147.5 Å²	147.5	78%	0.783	81%	0.81	S	S	*	*			trans	-3.2	126.3	158.5	-51.3	0	0	0	0	117.5
327	R	30.6	Very low	26.3	Very low	246 Å²	246	148.3 Å²	148.3	93%	0.928	81%	0.805	S	S	*	*			trans	-131.7	110.6	152.5	-140.8	175.4	177.6	180	-1.8	108.9
328	D	26.8	Very low	26.5	Very low	162 Å²	162	149.6 Å²	149.6	87%	0.866	82%	0.816	S	S	*	*			trans	-52.5	136.7	176.7	-62.7	-65.3	0	0	0	112.5
329	G	30	Very low	26.5	Very low	77 Å²	77	153.5 Å²	153.5	79%	0.794	82%	0.824	S	S	*	*			trans	-151	92.4	169.5	0	0	0	0	0	108.8
330	Q	26.9	Very low	26.7	Very low	187 Å²	187	147.7 Å²	147.7	87%	0.874	83%	0.826	S	S	*	*			trans	-57.6	148.6	-178.4	-97.5	167.6	-45.7	0	0	113.7
331	P	30.8	Very low	26.6	Very low	126 Å²	126	150.5 Å²	150.5	82%	0.818	83%	0.826	S	S	*	*			trans	-85.7	142.1	178.9	35.2	-31.1	0	0	0	111.3
332	V	28.8	Very low	26.4	Very low	136 Å²	136	149.5 Å²	149.5	82%	0.824	82%	0.821	S	S	*	*			trans	-110.4	126.7	172.3	179	0	0	0	0	109
333	E	23.5	Very low	26.5	Very low	188 Å²	188	147.6 Å²	147.6	88%	0.879	83%	0.826	S	S	*	*			trans	-47.5	138.6	179.3	-75.6	162.2	120.3	0	0	114.6
334	V	28.9	Very low	26.6	Very low	139 Å²	139	149 Å²	149	84%	0.842	83%	0.83	S	S	*	*			trans	-114.3	100.9	160.4	178.5	0	0	0	0	107.2	Q336	V334-Q336 PolarHBondContact O-N 3.17Å
335	E	25	Very low	26.7	Very low	140 Å²	140	149.2 Å²	149.2	65%	0.654	83%	0.831	S	S	*	*			trans	-62	115	-179.6	-169.7	-179.1	156.4	0	0	110.7	R337	E335-R337 IonicContact OE1-CZ 3.78Å; E335-R337 IonicContact OE1-NE 2.62Å; E335-R337 PolarHBondContact OE1-NE 3.38Å; E335-R337 IonicContact OE1-NH2 3.5Å; E335-R337 PolarHBondContact OE1-NH2 3.36Å
336	Q	21.3	Very low	26.6	Very low	188 Å²	188	149.7 Å²	149.7	88%	0.879	83%	0.834	S	S	*	*			trans	-76.9	127.1	166.2	-67.5	175.8	12.3	0	0	108.8	V334	V334-Q336 PolarHBondContact O-N 3.17Å
337	R	25	Very low	26.6	Very low	204 Å²	204	153.8 Å²	153.8	77%	0.77	84%	0.838	S	S	*	*			trans	-120.7	142	163.8	-84.1	-174.3	-174.4	-174.6	1.6	111.3	E335	E335-R337 IonicContact OE1-CZ 3.78Å; E335-R337 IonicContact OE1-NE 2.62Å; E335-R337 PolarHBondContact OE1-NE 3.38Å; E335-R337 IonicContact OE1-NH2 3.5Å; E335-R337 PolarHBondContact OE1-NH2 3.36Å
338	P	29.5	Very low	26.5	Very low	126 Å²	126	146.4 Å²	146.4	82%	0.818	83%	0.83	S	S	*	*			trans	-104.4	160.2	-150.7	10.5	12.3	0	0	0	113.6
339	M	21.8	Very low	27.4	Very low	192 Å²	192	144.6 Å²	144.6	95%	0.946	83%	0.827	S	S	*	*			trans	-32.5	120.4	174.2	-69.9	-126.1	-82.7	0	0	117.1
340	G	28.3	Very low	27.1	Very low	82 Å²	82	145.1 Å²	145.1	85%	0.845	82%	0.823	S	S	*	*			trans	-94.3	123.5	160.8	0	0	0	0	0	111.2
341	R	22.6	Very low	27.5	Very low	217 Å²	217	142.4 Å²	142.4	82%	0.819	82%	0.822	S	S	*	*			trans	-85.8	150.6	-173	-152.5	-172.7	177.5	175.1	2.3	111.5
342	K	22.6	Very low	27.2	Very low	183 Å²	183	143.4 Å²	143.4	80%	0.796	83%	0.826	S	S	*	*			trans	76.5	122.9	156.8	-77.7	168	179.5	-172.5	0	119.1
343	G	28.4	Very low	27.3	Very low	80 Å²	80	140 Å²	140	83%	0.825	82%	0.818	S	S	*	*			trans	-178	102.6	159.3	0	0	0	0	0	111.5
344	S	24.1	Very low	28.3	Very low	126 Å²	126	136.7 Å²	136.7	88%	0.881	81%	0.813	S	S	*	*			trans	-68.3	157.3	-176.2	-48	0	0	0	0	114
345	A	29.7	Very low	28.2	Very low	99 Å²	99	137.5 Å²	137.5	82%	0.818	81%	0.812	S	S	*	*			trans	-36.6	152.4	-177.3	0	0	0	0	0	118.8
346	P	30.7	Very low	28.3	Very low	133 Å²	133	137.2 Å²	137.2	86%	0.864	81%	0.811	S	S	*	*				-130	166.7	125.1	34.7	-21.5	0	0	0	113.6
347	K	23.6	Very low	28.5	Very low	199 Å²	199	136.4 Å²	136.4	87%	0.865	80%	0.804	S	S	*	*			trans	-113.9	135.3	-152.5	-179.9	-177.6	-177	-179.5	0	110.6
348	A	28.8	Very low	28.6	Very low	90 Å²	90	136 Å²	136	74%	0.744	81%	0.808	S	S	*	*			trans	65.1	166.5	154.6	0	0	0	0	0	119.2
349	P	45.2	Very low	28.4	Very low	124 Å²	124	142.2 Å²	142.2	81%	0.805	82%	0.815	S	S	*	*			cis	-126.9	178	-13.6	31.4	-10.1	0	0	0	114.6
350	A	24.5	Very low	28.7	Very low	88 Å²	88	141.7 Å²	141.7	73%	0.727	81%	0.81	S	S	*	*			trans	-52.5	154.8	179.8	0	0	0	0	0	117.5
351	P	33.7	Very low	28.6	Very low	130 Å²	130	143 Å²	143	84%	0.844	81%	0.807	S	S	*	*			trans	-118.4	120	140.9	32.2	-18.6	0	0	0	110.8
352	V	26.1	Very low	28.9	Very low	148 Å²	148	140.1 Å²	140.1	90%	0.897	81%	0.808	S	S	*	*			trans	-82.4	127.7	164.9	175.9	0	0	0	0	107.5
353	G	29.6	Very low	29	Very low	65 Å²	65	138.7 Å²	138.7	67%	0.67	81%	0.809	S	S	*	*			trans	166.4	121	169.9	0	0	0	0	0	114.1
354	P	45.8	Very low	29	Very low	118 Å²	118	140.2 Å²	140.2	77%	0.766	81%	0.806	S	S	*	*			trans	-95.8	155.4	-164.7	37.7	-32.5	0	0	0	112.7
355	L	26.7	Very low	29.1	Very low	155 Å²	155	143 Å²	143	81%	0.812	81%	0.806	S	S	*	*			trans	-167.5	113.5	138.1	-125.1	88.5	0	0	0	112.4
356	E	25.6	Very low	28.9	Very low	135 Å²	135	145.4 Å²	145.4	63%	0.631	80%	0.8	S	S	*	*			trans	53.8	116.1	133.1	-66.5	-165.7	122.1	0	0	123.8
357	K	25.5	Very low	28.6	Very low	171 Å²	171	150.9 Å²	150.9	74%	0.743	80%	0.803	S	S	*	*				60.2	101	123.9	-65.5	171.9	-179.5	153.1	0	118.8
358	K	27.1	Very low	28.7	Very low	196 Å²	196	151.1 Å²	151.1	85%	0.852	80%	0.8	S	S	*	*				-168.3	85.2	125.6	-112.9	170.9	-179.9	173.9	0	110.3
359	R	25.4	Very low	28.7	Very low	255 Å²	255	150.1 Å²	150.1	96%	0.962	80%	0.799	S	S	*	*			trans	-104.5	101.8	159.7	-89.1	-174.3	172	-172.2	-2.2	107.8	S361	R359-S361 PolarHBondContact O-N 3.29Å
360	Q	28.4	Very low	27.8	Very low	181 Å²	181	150 Å²	150	85%	0.846	80%	0.801	S	S	*	*			trans	-69	115.9	163.5	-81	168.4	-23.4	0	0	107.6	N362	Q360-N362 PolarHBondContact O-N 3.11Å
361	S	26.7	Very low	27.9	Very low	111 Å²	111	153.8 Å²	153.8	78%	0.776	81%	0.808	S	S	*	*			trans	-68	113.8	168.3	50.3	0	0	0	0	109.4	R359	R359-S361 PolarHBondContact O-N 3.29Å
362	N	28.3	Very low	27.5	Very low	156 Å²	156	156.4 Å²	156.4	83%	0.834	81%	0.809	S	S	*	*			trans	-93.5	103.3	160.6	-106.1	-1.3	0	0	0	107.9	Q360 S364	Q360-N362 PolarHBondContact O-N 3.11Å; N362-S364 PolarHBondContact O-N 3.31Å
363	D	25.4	Very low	27.4	Very low	153 Å²	153	158.4 Å²	158.4	82%	0.818	81%	0.808	S	S	*	*			trans	-53.3	112.6	162.9	-99.5	-35.8	0	0	0	109.1
364	S	29.1	Very low	27.2	Very low	111 Å²	111	160 Å²	160	78%	0.776	81%	0.809	S	S	*	*			trans	-112.6	89.8	162.8	-62.9	0	0	0	0	107	N362 E366	N362-S364 PolarHBondContact O-N 3.31Å; S364-E366 PolarHBondContact O-N 2.87Å
365	Q	25.7	Very low	26.3	Very low	185 Å²	185	160.3 Å²	160.3	86%	0.864	81%	0.811	S	S	*	*			trans	-63.6	122.8	-177.7	-159.6	172.5	-34.7	0	0	110.2	R367	Q365-R367 PolarHBondContact O-N 2.85Å
366	E	25.7	Very low	26.4	Very low	149 Å²	149	161.6 Å²	161.6	70%	0.696	81%	0.813	S	S	*	*			trans	-57.1	121.2	-177.2	-63.6	173.2	157.1	0	0	111.8	S364 Y368	S364-E366 PolarHBondContact O-N 2.87Å; E366-Y368 HydrophobicContact CB-CD2 4.42Å; E366-Y368 HydrophobicContact CB-CE2 4.2Å
367	R	24.6	Very low	26.4	Very low	249 Å²	249	161 Å²	161	94%	0.94	82%	0.819	S	S	*	*			trans	-94.5	96.5	174.2	-161.1	-177.2	-70.7	-159.4	-0.2	107.9	Q365 G369	Q365-R367 PolarHBondContact O-N 2.85Å; R367-G369 PolarHBondContact O-N 3.06Å
368	Y	24.9	Very low	26.4	Very low	204 Å²	204	160.7 Å²	160.7	80%	0.8	82%	0.824	S	S	*	*			trans	-65.5	107.4	171.5	-81.7	-99.2	0	0	0	109.7	E366	E366-Y368 HydrophobicContact CB-CD2 4.42Å; E366-Y368 HydrophobicContact CB-CE2 4.2Å
369	G	28.6	Very low	26.4	Very low	69 Å²	69	157.5 Å²	157.5	71%	0.711	82%	0.821	S	S	*	*			trans	-90.5	115.3	168.3	0	0	0	0	0	109.7	R367 L371	R367-G369 PolarHBondContact O-N 3.06Å; G369-L371 PolarHBondContact O-N 2.86Å
370	S	27.1	Very low	26.4	Very low	122 Å²	122	148.5 Å²	148.5	85%	0.853	81%	0.808	S	S	*	*			trans	-70.7	116.2	176	-167.1	0	0	0	0	109.6	Q372	S370-Q372 PolarHBondContact O-N 3.36Å
371	L	25.5	Very low	26.3	Very low	166 Å²	166	151.8 Å²	151.8	87%	0.869	81%	0.812	S	S	*	*			trans	-65.1	125.5	168.9	-79.5	151.9	0	0	0	109.1	G369	G369-L371 PolarHBondContact O-N 2.86Å
372	Q	25.3	Very low	26.3	Very low	185 Å²	185	151.6 Å²	151.6	86%	0.864	81%	0.811	S	S	*	*			trans	-99.4	98.2	175.4	-166.3	169.6	-4.8	0	0	106.8	S370 S374	S370-Q372 PolarHBondContact O-N 3.36Å; Q372-S374 PolarHBondContact O-N 3.11Å
373	E	24.1	Very low	26.2	Very low	190 Å²	190	150 Å²	150	89%	0.888	81%	0.812	S	S	*	*			trans	-63.4	119.7	175.1	-76.7	-179.5	156.8	0	0	109.8
374	S	25.7	Very low	26.4	Very low	98 Å²	98	150.4 Å²	150.4	69%	0.685	81%	0.812	S	S	*	*			trans	-101.4	126.1	169.1	-60.9	0	0	0	0	108.1	Q372 Q376	Q372-S374 PolarHBondContact O-N 3.11Å; S374-Q376 PolarHBondContact O-N 2.81Å; S374-Q376 VanDerWaalsContact O-N 3.17Å
375	P	27.5	Very low	26.3	Very low	126 Å²	126	150.5 Å²	150.5	82%	0.818	81%	0.813	S	S	*	*			trans	-76	106.9	-174.5	28.9	-31.4	0	0	0	110.3	T377	P375-T377 PolarHBondContact O-N 2.91Å
376	Q	28.6	Very low	26.4	Very low	181 Å²	181	147.2 Å²	147.2	85%	0.846	81%	0.811	S	S	*	*			trans	-78.6	111.4	171	-71.8	-171.1	-7.3	0	0	109.7	S374 I378	S374-Q376 PolarHBondContact O-N 2.81Å; S374-Q376 VanDerWaalsContact O-N 3.17Å; Q376-I378 PolarHBondContact O-N 3.33Å
377	T	24.3	Very low	26.4	Very low	124 Å²	124	148.6 Å²	148.6	76%	0.761	82%	0.822	S	S	*	*			trans	-72	106.1	174.4	-54.2	0	0	0	0	108.9	P375 T379	P375-T377 PolarHBondContact O-N 2.91Å; T377-T379 HydrophobicContact CG2-CG2 4.32Å; T377-T379 PolarHBondContact O-N 3.41Å
378	I	27.2	Very low	26.3	Very low	163 Å²	163	142 Å²	142	84%	0.836	81%	0.814	S	S	*	*			trans	-79.6	98	174	-62.9	175.8	0	0	0	108.6	Q376 G380	Q376-I378 PolarHBondContact O-N 3.33Å; I378-G380 PolarHBondContact O-N 2.93Å
379	T	26	Very low	26.4	Very low	130 Å²	130	138.2 Å²	138.2	80%	0.798	82%	0.818	S	S	*	*			trans	-81.8	103.8	166.4	52.5	0	0	0	0	109.4	T377	T377-T379 HydrophobicContact CG2-CG2 4.32Å; T377-T379 PolarHBondContact O-N 3.41Å
380	G	26.8	Very low	26.2	Very low	66 Å²	66	139 Å²	139	68%	0.68	83%	0.825	S	S	*	*			trans	-138.5	67.9	176.2	0	0	0	0	0	111.1	I378 S382	I378-G380 PolarHBondContact O-N 2.93Å; G380-S382 PolarHBondContact O-N 3.37Å
381	R	25.6	Very low	26.2	Very low	249 Å²	249	136.7 Å²	136.7	94%	0.94	82%	0.821	S	S	*	*			trans	-85.5	99.4	178.4	-159.1	179.6	-168.6	-156	3.7	108.8
382	S	26.7	Very low	26.3	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	83%	0.825	S	S	*	*			trans	-74.3	122.8	171.7	24.9	0	0	0	0	110.4	G380 I384	G380-S382 PolarHBondContact O-N 3.37Å; S382-I384 PolarHBondContact O-N 3.1Å
383	S	26.3	Very low	26.4	Very low	124 Å²	124	138.4 Å²	138.4	87%	0.867	83%	0.825	S	S	*	*			trans	-62.6	110.5	-178.4	-52.1	0	0	0	0	111.9
384	I	28.8	Very low	26.7	Very low	160 Å²	160	136 Å²	136	82%	0.821	82%	0.823	S	S	*	*			trans	-91.9	109.5	167.3	-56.8	177	0	0	0	107.1	S382 S386	S382-I384 PolarHBondContact O-N 3.1Å; I384-S386 PolarHBondContact O-N 3.31Å; I384-S386 VanDerWaalsContact O-N 3.16Å
385	S	26.5	Very low	26.8	Very low	114 Å²	114	137 Å²	137	80%	0.797	83%	0.83	S	S	*	*			trans	-65.9	105.3	173	52.1	0	0	0	0	109.8
386	S	29.3	Very low	27	Very low	116 Å²	116	140.5 Å²	140.5	81%	0.811	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-85.7	119.1	173.3	35.7	0	0	0	0	109.9	I384	I384-S386 PolarHBondContact O-N 3.31Å; I384-S386 VanDerWaalsContact O-N 3.16Å
387	L	25.1	Very low	27.2	Very low	177 Å²	177	141 Å²	141	93%	0.927	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-73.9	132.2	169.5	-88.5	148.8	0	0	0	109.9
388	S	23.2	Very low	27.8	Very low	112 Å²	112	140.4 Å²	140.4	78%	0.783	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-62.9	130.3	177.9	178.8	0	0	0	0	112.8
389	S	27.3	Very low	28.3	Very low	124 Å²	124	139.4 Å²	139.4	87%	0.867	83%	0.825	S	S	*	*			trans	-156.9	124.4	141.6	-86.2	0	0	0	0	109.3
390	G	23.5	Very low	29.1	Very low	84 Å²	84	138.8 Å²	138.8	87%	0.866	82%	0.816	S	S	*	*			trans	-77.6	157	-164.6	0	0	0	0	0	115.2
391	G	27.4	Very low	30	Very low	75 Å²	75	136.4 Å²	136.4	77%	0.773	79%	0.79	S	S	*	*			trans	-169.2	96.7	165.8	0	0	0	0	0	107.2	Q393	G391-Q393 PolarHBondContact O-N 3.05Å; G391-Q393 VanDerWaalsContact O-N 3.09Å
392	E	26.3	Very low	31	Very low	205 Å²	205	128.9 Å²	128.9	96%	0.958	77%	0.773	S	S	*	*			trans	-60.5	107.1	175.4	-77.3	173.6	129.4	0	0	110
393	Q	28.7	Very low	32.1	Very low	181 Å²	181	127 Å²	127	85%	0.846	76%	0.758	S	S	*	*			trans	-122.2	121.6	154	-86.5	-176.8	14.7	0	0	108.5	G391 S395	G391-Q393 PolarHBondContact O-N 3.05Å; G391-Q393 VanDerWaalsContact O-N 3.09Å; Q393-S395 PolarHBondContact O-N 2.7Å; Q393-S395 VanDerWaalsContact O-N 3.09Å
394	T	29.1	Very low	33.3	Very low	139 Å²	139	121.9 Å²	121.9	85%	0.853	72%	0.722	S	S	*	*			trans	-60.4	104.5	-175.5	51.2	0	0	0	0	111.4	K396	T394-K396 PolarHBondContact O-N 3.09Å
395	S	28.5	Very low	34.6	Very low	120 Å²	120	122.9 Å²	122.9	84%	0.839	72%	0.721	S	S	*	*			trans	-65.3	109.3	176	-62.7	0	0	0	0	111.9	Q393 K397	Q393-S395 PolarHBondContact O-N 2.7Å; Q393-S395 VanDerWaalsContact O-N 3.09Å; S395-K397 PolarHBondContact O-N 2.93Å
396	K	32.4	Very low	35.8	Very low	200 Å²	200	120.9 Å²	120.9	87%	0.87	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-70.3	122.8	161.2	-69.3	-178.2	179.2	179	0	107.9	T394	T394-K396 PolarHBondContact O-N 3.09Å
397	K	31.7	Very low	37.1	Very low	192 Å²	192	116.2 Å²	116.2	84%	0.835	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-59.9	136.5	175.4	-79.8	179.5	175.8	179.1	0	110	S395	S395-K397 PolarHBondContact O-N 2.93Å
398	P	36.3	Very low	38.4	Very low	111 Å²	111	113.1 Å²	113.1	72%	0.721	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-68.5	132.2	-178.8	27	-32	0	0	0	110.6	L400	P398-L400 PolarHBondContact O-N 3.21Å
399	I	38.7	Very low	40	Very low	141 Å²	141	108.6 Å²	108.6	72%	0.723	62%	0.619	S	S	*	*			trans	-82.1	105.1	175.9	-64	170.4	0	0	0	106.7	I506	I399-I506 HydrophobicContact CB-CD1 4.46Å; I399-I506 HydrophobicContact CG2-CD1 4.39Å; I399-I506 WeakPolarHBondContact O-CD1 3.28Å
400	L	42.4	Very low	41.1	Very low	117 Å²	117	107.5 Å²	107.5	61%	0.613	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-81.8	132.1	176.3	-113.4	78.8	0	0	0	110.1	P398	P398-L400 PolarHBondContact O-N 3.21Å
401	A	45.6	Very low	41.9	Very low	16 Å²	16	110.1 Å²	110.1	13%	0.132	61%	0.605	C	S	.	*	P	Polyproline II helix	trans	-89.2	120.2	164.4	0	0	0	0	0	108.2	I506 N508	A401-I506 HydrophobicContact CB-CB 4.16Å; A401-I506 HydrophobicContact CB-CG2 3.8Å; A401-N508 PolarHBondContact N-O 2.93Å; A401-N508 CarbonylContact O-C 3.51Å; A401-N508 WeakPolarHBondContact O-CA 3.37Å; A401-N508 VanDerWaalsContact O-O 3.05Å
402	P	46.9	Very low	42.3	Very low	91 Å²	91	110.8 Å²	110.8	59%	0.591	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-65.2	149.5	178.6	22.8	-29.9	0	0	0	111.8	R915	P402-R915 PolarHBondContact O-NH1 2.83Å
403	P	50.5	Low	42.5	Very low	67 Å²	67	104.1 Å²	104.1	44%	0.435	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-61.8	154.6	170.9	26.4	-33.5	0	0	0	110.3	K405 N508	P403-K405 PolarHBondContact O-N 3.44Å; P403-N508 VanDerWaalsContact CA-OD1 3.29Å; P403-N508 WeakPolarHBondContact CA-OD1 3.06Å
404	P	51.7	Low	42.6	Very low	17 Å²	17	104.6 Å²	104.6	11%	0.11	58%	0.579	C	S	.	*			trans	-58.8	111.6	175.1	25	-31.6	0	0	0	108	L406 Y767 F908 D911	P404-L406 PolarHBondContact O-N 3.29Å; P404-L406 VanDerWaalsContact O-N 3.17Å; P404-Y767 HydrophobicContact CG-CD1 3.71Å; P404-Y767 HydrophobicContact CG-CE1 3.86Å; P404-F908 HydrophobicContact CB-CD2 4.24Å; P404-F908 HydrophobicContact CB-CE2 3.82Å; P404-F908 HydrophobicContact CG-CE2 4.4Å; P404-D911 WeakPolarHBondContact CB-OD2 3.47Å
405	K	54.5	Low	42.7	Very low	181 Å²	181	104.1 Å²	104.1	79%	0.787	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.4	172.8	-75.4	-175.3	179	-178.5	0	106.7	P403	P403-K405 PolarHBondContact O-N 3.44Å
406	L	53.1	Low	42.7	Very low	72 Å²	72	107 Å²	107	38%	0.377	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-46.9	129.1	161.5	-78.8	166.3	0	0	0	107.1	P404 D408 M764 L765	P404-L406 PolarHBondContact O-N 3.29Å; P404-L406 VanDerWaalsContact O-N 3.17Å; L406-D408 PolarHBondContact O-N 3.45Å; L406-D408 VanDerWaalsContact O-N 3.09Å; L406-M764 HydrophobicContact CD2-CB 4.14Å; L406-M764 WeakPolarHBondContact CD2-O 3.36Å; L406-L765 HydrophobicContact CD1-CD2 3.98Å; L406-L765 HydrophobicContact CD2-CD2 4.32Å
407	P	56	Low	42.7	Very low	19 Å²	19	103.2 Å²	103.2	12%	0.123	57%	0.574	C	S	.	*	P	Polyproline II helix	trans	-57.2	124.4	179.7	-19.8	29.6	0	0	0	108.6	F409 M764 K904 F908	P407-F409 HydrophobicContact CB-CD1 4.32Å; P407-F409 HydrophobicContact CB-CE1 3.69Å; P407-F409 HydrophobicContact CB-CE2 4.2Å; P407-F409 HydrophobicContact CB-CZ 3.64Å; P407-F409 HydrophobicContact CG-CE1 4.25Å; P407-F409 HydrophobicContact CG-CE2 4.46Å; P407-F409 HydrophobicContact CG-CZ 3.82Å; P407-F409 WeakPolarHBondContact O-CD2 3.49Å; P407-F409 WeakPolarHBondContact O-CE2 3.43Å; P407-F409 WeakPolarHBondContact O-CG 3.35Å; P407-F409 PolarHBondContact O-N 3.38Å; P407-M764 VanDerWaalsContact CD-CE 3.43Å; P407-M764 HydrophobicContact CG-CE 3.68Å; P407-K904 HydrophobicContact CB-CB 4.06Å; P407-K904 HydrophobicContact CB-CD 4.47Å; P407-F908 HydrophobicContact CG-CB 3.97Å; P407-F908 HydrophobicContact CG-CD2 4.43Å; P407-F908 HydrophobicContact CG-CG 4.38Å
408	D	53.2	Low	42.6	Very low	111 Å²	111	99.5 Å²	99.5	59%	0.594	57%	0.573	S	S	*	*			trans	-69.5	108.4	175.1	-173.6	-6.6	0	0	0	108.3	L406 S410 K904	L406-D408 PolarHBondContact O-N 3.45Å; L406-D408 VanDerWaalsContact O-N 3.09Å; D408-S410 VanDerWaalsContact OD1-CB 3.27Å; D408-S410 WeakPolarHBondContact OD1-CB 3.38Å; D408-S410 PolarHBondContact OD1-N 2.48Å; D408-S410 PolarHBondContact OD1-OG 2.64Å; D408-K904 PolarHBondContact O-NZ 3.14Å
409	F	56.4	Low	42.3	Very low	18 Å²	18	100 Å²	100	8%	0.079	58%	0.576	C	S	.	*			trans	-90.3	-1.5	-178.7	-57.9	-67.4	0	0	0	112.7	P407 N411 K698 F699 M764 L901 I905	P407-F409 HydrophobicContact CB-CD1 4.32Å; P407-F409 HydrophobicContact CB-CE1 3.69Å; P407-F409 HydrophobicContact CB-CE2 4.2Å; P407-F409 HydrophobicContact CB-CZ 3.64Å; P407-F409 HydrophobicContact CG-CE1 4.25Å; P407-F409 HydrophobicContact CG-CE2 4.46Å; P407-F409 HydrophobicContact CG-CZ 3.82Å; P407-F409 WeakPolarHBondContact O-CD2 3.49Å; P407-F409 WeakPolarHBondContact O-CE2 3.43Å; P407-F409 WeakPolarHBondContact O-CG 3.35Å; P407-F409 PolarHBondContact O-N 3.38Å; F409-N411 PolarHBondContact O-N 3.27Å; F409-K698 VanDerWaalsContact CB-O 3.23Å; F409-K698 WeakPolarHBondContact CB-O 3.35Å; F409-K698 WeakPolarHBondContact CG-O 3.22Å; F409-F699 HydrophobicContact CD2-CB 3.61Å; F409-F699 WeakPolarHBondContact CD2-O 2.98Å; F409-F699 HydrophobicContact CE1-CB 4.46Å; F409-F699 HydrophobicContact CE2-CB 3.38Å; F409-F699 HydrophobicContact CE2-CG 4.28Å; F409-F699 HydrophobicContact CG-CB 4.24Å; F409-F699 HydrophobicContact CZ-CB 3.84Å; F409-F699 HydrophobicContact CZ-CG 4.29Å; F409-M764 HydrophobicContact CE2-CE 4.35Å; F409-M764 HydrophobicContact CZ-CE 3.88Å; F409-L901 HydrophobicContact CD1-CD1 3.41Å; F409-L901 VanDerWaalsContact CD1-CD1 3.41Å; F409-L901 HydrophobicContact CE1-CD1 3.33Å; F409-L901 HydrophobicContact CZ-CD1 4.4Å; F409-I905 HydrophobicContact CE1-CG1 4.2Å; F409-I905 HydrophobicContact CZ-CG1 4.23Å
410	S	50	Low	41.8	Very low	101 Å²	101	102 Å²	102	71%	0.706	59%	0.587	S	S	*	*	S	Bend	trans	-65.7	-25.2	-174.8	-62.8	0	0	0	0	113.6	D408	D408-S410 VanDerWaalsContact OD1-CB 3.27Å; D408-S410 WeakPolarHBondContact OD1-CB 3.38Å; D408-S410 PolarHBondContact OD1-N 2.48Å; D408-S410 PolarHBondContact OD1-OG 2.64Å
411	N	40.4	Very low	41.1	Very low	138 Å²	138	101.8 Å²	101.8	74%	0.738	60%	0.596	S	S	*	*			trans	-114.5	90.6	174.7	-87.7	-37.1	0	0	0	111.5	F409 K904	F409-N411 PolarHBondContact O-N 3.27Å; N411-K904 PolarHBondContact O-NZ 3.26Å
412	L	35	Very low	40.5	Very low	89 Å²	89	106.9 Å²	106.9	47%	0.466	63%	0.627	S	S	.	*			trans	-104.3	65	160.3	-69.3	169.2	0	0	0	107.8
413	G	31.1	Very low	39.6	Very low	66 Å²	66	109.4 Å²	109.4	68%	0.68	64%	0.641	S	S	*	*			trans	-102.9	147.1	173.1	0	0	0	0	0	110.8
414	E	30.5	Very low	38.5	Very low	191 Å²	191	110 Å²	110	89%	0.893	66%	0.66	S	S	*	*			trans	-47.5	149.5	-168.3	-74.9	171.8	143.1	0	0	116.3	E416	E414-E416 PolarHBondContact O-N 3.26Å
415	P	32.5	Very low	37.3	Very low	128 Å²	128	114.7 Å²	114.7	83%	0.831	70%	0.699	S	S	*	*			trans	-75.4	114.9	-172.2	31.1	-32.1	0	0	0	111
416	E	27	Very low	35.9	Very low	181 Å²	181	109.7 Å²	109.7	85%	0.846	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-73.2	136.5	163	-106.4	-156.5	150.8	0	0	110.4	E414 S418	E414-E416 PolarHBondContact O-N 3.26Å; E416-S418 PolarHBondContact O-N 3.35Å
417	P	33.2	Very low	34.6	Very low	120 Å²	120	111.6 Å²	111.6	78%	0.779	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-75.2	121.4	-171.7	29.5	-32	0	0	0	111.3
418	S	28.6	Very low	33.5	Very low	115 Å²	115	116.5 Å²	116.5	80%	0.804	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-70.7	131.4	177.7	-40.2	0	0	0	0	111.3	E416	E416-S418 PolarHBondContact O-N 3.35Å
419	P	31.8	Very low	32.2	Very low	122 Å²	122	118 Å²	118	79%	0.792	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-80.9	138	174.7	29.3	-27.7	0	0	0	111.3
420	L	27	Very low	30.6	Very low	183 Å²	183	123.5 Å²	123.5	96%	0.958	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-60.3	127.9	177.7	-68.8	152.3	0	0	0	111.4
421	S	27.2	Very low	29.4	Very low	112 Å²	112	123.8 Å²	123.8	78%	0.783	79%	0.791	S	S	*	*			trans	-141.1	143.6	161.8	49.1	0	0	0	0	110.9
422	P	34.9	Very low	28.7	Very low	122 Å²	122	122.7 Å²	122.7	79%	0.792	79%	0.79	S	S	*	*			trans	-94.1	152.3	-150.1	35.2	-31.9	0	0	0	114.3
423	T	26.6	Very low	28.2	Very low	145 Å²	145	127.3 Å²	127.3	89%	0.89	81%	0.806	S	S	*	*			trans	-29.9	122.3	165.2	49.4	0	0	0	0	115.9
424	G	27.5	Very low	27.9	Very low	80 Å²	80	133.1 Å²	133.1	83%	0.825	81%	0.809	S	S	*	*			trans	-138.4	102.4	162.7	0	0	0	0	0	109.3
425	A	27.2	Very low	27.5	Very low	114 Å²	114	133.1 Å²	133.1	94%	0.942	81%	0.809	S	S	*	*			trans	-74.7	145.1	-178.1	0	0	0	0	0	112.1
426	G	25.5	Very low	27.2	Very low	77 Å²	77	136.5 Å²	136.5	79%	0.794	81%	0.813	S	S	*	*			trans	170.8	58.1	171.1	0	0	0	0	0	114
427	S	25.4	Very low	27	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	81%	0.811	S	S	*	*			trans	-99	127.3	166.9	-84.2	0	0	0	0	110.3	N429	S427-N429 PolarHBondContact O-N 3.32Å
428	P	32.2	Very low	26.6	Very low	122 Å²	122	136.8 Å²	136.8	79%	0.792	81%	0.81	S	S	*	*			trans	-81.9	111.2	171.4	31.3	-27.5	0	0	0	109.5	T430	P428-T430 PolarHBondContact O-N 3.06Å
429	N	26.2	Very low	26.4	Very low	141 Å²	141	138 Å²	138	75%	0.754	81%	0.813	S	S	*	*			trans	-71.2	118.2	174.5	-82.1	-23.1	0	0	0	110.8	S427	S427-N429 PolarHBondContact O-N 3.32Å
430	T	23.3	Very low	26.1	Very low	135 Å²	135	141.3 Å²	141.3	83%	0.828	82%	0.818	S	S	*	*			trans	-123.2	87.8	154.1	-53.3	0	0	0	0	107.7	P428 V432	P428-T430 PolarHBondContact O-N 3.06Å; T430-V432 PolarHBondContact O-N 3.47Å
431	T	25.3	Very low	26.4	Very low	106 Å²	106	138.7 Å²	138.7	65%	0.65	81%	0.811	S	S	*	*			trans	-80.2	108.6	-178.4	-49	0	0	0	0	109.9	K433	T431-K433 PolarHBondContact O-N 3.42Å
432	V	25.7	Very low	26.5	Very low	115 Å²	115	142.8 Å²	142.8	70%	0.697	82%	0.818	S	S	*	*			trans	-80	106.7	169.9	179.7	0	0	0	0	108.3	T430 Y434	T430-V432 PolarHBondContact O-N 3.47Å; V432-Y434 PolarHBondContact O-N 3.42Å
433	K	23.7	Very low	26.2	Very low	186 Å²	186	141.8 Å²	141.8	81%	0.809	82%	0.82	S	S	*	*			trans	-78.4	115	177.1	-75.6	-177.8	174.4	179.8	0	110.7	T431 Q435	T431-K433 PolarHBondContact O-N 3.42Å; K433-Q435 PolarHBondContact O-N 2.89Å
434	Y	24.2	Very low	26.1	Very low	189 Å²	189	139.8 Å²	139.8	74%	0.741	82%	0.819	S	S	*	*			trans	-71.3	114.9	163.8	-95.3	-96.2	0	0	0	109.9	V432	V432-Y434 PolarHBondContact O-N 3.42Å
435	Q	23.1	Very low	26.3	Very low	191 Å²	191	139.4 Å²	139.4	89%	0.893	82%	0.815	S	S	*	*			trans	-85.9	109.3	169.6	-91.8	178	-9.7	0	0	109.9	K433	K433-Q435 PolarHBondContact O-N 2.89Å
436	Q	25.5	Very low	26.9	Very low	198 Å²	198	139.6 Å²	139.6	93%	0.925	81%	0.806	S	S	*	*			trans	-88.6	113.9	170.3	-155.3	168.9	4.5	0	0	109
437	K	24	Very low	26.9	Very low	186 Å²	186	142.1 Å²	142.1	81%	0.809	81%	0.806	S	S	*	*			trans	-88.3	134.2	167.5	-147.2	-178.8	178.4	177.1	0	105.5
438	T	24.5	Very low	26.9	Very low	122 Å²	122	143 Å²	143	75%	0.748	81%	0.807	S	S	*	*				-168.2	127.4	50.1	-19.2	0	0	0	0	106.8
439	T	24	Very low	26.8	Very low	141 Å²	141	143.8 Å²	143.8	87%	0.865	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-100.3	121.9	166.1	40.3	0	0	0	0	108.4
440	E	25.5	Very low	26.8	Very low	191 Å²	191	140.6 Å²	140.6	89%	0.893	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-87.3	147.5	161.6	-89.2	-175.5	153.9	0	0	110
441	P	33.9	Very low	26.9	Very low	127 Å²	127	140.2 Å²	140.2	83%	0.825	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-100	128.2	-156.1	34.8	-24.9	0	0	0	111.4
442	E	27.5	Very low	27.1	Very low	199 Å²	199	141.2 Å²	141.2	93%	0.93	81%	0.806	S	S	*	*			trans	-110.7	131.1	165.1	-156.8	173	-179.4	0	0	109.9
443	A	29.5	Very low	27.9	Very low	100 Å²	100	141.1 Å²	141.1	83%	0.826	81%	0.808	S	S	*	*			trans	-72	140.9	-162.7	0	0	0	0	0	113.3
444	A	24.9	Very low	28.2	Very low	104 Å²	104	141.6 Å²	141.6	86%	0.86	81%	0.813	S	S	*	*			trans	-73.5	146.5	171.8	0	0	0	0	0	112.4
445	G	30.5	Very low	28.4	Very low	72 Å²	72	139.3 Å²	139.3	74%	0.742	81%	0.814	S	S	*	*			trans	-167	102.2	166.2	0	0	0	0	0	111
446	P	40	Very low	28.8	Very low	117 Å²	117	137.8 Å²	137.8	76%	0.76	81%	0.812	S	S	*	*			trans	-92.6	162.8	-177.4	36.8	-31.6	0	0	0	111
447	T	27	Very low	29	Very low	130 Å²	130	135.8 Å²	135.8	80%	0.798	81%	0.808	S	S	*	*			trans	-168.3	105.7	132.1	-63.9	0	0	0	0	109.6	V449	T447-V449 HydrophobicContact CG2-CG2 4.29Å
448	T	24.9	Very low	29.5	Very low	131 Å²	131	131.7 Å²	131.7	80%	0.804	81%	0.808	S	S	*	*			trans	-58.5	136	154.3	40.1	0	0	0	0	111.7
449	V	29.6	Very low	30.3	Very low	138 Å²	138	131.6 Å²	131.6	84%	0.836	81%	0.81	S	S	*	*			trans	-131.1	109.1	149	-179.7	0	0	0	0	107.8	T447	T447-V449 HydrophobicContact CG2-CG2 4.29Å
450	A	26	Very low	30.8	Very low	75 Å²	75	129.7 Å²	129.7	62%	0.62	81%	0.808	S	S	*	*			trans	-88.7	-176.7	168.7	0	0	0	0	0	110.2
451	T	25.8	Very low	31.6	Very low	126 Å²	126	124.1 Å²	124.1	77%	0.773	80%	0.802	S	S	*	*			trans	93.7	129.7	166.2	67.2	0	0	0	0	115.6
452	T	28.8	Very low	32.3	Very low	127 Å²	127	123.3 Å²	123.3	78%	0.779	80%	0.795	S	S	*	*			cis	-168.4	157.3	3.3	12.4	0	0	0	0	108.6
453	P	43.7	Very low	33.4	Very low	113 Å²	113	122.1 Å²	122.1	73%	0.734	79%	0.787	S	S	*	*			trans	-94.5	154.2	177	36.7	-29.5	0	0	0	112.6
454	E	29.8	Very low	34.7	Very low	196 Å²	196	120.3 Å²	120.3	92%	0.916	77%	0.772	S	S	*	*			trans	-121.4	136.9	158.9	-91.4	-173.9	149.3	0	0	110.5
455	N	27.7	Very low	36.3	Very low	142 Å²	142	119.2 Å²	119.2	76%	0.759	76%	0.758	S	S	*	*			trans	-75.6	153.6	-178.9	-61.5	-60.1	0	0	0	110.8
456	D	31.1	Very low	37.7	Very low	159 Å²	159	118.7 Å²	118.7	85%	0.85	75%	0.747	S	S	*	*				-177	152.1	117.5	-91.5	-19.7	0	0	0	112.8
457	D	29.4	Very low	38.6	Very low	156 Å²	156	118.7 Å²	118.7	83%	0.834	74%	0.74	S	S	*	*			trans	-57.8	146.9	-165.1	-69.9	-66.6	0	0	0	118.2
458	A	35.2	Very low	40.4	Very low	99 Å²	99	115.9 Å²	115.9	82%	0.818	73%	0.725	S	S	*	*			trans	-175.5	154.9	136.4	0	0	0	0	0	113.2
459	P	40.7	Very low	42.4	Very low	121 Å²	121	117.6 Å²	117.6	79%	0.786	72%	0.722	S	S	*	*			trans	-108.8	162.2	-145.6	38.5	-30.1	0	0	0	116.2
460	A	36	Very low	44	Very low	101 Å²	101	114 Å²	114	84%	0.835	71%	0.706	S	S	*	*			trans	56.8	113.4	144	0	0	0	0	0	120
461	G	41.8	Very low	45.5	Very low	74 Å²	74	117.2 Å²	117.2	76%	0.763	71%	0.706	S	S	*	*				97.8	52.9	127.8	0	0	0	0	0	117.2
462	T	48.5	Very low	47.4	Very low	109 Å²	109	120.2 Å²	120.2	67%	0.669	70%	0.703	S	S	*	*			trans	-128.5	151.9	160.6	52	0	0	0	0	111.1	A464 S465	T462-A464 PolarHBondContact O-N 3.05Å; T462-S465 WeakPolarHBondContact O-CB 3.49Å; T462-S465 PolarHBondContact O-N 3.04Å
463	F	50.5	Low	48.5	Very low	174 Å²	174	116.1 Å²	116.1	76%	0.763	69%	0.686	S	S	*	*	H	α-helix	trans	-42.5	-27.3	-175.8	-174.1	-100.6	0	0	0	115.1	S465 A466 L467	F463-S465 VanDerWaalsContact C-N 3.27Å; F463-S465 PolarHBondContact O-N 3.46Å; F463-A466 PolarHBondContact O-N 2.83Å; F463-A466 VanDerWaalsContact O-N 3.17Å; F463-L467 PolarHBondContact O-N 3.1Å
464	A	56	Low	48.9	Very low	62 Å²	62	117 Å²	117	51%	0.512	68%	0.682	S	S	.	*	H	α-helix	trans	-58.8	-32.9	172.4	0	0	0	0	0	113.9	T462 S468	T462-A464 PolarHBondContact O-N 3.05Å; A464-S468 WeakPolarHBondContact O-CB 3.5Å; A464-S468 PolarHBondContact O-N 3.15Å; A464-S468 PolarHBondContact O-OG 3.45Å
465	S	59.6	Low	49.9	Very low	81 Å²	81	111.4 Å²	111.4	57%	0.566	66%	0.658	S	S	*	*	H	α-helix	trans	-70.4	-38.4	175.5	-174.9	0	0	0	0	111.7	T462 F463 S468 K469	T462-S465 WeakPolarHBondContact O-CB 3.49Å; T462-S465 PolarHBondContact O-N 3.04Å; F463-S465 VanDerWaalsContact C-N 3.27Å; F463-S465 PolarHBondContact O-N 3.46Å; S465-S468 PolarHBondContact O-N 2.56Å; S465-K469 WeakPolarHBondContact O-CB 3.22Å; S465-K469 PolarHBondContact O-N 3.36Å
466	A	59.1	Low	51.1	Low	62 Å²	62	112.5 Å²	112.5	51%	0.512	66%	0.656	S	S	.	*	H	α-helix	trans	-65.7	-42.1	174.1	0	0	0	0	0	111.3	F463 K469 A470	F463-A466 PolarHBondContact O-N 2.83Å; F463-A466 VanDerWaalsContact O-N 3.17Å; A466-K469 PolarHBondContact O-N 3.39Å; A466-A470 PolarHBondContact O-N 3.02Å
467	L	59	Low	51.9	Low	117 Å²	117	113.3 Å²	113.3	61%	0.613	65%	0.652	S	S	*	*	H	α-helix	trans	-66.4	-39	176	-168.3	65.3	0	0	0	112.2	F463 K469 A470 K471	F463-L467 PolarHBondContact O-N 3.1Å; L467-K469 VanDerWaalsContact C-N 3.33Å; L467-K469 PolarHBondContact O-N 3.05Å; L467-A470 PolarHBondContact O-N 3.23Å; L467-K471 WeakPolarHBondContact O-CB 3.23Å; L467-K471 PolarHBondContact O-N 2.81Å
468	S	64.6	Low	52.7	Low	70 Å²	70	112.5 Å²	112.5	49%	0.49	65%	0.645	S	S	.	*	H	α-helix	trans	-67.2	-32.7	173.7	-72.6	0	0	0	0	112.7	A464 S465 K471 R472	A464-S468 WeakPolarHBondContact O-CB 3.5Å; A464-S468 PolarHBondContact O-N 3.15Å; A464-S468 PolarHBondContact O-OG 3.45Å; S465-S468 PolarHBondContact O-N 2.56Å; S468-K471 PolarHBondContact O-N 3.41Å; S468-R472 WeakPolarHBondContact O-CB 3.45Å; S468-R472 PolarHBondContact O-N 3.05Å
469	K	67.5	Low	53.5	Low	168 Å²	168	111.9 Å²	111.9	73%	0.73	64%	0.64	S	S	*	*	H	α-helix	trans	-70.7	-37.6	174.2	-157.1	174.8	-173.6	178.3	0	111.5	S465 A466 L467 G473	S465-K469 WeakPolarHBondContact O-CB 3.22Å; S465-K469 PolarHBondContact O-N 3.36Å; A466-K469 PolarHBondContact O-N 3.39Å; L467-K469 VanDerWaalsContact C-N 3.33Å; L467-K469 PolarHBondContact O-N 3.05Å; K469-G473 PolarHBondContact O-N 3.34Å
470	A	63.4	Low	53.7	Low	61 Å²	61	110.1 Å²	110.1	50%	0.504	64%	0.636	S	S	.	*	H	α-helix	trans	-65.2	-42.1	171.8	0	0	0	0	0	111.8	A466 L467 G473 M474	A466-A470 PolarHBondContact O-N 3.02Å; L467-A470 PolarHBondContact O-N 3.23Å; A470-G473 PolarHBondContact O-N 3.18Å; A470-M474 PolarHBondContact O-N 3.12Å
471	K	58.2	Low	53.8	Low	144 Å²	144	114.1 Å²	114.1	63%	0.626	63%	0.629	S	S	*	*	H	α-helix	trans	-65.5	-46.5	175.8	-164.3	170.3	-178.9	179.1	0	111.9	L467 S468 G473 M474 D475	L467-K471 WeakPolarHBondContact O-CB 3.23Å; L467-K471 PolarHBondContact O-N 2.81Å; S468-K471 PolarHBondContact O-N 3.41Å; K471-G473 PolarHBondContact O-N 3.03Å; K471-M474 CarbonylContact O-C 3.58Å; K471-M474 WeakPolarHBondContact O-CB 3.42Å; K471-M474 PolarHBondContact O-N 3.03Å; K471-M474 VanDerWaalsContact O-N 3.08Å; K471-D475 VanDerWaalsContact O-CG 3.23Å; K471-D475 PolarHBondContact O-N 3Å
472	R	64.3	Low	53.6	Low	189 Å²	189	118.8 Å²	118.8	71%	0.713	63%	0.631	S	S	*	*	H	α-helix	trans	-61.5	-30	171.8	-82.9	-179.7	172.3	170.1	-1.6	113.2	S468 K476	S468-R472 WeakPolarHBondContact O-CB 3.45Å; S468-R472 PolarHBondContact O-N 3.05Å; R472-K476 WeakPolarHBondContact O-CB 3.45Å; R472-K476 PolarHBondContact O-N 3.36Å
473	G	53.2	Low	53.2	Low	40 Å²	40	119.7 Å²	119.7	41%	0.412	64%	0.639	S	S	.	*	H	α-helix	trans	-66.3	-43	172.8	0	0	0	0	0	112	K469 A470 K471 K477	K469-G473 PolarHBondContact O-N 3.34Å; A470-G473 PolarHBondContact O-N 3.18Å; K471-G473 PolarHBondContact O-N 3.03Å; G473-K477 WeakPolarHBondContact O-CB 3.19Å; G473-K477 PolarHBondContact O-N 3.01Å
474	M	51.6	Low	53.1	Low	132 Å²	132	117 Å²	117	65%	0.65	64%	0.637	S	S	*	*	H	α-helix	trans	-66	-42.1	171	-90.1	176.3	62.5	0	0	112.1	A470 K471 K476 K477 M478	A470-M474 PolarHBondContact O-N 3.12Å; K471-M474 CarbonylContact O-C 3.58Å; K471-M474 WeakPolarHBondContact O-CB 3.42Å; K471-M474 PolarHBondContact O-N 3.03Å; K471-M474 VanDerWaalsContact O-N 3.08Å; M474-K476 PolarHBondContact O-N 3.45Å; M474-K477 CarbonylContact O-C 3.23Å; M474-K477 PolarHBondContact O-N 3.45Å; M474-K477 VanDerWaalsContact O-N 3.12Å; M474-M478 PolarHBondContact O-N 3.29Å
475	D	50.7	Low	52.8	Low	78 Å²	78	117.1 Å²	117.1	42%	0.417	63%	0.629	S	S	.	*	H	α-helix	trans	-67.5	-37.4	179.5	-62.6	-34.1	0	0	0	111.4	K471 M478 A479	K471-D475 VanDerWaalsContact O-CG 3.23Å; K471-D475 PolarHBondContact O-N 3Å; D475-M478 CarbonylContact O-C 3.58Å; D475-M478 PolarHBondContact O-N 3.39Å; D475-A479 WeakPolarHBondContact O-CB 3.49Å; D475-A479 PolarHBondContact O-N 3.01Å
476	K	52.2	Low	52.5	Low	166 Å²	166	118.4 Å²	118.4	72%	0.722	64%	0.644	S	S	*	*	H	α-helix	trans	-67.2	-33.9	170.5	-84.5	-173.9	173.1	-174.2	0	112.3	R472 M474 M478 A480	R472-K476 WeakPolarHBondContact O-CB 3.45Å; R472-K476 PolarHBondContact O-N 3.36Å; M474-K476 PolarHBondContact O-N 3.45Å; K476-M478 VanDerWaalsContact C-N 3.33Å; K476-A480 WeakPolarHBondContact O-CB 3.5Å; K476-A480 PolarHBondContact O-N 2.9Å
477	K	48.3	Very low	52.6	Low	175 Å²	175	121.3 Å²	121.3	76%	0.761	64%	0.642	S	S	*	*	H	α-helix	trans	-71.8	-28.4	173.1	-123.7	-180	179.5	-178.5	0	112.5	G473 M474	G473-K477 WeakPolarHBondContact O-CB 3.19Å; G473-K477 PolarHBondContact O-N 3.01Å; M474-K477 CarbonylContact O-C 3.23Å; M474-K477 PolarHBondContact O-N 3.45Å; M474-K477 VanDerWaalsContact O-N 3.12Å
478	M	47.2	Very low	53.1	Low	140 Å²	140	121.9 Å²	121.9	69%	0.69	64%	0.639	S	S	*	*	H	α-helix	trans	-78.1	-37.3	171.8	-91.8	178	141.4	0	0	112.2	M474 D475 K476	M474-M478 PolarHBondContact O-N 3.29Å; D475-M478 CarbonylContact O-C 3.58Å; D475-M478 PolarHBondContact O-N 3.39Å; K476-M478 VanDerWaalsContact C-N 3.33Å
479	A	50.9	Low	53.5	Low	85 Å²	85	121.8 Å²	121.8	70%	0.702	63%	0.631	S	S	*	*	H	α-helix	trans	-80.6	-21.8	-179.8	0	0	0	0	0	113.6	D475 R481	D475-A479 WeakPolarHBondContact O-CB 3.49Å; D475-A479 PolarHBondContact O-N 3.01Å; A479-R481 VanDerWaalsContact C-N 3.3Å
480	A	45.8	Very low	53.9	Low	85 Å²	85	113.9 Å²	113.9	70%	0.702	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	2.3	172.8	0	0	0	0	0	113.5	K476 E482	K476-A480 WeakPolarHBondContact O-CB 3.5Å; K476-A480 PolarHBondContact O-N 2.9Å; A480-E482 PolarHBondContact O-N 2.64Å
481	R	37.9	Very low	54.9	Low	184 Å²	184	114.5 Å²	114.5	69%	0.694	59%	0.592	S	S	*	*	S	Bend	trans	-76.1	111.2	159.4	-81.5	-180	157.2	178.6	-5.8	106.2	A479	A479-R481 VanDerWaalsContact C-N 3.3Å
482	E	36.7	Very low	56.1	Low	173 Å²	173	109.5 Å²	109.5	81%	0.808	57%	0.572	S	S	*	*			trans	-41	139.5	160	-80	-165.7	147.8	0	0	108.8	A480 V484	A480-E482 PolarHBondContact O-N 2.64Å; E482-V484 PolarHBondContact O-N 3.42Å
483	P	40.1	Very low	57	Low	128 Å²	128	102.6 Å²	102.6	83%	0.831	55%	0.547	S	S	*	.			trans	-52.7	107.6	-175	21.7	-31.9	0	0	0	108.1	D485	P483-D485 VanDerWaalsContact C-N 3.3Å; P483-D485 PolarHBondContact O-N 2.96Å
484	V	48.2	Very low	58.6	Low	117 Å²	117	101.7 Å²	101.7	71%	0.709	53%	0.532	S	S	*	.			trans	-67.2	102	178.7	-179.7	0	0	0	0	104.4	E482 A486	E482-V484 PolarHBondContact O-N 3.42Å; V484-A486 PolarHBondContact O-N 3.33Å
485	D	49.9	Very low	60.3	Low	65 Å²	65	99.4 Å²	99.4	35%	0.348	52%	0.519	S	S	.	.			trans	-46.8	114.1	175.3	-169.9	-8.2	0	0	0	108.5	P483 R487 I492	P483-D485 VanDerWaalsContact C-N 3.3Å; P483-D485 PolarHBondContact O-N 2.96Å; D485-R487 VanDerWaalsContact CG-NE 3.26Å; D485-R487 PolarHBondContact O-N 2.93Å; D485-R487 VanDerWaalsContact O-N 3.15Å; D485-R487 VanDerWaalsContact OD1-CB 3.26Å; D485-R487 WeakPolarHBondContact OD1-CB 3.45Å; D485-R487 WeakPolarHBondContact OD1-CG 3.4Å; D485-R487 IonicContact OD1-CZ 2.7Å; D485-R487 PolarHBondContact OD1-N 3.48Å; D485-R487 IonicContact OD1-NE 2.66Å; D485-R487 PolarHBondContact OD1-NE 2.83Å; D485-R487 IonicContact OD2-CZ 3.1Å; D485-R487 IonicContact OD2-NE 3.92Å; D485-R487 PolarHBondContact OD2-NE 3.23Å; D485-R487 IonicContact OD2-NH2 2.65Å; D485-R487 PolarHBondContact OD2-NH2 2.89Å; D485-I492 HydrophobicContact CB-CD1 4.13Å
486	A	54	Low	62.1	Low	107 Å²	107	101 Å²	101	88%	0.884	52%	0.522	S	S	*	.			trans	-70.8	-4	-177.5	0	0	0	0	0	112	V484	V484-A486 PolarHBondContact O-N 3.33Å
487	R	61.1	Low	63.6	Low	124 Å²	124	93.1 Å²	93.1	47%	0.468	49%	0.489	S	S	.	.	S	Bend	trans	-62.3	146.4	170.9	-67.3	-175.9	-69.7	165	6.2	110.4	D485 E489 I492 E495	D485-R487 VanDerWaalsContact CG-NE 3.26Å; D485-R487 PolarHBondContact O-N 2.93Å; D485-R487 VanDerWaalsContact O-N 3.15Å; D485-R487 VanDerWaalsContact OD1-CB 3.26Å; D485-R487 WeakPolarHBondContact OD1-CB 3.45Å; D485-R487 WeakPolarHBondContact OD1-CG 3.4Å; D485-R487 IonicContact OD1-CZ 2.7Å; D485-R487 PolarHBondContact OD1-N 3.48Å; D485-R487 IonicContact OD1-NE 2.66Å; D485-R487 PolarHBondContact OD1-NE 2.83Å; D485-R487 IonicContact OD2-CZ 3.1Å; D485-R487 IonicContact OD2-NE 3.92Å; D485-R487 PolarHBondContact OD2-NE 3.23Å; D485-R487 IonicContact OD2-NH2 2.65Å; D485-R487 PolarHBondContact OD2-NH2 2.89Å; R487-E489 PolarHBondContact O-N 2.92Å; R487-I492 HydrophobicContact CB-CG1 4.28Å; R487-E495 IonicContact CZ-OE2 3.44Å; R487-E495 IonicContact NH1-OE1 3.5Å; R487-E495 IonicContact NH1-OE2 2.7Å; R487-E495 PolarHBondContact NH1-OE2 2.84Å; R487-E495 IonicContact NH2-OE2 3.33Å
488	K	70	Confident	65.4	Low	129 Å²	129	88.1 Å²	88.1	56%	0.561	47%	0.472	S	S	*	.			trans	-63.8	140.5	178.7	-60.8	175.5	179	175.9	0	108.1	S490 D491 I492	K488-S490 WeakPolarHBondContact CB-OG 3.42Å; K488-S490 PolarHBondContact O-N 3.38Å; K488-D491 WeakPolarHBondContact CB-OD2 3.49Å; K488-D491 WeakPolarHBondContact O-CA 3.34Å; K488-D491 WeakPolarHBondContact O-CB 3.44Å; K488-D491 PolarHBondContact O-N 2.79Å; K488-I492 PolarHBondContact O-N 3.29Å; K488-I492 VanDerWaalsContact O-N 3.15Å
489	E	71.8	Confident	67.1	Low	67 Å²	67	88.7 Å²	88.7	31%	0.313	47%	0.473	S	S	.	.	H	α-helix	trans	-56.9	-33.4	178.9	-174.5	168.9	-177.9	0	0	111.6	R487 D491 I492 Q493 R891	R487-E489 PolarHBondContact O-N 2.92Å; E489-D491 VanDerWaalsContact C-N 3.34Å; E489-D491 PolarHBondContact O-N 2.78Å; E489-I492 PolarHBondContact O-N 2.79Å; E489-Q493 VanDerWaalsContact O-CG 3.3Å; E489-Q493 WeakPolarHBondContact O-CG 3.45Å; E489-Q493 PolarHBondContact O-N 3.29Å; E489-R891 WeakPolarHBondContact OE2-CD 3.32Å; E489-R891 IonicContact OE2-CZ 3.51Å; E489-R891 IonicContact OE2-NE 3.62Å; E489-R891 PolarHBondContact OE2-NE 3.14Å
490	S	77.3	Confident	68.6	Low	3 Å²	3	87.5 Å²	87.5	2%	0.021	46%	0.46	C	S	.	.	H	α-helix	trans	-57.3	-41.1	169.7	39.3	0	0	0	0	113.2	K488 W494 D888	K488-S490 WeakPolarHBondContact CB-OG 3.42Å; K488-S490 PolarHBondContact O-N 3.38Å; S490-W494 VanDerWaalsContact O-CB 3.27Å; S490-W494 WeakPolarHBondContact O-CB 3.35Å; S490-W494 PolarHBondContact O-N 3.38Å; S490-D888 VanDerWaalsContact CB-OD1 3.31Å; S490-D888 WeakPolarHBondContact CB-OD1 3.46Å; S490-D888 PolarHBondContact OG-OD1 3.13Å
491	D	83.4	Confident	70.4	Confident	73 Å²	73	85.9 Å²	85.9	39%	0.39	44%	0.439	S	S	.	.	H	α-helix	trans	-67.9	-41	176.8	-60.8	-38.6	0	0	0	111.3	K488 E489 W494 E495	K488-D491 WeakPolarHBondContact CB-OD2 3.49Å; K488-D491 WeakPolarHBondContact O-CA 3.34Å; K488-D491 WeakPolarHBondContact O-CB 3.44Å; K488-D491 PolarHBondContact O-N 2.79Å; E489-D491 VanDerWaalsContact C-N 3.34Å; E489-D491 PolarHBondContact O-N 2.78Å; D491-W494 PolarHBondContact O-N 3.08Å; D491-E495 WeakPolarHBondContact O-CB 3.35Å; D491-E495 PolarHBondContact O-N 3.29Å
492	I	84.1	Confident	72.4	Confident	40 Å²	40	84.7 Å²	84.7	21%	0.205	45%	0.446	C	S	.	.	H	α-helix	trans	-63.5	-45.4	177.3	-60.3	171.3	0	0	0	110.7	D485 R487 K488 E489 W494 E495 K496	D485-I492 HydrophobicContact CB-CD1 4.13Å; R487-I492 HydrophobicContact CB-CG1 4.28Å; K488-I492 PolarHBondContact O-N 3.29Å; K488-I492 VanDerWaalsContact O-N 3.15Å; E489-I492 PolarHBondContact O-N 2.79Å; I492-W494 VanDerWaalsContact C-N 3.31Å; I492-E495 PolarHBondContact O-N 3.46Å; I492-K496 WeakPolarHBondContact O-CG 3.32Å; I492-K496 PolarHBondContact O-N 3.18Å
493	Q	83.7	Confident	74.5	Confident	43 Å²	43	79.1 Å²	79.1	20%	0.201	42%	0.418	C	S	.	.	H	α-helix	trans	-66.5	-36.4	177.5	-65.8	-64.8	-8.4	0	0	111.6	E489 K496 A497 W887	E489-Q493 VanDerWaalsContact O-CG 3.3Å; E489-Q493 WeakPolarHBondContact O-CG 3.45Å; E489-Q493 PolarHBondContact O-N 3.29Å; Q493-K496 PolarHBondContact O-N 2.75Å; Q493-A497 WeakPolarHBondContact O-CB 3.43Å; Q493-A497 PolarHBondContact O-N 3.13Å; Q493-W887 HydrophobicContact CB-CD2 4.15Å; Q493-W887 HydrophobicContact CB-CE3 4.46Å; Q493-W887 HydrophobicContact CB-CH2 4.49Å; Q493-W887 HydrophobicContact CB-CZ2 4.2Å; Q493-W887 HydrophobicContact CG-CD2 4.18Å; Q493-W887 HydrophobicContact CG-CE3 3.98Å; Q493-W887 HydrophobicContact CG-CH2 4.2Å; Q493-W887 HydrophobicContact CG-CZ2 4.4Å; Q493-W887 HydrophobicContact CG-CZ3 4Å
494	W	86.4	Confident	76.5	Confident	22 Å²	22	76.6 Å²	76.6	8%	0.083	40%	0.402	C	S	.	.	H	α-helix	trans	-66	-43.2	175.8	-161.2	-94.4	0	0	0	112	S490 D491 I492 A497 V498 E880 C883 K884 A913 I916 L917	S490-W494 VanDerWaalsContact O-CB 3.27Å; S490-W494 WeakPolarHBondContact O-CB 3.35Å; S490-W494 PolarHBondContact O-N 3.38Å; D491-W494 PolarHBondContact O-N 3.08Å; I492-W494 VanDerWaalsContact C-N 3.31Å; W494-A497 WeakPolarHBondContact O-CB 3.43Å; W494-A497 PolarHBondContact O-N 3.29Å; W494-V498 WeakPolarHBondContact O-CG2 3.42Å; W494-V498 PolarHBondContact O-N 3.26Å; W494-E880 HydrophobicContact CH2-CB 4.21Å; W494-E880 HydrophobicContact CH2-CG 3.74Å; W494-E880 HydrophobicContact CZ2-CB 4.33Å; W494-E880 HydrophobicContact CZ2-CG 3.54Å; W494-C883 HydrophobicContact CZ3-CB 4.05Å; W494-K884 HydrophobicContact CD2-CD 4.32Å; W494-K884 HydrophobicContact CD2-CG 4.07Å; W494-K884 HydrophobicContact CE3-CD 4.41Å; W494-K884 HydrophobicContact CE3-CG 3.67Å; W494-K884 HydrophobicContact CZ3-CG 4.05Å; W494-A913 HydrophobicContact CE3-CB 3.97Å; W494-A913 HydrophobicContact CH2-CB 4.38Å; W494-A913 HydrophobicContact CZ3-CB 3.71Å; W494-I916 HydrophobicContact CH2-CB 4.18Å; W494-I916 HydrophobicContact CH2-CD1 4.2Å; W494-I916 HydrophobicContact CH2-CG2 3.91Å; W494-I916 HydrophobicContact CZ2-CG2 4.28Å; W494-L917 HydrophobicContact CZ2-CD2 4.09Å; W494-L917 HydrophobicContact CZ2-CG 4.26Å
495	E	87.4	Confident	78.3	Confident	83 Å²	83	72 Å²	72	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-61.2	-44.5	175.2	-171.8	169.6	-145	0	0	111.3	R487 D491 I492 A497 V498 E499	R487-E495 IonicContact CZ-OE2 3.44Å; R487-E495 IonicContact NH1-OE1 3.5Å; R487-E495 IonicContact NH1-OE2 2.7Å; R487-E495 PolarHBondContact NH1-OE2 2.84Å; R487-E495 IonicContact NH2-OE2 3.33Å; D491-E495 WeakPolarHBondContact O-CB 3.35Å; D491-E495 PolarHBondContact O-N 3.29Å; I492-E495 PolarHBondContact O-N 3.46Å; E495-A497 VanDerWaalsContact C-N 3.31Å; E495-A497 PolarHBondContact O-N 3.46Å; E495-V498 WeakPolarHBondContact O-CB 3.32Å; E495-V498 PolarHBondContact O-N 2.73Å; E495-V498 VanDerWaalsContact O-N 3.09Å; E495-E499 WeakPolarHBondContact O-CG 3.45Å; E495-E499 PolarHBondContact O-N 3.01Å
496	K	87.2	Confident	79.9	Confident	111 Å²	111	69.4 Å²	69.4	48%	0.483	36%	0.359	S	S	.	.	H	α-helix	trans	-59.6	-39.5	172.6	-73.6	176	180	179	0	113	I492 Q493 V498 E499 S500	I492-K496 WeakPolarHBondContact O-CG 3.32Å; I492-K496 PolarHBondContact O-N 3.18Å; Q493-K496 PolarHBondContact O-N 2.75Å; K496-V498 VanDerWaalsContact C-N 3.29Å; K496-V498 PolarHBondContact O-N 3.05Å; K496-E499 PolarHBondContact O-N 3.24Å; K496-S500 VanDerWaalsContact O-CB 3.31Å; K496-S500 WeakPolarHBondContact O-CB 3.4Å; K496-S500 PolarHBondContact O-N 2.92Å; K496-S500 PolarHBondContact O-OG 3.3Å
497	A	84.7	Confident	81.4	Confident	2 Å²	2	64.4 Å²	64.4	2%	0.017	32%	0.318	C	S	.	.	H	α-helix	trans	-65.4	-34.4	176.1	0	0	0	0	0	111.8	Q493 W494 E495 S500 L501 A913 Q914 L917	Q493-A497 WeakPolarHBondContact O-CB 3.43Å; Q493-A497 PolarHBondContact O-N 3.13Å; W494-A497 WeakPolarHBondContact O-CB 3.43Å; W494-A497 PolarHBondContact O-N 3.29Å; E495-A497 VanDerWaalsContact C-N 3.31Å; E495-A497 PolarHBondContact O-N 3.46Å; A497-S500 PolarHBondContact O-OG 3.48Å; A497-L501 PolarHBondContact O-N 2.87Å; A497-A913 HydrophobicContact CB-CB 3.83Å; A497-Q914 HydrophobicContact CB-CG 4.36Å; A497-L917 HydrophobicContact CB-CD1 4.02Å
498	V	85.2	Confident	82.5	Confident	69 Å²	69	58.6 Å²	58.6	42%	0.418	30%	0.296	S	S	.	.	H	α-helix	trans	-68.4	-46.5	173.1	174.5	0	0	0	0	111.3	W494 E495 K496 S500 L501 L917	W494-V498 WeakPolarHBondContact O-CG2 3.42Å; W494-V498 PolarHBondContact O-N 3.26Å; E495-V498 WeakPolarHBondContact O-CB 3.32Å; E495-V498 PolarHBondContact O-N 2.73Å; E495-V498 VanDerWaalsContact O-N 3.09Å; K496-V498 VanDerWaalsContact C-N 3.29Å; K496-V498 PolarHBondContact O-N 3.05Å; V498-S500 VanDerWaalsContact C-N 3.32Å; V498-S500 PolarHBondContact O-N 3.42Å; V498-L501 VanDerWaalsContact O-CB 3.27Å; V498-L501 WeakPolarHBondContact O-CB 3.45Å; V498-L501 PolarHBondContact O-N 3.45Å; V498-L917 HydrophobicContact CB-CD1 4.35Å; V498-L917 HydrophobicContact CG2-CD1 3.63Å; V498-L917 HydrophobicContact CG2-CD2 3.8Å; V498-L917 HydrophobicContact CG2-CG 4.38Å
499	E	83.6	Confident	83.2	Confident	152 Å²	152	57 Å²	57	71%	0.71	29%	0.294	S	S	*	.	H	α-helix	trans	-65.5	-34.1	179.7	-70.8	179.2	166.1	0	0	113	E495 K496 L501	E495-E499 WeakPolarHBondContact O-CG 3.45Å; E495-E499 PolarHBondContact O-N 3.01Å; K496-E499 PolarHBondContact O-N 3.24Å; E499-L501 VanDerWaalsContact C-N 3.32Å
500	S	82.9	Confident	84	Confident	60 Å²	60	55 Å²	55	42%	0.42	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6.9	178.6	61.3	0	0	0	0	114	K496 A497 V498 N502 Q914	K496-S500 VanDerWaalsContact O-CB 3.31Å; K496-S500 WeakPolarHBondContact O-CB 3.4Å; K496-S500 PolarHBondContact O-N 2.92Å; K496-S500 PolarHBondContact O-OG 3.3Å; A497-S500 PolarHBondContact O-OG 3.48Å; V498-S500 VanDerWaalsContact C-N 3.32Å; V498-S500 PolarHBondContact O-N 3.42Å; S500-N502 PolarHBondContact O-N 3.36Å; S500-Q914 PolarHBondContact O-NE2 3.26Å; S500-Q914 PolarHBondContact OG-NE2 3.28Å; S500-Q914 VanDerWaalsContact OG-NE2 3.09Å
501	L	83.8	Confident	84.5	Confident	52 Å²	52	58.7 Å²	58.7	27%	0.272	30%	0.304	S	S	.	.			trans	-71.2	94.8	-177.1	-169.6	68.6	0	0	0	111	A497 V498 E499 Q914 L917 I921	A497-L501 PolarHBondContact O-N 2.87Å; V498-L501 VanDerWaalsContact O-CB 3.27Å; V498-L501 WeakPolarHBondContact O-CB 3.45Å; V498-L501 PolarHBondContact O-N 3.45Å; E499-L501 VanDerWaalsContact C-N 3.32Å; L501-Q914 HydrophobicContact CD1-CB 4.34Å; L501-Q914 WeakPolarHBondContact CD1-O 3.33Å; L501-L917 HydrophobicContact CD1-CB 3.97Å; L501-L917 HydrophobicContact CD2-CB 3.96Å; L501-I921 HydrophobicContact CD2-CD1 3.57Å
502	N	79.8	Confident	84.9	Confident	158 Å²	158	55.2 Å²	55.2	85%	0.845	29%	0.286	S	S	*	.			trans	-136.2	51.2	173.5	-168.4	13.3	0	0	0	110.6	S500	S500-N502 PolarHBondContact O-N 3.36Å
503	R	80	Confident	85.1	Confident	56 Å²	56	57 Å²	57	21%	0.211	30%	0.299	C	S	.	.			trans	-102	138.2	-176.8	-156.9	174.4	-159.3	-110.3	11.9	109.8	I506 D911 R915	R503-I506 PolarHBondContact NH1-O 3.45Å; R503-D911 IonicContact NH2-OD1 3.51Å; R503-D911 PolarHBondContact NH2-OD1 2.74Å; R503-R915 VanDerWaalsContact CZ-CG 3.49Å
504	P	81.6	Confident	85.1	Confident	76 Å²	76	58.8 Å²	58.8	49%	0.494	31%	0.307	S	S	.	.			trans	-60.3	150.2	168.8	27.5	-34.7	0	0	0	109.8	I506	P504-I506 HydrophobicContact CB-CD1 4.24Å; P504-I506 HydrophobicContact CB-CG1 4.28Å; P504-I506 PolarHBondContact O-N 3.41Å
505	L	86	Confident	85.1	Confident	20 Å²	20	58 Å²	58	11%	0.105	30%	0.304	C	S	.	.	S	Bend	trans	-76.9	56	179.6	-57.4	-178.3	0	0	0	111.1	F512 T513 L515 T918 I921 I922	L505-F512 HydrophobicContact CB-CB 4Å; L505-F512 CarbonylContact O-C 3.4Å; L505-F512 VanDerWaalsContact O-CA 3.26Å; L505-F512 WeakPolarHBondContact O-CA 3.48Å; L505-F512 VanDerWaalsContact O-CB 3.23Å; L505-F512 WeakPolarHBondContact O-CB 3.31Å; L505-F512 PolarHBondContact O-N 3.39Å; L505-T513 PolarHBondContact O-N 3.19Å; L505-L515 HydrophobicContact CD1-CB 3.88Å; L505-L515 WeakPolarHBondContact CD1-O 3.26Å; L505-T918 HydrophobicContact CD2-CG2 3.82Å; L505-I921 HydrophobicContact CD2-CG2 4.23Å; L505-I922 HydrophobicContact CB-CD1 4.4Å; L505-I922 HydrophobicContact CB-CG1 4.31Å; L505-I922 HydrophobicContact CD2-CG1 4.2Å
506	I	84.5	Confident	85	Confident	11 Å²	11	57.9 Å²	57.9	6%	0.056	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.4	178.4	-56.5	173.5	0	0	0	106.9	I399 A401 R503 P504 L510 T513	I399-I506 HydrophobicContact CB-CD1 4.46Å; I399-I506 HydrophobicContact CG2-CD1 4.39Å; I399-I506 WeakPolarHBondContact O-CD1 3.28Å; A401-I506 HydrophobicContact CB-CB 4.16Å; A401-I506 HydrophobicContact CB-CG2 3.8Å; R503-I506 PolarHBondContact NH1-O 3.45Å; P504-I506 HydrophobicContact CB-CD1 4.24Å; P504-I506 HydrophobicContact CB-CG1 4.28Å; P504-I506 PolarHBondContact O-N 3.41Å; I506-L510 WeakPolarHBondContact CA-O 3.47Å; I506-T513 WeakPolarHBondContact CG1-OG1 3.41Å
507	V	84.4	Confident	84.7	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	104.6	179.6	-176.8	0	0	0	0	107.3	D509 L510 F512 E771 A775 L919 I922	V507-D509 PolarHBondContact O-N 3.29Å; V507-L510 PolarHBondContact N-O 3.1Å; V507-L510 WeakPolarHBondContact O-CB 3.3Å; V507-L510 PolarHBondContact O-N 3.06Å; V507-F512 HydrophobicContact CB-CE2 4.49Å; V507-F512 HydrophobicContact CG2-CE2 4.46Å; V507-E771 HydrophobicContact CG1-CG 3.73Å; V507-A775 HydrophobicContact CB-CB 4.39Å; V507-A775 HydrophobicContact CG1-CB 3.87Å; V507-L919 HydrophobicContact CG1-CD2 4.3Å; V507-L919 HydrophobicContact CG2-CD2 3.91Å; V507-L919 HydrophobicContact CG2-CG 4.31Å; V507-I922 HydrophobicContact CG2-CD1 3.57Å
508	N	84.6	Confident	84.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.011	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-116.4	-174	-56.2	-34.8	0	0	0	111.3	A401 P403 E771 Y772 R915	A401-N508 PolarHBondContact N-O 2.93Å; A401-N508 CarbonylContact O-C 3.51Å; A401-N508 WeakPolarHBondContact O-CA 3.37Å; A401-N508 VanDerWaalsContact O-O 3.05Å; P403-N508 VanDerWaalsContact CA-OD1 3.29Å; P403-N508 WeakPolarHBondContact CA-OD1 3.06Å; N508-E771 PolarHBondContact ND2-OE2 2.95Å; N508-E771 PolarHBondContact OD1-OE2 3.36Å; N508-Y772 HydrophobicContact CB-CE1 4.16Å; N508-Y772 HydrophobicContact CB-CE2 4.48Å; N508-Y772 VanDerWaalsContact CB-OH 3.28Å; N508-Y772 WeakPolarHBondContact CB-OH 3.47Å; N508-Y772 WeakPolarHBondContact ND2-CE2 3.49Å; N508-R915 PolarHBondContact OD1-NH2 3.43Å
509	D	85.1	Confident	84.5	Confident	96 Å²	96	58.3 Å²	58.3	51%	0.513	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-2	176.4	56.1	-53.6	0	0	0	113.9	V507 Y772	V507-D509 PolarHBondContact O-N 3.29Å; D509-Y772 WeakPolarHBondContact OD1-CE1 3.2Å; D509-Y772 PolarHBondContact OD1-OH 2.98Å
510	L	87.7	Confident	84.5	Confident	25 Å²	25	52.6 Å²	52.6	13%	0.131	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124	-177.2	-53	175.1	0	0	0	111.5	I506 V507 F512 A775 M779	I506-L510 WeakPolarHBondContact CA-O 3.47Å; V507-L510 PolarHBondContact N-O 3.1Å; V507-L510 WeakPolarHBondContact O-CB 3.3Å; V507-L510 PolarHBondContact O-N 3.06Å; L510-F512 HydrophobicContact CB-CE2 3.79Å; L510-F512 HydrophobicContact CB-CZ 4.38Å; L510-A775 HydrophobicContact CD1-CB 3.71Å; L510-M779 HydrophobicContact CD1-CB 4.17Å; L510-M779 HydrophobicContact CD2-CB 4.24Å; L510-M779 HydrophobicContact CD2-CG 3.9Å
511	D	88.6	Confident	84.4	Confident	80 Å²	80	56 Å²	56	43%	0.428	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.7	-175.4	-173.3	6.4	0	0	0	113	T513 K782	D511-T513 WeakPolarHBondContact OD1-CB 3.39Å; D511-T513 PolarHBondContact OD1-N 2.89Å; D511-T513 PolarHBondContact OD1-OG1 3.26Å; D511-K782 PolarHBondContact O-NZ 3.19Å
512	F	91.9	Very high	84.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.299	C	S	.	.			trans	-114.5	16.1	175.7	-55.3	-90.4	0	0	0	112.8	L505 V507 L510 E514 L515 L778 M779 I922 I926	L505-F512 HydrophobicContact CB-CB 4Å; L505-F512 CarbonylContact O-C 3.4Å; L505-F512 VanDerWaalsContact O-CA 3.26Å; L505-F512 WeakPolarHBondContact O-CA 3.48Å; L505-F512 VanDerWaalsContact O-CB 3.23Å; L505-F512 WeakPolarHBondContact O-CB 3.31Å; L505-F512 PolarHBondContact O-N 3.39Å; V507-F512 HydrophobicContact CB-CE2 4.49Å; V507-F512 HydrophobicContact CG2-CE2 4.46Å; L510-F512 HydrophobicContact CB-CE2 3.79Å; L510-F512 HydrophobicContact CB-CZ 4.38Å; F512-E514 PolarHBondContact O-N 3.38Å; F512-L515 HydrophobicContact CB-CD1 3.88Å; F512-L515 HydrophobicContact CB-CG 4.35Å; F512-L515 HydrophobicContact CD1-CD1 4.14Å; F512-L515 HydrophobicContact CG-CD1 4.45Å; F512-L515 WeakPolarHBondContact O-CB 3.1Å; F512-L515 WeakPolarHBondContact O-CG 3.47Å; F512-L515 PolarHBondContact O-N 2.87Å; F512-L778 HydrophobicContact CE1-CB 4.2Å; F512-L778 HydrophobicContact CZ-CB 4.24Å; F512-M779 HydrophobicContact CE1-CB 4.16Å; F512-M779 HydrophobicContact CE1-SD 4.11Å; F512-M779 HydrophobicContact CZ-CB 3.82Å; F512-M779 HydrophobicContact CZ-SD 4.23Å; F512-I922 HydrophobicContact CB-CD1 4.14Å; F512-I922 HydrophobicContact CB-CG1 4.04Å; F512-I922 HydrophobicContact CB-CG2 4.29Å; F512-I922 HydrophobicContact CD1-CG2 3.48Å; F512-I922 VanDerWaalsContact CD1-CG2 3.48Å; F512-I922 HydrophobicContact CD2-CD1 3.63Å; F512-I922 HydrophobicContact CD2-CG1 4.28Å; F512-I922 HydrophobicContact CD2-CG2 4.04Å; F512-I922 HydrophobicContact CE1-CG2 3.62Å; F512-I922 HydrophobicContact CE2-CD1 4.2Å; F512-I922 HydrophobicContact CE2-CG2 4.16Å; F512-I922 HydrophobicContact CG-CD1 3.99Å; F512-I922 HydrophobicContact CG-CG1 4.13Å; F512-I922 HydrophobicContact CG-CG2 3.68Å; F512-I922 HydrophobicContact CZ-CG2 3.95Å; F512-I926 HydrophobicContact CD1-CD1 4.33Å; F512-I926 HydrophobicContact CD1-CG1 4.41Å; F512-I926 HydrophobicContact CE1-CG1 4.46Å
513	T	87.2	Confident	84.3	Confident	78 Å²	78	48.7 Å²	48.7	48%	0.479	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-21	-174.5	-54	0	0	0	0	113.6	L505 I506 D511 L515	L505-T513 PolarHBondContact O-N 3.19Å; I506-T513 WeakPolarHBondContact CG1-OG1 3.41Å; D511-T513 WeakPolarHBondContact OD1-CB 3.39Å; D511-T513 PolarHBondContact OD1-N 2.89Å; D511-T513 PolarHBondContact OD1-OG1 3.26Å; T513-L515 VanDerWaalsContact C-N 3.25Å; T513-L515 PolarHBondContact O-N 3.24Å
514	E	85.6	Confident	84.2	Confident	79 Å²	79	46.3 Å²	46.3	37%	0.369	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-19.1	174.3	63.2	178	-119.4	0	0	114.4	F512 K782 R929	F512-E514 PolarHBondContact O-N 3.38Å; E514-K782 VanDerWaalsContact CD-NZ 3.34Å; E514-K782 WeakPolarHBondContact OE1-CE 3.48Å; E514-K782 IonicContact OE1-NZ 2.74Å; E514-K782 WeakPolarHBondContact OE2-CE 3.36Å; E514-K782 IonicContact OE2-NZ 3.21Å; E514-K782 PolarHBondContact OE2-NZ 3.45Å; E514-R929 IonicContact OE1-CZ 2.78Å; E514-R929 VanDerWaalsContact OE1-CZ 3.23Å; E514-R929 IonicContact OE1-NH1 3.12Å; E514-R929 PolarHBondContact OE1-NH1 3.46Å; E514-R929 IonicContact OE1-NH2 3.34Å; E514-R929 PolarHBondContact OE1-NH2 3.36Å
515	L	85.5	Confident	84	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.026	25%	0.253	C	S	.	.			trans	-74.6	129.7	177.8	-59.2	177.7	0	0	0	110.2	L505 F512 T513 I922 R925 I926	L505-L515 HydrophobicContact CD1-CB 3.88Å; L505-L515 WeakPolarHBondContact CD1-O 3.26Å; F512-L515 HydrophobicContact CB-CD1 3.88Å; F512-L515 HydrophobicContact CB-CG 4.35Å; F512-L515 HydrophobicContact CD1-CD1 4.14Å; F512-L515 HydrophobicContact CG-CD1 4.45Å; F512-L515 WeakPolarHBondContact O-CB 3.1Å; F512-L515 WeakPolarHBondContact O-CG 3.47Å; F512-L515 PolarHBondContact O-N 2.87Å; T513-L515 VanDerWaalsContact C-N 3.25Å; T513-L515 PolarHBondContact O-N 3.24Å; L515-I922 HydrophobicContact CD1-CG2 4.2Å; L515-R925 HydrophobicContact CB-CB 4.26Å; L515-R925 HydrophobicContact CD1-CB 3.96Å; L515-R925 HydrophobicContact CD2-CB 4.41Å; L515-R925 HydrophobicContact CG-CB 4.45Å; L515-R925 PolarHBondContact O-NH1 3.04Å; L515-I926 HydrophobicContact CD1-CD1 3.76Å; L515-I926 HydrophobicContact CD1-CG1 3.79Å; L515-I926 HydrophobicContact CD2-CD1 3.92Å; L515-I926 HydrophobicContact CG-CD1 4.38Å
516	N	85.5	Confident	83.6	Confident	81 Å²	81	49 Å²	49	43%	0.433	27%	0.27	S	S	.	.			trans	-130.2	176.8	-174.4	62.2	68.3	0	0	0	112.3	A518 D519 R925	N516-A518 PolarHBondContact O-N 3.21Å; N516-A518 VanDerWaalsContact O-N 3.1Å; N516-A518 WeakPolarHBondContact OD1-CA 3.32Å; N516-A518 WeakPolarHBondContact OD1-CB 3.38Å; N516-A518 PolarHBondContact OD1-N 3.31Å; N516-D519 PolarHBondContact N-OD2 2.86Å; N516-D519 WeakPolarHBondContact O-CB 3.35Å; N516-D519 PolarHBondContact O-N 3.39Å; N516-R925 VanDerWaalsContact C-CZ 3.46Å; N516-R925 PolarHBondContact O-NE 2.87Å
517	D	81.6	Confident	83.2	Confident	112 Å²	112	49.5 Å²	49.5	60%	0.599	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-63.1	-17.8	-176.1	-58.7	-13.3	0	0	0	113.3	D519 D520 R925	D517-D519 PolarHBondContact O-N 3.21Å; D517-D520 WeakPolarHBondContact O-CB 3.48Å; D517-D520 PolarHBondContact O-N 3.49Å; D517-R925 IonicContact OD1-CZ 3.57Å; D517-R925 IonicContact OD1-NH1 3.93Å; D517-R925 IonicContact OD1-NH2 2.78Å; D517-R925 PolarHBondContact OD1-NH2 3.01Å
518	A	80	Confident	82.8	Confident	62 Å²	62	56.4 Å²	56.4	51%	0.512	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-67.5	-29.4	172.6	0	0	0	0	0	111.7	N516 D520 K521	N516-A518 PolarHBondContact O-N 3.21Å; N516-A518 VanDerWaalsContact O-N 3.1Å; N516-A518 WeakPolarHBondContact OD1-CA 3.32Å; N516-A518 WeakPolarHBondContact OD1-CB 3.38Å; N516-A518 PolarHBondContact OD1-N 3.31Å; A518-D520 PolarHBondContact O-N 2.84Å; A518-K521 PolarHBondContact O-N 3.38Å
519	D	84.7	Confident	82.4	Confident	18 Å²	18	60.9 Å²	60.9	10%	0.096	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-75.3	-11.6	177.3	-57.3	-57.4	0	0	0	112.4	N516 D517 K521 R925 N928	N516-D519 PolarHBondContact N-OD2 2.86Å; N516-D519 WeakPolarHBondContact O-CB 3.35Å; N516-D519 PolarHBondContact O-N 3.39Å; D517-D519 PolarHBondContact O-N 3.21Å; D519-K521 VanDerWaalsContact C-N 3.27Å; D519-K521 PolarHBondContact O-N 3.32Å; D519-R925 HydrophobicContact CB-CB 3.84Å; D519-R925 HydrophobicContact CB-CG 3.84Å; D519-N928 WeakPolarHBondContact O-CB 3.22Å; D519-N928 PolarHBondContact O-ND2 3.49Å
520	D	83.4	Confident	81.9	Confident	31 Å²	31	61.7 Å²	61.7	17%	0.166	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-73.9	-20.8	175.5	-72.4	-38.7	0	0	0	113.1	D517 A518 K924 R925 N928	D517-D520 WeakPolarHBondContact O-CB 3.48Å; D517-D520 PolarHBondContact O-N 3.49Å; A518-D520 PolarHBondContact O-N 2.84Å; D520-K924 WeakPolarHBondContact O-CE 3.41Å; D520-K924 PolarHBondContact O-NZ 2.73Å; D520-R925 WeakPolarHBondContact OD1-CG 3.41Å; D520-R925 IonicContact OD1-CZ 3.01Å; D520-R925 IonicContact OD1-NE 3.65Å; D520-R925 PolarHBondContact OD1-NE 2.89Å; D520-R925 IonicContact OD1-NH2 2.6Å; D520-R925 IonicContact OD2-CZ 3.61Å; D520-R925 IonicContact OD2-NE 3.6Å; D520-R925 PolarHBondContact OD2-NE 2.89Å; D520-R925 IonicContact OD2-NH2 3.34Å; D520-R925 PolarHBondContact OD2-NH2 3.25Å; D520-N928 PolarHBondContact O-ND2 2.99Å
521	K	81.3	Confident	81.3	Confident	131 Å²	131	65.1 Å²	65.1	57%	0.57	34%	0.34	S	S	*	.	S	Bend	trans	-79.3	119.3	179.1	-62.1	179.8	-177	176.5	0	109.3	A518 D519 P523 L526	A518-K521 PolarHBondContact O-N 3.38Å; D519-K521 VanDerWaalsContact C-N 3.27Å; D519-K521 PolarHBondContact O-N 3.32Å; K521-P523 VanDerWaalsContact O-CD 3.31Å; K521-P523 WeakPolarHBondContact O-CD 3.32Å; K521-P523 VanDerWaalsContact O-N 3.12Å; K521-L526 HydrophobicContact CB-CD1 3.92Å; K521-L526 HydrophobicContact CB-CG 4.34Å; K521-L526 HydrophobicContact CD-CD1 4.42Å; K521-L526 HydrophobicContact CD-CD2 4.43Å
522	D	82.5	Confident	80.4	Confident	42 Å²	42	66.1 Å²	66.1	23%	0.225	34%	0.343	C	S	.	.			trans	-60.8	115.9	175.3	-175.2	-9.7	0	0	0	109.4	L524 C525 L526 R931	D522-L524 PolarHBondContact O-N 3.21Å; D522-L524 VanDerWaalsContact O-N 3.14Å; D522-L524 WeakPolarHBondContact OD1-CB 3.33Å; D522-L524 PolarHBondContact OD1-N 3.21Å; D522-C525 HydrophobicContact CB-CB 4.16Å; D522-C525 WeakPolarHBondContact O-CB 3.36Å; D522-C525 PolarHBondContact O-N 3.24Å; D522-L526 PolarHBondContact O-N 3.45Å; D522-L526 VanDerWaalsContact O-N 3.15Å; D522-R931 IonicContact OD1-NH1 3.18Å; D522-R931 IonicContact OD2-NH1 3.78Å; D522-R931 PolarHBondContact OD2-NH1 3.44Å
523	P	78.9	Confident	79.4	Confident	15 Å²	15	70.9 Å²	70.9	10%	0.097	37%	0.369	C	S	.	.	H	α-helix	trans	-60.7	-26	-177.4	25.7	-36.4	0	0	0	112.3	K521 L526 A527 N928 R931 K932 L935	K521-P523 VanDerWaalsContact O-CD 3.31Å; K521-P523 WeakPolarHBondContact O-CD 3.32Å; K521-P523 VanDerWaalsContact O-N 3.12Å; P523-L526 PolarHBondContact O-N 3.04Å; P523-A527 WeakPolarHBondContact O-CB 3.31Å; P523-A527 PolarHBondContact O-N 3.35Å; P523-N928 WeakPolarHBondContact CG-O 3.15Å; P523-R931 HydrophobicContact CG-CB 3.65Å; P523-K932 HydrophobicContact CB-CB 4.11Å; P523-K932 HydrophobicContact CG-CB 4.15Å; P523-L935 HydrophobicContact CB-CD1 4.09Å
524	L	77.4	Confident	78.3	Confident	6 Å²	6	72.9 Å²	72.9	3%	0.031	37%	0.373	C	S	.	.	H	α-helix	trans	-73.8	-31.8	177.9	-59.2	173.6	0	0	0	112.1	D522 R528 L935 Q941 V944 K945	D522-L524 PolarHBondContact O-N 3.21Å; D522-L524 VanDerWaalsContact O-N 3.14Å; D522-L524 WeakPolarHBondContact OD1-CB 3.33Å; D522-L524 PolarHBondContact OD1-N 3.21Å; L524-R528 WeakPolarHBondContact O-CB 3.42Å; L524-R528 PolarHBondContact O-N 3.33Å; L524-R528 VanDerWaalsContact O-N 3.13Å; L524-L935 HydrophobicContact CD2-CD1 4.19Å; L524-L935 HydrophobicContact CD2-CD2 4.3Å; L524-Q941 HydrophobicContact CD2-CB 4.34Å; L524-V944 HydrophobicContact CD1-CG1 4.17Å; L524-V944 HydrophobicContact CD2-CB 4.03Å; L524-V944 HydrophobicContact CD2-CG1 3.92Å; L524-V944 HydrophobicContact CG-CG1 4.45Å; L524-K945 HydrophobicContact CD1-CD 4.17Å; L524-K945 HydrophobicContact CD1-CG 3.4Å
525	C	78	Confident	76.9	Confident	67 Å²	67	73.5 Å²	73.5	45%	0.453	39%	0.386	S	S	.	.	H	α-helix	trans	-69.4	-41.4	171	-72.8	0	0	0	0	110.9	D522 R528 L529	D522-C525 HydrophobicContact CB-CB 4.16Å; D522-C525 WeakPolarHBondContact O-CB 3.36Å; D522-C525 PolarHBondContact O-N 3.24Å; C525-R528 PolarHBondContact O-N 2.7Å; C525-L529 WeakPolarHBondContact O-CG 3.27Å; C525-L529 PolarHBondContact O-N 2.8Å
526	L	77.8	Confident	75.4	Confident	87 Å²	87	80.5 Å²	80.5	46%	0.455	42%	0.418	S	S	.	.	H	α-helix	trans	-62.8	-42.9	175.7	-66.9	177.9	0	0	0	112	K521 D522 P523 L529 H530	K521-L526 HydrophobicContact CB-CD1 3.92Å; K521-L526 HydrophobicContact CB-CG 4.34Å; K521-L526 HydrophobicContact CD-CD1 4.42Å; K521-L526 HydrophobicContact CD-CD2 4.43Å; D522-L526 PolarHBondContact O-N 3.45Å; D522-L526 VanDerWaalsContact O-N 3.15Å; P523-L526 PolarHBondContact O-N 3.04Å; L526-L529 PolarHBondContact O-N 2.87Å; L526-H530 PolarHBondContact O-N 3.02Å
527	A	75.2	Confident	73.4	Confident	20 Å²	20	84.9 Å²	84.9	17%	0.165	44%	0.436	C	S	.	.	H	α-helix	trans	-63.9	-43.3	179	0	0	0	0	0	111.9	P523 L529 H530 E531 Q941	P523-A527 WeakPolarHBondContact O-CB 3.31Å; P523-A527 PolarHBondContact O-N 3.35Å; A527-L529 PolarHBondContact O-N 2.81Å; A527-H530 WeakPolarHBondContact O-CB 3.29Å; A527-H530 PolarHBondContact O-N 2.66Å; A527-E531 PolarHBondContact O-N 2.65Å; A527-E531 VanDerWaalsContact O-N 3.13Å; A527-Q941 VanDerWaalsContact CB-CD 3.42Å; A527-Q941 HydrophobicContact CB-CG 4.1Å
528	R	76.8	Confident	71.6	Confident	147 Å²	147	85.5 Å²	85.5	56%	0.555	44%	0.444	S	S	*	.	H	α-helix	trans	-62.8	-40.8	174.2	-177.1	179.1	-85.5	170.2	-12.4	112.9	L524 C525 H530 E531 M532	L524-R528 WeakPolarHBondContact O-CB 3.42Å; L524-R528 PolarHBondContact O-N 3.33Å; L524-R528 VanDerWaalsContact O-N 3.13Å; C525-R528 PolarHBondContact O-N 2.7Å; R528-H530 VanDerWaalsContact C-N 3.28Å; R528-H530 PolarHBondContact O-N 3.5Å; R528-E531 PolarHBondContact O-N 2.58Å; R528-M532 HydrophobicContact CG-SD 4.47Å; R528-M532 WeakPolarHBondContact O-CG 3.34Å; R528-M532 PolarHBondContact O-N 3.06Å; R528-M532 VanDerWaalsContact O-N 3.11Å
529	L	76.3	Confident	69.4	Low	96 Å²	96	91.7 Å²	91.7	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-63.8	-35.7	175.8	-74.2	171.3	0	0	0	111.9	C525 L526 A527 M532 N533	C525-L529 WeakPolarHBondContact O-CG 3.27Å; C525-L529 PolarHBondContact O-N 2.8Å; L526-L529 PolarHBondContact O-N 2.87Å; A527-L529 PolarHBondContact O-N 2.81Å; L529-M532 PolarHBondContact O-N 2.89Å; L529-N533 PolarHBondContact O-N 3.45Å
530	H	74.7	Confident	67.3	Low	113 Å²	113	96.4 Å²	96.4	52%	0.523	49%	0.491	S	S	.	.	H	α-helix	trans	-65.5	-43.8	176.6	-169.4	67.5	0	0	0	112	L526 A527 R528 M532 N533 Q534	L526-H530 PolarHBondContact O-N 3.02Å; A527-H530 WeakPolarHBondContact O-CB 3.29Å; A527-H530 PolarHBondContact O-N 2.66Å; R528-H530 VanDerWaalsContact C-N 3.28Å; R528-H530 PolarHBondContact O-N 3.5Å; H530-M532 VanDerWaalsContact C-N 3.35Å; H530-M532 PolarHBondContact O-N 2.86Å; H530-N533 PolarHBondContact O-N 2.78Å; H530-Q534 PolarHBondContact CD2-NE2 3.44Å; H530-Q534 PolarHBondContact NE2-NE2 2.99Å; H530-Q534 WeakPolarHBondContact O-CG 3.44Å; H530-Q534 PolarHBondContact O-N 2.83Å
531	E	73.7	Confident	65.2	Low	98 Å²	98	101.2 Å²	101.2	46%	0.458	52%	0.521	S	S	.	.	H	α-helix	trans	-60.8	-41.8	174.8	-71.3	175.4	-179.5	0	0	112.2	A527 R528 N533 Q534 S535 Q941	A527-E531 PolarHBondContact O-N 2.65Å; A527-E531 VanDerWaalsContact O-N 3.13Å; R528-E531 PolarHBondContact O-N 2.58Å; E531-N533 PolarHBondContact O-N 2.66Å; E531-Q534 PolarHBondContact O-N 3.43Å; E531-S535 PolarHBondContact O-N 3.37Å; E531-S535 VanDerWaalsContact O-N 3.08Å; E531-S535 PolarHBondContact O-OG 3.28Å; E531-Q941 PolarHBondContact OE1-NE2 2.84Å
532	M	71.1	Confident	63.1	Low	100 Å²	100	101.8 Å²	101.8	49%	0.493	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-40.5	176.2	-70	175.7	66.8	0	0	112.2	R528 L529 H530 S535 Q536	R528-M532 HydrophobicContact CG-SD 4.47Å; R528-M532 WeakPolarHBondContact O-CG 3.34Å; R528-M532 PolarHBondContact O-N 3.06Å; R528-M532 VanDerWaalsContact O-N 3.11Å; L529-M532 PolarHBondContact O-N 2.89Å; H530-M532 VanDerWaalsContact C-N 3.35Å; H530-M532 PolarHBondContact O-N 2.86Å; M532-S535 WeakPolarHBondContact O-CB 3.06Å; M532-S535 PolarHBondContact O-N 3.37Å; M532-Q536 PolarHBondContact O-N 3.23Å
533	N	69.6	Low	60.9	Low	100 Å²	100	105.4 Å²	105.4	54%	0.535	56%	0.564	S	S	.	*	H	α-helix	trans	-68.9	-36.8	178.1	-76.5	-12.1	0	0	0	112.6	L529 H530 E531 S535 Q536	L529-N533 PolarHBondContact O-N 3.45Å; H530-N533 PolarHBondContact O-N 2.78Å; E531-N533 PolarHBondContact O-N 2.66Å; N533-S535 VanDerWaalsContact C-N 3.31Å; N533-Q536 PolarHBondContact O-N 3.42Å
534	Q	63.9	Low	58.7	Low	121 Å²	121	108.8 Å²	108.8	57%	0.565	60%	0.602	S	S	*	*	H	α-helix	trans	-64.1	-38.8	173.6	-72.2	-174.3	16.5	0	0	111.5	H530 E531 Q536 Q537	H530-Q534 PolarHBondContact CD2-NE2 3.44Å; H530-Q534 PolarHBondContact NE2-NE2 2.99Å; H530-Q534 WeakPolarHBondContact O-CG 3.44Å; H530-Q534 PolarHBondContact O-N 2.83Å; E531-Q534 PolarHBondContact O-N 3.43Å; Q534-Q536 PolarHBondContact O-N 2.84Å; Q534-Q537 PolarHBondContact O-N 2.98Å
535	S	57.4	Low	56.6	Low	91 Å²	91	112.1 Å²	112.1	64%	0.636	64%	0.637	S	S	*	*	H	α-helix	trans	-65.2	-25.3	179.1	-51.8	0	0	0	0	113.2	E531 M532 N533	E531-S535 PolarHBondContact O-N 3.37Å; E531-S535 VanDerWaalsContact O-N 3.08Å; E531-S535 PolarHBondContact O-OG 3.28Å; M532-S535 WeakPolarHBondContact O-CB 3.06Å; M532-S535 PolarHBondContact O-N 3.37Å; N533-S535 VanDerWaalsContact C-N 3.31Å
536	Q	53.1	Low	54.3	Low	152 Å²	152	118 Å²	118	71%	0.71	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-7.1	-178.1	-73.7	-176.4	5.5	0	0	114.7	M532 N533 Q534 V538	M532-Q536 PolarHBondContact O-N 3.23Å; N533-Q536 PolarHBondContact O-N 3.42Å; Q534-Q536 PolarHBondContact O-N 2.84Å; Q536-V538 PolarHBondContact O-N 3.43Å
537	Q	45.1	Very low	52.5	Low	173 Å²	173	119.3 Å²	119.3	81%	0.808	67%	0.674	S	S	*	*			trans	-91.2	17.2	-179.1	-75.9	-163.7	-1.7	0	0	115.4	Q534 K539	Q534-Q537 PolarHBondContact O-N 2.98Å; Q537-K539 PolarHBondContact O-N 3.28Å
538	V	43.1	Very low	50.7	Low	126 Å²	126	124 Å²	124	76%	0.764	70%	0.703	S	S	*	*			trans	-87.5	96.8	173.5	-156.1	0	0	0	0	109.7	Q536	Q536-V538 PolarHBondContact O-N 3.43Å
539	K	34.1	Very low	49.1	Very low	192 Å²	192	122.9 Å²	122.9	84%	0.835	72%	0.715	S	S	*	*			trans	-65.8	154.1	171.6	-85.3	179.3	175.4	177.3	0	111.7	Q537	Q537-K539 PolarHBondContact O-N 3.28Å
540	P	40.8	Very low	47.4	Very low	117 Å²	117	124 Å²	124	76%	0.76	73%	0.728	S	S	*	*			trans	-91.3	134.6	-160.2	17.9	-3.2	0	0	0	115.4
541	V	38.2	Very low	45.7	Very low	131 Å²	131	124.5 Å²	124.5	79%	0.794	74%	0.741	S	S	*	*			trans	46.8	100.2	138.8	-155.7	0	0	0	0	118.6
542	T	37.9	Very low	44.3	Very low	144 Å²	144	126.1 Å²	126.1	88%	0.883	76%	0.76	S	S	*	*			trans	-114	111.6	147.5	50.8	0	0	0	0	109.3
543	S	35	Very low	42.5	Very low	118 Å²	118	125.5 Å²	125.5	83%	0.825	78%	0.779	S	S	*	*			trans	-65.8	139.7	173.1	51	0	0	0	0	112.8
544	G	32.7	Very low	40.8	Very low	86 Å²	86	124.4 Å²	124.4	89%	0.887	79%	0.791	S	S	*	*			trans	136.4	114	151.5	0	0	0	0	0	115.4
545	G	33.2	Very low	39.5	Very low	75 Å²	75	125.5 Å²	125.5	77%	0.773	81%	0.806	S	S	*	*			trans	126.7	77.6	156.1	0	0	0	0	0	115.5	P547	G545-P547 WeakPolarHBondContact O-CD 3.23Å
546	M	31.6	Very low	38.6	Very low	190 Å²	190	127 Å²	127	94%	0.936	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.5	125.9	159.9	-76.5	168.8	60.4	0	0	109.6
547	P	39.2	Very low	37.8	Very low	115 Å²	115	122.6 Å²	122.6	75%	0.747	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-89.4	155.6	167.9	31.4	-24.2	0	0	0	111.8	G545	G545-P547 WeakPolarHBondContact O-CD 3.23Å
548	P	38	Very low	37.4	Very low	120 Å²	120	120.5 Å²	120.5	78%	0.779	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-85.2	162	-161.9	34.4	-35.4	0	0	0	114.6
549	P	42.4	Very low	37	Very low	123 Å²	123	119.9 Å²	119.9	80%	0.799	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-81.6	143.1	-168.1	32	-34.7	0	0	0	114.1
550	P	41.5	Very low	36.9	Very low	120 Å²	120	115.7 Å²	115.7	78%	0.779	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82.7	158.9	-180	32.3	-33.4	0	0	0	113.9
551	P	39	Very low	36.8	Very low	123 Å²	123	116.8 Å²	116.8	80%	0.799	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-84.9	157.8	-163.6	15	-0.8	0	0	0	114.9
552	P	43.4	Very low	36.4	Very low	132 Å²	132	117.2 Å²	117.2	86%	0.857	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-91.7	142.7	-174.5	35.3	-31.4	0	0	0	113
553	G	33.3	Very low	35.9	Very low	86 Å²	86	116.7 Å²	116.7	89%	0.887	80%	0.797	S	S	*	*			trans	122.2	100.2	156.8	0	0	0	0	0	115.1
554	G	34.2	Very low	35.7	Very low	77 Å²	77	115.7 Å²	115.7	79%	0.794	80%	0.796	S	S	*	*			trans	-178.8	92.2	169.7	0	0	0	0	0	109.7
555	V	36.2	Very low	35.5	Very low	144 Å²	144	115.2 Å²	115.2	87%	0.873	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-53	144.6	-177.4	-110.6	0	0	0	0	112.8
556	P	38.9	Very low	36.1	Very low	122 Å²	122	118.1 Å²	118.1	79%	0.792	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-86.8	123.5	-164	33.9	-30.9	0	0	0	112
557	G	35.7	Very low	36.2	Very low	60 Å²	60	114.7 Å²	114.7	62%	0.619	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77	141.2	161.1	0	0	0	0	0	110.1	P559	G557-P559 VanDerWaalsContact O-CD 3.32Å; G557-P559 WeakPolarHBondContact O-CD 3.5Å
558	P	37.1	Very low	36.4	Very low	129 Å²	129	115 Å²	115	84%	0.838	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-77.7	119.9	-172.1	31	-31.2	0	0	0	110.2
559	P	35.2	Very low	37.4	Very low	113 Å²	113	114.4 Å²	114.4	73%	0.734	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-82.6	143	168.1	25.8	-15.9	0	0	0	110.1	G557	G557-P559 VanDerWaalsContact O-CD 3.32Å; G557-P559 WeakPolarHBondContact O-CD 3.5Å
560	P	32	Very low	37.8	Very low	104 Å²	104	112.7 Å²	112.7	68%	0.675	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-70	156.4	-179	30.6	-34.3	0	0	0	111.4	L562	P560-L562 PolarHBondContact O-N 3.47Å
561	P	38.7	Very low	37.7	Very low	140 Å²	140	112.4 Å²	112.4	91%	0.909	77%	0.77	S	S	*	*			trans	-70.3	96.4	-171.3	29.5	-33.4	0	0	0	110.1
562	L	29.9	Very low	37.4	Very low	140 Å²	140	111.5 Å²	111.5	73%	0.733	77%	0.765	S	S	*	*			trans	-105.6	130.3	166.2	-91.8	-177.3	0	0	0	108.7	P560	P560-L562 PolarHBondContact O-N 3.47Å
563	L	27.2	Very low	36.9	Very low	134 Å²	134	110.8 Å²	110.8	70%	0.702	76%	0.763	S	S	*	*			trans	90	116.1	143.9	-60.3	161.8	0	0	0	117.8
564	A	30.1	Very low	36.6	Very low	97 Å²	97	111.9 Å²	111.9	80%	0.802	76%	0.757	S	S	*	*				50.8	113.8	117.3	0	0	0	0	0	116.8
565	G	28.2	Very low	36.3	Very low	75 Å²	75	115 Å²	115	77%	0.773	76%	0.76	S	S	*	*			trans	-170	77.6	164.6	0	0	0	0	0	111.5
566	T	46.8	Very low	35.8	Very low	136 Å²	136	111.3 Å²	111.3	83%	0.834	75%	0.751	S	S	*	*			trans	-98.2	137.7	135.1	61.7	0	0	0	0	105.3
567	P	33.8	Very low	35.2	Very low	119 Å²	119	111.1 Å²	111.1	77%	0.773	75%	0.753	S	S	*	*				-145.6	174.6	93.3	31.7	-10.6	0	0	0	114.1
568	P	42	Very low	34.6	Very low	120 Å²	120	112.3 Å²	112.3	78%	0.779	76%	0.757	S	S	*	*			trans	-110.2	-158.3	-156.4	49.8	-38.7	0	0	0	111.5
569	P	59.2	Low	34.1	Very low	108 Å²	108	111.9 Å²	111.9	70%	0.701	76%	0.757	S	S	*	*			trans	-87.8	178.5	-148.5	16.9	11	0	0	0	111.6
570	P	50.9	Low	33.7	Very low	87 Å²	87	109.7 Å²	109.7	57%	0.565	76%	0.755	S	S	*	*				-156.7	-148.3	54.5	41.7	-15.9	0	0	0	111.7
571	P	40.5	Very low	33.5	Very low	114 Å²	114	116.1 Å²	116.1	74%	0.74	77%	0.765	S	S	*	*			cis	-133.7	-141.5	-17.1	35.8	-11.3	0	0	0	109.7
572	P	32.1	Very low	32.9	Very low	105 Å²	105	116.3 Å²	116.3	68%	0.682	76%	0.759	S	S	*	*			cis	-126.9	159.6	-45.3	25	-4	0	0	0	114.5
573	S	32.2	Very low	32.7	Very low	116 Å²	116	116 Å²	116	81%	0.811	76%	0.757	S	S	*	*			trans	19.8	134.7	130.6	-16.9	0	0	0	0	121.3
574	S	27.3	Very low	32.7	Very low	109 Å²	109	116.5 Å²	116.5	76%	0.762	76%	0.76	S	S	*	*				170.4	108.5	125.8	-162.2	0	0	0	0	108.7
575	V	28.3	Very low	32.3	Very low	143 Å²	143	116.2 Å²	116.2	87%	0.867	76%	0.758	S	S	*	*				63.9	127.4	87.6	-176.6	0	0	0	0	114.1
576	G	26.3	Very low	32.1	Very low	66 Å²	66	117.4 Å²	117.4	68%	0.68	76%	0.76	S	S	*	*			trans	142	76.4	168.3	0	0	0	0	0	110.2
577	S	25.8	Very low	31	Very low	119 Å²	119	115.4 Å²	115.4	83%	0.832	76%	0.757	S	S	*	*				49.3	110.7	78.1	-158.9	0	0	0	0	112.5
578	A	24	Very low	30.6	Very low	84 Å²	84	114.9 Å²	114.9	69%	0.694	76%	0.763	S	S	*	*				150.1	145	114.2	0	0	0	0	0	112.4
579	S	26.1	Very low	29.9	Very low	121 Å²	121	112.1 Å²	112.1	85%	0.846	76%	0.757	S	S	*	*			trans	64.7	104	154.7	-70.8	0	0	0	0	115.7
580	G	25.5	Very low	28.4	Very low	67 Å²	67	113.8 Å²	113.8	69%	0.691	77%	0.765	S	S	*	*				84.8	116.3	50.8	0	0	0	0	0	108.9
581	R	28.8	Very low	27.8	Very low	238 Å²	238	115.2 Å²	115.2	90%	0.898	78%	0.777	S	S	*	*			trans	173.8	119.6	134.2	-94.7	163.3	77	166.2	4.4	109.8
582	N	25.3	Very low	27.4	Very low	144 Å²	144	116 Å²	116	77%	0.77	78%	0.782	S	S	*	*			trans	-22.9	149.8	148.1	-61.5	-24.7	0	0	0	113.7
583	L	27.2	Very low	27.2	Very low	134 Å²	134	114.9 Å²	114.9	70%	0.702	79%	0.789	S	S	*	*				172.5	133.7	107	-87	169.7	0	0	0	111.3
584	L	26.4	Very low	27	Very low	145 Å²	145	121 Å²	121	76%	0.759	79%	0.794	S	S	*	*			trans	68	107	138.8	-57.4	165.7	0	0	0	117.3
585	A	22.5	Very low	27	Very low	91 Å²	91	120.8 Å²	120.8	75%	0.752	79%	0.793	S	S	*	*				82.7	127	70.5	0	0	0	0	0	114.2
586	A	22.9	Very low	27.2	Very low	99 Å²	99	120 Å²	120	82%	0.818	79%	0.791	S	S	*	*			trans	99.2	135.4	138.9	0	0	0	0	0	120.2
587	A	24.9	Very low	27.4	Very low	94 Å²	94	121.6 Å²	121.6	78%	0.777	79%	0.792	S	S	*	*			trans	78.4	104.6	147.2	0	0	0	0	0	116.6
588	A	24.4	Very low	27.9	Very low	108 Å²	108	121.8 Å²	121.8	89%	0.893	79%	0.79	S	S	*	*				81.5	125	74.1	0	0	0	0	0	112.7
589	G	27.6	Very low	28.4	Very low	63 Å²	63	125 Å²	125	65%	0.649	80%	0.795	S	S	*	*			trans	151.9	78	174.9	0	0	0	0	0	111.9
590	T	28.2	Very low	28.7	Very low	143 Å²	143	124.2 Å²	124.2	88%	0.877	79%	0.788	S	S	*	*				80.8	110.9	100.7	54.6	0	0	0	0	115.3
591	S	37	Very low	29.4	Very low	117 Å²	117	126.9 Å²	126.9	82%	0.818	79%	0.793	S	S	*	*			trans	-58.9	157.6	169.3	-41.2	0	0	0	0	113.8
592	P	33.3	Very low	29.9	Very low	131 Å²	131	123.1 Å²	123.1	85%	0.851	79%	0.789	S	S	*	*				-146.9	134.1	106.6	33.4	-15.8	0	0	0	112.1
593	G	27	Very low	30.5	Very low	80 Å²	80	123.1 Å²	123.1	83%	0.825	79%	0.789	S	S	*	*				109	92.5	73.3	0	0	0	0	0	109.8
594	R	27.9	Very low	31.4	Very low	244 Å²	244	126 Å²	126	92%	0.921	80%	0.796	S	S	*	*			trans	-131.1	122.2	165.4	-168.7	168.8	-177.2	-96.7	1.6	109.4
595	S	27.4	Very low	32.3	Very low	105 Å²	105	126.8 Å²	126.8	73%	0.734	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-61.6	140.7	-173.2	38.7	0	0	0	0	113.4
596	P	33.7	Very low	33.5	Very low	127 Å²	127	125.9 Å²	125.9	83%	0.825	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-87.6	122.7	179	32.4	-29.2	0	0	0	111
597	S	29.8	Very low	35.1	Very low	99 Å²	99	129 Å²	129	69%	0.692	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-78.2	144	166.4	55.5	0	0	0	0	110.4	N599	S597-N599 PolarHBondContact O-N 3.5Å
598	P	37.1	Very low	37.3	Very low	124 Å²	124	127.8 Å²	127.8	81%	0.805	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-82	119.4	-164.8	31.8	-32	0	0	0	111.7
599	N	33.2	Very low	39.6	Very low	150 Å²	150	126.9 Å²	126.9	80%	0.802	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-83.3	131.3	168.9	-72.6	-20.5	0	0	0	109.6	S597	S597-N599 PolarHBondContact O-N 3.5Å
600	P	33.6	Very low	41.9	Very low	105 Å²	105	133.2 Å²	133.2	68%	0.682	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-69.2	156	-179.6	28	-32.1	0	0	0	111.8	I602	P600-I602 PolarHBondContact O-N 3.03Å; P600-I602 VanDerWaalsContact O-N 3.13Å
601	P	39.6	Very low	44.1	Very low	124 Å²	124	131.8 Å²	131.8	81%	0.805	74%	0.741	S	S	*	*			trans	-71.9	109.6	-165	28.2	-32.9	0	0	0	111.6	N603	P601-N603 PolarHBondContact O-N 3.4Å
602	I	38.6	Very low	45.7	Very low	158 Å²	158	135.8 Å²	135.8	81%	0.81	74%	0.744	S	S	*	*			trans	-74.1	117.6	171.8	-73.2	169.6	0	0	0	109	P600	P600-I602 PolarHBondContact O-N 3.03Å; P600-I602 VanDerWaalsContact O-N 3.13Å
603	N	37.8	Very low	47.9	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	74%	0.741	S	S	*	*			trans	-54.7	130.8	176.1	-70.1	-45.9	0	0	0	111.6	P601 D605	P601-N603 PolarHBondContact O-N 3.4Å; N603-D605 VanDerWaalsContact C-N 3.33Å; N603-D605 PolarHBondContact O-N 3.27Å
604	K	46.6	Very low	49.9	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	6.6	-165.4	-78.9	-179.6	175.1	175.8	0	116.6
605	D	46.1	Very low	52.5	Low	163 Å²	163	142.4 Å²	142.4	87%	0.872	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	14.8	-169.3	-64.7	-36.5	0	0	0	116.2	N603	N603-D605 VanDerWaalsContact C-N 3.33Å; N603-D605 PolarHBondContact O-N 3.27Å
606	S	45.9	Very low	54.7	Low	72 Å²	72	139.9 Å²	139.9	50%	0.503	73%	0.726	S	S	.	*			trans	-122.9	123.2	169.4	83.6	0	0	0	0	111.5
607	K	57.6	Low	56.3	Low	163 Å²	163	142.9 Å²	142.9	71%	0.709	73%	0.729	S	S	*	*			trans	-107.7	106.1	173.5	-70.7	-179.8	-176.3	173	0	108.7	T651	K607-T651 PolarHBondContact O-N 3.01Å
608	T	69.9	Low	57.7	Low	69 Å²	69	140.6 Å²	140.6	42%	0.423	71%	0.713	S	S	.	*	B	Isolated β-bridge	trans	-73.5	151.2	166.8	24.5	0	0	0	0	110.9	R610 F649 V650	T608-R610 PolarHBondContact O-N 2.86Å; T608-F649 WeakPolarHBondContact CA-O 3.44Å; T608-F649 HydrophobicContact CG2-CB 4.13Å; T608-V650 HydrophobicContact CG2-CG2 3.92Å
609	V	73.1	Confident	58.9	Low	89 Å²	89	143 Å²	143	54%	0.539	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-53.2	124.9	174.1	177	0	0	0	0	109.9	F649	V609-F649 HydrophobicContact CG2-CD1 4.49Å; V609-F649 PolarHBondContact N-O 2.57Å
610	R	77.2	Confident	60.1	Low	196 Å²	196	138.6 Å²	138.6	74%	0.74	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-89.3	135.7	179.5	-66.9	-173.9	-175	-175.9	0.2	110.8	T608	T608-R610 PolarHBondContact O-N 2.86Å
611	L	74.2	Confident	61.4	Low	113 Å²	113	138.6 Å²	138.6	59%	0.592	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-91.7	129.5	173.5	-60.3	175.3	0	0	0	109.8	W613	L611-W613 VanDerWaalsContact C-N 3.34Å; L611-W613 HydrophobicContact CB-CD2 4.1Å; L611-W613 HydrophobicContact CB-CE3 4.11Å; L611-W613 HydrophobicContact CB-CZ3 4.34Å; L611-W613 HydrophobicContact CD1-CE3 4.02Å; L611-W613 HydrophobicContact CD1-CH2 3.83Å; L611-W613 HydrophobicContact CD1-CZ3 3.53Å; L611-W613 PolarHBondContact O-N 3.45Å
612	F	70.1	Confident	61.9	Low	202 Å²	202	138 Å²	138	89%	0.886	68%	0.681	S	S	*	*			trans	-95.7	53.9	179.7	-64.5	-85	0	0	0	111.4
613	W	80.4	Confident	62.9	Low	205 Å²	205	133.8 Å²	133.8	78%	0.777	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-73.9	149.4	172.2	42.5	39.9	0	0	0	111.1	L611	L611-W613 VanDerWaalsContact C-N 3.34Å; L611-W613 HydrophobicContact CB-CD2 4.1Å; L611-W613 HydrophobicContact CB-CE3 4.11Å; L611-W613 HydrophobicContact CB-CZ3 4.34Å; L611-W613 HydrophobicContact CD1-CE3 4.02Å; L611-W613 HydrophobicContact CD1-CH2 3.83Å; L611-W613 HydrophobicContact CD1-CZ3 3.53Å; L611-W613 PolarHBondContact O-N 3.45Å
614	K	69.2	Low	63.7	Low	204 Å²	204	132.6 Å²	132.6	89%	0.887	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-85.1	131.5	168.2	-70	-178	179	178.1	0	108.5	A616	K614-A616 PolarHBondContact O-N 3.42Å
615	E	81.7	Confident	63.9	Low	185 Å²	185	126.3 Å²	126.3	86%	0.864	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-64.7	128.9	-179.8	-173.1	171.4	-170.6	0	0	110.7
616	A	73.2	Confident	64.6	Low	51 Å²	51	123.5 Å²	123.5	42%	0.421	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-75.9	125.5	176.5	0	0	0	0	0	109.8	K614 C618	K614-A616 PolarHBondContact O-N 3.42Å; A616-C618 PolarHBondContact O-N 3.43Å; A616-C618 PolarHBondContact O-SG 2.84Å
617	Q	67.3	Low	65.2	Low	191 Å²	191	124.5 Å²	124.5	89%	0.893	64%	0.637	S	S	*	*			trans	-71.6	96.4	177.2	-69.8	174.3	-17	0	0	110.1	Q619	Q617-Q619 VanDerWaalsContact C-N 3.34Å; Q617-Q619 PolarHBondContact O-N 3.17Å
618	C	58.7	Low	65.2	Low	51 Å²	51	120.2 Å²	120.2	35%	0.345	62%	0.618	S	S	.	*			trans	-95.8	26.6	-175.3	-69	0	0	0	0	113.3	A616 V620 V630	A616-C618 PolarHBondContact O-N 3.43Å; A616-C618 PolarHBondContact O-SG 2.84Å; C618-V620 PolarHBondContact O-N 3Å; C618-V630 HydrophobicContact CB-CG2 4.01Å
619	Q	63.2	Low	65	Low	175 Å²	175	117.8 Å²	117.8	82%	0.818	61%	0.607	S	S	*	*			trans	-72	125	178.1	-74.4	-179.4	2.7	0	0	110	Q617 I621	Q617-Q619 VanDerWaalsContact C-N 3.34Å; Q617-Q619 PolarHBondContact O-N 3.17Å; Q619-I621 PolarHBondContact O-N 3.21Å
620	V	59.2	Low	65.1	Low	56 Å²	56	114.6 Å²	114.6	34%	0.339	59%	0.587	S	S	.	*			trans	-73.2	114.3	178.6	-175.9	0	0	0	0	107.7	C618 P622 L625	C618-V620 PolarHBondContact O-N 3Å; V620-P622 VanDerWaalsContact O-CD 3.24Å; V620-P622 WeakPolarHBondContact O-CD 3.33Å; V620-L625 HydrophobicContact CG1-CB 3.93Å
621	I	59.5	Low	65.2	Low	105 Å²	105	111.5 Å²	111.5	54%	0.538	58%	0.58	S	S	.	*			trans	-71	114.6	174.7	-60.3	172	0	0	0	107.7	Q619 G623 L624 L625	Q619-I621 PolarHBondContact O-N 3.21Å; I621-G623 PolarHBondContact O-N 2.77Å; I621-L624 PolarHBondContact O-N 3.27Å; I621-L625 PolarHBondContact O-N 3.12Å
622	P	50.6	Low	65.5	Low	111 Å²	111	113.4 Å²	113.4	72%	0.721	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	131.7	-178.5	-22.2	33.9	0	0	0	110.9	V620	V620-P622 VanDerWaalsContact O-CD 3.24Å; V620-P622 WeakPolarHBondContact O-CD 3.33Å
623	G	58.5	Low	65.8	Low	71 Å²	71	110 Å²	110	73%	0.732	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	94	-25.2	179.9	0	0	0	0	0	116.2	I621 D626	I621-G623 PolarHBondContact O-N 2.77Å; G623-D626 PolarHBondContact N-OD2 2.96Å
624	L	55	Low	65.6	Low	119 Å²	119	106.3 Å²	106.3	62%	0.623	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-30.6	179.6	-166.2	65.1	0	0	0	113.2	I621	I621-L624 PolarHBondContact O-N 3.27Å
625	L	52.5	Low	65.7	Low	61 Å²	61	100.9 Å²	100.9	32%	0.319	54%	0.536	S	S	.	.	S	Bend	trans	-125.6	4	-171.2	-72.9	163	0	0	0	114.9	V620 I621 S627 K628 G629	V620-L625 HydrophobicContact CG1-CB 3.93Å; I621-L625 PolarHBondContact O-N 3.12Å; L625-S627 PolarHBondContact O-N 2.92Å; L625-S627 VanDerWaalsContact O-N 3.12Å; L625-K628 PolarHBondContact O-N 3.18Å; L625-G629 PolarHBondContact O-N 2.81Å; L625-G629 VanDerWaalsContact O-N 3.14Å
626	D	60	Low	65.4	Low	104 Å²	104	102.9 Å²	102.9	56%	0.556	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.1	-174.5	-63.9	-22.6	0	0	0	114	G623	G623-D626 PolarHBondContact N-OD2 2.96Å
627	S	59.3	Low	65.4	Low	94 Å²	94	106.9 Å²	106.9	66%	0.657	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-18.5	-173.9	-56.9	0	0	0	0	114.5	L625	L625-S627 PolarHBondContact O-N 2.92Å; L625-S627 VanDerWaalsContact O-N 3.12Å
628	K	57.1	Low	65.9	Low	73 Å²	73	103.4 Å²	103.4	32%	0.317	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-12.9	-172.6	-76.9	-163.1	167.1	-166	0	114.4	D53 P55 L625 K634	D53-K628 WeakPolarHBondContact O-CE 3.39Å; D53-K628 PolarHBondContact O-NZ 3.42Å; P55-K628 VanDerWaalsContact CD-CE 3.46Å; P55-K628 HydrophobicContact CG-CD 4.3Å; P55-K628 HydrophobicContact CG-CG 4.15Å; L625-K628 PolarHBondContact O-N 3.18Å; K628-K634 WeakPolarHBondContact O-CE 3.09Å
629	G	65.8	Low	66.5	Low	17 Å²	17	106.7 Å²	106.7	18%	0.175	57%	0.572	C	S	.	*			trans	61.5	174.2	-171.2	0	0	0	0	0	111.8	L625	L625-G629 PolarHBondContact O-N 2.81Å; L625-G629 VanDerWaalsContact O-N 3.14Å
630	V	74.3	Confident	67.1	Low	22 Å²	22	103.6 Å²	103.6	13%	0.133	56%	0.56	C	S	.	*			trans	-80.4	149.5	173.8	-75.1	0	0	0	0	110.5	C618 W632 Q633	C618-V630 HydrophobicContact CB-CG2 4.01Å; V630-W632 PolarHBondContact O-N 2.98Å; V630-Q633 HydrophobicContact CG2-CG 3.96Å; V630-Q633 PolarHBondContact O-N 3.25Å
631	F	79.5	Confident	68.1	Low	132 Å²	132	105.5 Å²	105.5	58%	0.579	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-42.2	-45	-179.9	171	-98	0	0	0	113.5	Q633 K634 L635	F631-Q633 VanDerWaalsContact C-N 3.26Å; F631-Q633 PolarHBondContact O-N 3.43Å; F631-K634 WeakPolarHBondContact O-CB 3.19Å; F631-K634 PolarHBondContact O-N 3.46Å; F631-L635 HydrophobicContact CE1-CD1 4.16Å; F631-L635 HydrophobicContact CE1-CD2 4.2Å; F631-L635 HydrophobicContact CE1-CG 4.42Å; F631-L635 HydrophobicContact CZ-CD2 4Å
632	W	80.2	Confident	69.3	Low	152 Å²	152	105.9 Å²	105.9	58%	0.576	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-61.9	-25.6	-176.8	-56.2	107	0	0	0	114.7	V630 K634 L635	V630-W632 PolarHBondContact O-N 2.98Å; W632-K634 VanDerWaalsContact C-N 3.31Å; W632-L635 HydrophobicContact CE3-CD1 3.63Å; W632-L635 HydrophobicContact CZ3-CD1 4.05Å
633	Q	77.4	Confident	70.8	Confident	131 Å²	131	108.4 Å²	108.4	61%	0.612	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-76.5	-18.3	176.7	-71.4	174.5	-2.6	0	0	113.1	V630 F631	V630-Q633 HydrophobicContact CG2-CG 3.96Å; V630-Q633 PolarHBondContact O-N 3.25Å; F631-Q633 VanDerWaalsContact C-N 3.26Å; F631-Q633 PolarHBondContact O-N 3.43Å
634	K	75.7	Confident	71.6	Confident	127 Å²	127	111.5 Å²	111.5	55%	0.552	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-86.1	-12.7	-179.2	-60.5	-176.8	-177.4	178.6	0	113.2	K628 F631 W632 R636	K628-K634 WeakPolarHBondContact O-CE 3.09Å; F631-K634 WeakPolarHBondContact O-CB 3.19Å; F631-K634 PolarHBondContact O-N 3.46Å; W632-K634 VanDerWaalsContact C-N 3.31Å; K634-R636 PolarHBondContact O-N 2.88Å
635	L	70.6	Confident	72.6	Confident	91 Å²	91	109.6 Å²	109.6	48%	0.476	56%	0.561	S	S	.	*	S	Bend	trans	-70.6	122.9	180	-62	178	0	0	0	109.5	F631 W632	F631-L635 HydrophobicContact CE1-CD1 4.16Å; F631-L635 HydrophobicContact CE1-CD2 4.2Å; F631-L635 HydrophobicContact CE1-CG 4.42Å; F631-L635 HydrophobicContact CZ-CD2 4Å; W632-L635 HydrophobicContact CE3-CD1 3.63Å; W632-L635 HydrophobicContact CZ3-CD1 4.05Å
636	R	76.4	Confident	73.8	Confident	227 Å²	227	107.7 Å²	107.7	86%	0.857	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-69.7	134.8	174.7	-66.9	-172.9	-157.4	177.4	7.4	109.3	K634 V638	K634-R636 PolarHBondContact O-N 2.88Å; R636-V638 PolarHBondContact O-N 3.35Å
637	P	73.2	Confident	74.5	Confident	134 Å²	134	106.7 Å²	106.7	87%	0.87	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-58	128.2	172.8	-23.2	33.3	0	0	0	110.8
638	V	76.4	Confident	75.2	Confident	118 Å²	118	108 Å²	108	72%	0.715	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-99.3	126.8	174.7	-179.9	0	0	0	0	108	R636 I640	R636-V638 PolarHBondContact O-N 3.35Å; V638-I640 PolarHBondContact O-N 3.28Å
639	S	72.3	Confident	76	Confident	121 Å²	121	109.5 Å²	109.5	85%	0.846	56%	0.563	S	S	*	*			trans	-70.1	113.1	173	55.2	0	0	0	0	109.5
640	I	76.1	Confident	76.5	Confident	109 Å²	109	110.8 Å²	110.8	56%	0.559	57%	0.567	S	S	*	*			trans	-105	134.4	176.1	-60.5	170.5	0	0	0	107.5	V638 T642 L645	V638-I640 PolarHBondContact O-N 3.28Å; I640-T642 VanDerWaalsContact C-N 3.28Å; I640-T642 PolarHBondContact O-N 3.27Å; I640-L645 HydrophobicContact CG2-CD2 4.05Å
641	D	80.8	Confident	75.6	Confident	97 Å²	97	114.2 Å²	114.2	52%	0.519	59%	0.588	S	S	.	*			trans	-67.7	88.4	171.2	-177.1	-10.8	0	0	0	109.5	E643 K644 L645	D641-E643 PolarHBondContact O-N 3Å; D641-E643 PolarHBondContact OD1-N 2.95Å; D641-K644 HydrophobicContact CB-CB 4.18Å; D641-K644 VanDerWaalsContact CG-CB 3.47Å; D641-K644 PolarHBondContact O-N 2.9Å; D641-K644 PolarHBondContact OD1-N 3.37Å; D641-K644 WeakPolarHBondContact OD2-CB 3.16Å; D641-L645 WeakPolarHBondContact O-CB 3.48Å; D641-L645 PolarHBondContact O-N 3.13Å
642	T	84.8	Confident	74.4	Confident	112 Å²	112	116.6 Å²	116.6	69%	0.687	60%	0.599	S	S	*	*	H	α-helix	trans	-64.8	-24.2	-178.1	36.6	0	0	0	0	112.9	I640 G646	I640-T642 VanDerWaalsContact C-N 3.28Å; I640-T642 PolarHBondContact O-N 3.27Å; T642-G646 WeakPolarHBondContact O-CA 3.31Å; T642-G646 PolarHBondContact O-N 2.94Å
643	E	80.9	Confident	72.8	Confident	164 Å²	164	115.7 Å²	115.7	77%	0.766	61%	0.61	S	S	*	*	H	α-helix	trans	-74	-49.2	177	-69	-166.1	167	0	0	110.7	D641 L645 G646 S647	D641-E643 PolarHBondContact O-N 3Å; D641-E643 PolarHBondContact OD1-N 2.95Å; E643-L645 PolarHBondContact O-N 3.09Å; E643-G646 PolarHBondContact O-N 3Å; E643-S647 WeakPolarHBondContact O-CB 3.34Å; E643-S647 PolarHBondContact O-N 3.41Å
644	K	75.9	Confident	71.2	Confident	136 Å²	136	118.1 Å²	118.1	59%	0.591	62%	0.618	S	S	*	*	H	α-helix	trans	-60.8	-47.5	175.5	-174.6	176.7	-178	-179.7	0	110.8	D641 S647 L648	D641-K644 HydrophobicContact CB-CB 4.18Å; D641-K644 VanDerWaalsContact CG-CB 3.47Å; D641-K644 PolarHBondContact O-N 2.9Å; D641-K644 PolarHBondContact OD1-N 3.37Å; D641-K644 WeakPolarHBondContact OD2-CB 3.16Å; K644-S647 PolarHBondContact O-N 2.91Å; K644-S647 PolarHBondContact O-OG 2.97Å; K644-L648 HydrophobicContact CG-CD1 4.35Å; K644-L648 WeakPolarHBondContact O-CG 3.4Å; K644-L648 PolarHBondContact O-N 3.42Å
645	L	75.9	Confident	69.3	Low	80 Å²	80	121.1 Å²	121.1	42%	0.419	63%	0.634	S	S	.	*	H	α-helix	trans	-63.6	-45.3	179	-163.8	73.9	0	0	0	111.4	I640 D641 E643 S647 L648 F649	I640-L645 HydrophobicContact CG2-CD2 4.05Å; D641-L645 WeakPolarHBondContact O-CB 3.48Å; D641-L645 PolarHBondContact O-N 3.13Å; E643-L645 PolarHBondContact O-N 3.09Å; L645-S647 VanDerWaalsContact C-N 3.33Å; L645-S647 PolarHBondContact O-N 2.98Å; L645-L648 PolarHBondContact O-N 2.77Å; L645-F649 HydrophobicContact CD1-CD2 3.83Å; L645-F649 HydrophobicContact CD1-CE2 3.51Å; L645-F649 HydrophobicContact CG-CD2 3.93Å; L645-F649 HydrophobicContact CG-CE2 4.13Å; L645-F649 VanDerWaalsContact O-CD2 3.29Å; L645-F649 WeakPolarHBondContact O-CD2 3.26Å; L645-F649 PolarHBondContact O-N 3.46Å; L645-F649 VanDerWaalsContact O-N 3.14Å
646	G	76.6	Confident	67.7	Low	21 Å²	21	125.3 Å²	125.3	22%	0.216	65%	0.654	C	S	.	*	H	α-helix	trans	-54.6	-49.2	174.6	0	0	0	0	0	111.4	T642 E643 L648 F649 V650	T642-G646 WeakPolarHBondContact O-CA 3.31Å; T642-G646 PolarHBondContact O-N 2.94Å; E643-G646 PolarHBondContact O-N 3Å; G646-L648 PolarHBondContact O-N 3.12Å; G646-F649 PolarHBondContact O-N 2.86Å; G646-F649 VanDerWaalsContact O-N 3.15Å; G646-V650 WeakPolarHBondContact O-CB 3.33Å; G646-V650 WeakPolarHBondContact O-CG2 3.27Å; G646-V650 PolarHBondContact O-N 3.39Å
647	S	75.5	Confident	65.7	Low	82 Å²	82	118.2 Å²	118.2	57%	0.573	64%	0.644	S	S	*	*	H	α-helix	trans	-59.8	-31.7	-179.1	77.8	0	0	0	0	114.1	E643 K644 L645	E643-S647 WeakPolarHBondContact O-CB 3.34Å; E643-S647 PolarHBondContact O-N 3.41Å; K644-S647 PolarHBondContact O-N 2.91Å; K644-S647 PolarHBondContact O-OG 2.97Å; L645-S647 VanDerWaalsContact C-N 3.33Å; L645-S647 PolarHBondContact O-N 2.98Å
648	L	72.9	Confident	64.3	Low	121 Å²	121	118 Å²	118	63%	0.634	64%	0.642	S	S	*	*	H	α-helix	trans	-79	-30.8	179.6	-68	169.2	0	0	0	112.7	K644 L645 G646	K644-L648 HydrophobicContact CG-CD1 4.35Å; K644-L648 WeakPolarHBondContact O-CG 3.4Å; K644-L648 PolarHBondContact O-N 3.42Å; L645-L648 PolarHBondContact O-N 2.77Å; G646-L648 PolarHBondContact O-N 3.12Å
649	F	74	Confident	62.1	Low	105 Å²	105	122.3 Å²	122.3	46%	0.461	65%	0.651	S	S	.	*	H	α-helix	trans	-110.7	0.6	-174.8	-67.7	-77.6	0	0	0	114.4	T608 V609 L645 G646 T651	T608-F649 WeakPolarHBondContact CA-O 3.44Å; T608-F649 HydrophobicContact CG2-CB 4.13Å; V609-F649 HydrophobicContact CG2-CD1 4.49Å; V609-F649 PolarHBondContact N-O 2.57Å; L645-F649 HydrophobicContact CD1-CD2 3.83Å; L645-F649 HydrophobicContact CD1-CE2 3.51Å; L645-F649 HydrophobicContact CG-CD2 3.93Å; L645-F649 HydrophobicContact CG-CE2 4.13Å; L645-F649 VanDerWaalsContact O-CD2 3.29Å; L645-F649 WeakPolarHBondContact O-CD2 3.26Å; L645-F649 PolarHBondContact O-N 3.46Å; L645-F649 VanDerWaalsContact O-N 3.14Å; G646-F649 PolarHBondContact O-N 2.86Å; G646-F649 VanDerWaalsContact O-N 3.15Å; F649-T651 PolarHBondContact O-N 2.75Å
650	V	76.8	Confident	60.2	Low	44 Å²	44	126 Å²	126	27%	0.267	65%	0.652	S	S	.	*	B	Isolated β-bridge	trans	-71.3	113.5	169.8	164.3	0	0	0	0	108.2	T608 G646 K652	T608-V650 HydrophobicContact CG2-CG2 3.92Å; G646-V650 WeakPolarHBondContact O-CB 3.33Å; G646-V650 WeakPolarHBondContact O-CG2 3.27Å; G646-V650 PolarHBondContact O-N 3.39Å; V650-K652 PolarHBondContact O-N 2.91Å
651	T	56.8	Low	58.1	Low	94 Å²	94	131.1 Å²	131.1	58%	0.577	67%	0.67	S	S	*	*			trans	-72.4	98.8	172.1	-54.4	0	0	0	0	107.4	K607 F649 T653	K607-T651 PolarHBondContact O-N 3.01Å; F649-T651 PolarHBondContact O-N 2.75Å; T651-T653 PolarHBondContact O-N 3.32Å
652	K	52.9	Low	56	Low	183 Å²	183	135.4 Å²	135.4	80%	0.796	69%	0.687	S	S	*	*			trans	-62.4	104	172.4	-68.5	-178.8	-179.3	176.8	0	107.6	V650 K654	V650-K652 PolarHBondContact O-N 2.91Å; K652-K654 VanDerWaalsContact C-N 3.29Å; K652-K654 PolarHBondContact O-N 3.09Å
653	T	48	Very low	53.8	Low	132 Å²	132	137.5 Å²	137.5	81%	0.81	69%	0.694	S	S	*	*			trans	-58.4	98.1	165.4	18.3	0	0	0	0	107.2	T651 E655	T651-T653 PolarHBondContact O-N 3.32Å; T653-E655 PolarHBondContact O-N 3.09Å
654	K	41.8	Very low	51.9	Low	182 Å²	182	138.9 Å²	138.9	79%	0.791	70%	0.698	S	S	*	*			trans	-56.2	108.8	174.8	-166.8	175.7	-176.8	177.4	0	106.8	K652 M656	K652-K654 VanDerWaalsContact C-N 3.29Å; K652-K654 PolarHBondContact O-N 3.09Å; K654-M656 PolarHBondContact O-N 2.93Å
655	E	37.8	Very low	50.5	Low	191 Å²	191	142.7 Å²	142.7	89%	0.893	71%	0.708	S	S	*	*			trans	-50.3	106	168.2	-92.2	-173	139.9	0	0	107.6	T653 A657	T653-E655 PolarHBondContact O-N 3.09Å; E655-A657 VanDerWaalsContact C-N 3.34Å; E655-A657 PolarHBondContact O-N 2.82Å
656	M	36.2	Very low	49.7	Very low	179 Å²	179	143.4 Å²	143.4	88%	0.882	72%	0.716	S	S	*	*			trans	-74.8	96	173.3	-66.1	-177.1	86.3	0	0	106.4	K654	K654-M656 PolarHBondContact O-N 2.93Å
657	A	34.3	Very low	49.3	Very low	78 Å²	78	145.8 Å²	145.8	65%	0.645	72%	0.721	S	S	*	*			trans	-46.7	141.1	162.2	0	0	0	0	0	109.3	E655 K659	E655-A657 VanDerWaalsContact C-N 3.34Å; E655-A657 PolarHBondContact O-N 2.82Å; A657-K659 PolarHBondContact O-N 2.88Å
658	P	43	Very low	48.9	Very low	130 Å²	130	142.7 Å²	142.7	84%	0.844	70%	0.698	S	S	*	*			trans	-71.8	95.4	-161.6	29.8	-33.6	0	0	0	109.3	K660	P658-K660 PolarHBondContact O-N 2.87Å
659	K	31.2	Very low	48.8	Very low	207 Å²	207	144.9 Å²	144.9	90%	0.9	70%	0.698	S	S	*	*			trans	-69.3	122.6	170.6	-85	-171.5	174.2	-177.6	0	108	A657	A657-K659 PolarHBondContact O-N 2.88Å
660	K	31.5	Very low	48.8	Very low	198 Å²	198	142.5 Å²	142.5	86%	0.861	69%	0.692	S	S	*	*			trans	-35.8	137.6	178.6	-72.6	171.8	172	178.1	0	112.2	P658 E662	P658-K660 PolarHBondContact O-N 2.87Å; K660-E662 PolarHBondContact O-N 3.39Å
661	K	33.1	Very low	48.8	Very low	218 Å²	218	141.2 Å²	141.2	95%	0.948	68%	0.684	S	S	*	*			trans	-44.5	107.4	167.3	-66.1	175.9	176.7	180	0	109.2
662	E	35.2	Very low	50	Low	186 Å²	186	141 Å²	141	87%	0.869	68%	0.679	S	S	*	*			trans	-117.7	128.9	161.7	-163.9	161.1	-166	0	0	105.8	K660 K664	K660-E662 PolarHBondContact O-N 3.39Å; E662-K664 PolarHBondContact O-N 3.2Å
663	D	40.2	Very low	51.2	Low	156 Å²	156	137.2 Å²	137.2	83%	0.834	67%	0.671	S	S	*	*			trans	-51.5	116.4	-156.5	-81.1	-45.1	0	0	0	113.3	R665	D663-R665 PolarHBondContact O-N 3.14Å
664	K	41.2	Very low	52.9	Low	193 Å²	193	139.3 Å²	139.3	84%	0.839	67%	0.669	S	S	*	*			trans	-61.1	99.9	168.5	-67.9	177.2	178.6	-178.7	0	107.7	E662 V666	E662-K664 PolarHBondContact O-N 3.2Å; K664-V666 VanDerWaalsContact C-N 3.34Å; K664-V666 PolarHBondContact O-N 3.49Å
665	R	45.6	Very low	54.8	Low	216 Å²	216	134.1 Å²	134.1	82%	0.815	65%	0.645	S	S	*	*			trans	-59	107.6	154.3	-71.6	-175.1	180	-150.4	-1.1	105.9	D663 E667	D663-R665 PolarHBondContact O-N 3.14Å; R665-E667 HydrophobicContact CB-CG 4.47Å; R665-E667 PolarHBondContact O-N 3.32Å; R665-E667 VanDerWaalsContact O-N 3.16Å
666	V	58.9	Low	57	Low	96 Å²	96	125.2 Å²	125.2	58%	0.582	60%	0.604	S	S	*	*			trans	-66.1	113	175.3	-173.4	0	0	0	0	105.1	K664 I736	K664-V666 VanDerWaalsContact C-N 3.34Å; K664-V666 PolarHBondContact O-N 3.49Å; V666-I736 HydrophobicContact CB-CG2 4.21Å; V666-I736 HydrophobicContact CG1-CD1 3.88Å; V666-I736 HydrophobicContact CG1-CG1 4.49Å; V666-I736 HydrophobicContact CG1-CG2 3.82Å; V666-I736 WeakPolarHBondContact O-CG2 3.29Å
667	E	67.5	Low	59.3	Low	71 Å²	71	120.4 Å²	120.4	33%	0.332	58%	0.582	S	S	.	*			trans	-124.9	134.6	179.1	-72.1	175.8	-176.5	0	0	108.3	R665 R669 P737	R665-E667 HydrophobicContact CB-CG 4.47Å; R665-E667 PolarHBondContact O-N 3.32Å; R665-E667 VanDerWaalsContact O-N 3.16Å; E667-R669 PolarHBondContact O-N 2.96Å; E667-R669 IonicContact OE2-NH2 3.86Å; E667-P737 VanDerWaalsContact CA-O 3.32Å; E667-P737 WeakPolarHBondContact CA-O 3.3Å
668	I	67.6	Low	61.8	Low	17 Å²	17	118.6 Å²	118.6	9%	0.087	57%	0.566	C	S	.	*	B	Isolated β-bridge	trans	-75.3	117.1	178.2	-51	177.7	0	0	0	108.4	V670 A729 H733 I736 P737 L738 G739	I668-V670 HydrophobicContact CG2-CG2 3.78Å; I668-A729 HydrophobicContact CG2-CB 3.62Å; I668-H733 HydrophobicContact CD1-CB 3.77Å; I668-I736 HydrophobicContact CD1-CB 4.02Å; I668-I736 HydrophobicContact CD1-CG2 4.31Å; I668-I736 WeakPolarHBondContact CD1-O 3.48Å; I668-I736 HydrophobicContact CG1-CB 3.83Å; I668-I736 HydrophobicContact CG1-CG2 3.57Å; I668-P737 PolarHBondContact N-O 3.39Å; I668-L738 HydrophobicContact CB-CD2 4.35Å; I668-L738 HydrophobicContact CG2-CD2 4.46Å; I668-G739 PolarHBondContact O-N 2.88Å
669	R	70.6	Confident	63.7	Low	166 Å²	166	112.4 Å²	112.4	63%	0.626	53%	0.526	S	S	*	.			trans	-117.3	103.9	173.8	-65.2	-174.6	-177	-157.6	-1.6	109.2	E667	E667-R669 PolarHBondContact O-N 2.96Å; E667-R669 IonicContact OE2-NH2 3.86Å
670	V	74.8	Confident	66.2	Low	56 Å²	56	105 Å²	105	34%	0.339	50%	0.496	S	S	.	.			trans	-95.1	-31.7	-179.2	-173.6	0	0	0	0	110.8	I668 A725 A729 E742	I668-V670 HydrophobicContact CG2-CG2 3.78Å; V670-A725 HydrophobicContact CG1-CB 3.54Å; V670-A729 HydrophobicContact CG2-CB 3.35Å; V670-E742 PolarHBondContact N-OE1 3.32Å
671	L	77.6	Confident	68.6	Low	17 Å²	17	100.9 Å²	100.9	9%	0.089	48%	0.483	C	S	.	.	S	Bend	trans	-75.4	152	179.9	-80.3	90.4	0	0	0	111.8	R675 I679 I726 E742 L745	L671-R675 HydrophobicContact CD2-CB 4.35Å; L671-R675 HydrophobicContact CD2-CG 3.79Å; L671-I679 HydrophobicContact CD2-CD1 3.72Å; L671-I726 HydrophobicContact CD1-CD1 3.86Å; L671-I726 HydrophobicContact CD1-CG1 4.07Å; L671-E742 HydrophobicContact CD1-CG 3.63Å; L671-E742 PolarHBondContact N-OE1 3.37Å; L671-L745 HydrophobicContact CD1-CD1 3.89Å; L671-L745 HydrophobicContact CD2-CD1 3.43Å; L671-L745 VanDerWaalsContact CD2-CD1 3.43Å; L671-L745 HydrophobicContact CG-CD1 4.31Å
672	D	80.2	Confident	70.9	Confident	88 Å²	88	90.6 Å²	90.6	47%	0.471	44%	0.438	S	S	.	.			trans	-62	145.2	171.3	70.4	-78.7	0	0	0	110.7	K674 R675 S676	D672-K674 PolarHBondContact O-N 3.5Å; D672-K674 VanDerWaalsContact O-N 3.08Å; D672-K674 WeakPolarHBondContact OD2-CB 3.38Å; D672-K674 PolarHBondContact OD2-N 3.5Å; D672-R675 PolarHBondContact O-N 3.5Å; D672-R675 VanDerWaalsContact O-N 3.14Å; D672-R675 WeakPolarHBondContact OD1-CB 3.33Å; D672-R675 WeakPolarHBondContact OD2-CB 3.44Å; D672-R675 PolarHBondContact OD2-N 3.16Å; D672-S676 WeakPolarHBondContact O-CB 3.47Å; D672-S676 PolarHBondContact O-N 3.42Å
673	T	79.8	Confident	73	Confident	104 Å²	104	83.3 Å²	83.3	64%	0.638	41%	0.405	S	S	*	.	H	α-helix	trans	-54.7	-34	-175.5	-52.3	0	0	0	0	112.7	N677	T673-N677 VanDerWaalsContact O-CB 3.22Å; T673-N677 WeakPolarHBondContact O-CB 3.21Å; T673-N677 PolarHBondContact O-N 2.9Å; T673-N677 PolarHBondContact O-ND2 3.3Å; T673-N677 PolarHBondContact O-OD1 3.39Å
674	K	82.1	Confident	75	Confident	177 Å²	177	81.4 Å²	81.4	77%	0.77	40%	0.399	S	S	*	.	H	α-helix	trans	-72.1	-45.4	-178.1	-171.7	-178.7	178.8	-176.1	0	110.8	D672 N677 A678	D672-K674 PolarHBondContact O-N 3.5Å; D672-K674 VanDerWaalsContact O-N 3.08Å; D672-K674 WeakPolarHBondContact OD2-CB 3.38Å; D672-K674 PolarHBondContact OD2-N 3.5Å; K674-N677 PolarHBondContact O-N 2.91Å; K674-A678 PolarHBondContact O-N 2.84Å
675	R	83.1	Confident	76.8	Confident	72 Å²	72	79.7 Å²	79.7	27%	0.272	39%	0.392	S	S	.	.	H	α-helix	trans	-67.1	-45.4	176.1	-169.8	169.7	-177.4	143.2	-1	112.4	L671 D672 N677 A678 I679 L717 E722	L671-R675 HydrophobicContact CD2-CB 4.35Å; L671-R675 HydrophobicContact CD2-CG 3.79Å; D672-R675 PolarHBondContact O-N 3.5Å; D672-R675 VanDerWaalsContact O-N 3.14Å; D672-R675 WeakPolarHBondContact OD1-CB 3.33Å; D672-R675 WeakPolarHBondContact OD2-CB 3.44Å; D672-R675 PolarHBondContact OD2-N 3.16Å; R675-N677 VanDerWaalsContact C-N 3.3Å; R675-N677 PolarHBondContact O-N 3Å; R675-A678 WeakPolarHBondContact O-CB 3.46Å; R675-A678 PolarHBondContact O-N 2.92Å; R675-A678 VanDerWaalsContact O-N 3.13Å; R675-I679 HydrophobicContact CG-CD1 4.09Å; R675-I679 WeakPolarHBondContact O-CG1 3.03Å; R675-I679 PolarHBondContact O-N 2.93Å; R675-L717 PolarHBondContact NH2-O 2.83Å; R675-E722 WeakPolarHBondContact CD-OE1 3.26Å; R675-E722 IonicContact CZ-OE1 3.88Å; R675-E722 IonicContact CZ-OE2 3.52Å; R675-E722 IonicContact NE-OE1 3.7Å; R675-E722 PolarHBondContact NE-OE1 3.33Å; R675-E722 IonicContact NE-OE2 2.72Å; R675-E722 PolarHBondContact NE-OE2 3.44Å; R675-E722 IonicContact NH1-OE1 3.02Å; R675-E722 PolarHBondContact NH1-OE1 3.44Å; R675-E722 IonicContact NH1-OE2 3.41Å; R675-E722 VanDerWaalsContact NH2-CD 3.29Å; R675-E722 IonicContact NH2-OE1 3.79Å; R675-E722 PolarHBondContact NH2-OE1 2.9Å; R675-E722 IonicContact NH2-OE2 2.78Å; R675-E722 PolarHBondContact NH2-OE2 3.47Å
676	S	83.5	Confident	78.3	Confident	5 Å²	5	70.2 Å²	70.2	4%	0.035	36%	0.357	C	S	.	.	H	α-helix	trans	-57.7	-42.9	175.1	-175.2	0	0	0	0	111.4	D672 I679 N680	D672-S676 WeakPolarHBondContact O-CB 3.47Å; D672-S676 PolarHBondContact O-N 3.42Å; S676-I679 PolarHBondContact O-N 3.39Å; S676-N680 WeakPolarHBondContact O-CB 3.47Å; S676-N680 VanDerWaalsContact O-CG 3.28Å; S676-N680 PolarHBondContact O-N 3.3Å; S676-N680 PolarHBondContact O-ND2 2.95Å
677	N	85.2	Confident	79.2	Confident	78 Å²	78	67.2 Å²	67.2	42%	0.417	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-42.3	174.6	-73.6	-13.1	0	0	0	112.8	T673 K674 R675 I679 N680 I681	T673-N677 VanDerWaalsContact O-CB 3.22Å; T673-N677 WeakPolarHBondContact O-CB 3.21Å; T673-N677 PolarHBondContact O-N 2.9Å; T673-N677 PolarHBondContact O-ND2 3.3Å; T673-N677 PolarHBondContact O-OD1 3.39Å; K674-N677 PolarHBondContact O-N 2.91Å; R675-N677 VanDerWaalsContact C-N 3.3Å; R675-N677 PolarHBondContact O-N 3Å; N677-I679 VanDerWaalsContact C-N 3.28Å; N677-I679 PolarHBondContact O-N 2.84Å; N677-N680 PolarHBondContact O-N 2.85Å; N677-I681 WeakPolarHBondContact O-CB 3.11Å; N677-I681 VanDerWaalsContact O-CG1 3.23Å; N677-I681 WeakPolarHBondContact O-CG1 3.41Å; N677-I681 PolarHBondContact O-N 3.2Å
678	A	85.2	Confident	79.7	Confident	39 Å²	39	68.2 Å²	68.2	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-60.1	-40.8	176.1	0	0	0	0	0	111.5	K674 R675 I681 G682 M716	K674-A678 PolarHBondContact O-N 2.84Å; R675-A678 WeakPolarHBondContact O-CB 3.46Å; R675-A678 PolarHBondContact O-N 2.92Å; R675-A678 VanDerWaalsContact O-N 3.13Å; A678-I681 PolarHBondContact O-N 2.98Å; A678-G682 PolarHBondContact O-N 3.5Å; A678-M716 WeakPolarHBondContact O-CE 3.37Å
679	I	83.3	Confident	80	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-64.1	-48	175.5	-65.7	163.8	0	0	0	111.4	L671 R675 S676 N677 I681 G682 L683 M716 A741 F744 L745	L671-I679 HydrophobicContact CD2-CD1 3.72Å; R675-I679 HydrophobicContact CG-CD1 4.09Å; R675-I679 WeakPolarHBondContact O-CG1 3.03Å; R675-I679 PolarHBondContact O-N 2.93Å; S676-I679 PolarHBondContact O-N 3.39Å; N677-I679 VanDerWaalsContact C-N 3.28Å; N677-I679 PolarHBondContact O-N 2.84Å; I679-I681 VanDerWaalsContact C-N 3.3Å; I679-I681 PolarHBondContact O-N 3.31Å; I679-G682 CarbonylContact O-C 3.6Å; I679-G682 WeakPolarHBondContact O-CA 3.37Å; I679-G682 PolarHBondContact O-N 2.62Å; I679-L683 HydrophobicContact CG2-CD1 4.15Å; I679-L683 HydrophobicContact CG2-CG 4.41Å; I679-L683 WeakPolarHBondContact O-CG 3.45Å; I679-L683 PolarHBondContact O-N 3.16Å; I679-M716 VanDerWaalsContact CA-SD 3.56Å; I679-M716 HydrophobicContact CB-CE 4.45Å; I679-M716 HydrophobicContact CB-SD 3.87Å; I679-M716 HydrophobicContact CG1-CE 4.34Å; I679-M716 HydrophobicContact CG1-SD 3.68Å; I679-M716 HydrophobicContact CG2-SD 3.8Å; I679-A741 HydrophobicContact CB-CB 3.94Å; I679-A741 HydrophobicContact CD1-CB 4.4Å; I679-A741 HydrophobicContact CG2-CB 3.68Å; I679-F744 HydrophobicContact CG2-CD1 4.08Å; I679-L745 HydrophobicContact CD1-CD1 3.63Å; I679-L745 HydrophobicContact CD1-CD2 4.11Å; I679-L745 HydrophobicContact CD1-CG 3.96Å
680	N	83.3	Confident	80.3	Confident	51 Å²	51	72.9 Å²	72.9	27%	0.273	38%	0.376	S	S	.	.	H	α-helix	trans	-60.7	-38.5	177.4	-71.5	-38.9	0	0	0	112.3	S676 N677 G682 L683 T684	S676-N680 WeakPolarHBondContact O-CB 3.47Å; S676-N680 VanDerWaalsContact O-CG 3.28Å; S676-N680 PolarHBondContact O-N 3.3Å; S676-N680 PolarHBondContact O-ND2 2.95Å; N677-N680 PolarHBondContact O-N 2.85Å; N680-G682 VanDerWaalsContact C-N 3.31Å; N680-L683 PolarHBondContact O-N 2.92Å; N680-T684 WeakPolarHBondContact O-CG2 3.43Å; N680-T684 PolarHBondContact O-N 2.84Å
681	I	82.3	Confident	80.7	Confident	112 Å²	112	71.6 Å²	71.6	57%	0.574	37%	0.372	S	S	*	.	H	α-helix	trans	-68.8	-30	172.5	-65.4	164.2	0	0	0	111.5	N677 A678 I679 T684	N677-I681 WeakPolarHBondContact O-CB 3.11Å; N677-I681 VanDerWaalsContact O-CG1 3.23Å; N677-I681 WeakPolarHBondContact O-CG1 3.41Å; N677-I681 PolarHBondContact O-N 3.2Å; A678-I681 PolarHBondContact O-N 2.98Å; I679-I681 VanDerWaalsContact C-N 3.3Å; I679-I681 PolarHBondContact O-N 3.31Å; I681-T684 PolarHBondContact O-OG1 3.26Å
682	G	81.1	Confident	81	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-63.7	-48.9	170.8	0	0	0	0	0	112.2	A678 I679 N680 T684 K685	A678-G682 PolarHBondContact O-N 3.5Å; I679-G682 CarbonylContact O-C 3.6Å; I679-G682 WeakPolarHBondContact O-CA 3.37Å; I679-G682 PolarHBondContact O-N 2.62Å; N680-G682 VanDerWaalsContact C-N 3.31Å; G682-T684 PolarHBondContact O-N 3.45Å; G682-K685 PolarHBondContact O-N 3.01Å
683	L	80.1	Confident	81.2	Confident	34 Å²	34	69.7 Å²	69.7	18%	0.178	36%	0.359	C	S	.	.	H	α-helix	trans	-59.9	-29.4	-177.9	-74.5	172.1	0	0	0	113.4	I679 N680 K685 L686 P689 F744	I679-L683 HydrophobicContact CG2-CD1 4.15Å; I679-L683 HydrophobicContact CG2-CG 4.41Å; I679-L683 WeakPolarHBondContact O-CG 3.45Å; I679-L683 PolarHBondContact O-N 3.16Å; N680-L683 PolarHBondContact O-N 2.92Å; L683-K685 PolarHBondContact O-N 3.12Å; L683-L686 PolarHBondContact O-N 2.95Å; L683-P689 HydrophobicContact CD2-CG 4.46Å; L683-F744 HydrophobicContact CD1-CB 4.23Å; L683-F744 HydrophobicContact CD1-CG 4.39Å; L683-F744 HydrophobicContact CD2-CB 4.31Å; L683-F744 HydrophobicContact CD2-CD1 3.8Å; L683-F744 HydrophobicContact CD2-CD2 3.75Å; L683-F744 HydrophobicContact CD2-CE1 3.95Å; L683-F744 HydrophobicContact CD2-CE2 3.94Å; L683-F744 HydrophobicContact CD2-CG 3.68Å; L683-F744 HydrophobicContact CD2-CZ 4.02Å; L683-F744 HydrophobicContact CG-CD1 4.33Å; L683-F744 HydrophobicContact CG-CG 4.45Å
684	T	81.5	Confident	81.4	Confident	116 Å²	116	68.2 Å²	68.2	71%	0.712	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-20	176.5	61.7	0	0	0	0	113.9	N680 I681 G682	N680-T684 WeakPolarHBondContact O-CG2 3.43Å; N680-T684 PolarHBondContact O-N 2.84Å; I681-T684 PolarHBondContact O-OG1 3.26Å; G682-T684 PolarHBondContact O-N 3.45Å
685	K	79.1	Confident	81.5	Confident	156 Å²	156	59.8 Å²	59.8	68%	0.678	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-9.1	176.3	-62.4	-153.3	-179.4	-169.6	0	113.4	G682 L683	G682-K685 PolarHBondContact O-N 3.01Å; L683-K685 PolarHBondContact O-N 3.12Å
686	L	77.9	Confident	81.7	Confident	18 Å²	18	56.4 Å²	56.4	9%	0.094	30%	0.3	C	S	.	.	S	Bend	trans	-99.6	153	-173.6	-68.1	171.7	0	0	0	110.9	L683 I692 C708 V712 F744	L683-L686 PolarHBondContact O-N 2.95Å; L686-I692 HydrophobicContact CB-CD1 3.83Å; L686-I692 HydrophobicContact CD1-CD1 4.26Å; L686-C708 HydrophobicContact CD2-CB 3.69Å; L686-V712 HydrophobicContact CD1-CG2 3.93Å; L686-V712 HydrophobicContact CD2-CG2 4.15Å; L686-F744 HydrophobicContact CD1-CZ 4.22Å
687	P	78	Confident	81.8	Confident	32 Å²	32	58.5 Å²	58.5	21%	0.208	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-58.6	171.5	171.2	-19.5	29.8	0	0	0	112.5	I692 I703	P687-I692 WeakPolarHBondContact O-CD1 3.29Å; P687-I703 HydrophobicContact CB-CG2 4.18Å; P687-I703 HydrophobicContact CG-CG2 4.21Å; P687-I703 WeakPolarHBondContact CG-O 3.35Å
688	P	77.9	Confident	81.7	Confident	92 Å²	92	59.9 Å²	59.9	60%	0.597	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-49.7	130.6	177.2	-27.3	34.8	0	0	0	111.9	R690 A691 I692	P688-R690 PolarHBondContact O-N 3.28Å; P688-A691 WeakPolarHBondContact O-CB 3.49Å; P688-A691 PolarHBondContact O-N 2.72Å; P688-I692 PolarHBondContact O-N 3.05Å
689	P	74	Confident	81.6	Confident	60 Å²	60	58 Å²	58	39%	0.39	30%	0.299	S	S	.	.	H	α-helix	trans	-51.8	-37.4	-169.8	-29.5	33.4	0	0	0	114.5	L683 A691 I692 F744 M747	L683-P689 HydrophobicContact CD2-CG 4.46Å; P689-A691 VanDerWaalsContact C-N 3.34Å; P689-A691 PolarHBondContact O-N 3.42Å; P689-I692 WeakPolarHBondContact O-CB 3.46Å; P689-I692 PolarHBondContact O-N 3.44Å; P689-F744 HydrophobicContact CB-CD2 4.15Å; P689-M747 HydrophobicContact CB-CE 3.25Å; P689-M747 WeakPolarHBondContact O-CE 3.35Å; P689-M747 VanDerWaalsContact O-SD 3.38Å
690	R	76.6	Confident	81.4	Confident	221 Å²	221	60.1 Å²	60.1	83%	0.834	31%	0.311	S	S	*	.	H	α-helix	trans	-66.4	-32.6	178.2	-66.4	-176.9	178.7	171.9	-0.9	113.6	P688 I692 T694	P688-R690 PolarHBondContact O-N 3.28Å; R690-I692 VanDerWaalsContact C-N 3.32Å; R690-T694 PolarHBondContact O-OG1 3.24Å
691	A	83.1	Confident	81.3	Confident	29 Å²	29	59.7 Å²	59.7	24%	0.24	31%	0.312	C	S	.	.	H	α-helix	trans	-69.5	-34.9	176.7	0	0	0	0	0	110.8	P688 P689 K693 T694 A695 I703	P688-A691 WeakPolarHBondContact O-CB 3.49Å; P688-A691 PolarHBondContact O-N 2.72Å; P689-A691 VanDerWaalsContact C-N 3.34Å; P689-A691 PolarHBondContact O-N 3.42Å; A691-K693 PolarHBondContact O-N 3.18Å; A691-T694 PolarHBondContact O-N 3.38Å; A691-A695 VanDerWaalsContact O-CB 3.29Å; A691-A695 WeakPolarHBondContact O-CB 3.37Å; A691-A695 PolarHBondContact O-N 2.86Å; A691-I703 HydrophobicContact CB-CG2 4.01Å
692	I	84.1	Confident	81	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-48.7	179.6	-57.4	175.2	0	0	0	111.3	L686 P687 P688 P689 R690 T694 A695 I696 M704 F744 L748	L686-I692 HydrophobicContact CB-CD1 3.83Å; L686-I692 HydrophobicContact CD1-CD1 4.26Å; P687-I692 WeakPolarHBondContact O-CD1 3.29Å; P688-I692 PolarHBondContact O-N 3.05Å; P689-I692 WeakPolarHBondContact O-CB 3.46Å; P689-I692 PolarHBondContact O-N 3.44Å; R690-I692 VanDerWaalsContact C-N 3.32Å; I692-T694 VanDerWaalsContact C-N 3.31Å; I692-T694 PolarHBondContact O-N 3.46Å; I692-A695 PolarHBondContact O-N 3.49Å; I692-I696 HydrophobicContact CG2-CD1 3.65Å; I692-I696 HydrophobicContact CG2-CG1 4.3Å; I692-I696 VanDerWaalsContact O-CG1 3.3Å; I692-I696 WeakPolarHBondContact O-CG1 3.34Å; I692-I696 PolarHBondContact O-N 3.01Å; I692-M704 HydrophobicContact CG2-SD 4.21Å; I692-F744 HydrophobicContact CD1-CE2 3.83Å; I692-F744 HydrophobicContact CD1-CZ 4.15Å; I692-L748 HydrophobicContact CG2-CD2 4.49Å
693	K	83.3	Confident	80.7	Confident	66 Å²	66	61.7 Å²	61.7	29%	0.287	33%	0.33	S	S	.	.	H	α-helix	trans	-56.7	-46.6	178	-176	175.7	-171.1	-177	0	111.8	A691 I696 V697 M747 E750 I751	A691-K693 PolarHBondContact O-N 3.18Å; K693-I696 PolarHBondContact O-N 3.5Å; K693-V697 WeakPolarHBondContact O-CG2 3.4Å; K693-V697 PolarHBondContact O-N 3.44Å; K693-V697 VanDerWaalsContact O-N 3.17Å; K693-M747 HydrophobicContact CB-CG 4.41Å; K693-M747 HydrophobicContact CB-SD 3.74Å; K693-M747 HydrophobicContact CD-CG 4.08Å; K693-M747 HydrophobicContact CD-SD 4.49Å; K693-E750 IonicContact NZ-OE2 3.47Å; K693-E750 PolarHBondContact NZ-OE2 3.26Å; K693-I751 HydrophobicContact CB-CD1 4.31Å; K693-I751 HydrophobicContact CG-CD1 3.89Å; K693-I751 HydrophobicContact CG-CG1 3.91Å
694	T	84.8	Confident	80.5	Confident	72 Å²	72	60.1 Å²	60.1	44%	0.442	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-42.2	179.9	-51.2	0	0	0	0	111.2	R690 A691 I692 V697 K698	R690-T694 PolarHBondContact O-OG1 3.24Å; A691-T694 PolarHBondContact O-N 3.38Å; I692-T694 VanDerWaalsContact C-N 3.31Å; I692-T694 PolarHBondContact O-N 3.46Å; T694-V697 PolarHBondContact O-N 2.86Å; T694-K698 HydrophobicContact CG2-CD 4.19Å; T694-K698 WeakPolarHBondContact O-CB 3.49Å; T694-K698 PolarHBondContact O-N 2.92Å
695	A	85	Confident	80.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63	-42	178.8	0	0	0	0	0	112.1	A691 I692 K698 F699 D700 I703 W761	A691-A695 VanDerWaalsContact O-CB 3.29Å; A691-A695 WeakPolarHBondContact O-CB 3.37Å; A691-A695 PolarHBondContact O-N 2.86Å; I692-A695 PolarHBondContact O-N 3.49Å; A695-K698 PolarHBondContact O-N 3.41Å; A695-F699 WeakPolarHBondContact O-CA 3.28Å; A695-F699 PolarHBondContact O-N 3.32Å; A695-D700 HydrophobicContact CB-CB 4.24Å; A695-D700 PolarHBondContact O-N 2.88Å; A695-I703 HydrophobicContact CB-CB 3.99Å; A695-I703 HydrophobicContact CB-CD1 4.31Å; A695-I703 HydrophobicContact CB-CG2 4.04Å; A695-W761 HydrophobicContact CB-CH2 4.17Å
696	I	86.3	Confident	80.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-39.3	177.1	-66.1	167.7	0	0	0	112.2	I692 K693 M704 L748 I751 L754 R757 L758 W761	I692-I696 HydrophobicContact CG2-CD1 3.65Å; I692-I696 HydrophobicContact CG2-CG1 4.3Å; I692-I696 VanDerWaalsContact O-CG1 3.3Å; I692-I696 WeakPolarHBondContact O-CG1 3.34Å; I692-I696 PolarHBondContact O-N 3.01Å; K693-I696 PolarHBondContact O-N 3.5Å; I696-M704 HydrophobicContact CD1-CE 4.26Å; I696-M704 HydrophobicContact CG1-CE 3.58Å; I696-L748 HydrophobicContact CD1-CD2 4.02Å; I696-I751 HydrophobicContact CB-CD1 4.26Å; I696-I751 HydrophobicContact CD1-CD1 4.09Å; I696-I751 HydrophobicContact CG2-CD1 4.2Å; I696-I751 HydrophobicContact CG2-CG2 4.21Å; I696-L754 HydrophobicContact CD1-CD1 4.01Å; I696-L754 HydrophobicContact CG2-CD1 3.9Å; I696-R757 HydrophobicContact CG2-CB 4.24Å; I696-L758 HydrophobicContact CD1-CD2 4.01Å; I696-L758 HydrophobicContact CG1-CD2 4.02Å; I696-L758 HydrophobicContact CG2-CD2 4.41Å; I696-W761 HydrophobicContact CB-CZ3 4.4Å; I696-W761 HydrophobicContact CG1-CZ3 4Å
697	V	85.2	Confident	80.9	Confident	49 Å²	49	59.5 Å²	59.5	30%	0.297	32%	0.319	S	S	.	.	H	α-helix	trans	-70	-39.5	178.8	173.3	0	0	0	0	111.1	K693 T694 I751	K693-V697 WeakPolarHBondContact O-CG2 3.4Å; K693-V697 PolarHBondContact O-N 3.44Å; K693-V697 VanDerWaalsContact O-N 3.17Å; T694-V697 PolarHBondContact O-N 2.86Å; V697-I751 HydrophobicContact CG2-CG2 4.36Å
698	K	83.1	Confident	81.1	Confident	107 Å²	107	59.1 Å²	59.1	47%	0.465	32%	0.317	S	S	.	.	H	α-helix	trans	-91.5	-2.6	-177.6	-67	-171.3	175.3	-173.7	0	115.3	F409 T694 A695 D700	F409-K698 VanDerWaalsContact CB-O 3.23Å; F409-K698 WeakPolarHBondContact CB-O 3.35Å; F409-K698 WeakPolarHBondContact CG-O 3.22Å; T694-K698 HydrophobicContact CG2-CD 4.19Å; T694-K698 WeakPolarHBondContact O-CB 3.49Å; T694-K698 PolarHBondContact O-N 2.92Å; A695-K698 PolarHBondContact O-N 3.41Å; K698-D700 VanDerWaalsContact C-N 3.26Å; K698-D700 PolarHBondContact O-N 3.26Å
699	F	82.9	Confident	81.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	38.8	-171.7	-65.3	-97.4	0	0	0	113	F409 A695 S701 L760 W761 I893 L901 I905	F409-F699 HydrophobicContact CD2-CB 3.61Å; F409-F699 WeakPolarHBondContact CD2-O 2.98Å; F409-F699 HydrophobicContact CE1-CB 4.46Å; F409-F699 HydrophobicContact CE2-CB 3.38Å; F409-F699 HydrophobicContact CE2-CG 4.28Å; F409-F699 HydrophobicContact CG-CB 4.24Å; F409-F699 HydrophobicContact CZ-CB 3.84Å; F409-F699 HydrophobicContact CZ-CG 4.29Å; A695-F699 WeakPolarHBondContact O-CA 3.28Å; A695-F699 PolarHBondContact O-N 3.32Å; F699-S701 PolarHBondContact O-N 3.28Å; F699-L760 HydrophobicContact CE1-CD2 4.38Å; F699-L760 HydrophobicContact CE1-CG 4.3Å; F699-L760 HydrophobicContact CZ-CD2 4.19Å; F699-W761 HydrophobicContact CD1-CB 3.57Å; F699-W761 AromaticContact CD1-CD1 3.79Å; F699-W761 HydrophobicContact CD1-CD2 4.1Å; F699-W761 AromaticContact CD1-CG 3.54Å; F699-W761 HydrophobicContact CD1-CG 3.54Å; F699-W761 HydrophobicContact CE1-CB 3.69Å; F699-W761 HydrophobicContact CE1-CG 4.19Å; F699-W761 HydrophobicContact CG-CG 4.48Å; F699-I893 HydrophobicContact CZ-CD1 4.46Å; F699-L901 HydrophobicContact CD2-CD1 4.28Å; F699-L901 HydrophobicContact CD2-CD2 4.2Å; F699-L901 HydrophobicContact CE2-CD2 4.07Å; F699-I905 HydrophobicContact CD2-CD1 4.29Å; F699-I905 HydrophobicContact CE2-CD1 3.83Å; F699-I905 HydrophobicContact CZ-CD1 3.98Å
700	D	79.5	Confident	81.9	Confident	45 Å²	45	55.5 Å²	55.5	24%	0.241	29%	0.287	C	S	.	.			trans	-80	103	-173.4	-171.1	-11	0	0	0	112.4	A695 K698 S702 I703 W761	A695-D700 HydrophobicContact CB-CB 4.24Å; A695-D700 PolarHBondContact O-N 2.88Å; K698-D700 VanDerWaalsContact C-N 3.26Å; K698-D700 PolarHBondContact O-N 3.26Å; D700-S702 PolarHBondContact O-N 2.8Å; D700-S702 WeakPolarHBondContact OD1-CB 3.27Å; D700-S702 PolarHBondContact OD1-N 3.45Å; D700-S702 PolarHBondContact OD1-OG 2.96Å; D700-S702 PolarHBondContact OD2-OG 3.41Å; D700-I703 HydrophobicContact CB-CD1 4.5Å; D700-I703 WeakPolarHBondContact OD2-CD1 3.4Å; D700-W761 VanDerWaalsContact C-CZ2 3.42Å; D700-W761 WeakPolarHBondContact O-CH2 3.35Å; D700-W761 WeakPolarHBondContact O-CZ2 3.27Å
701	S	80.7	Confident	82.2	Confident	42 Å²	42	47.5 Å²	47.5	29%	0.294	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-11.3	-176.3	-51.9	0	0	0	0	113.6	F699 L765	F699-S701 PolarHBondContact O-N 3.28Å; S701-L765 WeakPolarHBondContact OG-CD2 3.44Å
702	S	76.4	Confident	82.2	Confident	97 Å²	97	46.1 Å²	46.1	68%	0.678	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-25.3	178.5	71	0	0	0	0	113.1	D700	D700-S702 PolarHBondContact O-N 2.8Å; D700-S702 WeakPolarHBondContact OD1-CB 3.27Å; D700-S702 PolarHBondContact OD1-N 3.45Å; D700-S702 PolarHBondContact OD1-OG 2.96Å; D700-S702 PolarHBondContact OD2-OG 3.41Å
703	I	75.4	Confident	82.2	Confident	58 Å²	58	47.5 Å²	47.5	30%	0.297	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-36.8	-176.1	-59.8	174.3	0	0	0	110.9	P687 A691 A695 D700	P687-I703 HydrophobicContact CB-CG2 4.18Å; P687-I703 HydrophobicContact CG-CG2 4.21Å; P687-I703 WeakPolarHBondContact CG-O 3.35Å; A691-I703 HydrophobicContact CB-CG2 4.01Å; A695-I703 HydrophobicContact CB-CB 3.99Å; A695-I703 HydrophobicContact CB-CD1 4.31Å; A695-I703 HydrophobicContact CB-CG2 4.04Å; D700-I703 HydrophobicContact CB-CD1 4.5Å; D700-I703 WeakPolarHBondContact OD2-CD1 3.4Å
704	M	76.2	Confident	82	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	27%	0.271	C	S	.	.			trans	-132	117.6	-173.7	-162	170.1	51.9	0	0	112.4	I692 I696 C708 I709 L758 W761	I692-M704 HydrophobicContact CG2-SD 4.21Å; I696-M704 HydrophobicContact CD1-CE 4.26Å; I696-M704 HydrophobicContact CG1-CE 3.58Å; M704-C708 HydrophobicContact CG-CB 3.4Å; M704-C708 HydrophobicContact SD-CB 4.16Å; M704-I709 HydrophobicContact CE-CD1 4.3Å; M704-I709 HydrophobicContact CE-CG1 3.49Å; M704-I709 VanDerWaalsContact CE-CG1 3.49Å; M704-I709 HydrophobicContact CG-CG1 4.06Å; M704-I709 HydrophobicContact SD-CG1 4.11Å; M704-L758 HydrophobicContact CE-CD2 4.42Å; M704-W761 HydrophobicContact CB-CH2 3.84Å; M704-W761 HydrophobicContact CE-CE3 3.83Å; M704-W761 HydrophobicContact CE-CH2 3.49Å; M704-W761 VanDerWaalsContact CE-CH2 3.49Å; M704-W761 HydrophobicContact CE-CZ3 3.01Å
705	N	80.8	Confident	81.5	Confident	98 Å²	98	48.2 Å²	48.2	52%	0.524	27%	0.268	S	S	.	.			trans	-83.1	167.8	-179.9	-62.8	-0.5	0	0	0	112.1	D707 C708 I709	N705-D707 PolarHBondContact O-N 3.23Å; N705-C708 WeakPolarHBondContact O-CB 3.36Å; N705-C708 PolarHBondContact O-N 2.89Å; N705-I709 PolarHBondContact O-N 3.42Å
706	K	82.8	Confident	80.8	Confident	65 Å²	65	48.3 Å²	48.3	28%	0.283	27%	0.268	S	S	.	.	H	α-helix	trans	-45.5	-53.1	176.5	-174.9	-173.7	174.1	179.8	0	112.9	C708 I709 E710 L762 D766	K706-C708 VanDerWaalsContact C-N 3.27Å; K706-C708 PolarHBondContact O-N 2.96Å; K706-I709 WeakPolarHBondContact O-CB 3.31Å; K706-I709 PolarHBondContact O-N 2.9Å; K706-I709 VanDerWaalsContact O-N 3.1Å; K706-E710 WeakPolarHBondContact CE-OE1 3.33Å; K706-E710 PolarHBondContact O-N 2.91Å; K706-L762 HydrophobicContact CG-CD1 3.61Å; K706-D766 VanDerWaalsContact CE-CG 3.47Å; K706-D766 WeakPolarHBondContact CE-OD1 3.46Å; K706-D766 WeakPolarHBondContact CE-OD2 3.33Å; K706-D766 IonicContact NZ-OD1 3.93Å; K706-D766 PolarHBondContact NZ-OD1 3.5Å; K706-D766 IonicContact NZ-OD2 3.92Å; K706-D766 PolarHBondContact NZ-OD2 2.8Å
707	D	83.3	Confident	80.4	Confident	114 Å²	114	50.6 Å²	50.6	61%	0.61	28%	0.28	S	S	*	.	H	α-helix	trans	-61.9	-34	-177.3	-53.9	-44.2	0	0	0	113	N705 K711	N705-D707 PolarHBondContact O-N 3.23Å; D707-K711 VanDerWaalsContact O-CB 3.3Å; D707-K711 WeakPolarHBondContact O-CB 3.32Å; D707-K711 PolarHBondContact O-N 3.2Å
708	C	81.9	Confident	79.9	Confident	25 Å²	25	49.2 Å²	49.2	17%	0.169	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-42.4	177.7	-68.3	0	0	0	0	110.6	L686 M704 N705 K706 K711 V712	L686-C708 HydrophobicContact CD2-CB 3.69Å; M704-C708 HydrophobicContact CG-CB 3.4Å; M704-C708 HydrophobicContact SD-CB 4.16Å; N705-C708 WeakPolarHBondContact O-CB 3.36Å; N705-C708 PolarHBondContact O-N 2.89Å; K706-C708 VanDerWaalsContact C-N 3.27Å; K706-C708 PolarHBondContact O-N 2.96Å; C708-K711 PolarHBondContact O-N 3.35Å; C708-V712 VanDerWaalsContact O-CG2 3.28Å; C708-V712 WeakPolarHBondContact O-CG2 3.23Å; C708-V712 PolarHBondContact O-N 3.05Å
709	I	84.1	Confident	79.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-46.5	177	-66.4	161.2	0	0	0	110.4	M704 N705 K706 K711 V712 L713 L758 W761 L762 L765	M704-I709 HydrophobicContact CE-CD1 4.3Å; M704-I709 HydrophobicContact CE-CG1 3.49Å; M704-I709 VanDerWaalsContact CE-CG1 3.49Å; M704-I709 HydrophobicContact CG-CG1 4.06Å; M704-I709 HydrophobicContact SD-CG1 4.11Å; N705-I709 PolarHBondContact O-N 3.42Å; K706-I709 WeakPolarHBondContact O-CB 3.31Å; K706-I709 PolarHBondContact O-N 2.9Å; K706-I709 VanDerWaalsContact O-N 3.1Å; I709-K711 VanDerWaalsContact C-N 3.33Å; I709-K711 PolarHBondContact O-N 3.21Å; I709-V712 PolarHBondContact O-N 3.29Å; I709-L713 WeakPolarHBondContact O-CB 3.38Å; I709-L713 PolarHBondContact O-N 2.8Å; I709-L758 HydrophobicContact CG2-CB 4.26Å; I709-L758 HydrophobicContact CG2-CD2 4.1Å; I709-W761 HydrophobicContact CD1-CD2 3.58Å; I709-W761 HydrophobicContact CD1-CE3 3.77Å; I709-W761 HydrophobicContact CD1-CG 4.01Å; I709-W761 HydrophobicContact CD1-CH2 4.31Å; I709-W761 HydrophobicContact CD1-CZ2 4.1Å; I709-W761 HydrophobicContact CD1-CZ3 4.18Å; I709-W761 HydrophobicContact CG1-CD2 4.46Å; I709-W761 HydrophobicContact CG1-CE3 4.17Å; I709-W761 HydrophobicContact CG1-CZ3 4.37Å; I709-L762 HydrophobicContact CG2-CB 4.03Å; I709-L762 HydrophobicContact CG2-CD1 4.42Å; I709-L765 HydrophobicContact CD1-CD1 3.38Å
710	E	85.1	Confident	79.1	Confident	76 Å²	76	52.9 Å²	52.9	36%	0.355	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-40.7	176.9	-72.9	-175.9	-179.2	0	0	112.2	K706 L713 S714 L762	K706-E710 WeakPolarHBondContact CE-OE1 3.33Å; K706-E710 PolarHBondContact O-N 2.91Å; E710-L713 PolarHBondContact O-N 3.44Å; E710-S714 VanDerWaalsContact O-CB 3.28Å; E710-S714 WeakPolarHBondContact O-CB 3.48Å; E710-S714 PolarHBondContact O-N 2.79Å; E710-S714 PolarHBondContact O-OG 3.09Å; E710-L762 HydrophobicContact CG-CD1 3.69Å; E710-L762 HydrophobicContact CG-CD2 3.79Å; E710-L762 HydrophobicContact CG-CG 4.41Å
711	K	82.2	Confident	79	Confident	52 Å²	52	58.2 Å²	58.2	23%	0.226	32%	0.32	C	S	.	.	H	α-helix	trans	-66.7	-39.3	177.1	-166.5	170.1	-178	-168.9	0	112.4	D707 C708 I709 S714 T715	D707-K711 VanDerWaalsContact O-CB 3.3Å; D707-K711 WeakPolarHBondContact O-CB 3.32Å; D707-K711 PolarHBondContact O-N 3.2Å; C708-K711 PolarHBondContact O-N 3.35Å; I709-K711 VanDerWaalsContact C-N 3.33Å; I709-K711 PolarHBondContact O-N 3.21Å; K711-S714 WeakPolarHBondContact CA-OG 3.47Å; K711-S714 PolarHBondContact O-OG 3.34Å; K711-T715 WeakPolarHBondContact O-CB 3.13Å; K711-T715 PolarHBondContact O-N 3.4Å; K711-T715 PolarHBondContact O-OG1 3.48Å
712	V	82.9	Confident	79	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.006	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-44.3	173.8	173.1	0	0	0	0	110.4	L686 C708 I709 M716 L717 L748 L758	L686-V712 HydrophobicContact CD1-CG2 3.93Å; L686-V712 HydrophobicContact CD2-CG2 4.15Å; C708-V712 VanDerWaalsContact O-CG2 3.28Å; C708-V712 WeakPolarHBondContact O-CG2 3.23Å; C708-V712 PolarHBondContact O-N 3.05Å; I709-V712 PolarHBondContact O-N 3.29Å; V712-M716 HydrophobicContact CG1-CB 4.29Å; V712-M716 CarbonylContact O-C 3.56Å; V712-M716 WeakPolarHBondContact O-CA 3.21Å; V712-M716 WeakPolarHBondContact O-CB 3.38Å; V712-M716 PolarHBondContact O-N 3.49Å; V712-L717 PolarHBondContact O-N 2.79Å; V712-L748 HydrophobicContact CG1-CD1 4.31Å; V712-L758 HydrophobicContact CG1-CD1 3.71Å
713	L	83.4	Confident	79	Confident	28 Å²	28	57.1 Å²	57.1	15%	0.147	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-39	179.7	-171.1	77.3	0	0	0	112.6	I709 E710 L717 L758 R759 L762	I709-L713 WeakPolarHBondContact O-CB 3.38Å; I709-L713 PolarHBondContact O-N 2.8Å; E710-L713 PolarHBondContact O-N 3.44Å; L713-L717 HydrophobicContact CD1-CD1 3.73Å; L713-L717 HydrophobicContact CG-CD1 4.39Å; L713-L717 WeakPolarHBondContact O-CD1 3.35Å; L713-L758 HydrophobicContact CD1-CB 4.11Å; L713-L758 HydrophobicContact CD1-CD1 4.47Å; L713-R759 HydrophobicContact CD1-CG 4.11Å; L713-R759 HydrophobicContact CD2-CG 4.48Å; L713-L762 HydrophobicContact CD2-CD2 4.45Å
714	S	79.6	Confident	79.4	Confident	92 Å²	92	60.3 Å²	60.3	64%	0.643	31%	0.309	S	S	*	.	H	α-helix	trans	-82.6	-36.5	-176.3	56.6	0	0	0	0	114.1	E710 K711	E710-S714 VanDerWaalsContact O-CB 3.28Å; E710-S714 WeakPolarHBondContact O-CB 3.48Å; E710-S714 PolarHBondContact O-N 2.79Å; E710-S714 PolarHBondContact O-OG 3.09Å; K711-S714 WeakPolarHBondContact CA-OG 3.47Å; K711-S714 PolarHBondContact O-OG 3.34Å
715	T	73.8	Confident	79.6	Confident	62 Å²	62	62.1 Å²	62.1	38%	0.38	32%	0.324	S	S	.	.	H	α-helix	trans	-120.2	-21.8	-167.2	-35.8	0	0	0	0	113.9	K711	K711-T715 WeakPolarHBondContact O-CB 3.13Å; K711-T715 PolarHBondContact O-N 3.4Å; K711-T715 PolarHBondContact O-OG1 3.48Å
716	M	71	Confident	79.6	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	30%	0.3	C	S	.	.			trans	-119.3	12.4	-166.3	-51.1	-72.9	143.1	0	0	113.9	A678 I679 V712 P718 F744 L745 L748	A678-M716 WeakPolarHBondContact O-CE 3.37Å; I679-M716 VanDerWaalsContact CA-SD 3.56Å; I679-M716 HydrophobicContact CB-CE 4.45Å; I679-M716 HydrophobicContact CB-SD 3.87Å; I679-M716 HydrophobicContact CG1-CE 4.34Å; I679-M716 HydrophobicContact CG1-SD 3.68Å; I679-M716 HydrophobicContact CG2-SD 3.8Å; V712-M716 HydrophobicContact CG1-CB 4.29Å; V712-M716 CarbonylContact O-C 3.56Å; V712-M716 WeakPolarHBondContact O-CA 3.21Å; V712-M716 WeakPolarHBondContact O-CB 3.38Å; V712-M716 PolarHBondContact O-N 3.49Å; M716-P718 VanDerWaalsContact O-CD 3.29Å; M716-P718 WeakPolarHBondContact O-CD 2.75Å; M716-F744 HydrophobicContact CB-CE1 4.19Å; M716-F744 HydrophobicContact CG-CE1 4.36Å; M716-F744 HydrophobicContact SD-CE1 4.38Å; M716-L745 WeakPolarHBondContact O-CD2 3.31Å; M716-L748 HydrophobicContact CB-CD1 4.46Å
717	L	77.4	Confident	79.5	Confident	49 Å²	49	58 Å²	58	26%	0.257	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-75.6	117.2	-176	-134.7	151.9	0	0	0	109.9	R675 V712 L713 T719 H755	R675-L717 PolarHBondContact NH2-O 2.83Å; V712-L717 PolarHBondContact O-N 2.79Å; L713-L717 HydrophobicContact CD1-CD1 3.73Å; L713-L717 HydrophobicContact CG-CD1 4.39Å; L713-L717 WeakPolarHBondContact O-CD1 3.35Å; L717-T719 PolarHBondContact O-N 2.94Å; L717-H755 HydrophobicContact CD1-CB 4.45Å; L717-H755 HydrophobicContact CD2-CB 4.41Å
718	P	74.6	Confident	79.4	Confident	20 Å²	20	55.4 Å²	55.4	13%	0.13	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-64.5	131	-178.4	-17.2	29.3	0	0	0	110.8	M716 L745 L748	M716-P718 VanDerWaalsContact O-CD 3.29Å; M716-P718 WeakPolarHBondContact O-CD 2.75Å; P718-L745 HydrophobicContact CB-CD2 4.29Å; P718-L745 HydrophobicContact CG-CD2 3.97Å; P718-L748 HydrophobicContact CG-CB 3.88Å
719	T	78.2	Confident	79.2	Confident	53 Å²	53	54.8 Å²	54.8	33%	0.325	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-80.4	157.1	168.4	66.7	0	0	0	0	110.2	L717 E721 E722 R723	L717-T719 PolarHBondContact O-N 2.94Å; T719-E721 VanDerWaalsContact C-N 3.28Å; T719-E721 PolarHBondContact O-N 3.39Å; T719-E722 PolarHBondContact N-OE2 3.39Å; T719-E722 PolarHBondContact O-N 2.92Å; T719-E722 WeakPolarHBondContact OG1-CB 3.33Å; T719-E722 VanDerWaalsContact OG1-CD 3.23Å; T719-E722 WeakPolarHBondContact OG1-CG 3.04Å; T719-E722 PolarHBondContact OG1-N 3.29Å; T719-E722 PolarHBondContact OG1-OE2 3.5Å; T719-R723 PolarHBondContact O-N 3.29Å
720	M	72.8	Confident	79	Confident	132 Å²	132	58.7 Å²	58.7	65%	0.65	31%	0.313	S	S	*	.	H	α-helix	trans	-60.9	-41.9	176.5	-70	-65.4	148.2	0	0	111.2	E722 R723 E724	M720-E722 VanDerWaalsContact C-N 3.34Å; M720-E722 PolarHBondContact O-N 2.75Å; M720-R723 PolarHBondContact O-N 2.73Å; M720-E724 WeakPolarHBondContact O-CG 3.37Å; M720-E724 PolarHBondContact O-N 3.17Å
721	E	75.8	Confident	78.8	Confident	156 Å²	156	58.9 Å²	58.9	73%	0.729	33%	0.327	S	S	*	.	H	α-helix	trans	-58.7	-43.4	176.3	-63.3	174.1	-177.3	0	0	112	T719 E724 A725	T719-E721 VanDerWaalsContact C-N 3.28Å; T719-E721 PolarHBondContact O-N 3.39Å; E721-E724 PolarHBondContact O-N 2.82Å; E721-A725 VanDerWaalsContact O-CB 3.28Å; E721-A725 WeakPolarHBondContact O-CB 3.23Å; E721-A725 PolarHBondContact O-N 2.72Å
722	E	80.4	Confident	78.6	Confident	26 Å²	26	63.3 Å²	63.3	12%	0.121	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-40.7	178.9	-77.7	168	176.3	0	0	112.5	R675 T719 M720 E724 A725 I726	R675-E722 WeakPolarHBondContact CD-OE1 3.26Å; R675-E722 IonicContact CZ-OE1 3.88Å; R675-E722 IonicContact CZ-OE2 3.52Å; R675-E722 IonicContact NE-OE1 3.7Å; R675-E722 PolarHBondContact NE-OE1 3.33Å; R675-E722 IonicContact NE-OE2 2.72Å; R675-E722 PolarHBondContact NE-OE2 3.44Å; R675-E722 IonicContact NH1-OE1 3.02Å; R675-E722 PolarHBondContact NH1-OE1 3.44Å; R675-E722 IonicContact NH1-OE2 3.41Å; R675-E722 VanDerWaalsContact NH2-CD 3.29Å; R675-E722 IonicContact NH2-OE1 3.79Å; R675-E722 PolarHBondContact NH2-OE1 2.9Å; R675-E722 IonicContact NH2-OE2 2.78Å; R675-E722 PolarHBondContact NH2-OE2 3.47Å; T719-E722 PolarHBondContact N-OE2 3.39Å; T719-E722 PolarHBondContact O-N 2.92Å; T719-E722 WeakPolarHBondContact OG1-CB 3.33Å; T719-E722 VanDerWaalsContact OG1-CD 3.23Å; T719-E722 WeakPolarHBondContact OG1-CG 3.04Å; T719-E722 PolarHBondContact OG1-N 3.29Å; T719-E722 PolarHBondContact OG1-OE2 3.5Å; M720-E722 VanDerWaalsContact C-N 3.34Å; M720-E722 PolarHBondContact O-N 2.75Å; E722-E724 VanDerWaalsContact C-N 3.34Å; E722-A725 PolarHBondContact O-N 3.26Å; E722-I726 WeakPolarHBondContact O-CB 3.46Å; E722-I726 WeakPolarHBondContact O-CD1 3.35Å; E722-I726 WeakPolarHBondContact O-CG1 3.4Å; E722-I726 PolarHBondContact O-N 2.82Å
723	R	78.1	Confident	78.2	Confident	90 Å²	90	67.3 Å²	67.3	34%	0.34	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-47.7	176	-173.9	-165.8	174	169.9	-0.6	110.4	T719 M720 I726 M727	T719-R723 PolarHBondContact O-N 3.29Å; M720-R723 PolarHBondContact O-N 2.73Å; R723-I726 PolarHBondContact O-N 2.81Å; R723-M727 HydrophobicContact CG-CE 3.86Å; R723-M727 HydrophobicContact CG-SD 4.28Å; R723-M727 WeakPolarHBondContact O-CB 3.41Å; R723-M727 VanDerWaalsContact O-CG 3.27Å; R723-M727 WeakPolarHBondContact O-CG 3.4Å; R723-M727 PolarHBondContact O-N 3.03Å
724	E	82.5	Confident	77.7	Confident	126 Å²	126	70.6 Å²	70.6	59%	0.589	39%	0.391	S	S	*	.	H	α-helix	trans	-62.5	-44.6	178	-73.1	175.4	-172.4	0	0	111.7	M720 E721 E722 M727 A728	M720-E724 WeakPolarHBondContact O-CG 3.37Å; M720-E724 PolarHBondContact O-N 3.17Å; E721-E724 PolarHBondContact O-N 2.82Å; E722-E724 VanDerWaalsContact C-N 3.34Å; E724-M727 HydrophobicContact CG-CE 4.48Å; E724-M727 PolarHBondContact O-N 3.34Å; E724-A728 VanDerWaalsContact O-CB 3.3Å; E724-A728 WeakPolarHBondContact O-CB 2.8Å; E724-A728 PolarHBondContact O-N 3.32Å
725	A	80.8	Confident	77.5	Confident	39 Å²	39	73.6 Å²	73.6	32%	0.322	40%	0.399	S	S	.	.	H	α-helix	trans	-64.9	-41.5	179.2	0	0	0	0	0	112.3	V670 E721 E722 A729	V670-A725 HydrophobicContact CG1-CB 3.54Å; E721-A725 VanDerWaalsContact O-CB 3.28Å; E721-A725 WeakPolarHBondContact O-CB 3.23Å; E721-A725 PolarHBondContact O-N 2.72Å; E722-A725 PolarHBondContact O-N 3.26Å; A725-A729 WeakPolarHBondContact O-CB 3.48Å; A725-A729 PolarHBondContact O-N 3.26Å
726	I	81	Confident	77.5	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	39%	0.393	C	S	.	.	H	α-helix	trans	-62.5	-45.9	174.4	-70.9	162.9	0	0	0	110.7	L671 E722 R723 A729 Q730 L738 E742 L745 L746	L671-I726 HydrophobicContact CD1-CD1 3.86Å; L671-I726 HydrophobicContact CD1-CG1 4.07Å; E722-I726 WeakPolarHBondContact O-CB 3.46Å; E722-I726 WeakPolarHBondContact O-CD1 3.35Å; E722-I726 WeakPolarHBondContact O-CG1 3.4Å; E722-I726 PolarHBondContact O-N 2.82Å; R723-I726 PolarHBondContact O-N 2.81Å; I726-A729 PolarHBondContact O-N 3.46Å; I726-Q730 WeakPolarHBondContact O-CB 3.39Å; I726-Q730 PolarHBondContact O-N 2.84Å; I726-L738 HydrophobicContact CG2-CD1 4.39Å; I726-L738 HydrophobicContact CG2-CD2 3.78Å; I726-E742 HydrophobicContact CD1-CB 4.37Å; I726-E742 HydrophobicContact CG1-CB 4.27Å; I726-E742 HydrophobicContact CG1-CG 4.23Å; I726-L745 HydrophobicContact CD1-CB 3.92Å; I726-L745 HydrophobicContact CD1-CD1 4.21Å; I726-L746 HydrophobicContact CG2-CB 4.21Å; I726-L746 HydrophobicContact CG2-CD1 4.32Å; I726-L746 HydrophobicContact CG2-CD2 4.43Å
727	M	80	Confident	77.8	Confident	76 Å²	76	76.9 Å²	76.9	37%	0.374	42%	0.418	S	S	.	.	H	α-helix	trans	-66.5	-40.3	179.7	-72.3	-175	-53.7	0	0	112.1	R723 E724 Q730 A731 L746	R723-M727 HydrophobicContact CG-CE 3.86Å; R723-M727 HydrophobicContact CG-SD 4.28Å; R723-M727 WeakPolarHBondContact O-CB 3.41Å; R723-M727 VanDerWaalsContact O-CG 3.27Å; R723-M727 WeakPolarHBondContact O-CG 3.4Å; R723-M727 PolarHBondContact O-N 3.03Å; E724-M727 HydrophobicContact CG-CE 4.48Å; E724-M727 PolarHBondContact O-N 3.34Å; M727-Q730 PolarHBondContact O-N 3.4Å; M727-A731 WeakPolarHBondContact O-CB 3.45Å; M727-A731 PolarHBondContact O-N 2.86Å; M727-L746 HydrophobicContact CG-CD1 3.97Å
728	A	82.6	Confident	77.8	Confident	58 Å²	58	75.6 Å²	75.6	48%	0.479	41%	0.412	S	S	.	.	H	α-helix	trans	-62.9	-46.3	176.7	0	0	0	0	0	111.2	E724 Q730 A731 E732	E724-A728 VanDerWaalsContact O-CB 3.3Å; E724-A728 WeakPolarHBondContact O-CB 2.8Å; E724-A728 PolarHBondContact O-N 3.32Å; A728-Q730 VanDerWaalsContact C-N 3.33Å; A728-Q730 PolarHBondContact O-N 3.48Å; A728-A731 PolarHBondContact O-N 3.45Å; A728-E732 WeakPolarHBondContact O-CB 3.47Å; A728-E732 PolarHBondContact O-N 2.94Å
729	A	77.5	Confident	78.2	Confident	13 Å²	13	74.7 Å²	74.7	11%	0.107	41%	0.406	C	S	.	.	H	α-helix	trans	-65.6	-36.3	178.4	0	0	0	0	0	112.4	I668 V670 A725 I726 H733	I668-A729 HydrophobicContact CG2-CB 3.62Å; V670-A729 HydrophobicContact CG2-CB 3.35Å; A725-A729 WeakPolarHBondContact O-CB 3.48Å; A725-A729 PolarHBondContact O-N 3.26Å; I726-A729 PolarHBondContact O-N 3.46Å; A729-H733 PolarHBondContact O-N 2.83Å; A729-H733 VanDerWaalsContact O-N 3.12Å
730	Q	79.3	Confident	78.4	Confident	82 Å²	82	75.4 Å²	75.4	38%	0.383	41%	0.411	S	S	.	.	H	α-helix	trans	-67.4	-35.4	173.8	-170.3	178	8.5	0	0	112.4	I726 M727 A728 H733 P734 L738 L746	I726-Q730 WeakPolarHBondContact O-CB 3.39Å; I726-Q730 PolarHBondContact O-N 2.84Å; M727-Q730 PolarHBondContact O-N 3.4Å; A728-Q730 VanDerWaalsContact C-N 3.33Å; A728-Q730 PolarHBondContact O-N 3.48Å; Q730-H733 CarbonylContact O-C 3.4Å; Q730-P734 WeakPolarHBondContact O-CA 3.31Å; Q730-L738 HydrophobicContact CB-CD1 4.19Å; Q730-L738 HydrophobicContact CG-CD1 4.01Å; Q730-L746 VanDerWaalsContact OE1-CD2 3.29Å
731	A	79.9	Confident	78.8	Confident	79 Å²	79	69.1 Å²	69.1	65%	0.653	38%	0.38	S	S	*	.	H	α-helix	trans	-73.5	-34.5	176.8	0	0	0	0	0	112.8	M727 A728 H733	M727-A731 WeakPolarHBondContact O-CB 3.45Å; M727-A731 PolarHBondContact O-N 2.86Å; A728-A731 PolarHBondContact O-N 3.45Å; A731-H733 VanDerWaalsContact C-N 3.34Å
732	E	78.2	Confident	79.3	Confident	145 Å²	145	61.7 Å²	61.7	68%	0.678	35%	0.346	S	S	*	.	H	α-helix	trans	-71.6	-31.2	176.8	-168.9	170.2	-169	0	0	112	A728	A728-E732 WeakPolarHBondContact O-CB 3.47Å; A728-E732 PolarHBondContact O-N 2.94Å
733	H	75.1	Confident	79.4	Confident	85 Å²	85	66.5 Å²	66.5	39%	0.394	37%	0.368	S	S	.	.			trans	-132	70.6	-178.5	-61.4	-43.4	0	0	0	112.4	I668 A729 Q730 A731 D735 I736	I668-H733 HydrophobicContact CD1-CB 3.77Å; A729-H733 PolarHBondContact O-N 2.83Å; A729-H733 VanDerWaalsContact O-N 3.12Å; Q730-H733 CarbonylContact O-C 3.4Å; A731-H733 VanDerWaalsContact C-N 3.34Å; H733-D735 PolarHBondContact O-N 2.88Å; H733-D735 VanDerWaalsContact O-N 3.15Å; H733-I736 HydrophobicContact CB-CB 4.21Å; H733-I736 HydrophobicContact CB-CD1 3.91Å; H733-I736 HydrophobicContact CB-CG1 4.14Å; H733-I736 PolarHBondContact O-N 3.34Å
734	P	72.5	Confident	79.7	Confident	98 Å²	98	62.4 Å²	62.4	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-23.7	-176.8	24.7	-33.9	0	0	0	113.8	Q730	Q730-P734 WeakPolarHBondContact O-CA 3.31Å
735	D	75.2	Confident	79.9	Confident	154 Å²	154	56.6 Å²	56.6	82%	0.824	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-7.4	-177.2	-54.3	-35.6	0	0	0	113.6	H733	H733-D735 PolarHBondContact O-N 2.88Å; H733-D735 VanDerWaalsContact O-N 3.15Å
736	I	74.7	Confident	80	Confident	48 Å²	48	55.8 Å²	55.8	25%	0.246	32%	0.316	C	S	.	.	S	Bend	trans	-110.5	124.6	-173.3	-53.3	179.2	0	0	0	109.8	V666 I668 H733	V666-I736 HydrophobicContact CB-CG2 4.21Å; V666-I736 HydrophobicContact CG1-CD1 3.88Å; V666-I736 HydrophobicContact CG1-CG1 4.49Å; V666-I736 HydrophobicContact CG1-CG2 3.82Å; V666-I736 WeakPolarHBondContact O-CG2 3.29Å; I668-I736 HydrophobicContact CD1-CB 4.02Å; I668-I736 HydrophobicContact CD1-CG2 4.31Å; I668-I736 WeakPolarHBondContact CD1-O 3.48Å; I668-I736 HydrophobicContact CG1-CB 3.83Å; I668-I736 HydrophobicContact CG1-CG2 3.57Å; H733-I736 HydrophobicContact CB-CB 4.21Å; H733-I736 HydrophobicContact CB-CD1 3.91Å; H733-I736 HydrophobicContact CB-CG1 4.14Å; H733-I736 PolarHBondContact O-N 3.34Å
737	P	76.3	Confident	80.1	Confident	84 Å²	84	57.1 Å²	57.1	55%	0.545	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-69.2	144.5	178.7	28.1	-33.4	0	0	0	112.2	E667 I668	E667-P737 VanDerWaalsContact CA-O 3.32Å; E667-P737 WeakPolarHBondContact CA-O 3.3Å; I668-P737 PolarHBondContact N-O 3.39Å
738	L	78.5	Confident	80.4	Confident	23 Å²	23	53.5 Å²	53.5	12%	0.12	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-69.9	149	172.7	-73.1	147.6	0	0	0	111.3	I668 I726 Q730 E742 Q743 L746	I668-L738 HydrophobicContact CB-CD2 4.35Å; I668-L738 HydrophobicContact CG2-CD2 4.46Å; I726-L738 HydrophobicContact CG2-CD1 4.39Å; I726-L738 HydrophobicContact CG2-CD2 3.78Å; Q730-L738 HydrophobicContact CB-CD1 4.19Å; Q730-L738 HydrophobicContact CG-CD1 4.01Å; L738-E742 HydrophobicContact CB-CB 4.17Å; L738-E742 HydrophobicContact CD2-CB 3.91Å; L738-E742 HydrophobicContact CD2-CG 4.47Å; L738-Q743 HydrophobicContact CB-CB 4.5Å; L738-L746 HydrophobicContact CD1-CD2 4.08Å
739	G	82.3	Confident	80.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-59.4	158	170.6	0	0	0	0	0	112.8	I668 A741 E742 Q743	I668-G739 PolarHBondContact O-N 2.88Å; G739-A741 VanDerWaalsContact C-N 3.28Å; G739-A741 PolarHBondContact O-N 3.14Å; G739-E742 WeakPolarHBondContact CA-OE2 3.48Å; G739-E742 PolarHBondContact O-N 3.41Å; G739-Q743 WeakPolarHBondContact O-CB 3.47Å; G739-Q743 PolarHBondContact O-N 2.94Å
740	P	82	Confident	80.8	Confident	68 Å²	68	56 Å²	56	44%	0.442	31%	0.306	S	S	.	.	H	α-helix	trans	-57.3	-37.1	-177.5	-26.2	33.8	0	0	0	114.4	F744	P740-F744 WeakPolarHBondContact O-CB 3.37Å; P740-F744 PolarHBondContact O-N 3.43Å
741	A	83.1	Confident	81.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-70.3	-46.2	179.1	0	0	0	0	0	111.4	I679 G739 F744 L745	I679-A741 HydrophobicContact CB-CB 3.94Å; I679-A741 HydrophobicContact CD1-CB 4.4Å; I679-A741 HydrophobicContact CG2-CB 3.68Å; G739-A741 VanDerWaalsContact C-N 3.28Å; G739-A741 PolarHBondContact O-N 3.14Å; A741-F744 PolarHBondContact O-N 3.26Å; A741-L745 WeakPolarHBondContact O-CG 3.3Å; A741-L745 PolarHBondContact O-N 2.85Å
742	E	84.7	Confident	81.3	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-45.1	175.9	-69.8	68.8	-165.8	0	0	111.2	V670 L671 I726 L738 G739 F744 L745 L746	V670-E742 PolarHBondContact N-OE1 3.32Å; L671-E742 HydrophobicContact CD1-CG 3.63Å; L671-E742 PolarHBondContact N-OE1 3.37Å; I726-E742 HydrophobicContact CD1-CB 4.37Å; I726-E742 HydrophobicContact CG1-CB 4.27Å; I726-E742 HydrophobicContact CG1-CG 4.23Å; L738-E742 HydrophobicContact CB-CB 4.17Å; L738-E742 HydrophobicContact CD2-CB 3.91Å; L738-E742 HydrophobicContact CD2-CG 4.47Å; G739-E742 WeakPolarHBondContact CA-OE2 3.48Å; G739-E742 PolarHBondContact O-N 3.41Å; E742-F744 VanDerWaalsContact C-N 3.31Å; E742-F744 PolarHBondContact O-N 2.92Å; E742-L745 PolarHBondContact O-N 3.37Å; E742-L746 WeakPolarHBondContact O-CB 3.18Å; E742-L746 PolarHBondContact O-N 2.87Å
743	Q	83.7	Confident	81.8	Confident	127 Å²	127	48.1 Å²	48.1	59%	0.593	26%	0.26	S	S	*	.	H	α-helix	trans	-61.2	-40.4	176.5	-173	-179.8	41.7	0	0	111.6	L738 G739 M747	L738-Q743 HydrophobicContact CB-CB 4.5Å; G739-Q743 WeakPolarHBondContact O-CB 3.47Å; G739-Q743 PolarHBondContact O-N 2.94Å; Q743-M747 WeakPolarHBondContact O-CB 3.25Å; Q743-M747 PolarHBondContact O-N 3.42Å
744	F	84.5	Confident	82.4	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-66.8	-45.6	177.2	-179.9	-117.3	0	0	0	112.4	I679 L683 L686 P689 I692 M716 P740 A741 E742 L746 M747 L748	I679-F744 HydrophobicContact CG2-CD1 4.08Å; L683-F744 HydrophobicContact CD1-CB 4.23Å; L683-F744 HydrophobicContact CD1-CG 4.39Å; L683-F744 HydrophobicContact CD2-CB 4.31Å; L683-F744 HydrophobicContact CD2-CD1 3.8Å; L683-F744 HydrophobicContact CD2-CD2 3.75Å; L683-F744 HydrophobicContact CD2-CE1 3.95Å; L683-F744 HydrophobicContact CD2-CE2 3.94Å; L683-F744 HydrophobicContact CD2-CG 3.68Å; L683-F744 HydrophobicContact CD2-CZ 4.02Å; L683-F744 HydrophobicContact CG-CD1 4.33Å; L683-F744 HydrophobicContact CG-CG 4.45Å; L686-F744 HydrophobicContact CD1-CZ 4.22Å; P689-F744 HydrophobicContact CB-CD2 4.15Å; I692-F744 HydrophobicContact CD1-CE2 3.83Å; I692-F744 HydrophobicContact CD1-CZ 4.15Å; M716-F744 HydrophobicContact CB-CE1 4.19Å; M716-F744 HydrophobicContact CG-CE1 4.36Å; M716-F744 HydrophobicContact SD-CE1 4.38Å; P740-F744 WeakPolarHBondContact O-CB 3.37Å; P740-F744 PolarHBondContact O-N 3.43Å; A741-F744 PolarHBondContact O-N 3.26Å; E742-F744 VanDerWaalsContact C-N 3.31Å; E742-F744 PolarHBondContact O-N 2.92Å; F744-L746 VanDerWaalsContact C-N 3.34Å; F744-L746 PolarHBondContact O-N 3.49Å; F744-M747 HydrophobicContact CD2-CE 3.76Å; F744-M747 HydrophobicContact CE2-CE 4.23Å; F744-M747 PolarHBondContact O-N 2.82Å; F744-L748 HydrophobicContact CD1-CD1 4.14Å; F744-L748 HydrophobicContact CE1-CD1 3.54Å; F744-L748 HydrophobicContact CE1-CG 4.24Å; F744-L748 HydrophobicContact CE2-CD1 4.27Å; F744-L748 HydrophobicContact CE2-CD2 4.32Å; F744-L748 HydrophobicContact CE2-CG 4.12Å; F744-L748 HydrophobicContact CZ-CD1 3.62Å; F744-L748 HydrophobicContact CZ-CD2 4.24Å; F744-L748 HydrophobicContact CZ-CG 3.98Å; F744-L748 PolarHBondContact O-N 2.75Å
745	L	85.6	Confident	83.3	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-62.9	-40.4	177	-71.7	-179.9	0	0	0	112.1	L671 I679 M716 P718 I726 A741 E742 M747 L748 S749	L671-L745 HydrophobicContact CD1-CD1 3.89Å; L671-L745 HydrophobicContact CD2-CD1 3.43Å; L671-L745 VanDerWaalsContact CD2-CD1 3.43Å; L671-L745 HydrophobicContact CG-CD1 4.31Å; I679-L745 HydrophobicContact CD1-CD1 3.63Å; I679-L745 HydrophobicContact CD1-CD2 4.11Å; I679-L745 HydrophobicContact CD1-CG 3.96Å; M716-L745 WeakPolarHBondContact O-CD2 3.31Å; P718-L745 HydrophobicContact CB-CD2 4.29Å; P718-L745 HydrophobicContact CG-CD2 3.97Å; I726-L745 HydrophobicContact CD1-CB 3.92Å; I726-L745 HydrophobicContact CD1-CD1 4.21Å; A741-L745 WeakPolarHBondContact O-CG 3.3Å; A741-L745 PolarHBondContact O-N 2.85Å; E742-L745 PolarHBondContact O-N 3.37Å; L745-M747 VanDerWaalsContact C-N 3.35Å; L745-L748 PolarHBondContact O-N 3.27Å; L745-S749 WeakPolarHBondContact O-CB 3.48Å; L745-S749 PolarHBondContact O-N 2.97Å
746	L	82.6	Confident	84	Confident	23 Å²	23	36.2 Å²	36.2	12%	0.12	19%	0.192	C	C	.	.	H	α-helix	trans	-60.4	-47.2	175.3	-174.3	63.1	0	0	0	110.6	I726 M727 Q730 L738 E742 F744 L748 S749 E750	I726-L746 HydrophobicContact CG2-CB 4.21Å; I726-L746 HydrophobicContact CG2-CD1 4.32Å; I726-L746 HydrophobicContact CG2-CD2 4.43Å; M727-L746 HydrophobicContact CG-CD1 3.97Å; Q730-L746 VanDerWaalsContact OE1-CD2 3.29Å; L738-L746 HydrophobicContact CD1-CD2 4.08Å; E742-L746 WeakPolarHBondContact O-CB 3.18Å; E742-L746 PolarHBondContact O-N 2.87Å; F744-L746 VanDerWaalsContact C-N 3.34Å; F744-L746 PolarHBondContact O-N 3.49Å; L746-L748 VanDerWaalsContact C-N 3.33Å; L746-L748 PolarHBondContact O-N 3.45Å; L746-S749 WeakPolarHBondContact O-CB 3.06Å; L746-S749 PolarHBondContact O-N 2.88Å; L746-S749 PolarHBondContact O-OG 3.29Å; L746-E750 WeakPolarHBondContact O-CG 3.4Å; L746-E750 PolarHBondContact O-N 2.85Å; L746-E750 VanDerWaalsContact O-N 3.13Å
747	M	84.7	Confident	84.9	Confident	29 Å²	29	34 Å²	34	14%	0.143	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-37.5	178	-177.7	-115	-68.2	0	0	113.1	P689 K693 Q743 F744 L745	P689-M747 HydrophobicContact CB-CE 3.25Å; P689-M747 WeakPolarHBondContact O-CE 3.35Å; P689-M747 VanDerWaalsContact O-SD 3.38Å; K693-M747 HydrophobicContact CB-CG 4.41Å; K693-M747 HydrophobicContact CB-SD 3.74Å; K693-M747 HydrophobicContact CD-CG 4.08Å; K693-M747 HydrophobicContact CD-SD 4.49Å; Q743-M747 WeakPolarHBondContact O-CB 3.25Å; Q743-M747 PolarHBondContact O-N 3.42Å; F744-M747 HydrophobicContact CD2-CE 3.76Å; F744-M747 HydrophobicContact CE2-CE 4.23Å; F744-M747 PolarHBondContact O-N 2.82Å; L745-M747 VanDerWaalsContact C-N 3.35Å
748	L	85.9	Confident	85.6	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68.1	-38.7	171.6	-74.2	-175.1	0	0	0	112.1	I692 I696 V712 M716 P718 F744 L745 L746 E750 I751 L754	I692-L748 HydrophobicContact CG2-CD2 4.49Å; I696-L748 HydrophobicContact CD1-CD2 4.02Å; V712-L748 HydrophobicContact CG1-CD1 4.31Å; M716-L748 HydrophobicContact CB-CD1 4.46Å; P718-L748 HydrophobicContact CG-CB 3.88Å; F744-L748 HydrophobicContact CD1-CD1 4.14Å; F744-L748 HydrophobicContact CE1-CD1 3.54Å; F744-L748 HydrophobicContact CE1-CG 4.24Å; F744-L748 HydrophobicContact CE2-CD1 4.27Å; F744-L748 HydrophobicContact CE2-CD2 4.32Å; F744-L748 HydrophobicContact CE2-CG 4.12Å; F744-L748 HydrophobicContact CZ-CD1 3.62Å; F744-L748 HydrophobicContact CZ-CD2 4.24Å; F744-L748 HydrophobicContact CZ-CG 3.98Å; F744-L748 PolarHBondContact O-N 2.75Å; L745-L748 PolarHBondContact O-N 3.27Å; L746-L748 VanDerWaalsContact C-N 3.33Å; L746-L748 PolarHBondContact O-N 3.45Å; L748-E750 PolarHBondContact O-N 3.28Å; L748-I751 HydrophobicContact CD2-CD1 4.2Å; L748-I751 WeakPolarHBondContact O-CB 3.49Å; L748-I751 PolarHBondContact O-N 3.45Å; L748-I751 VanDerWaalsContact O-N 3.07Å; L748-L754 HydrophobicContact CB-CD2 3.82Å; L748-L754 HydrophobicContact CD1-CD2 4.5Å; L748-L754 HydrophobicContact CD2-CD2 4.35Å; L748-L754 HydrophobicContact CG-CD2 4.46Å
749	S	82.8	Confident	86.3	Confident	17 Å²	17	34.1 Å²	34.1	12%	0.119	17%	0.169	C	C	.	.	H	α-helix	trans	-67.6	-21.6	-179	81.2	0	0	0	0	114.1	L745 L746 I751	L745-S749 WeakPolarHBondContact O-CB 3.48Å; L745-S749 PolarHBondContact O-N 2.97Å; L746-S749 WeakPolarHBondContact O-CB 3.06Å; L746-S749 PolarHBondContact O-N 2.88Å; L746-S749 PolarHBondContact O-OG 3.29Å; S749-I751 PolarHBondContact O-N 3.36Å
750	E	85.6	Confident	86.7	Confident	107 Å²	107	34.1 Å²	34.1	50%	0.5	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.4	172.7	-70.3	172.8	-178.3	0	0	112.8	K693 L746 L748 P752	K693-E750 IonicContact NZ-OE2 3.47Å; K693-E750 PolarHBondContact NZ-OE2 3.26Å; L746-E750 WeakPolarHBondContact O-CG 3.4Å; L746-E750 PolarHBondContact O-N 2.85Å; L746-E750 VanDerWaalsContact O-N 3.13Å; L748-E750 PolarHBondContact O-N 3.28Å; E750-P752 WeakPolarHBondContact O-CD 3.32Å
751	I	85.5	Confident	87.2	Confident	6 Å²	6	31 Å²	31	3%	0.031	15%	0.148	C	C	.	.	S	Bend	trans	-82.4	114.3	179.5	-55.2	171.9	0	0	0	108.9	K693 I696 V697 L748 S749 Q753 L754	K693-I751 HydrophobicContact CB-CD1 4.31Å; K693-I751 HydrophobicContact CG-CD1 3.89Å; K693-I751 HydrophobicContact CG-CG1 3.91Å; I696-I751 HydrophobicContact CB-CD1 4.26Å; I696-I751 HydrophobicContact CD1-CD1 4.09Å; I696-I751 HydrophobicContact CG2-CD1 4.2Å; I696-I751 HydrophobicContact CG2-CG2 4.21Å; V697-I751 HydrophobicContact CG2-CG2 4.36Å; L748-I751 HydrophobicContact CD2-CD1 4.2Å; L748-I751 WeakPolarHBondContact O-CB 3.49Å; L748-I751 PolarHBondContact O-N 3.45Å; L748-I751 VanDerWaalsContact O-N 3.07Å; S749-I751 PolarHBondContact O-N 3.36Å; I751-Q753 PolarHBondContact O-N 3.46Å; I751-L754 HydrophobicContact CB-CB 4.4Å; I751-L754 HydrophobicContact CB-CD1 4.31Å; I751-L754 HydrophobicContact CD1-CD1 4.06Å; I751-L754 HydrophobicContact CG2-CD1 4.26Å; I751-L754 PolarHBondContact O-N 3.39Å
752	P	84.4	Confident	87.7	Confident	53 Å²	53	32.2 Å²	32.2	34%	0.344	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	134.8	179.3	27.4	-33.7	0	0	0	110.3	E750 L754 R757 H896	E750-P752 WeakPolarHBondContact O-CD 3.32Å; P752-L754 VanDerWaalsContact C-N 3.28Å; P752-L754 PolarHBondContact O-N 2.9Å; P752-R757 PolarHBondContact O-NE 2.88Å; P752-H896 HydrophobicContact CB-CB 4.26Å; P752-H896 HydrophobicContact CG-CB 4.04Å
753	Q	87.8	Confident	88.1	Confident	80 Å²	80	32.7 Å²	32.7	37%	0.374	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	38.7	179.1	-55.8	-63.5	-7.4	0	0	113.8	I751 H755 A756 R757 Q892 I893	I751-Q753 PolarHBondContact O-N 3.46Å; Q753-H755 VanDerWaalsContact C-N 3.29Å; Q753-H755 PolarHBondContact O-N 2.88Å; Q753-A756 HydrophobicContact CB-CB 4.18Å; Q753-A756 PolarHBondContact O-N 3.39Å; Q753-R757 PolarHBondContact O-N 3.1Å; Q753-Q892 HydrophobicContact CG-CB 4.28Å; Q753-I893 HydrophobicContact CB-CG1 4.47Å
754	L	88.5	Confident	88.4	Confident	13 Å²	13	26.9 Å²	26.9	7%	0.068	13%	0.13	C	C	.	.	H	α-helix	trans	-46.8	-48.4	-179.7	177.2	62.2	0	0	0	113.4	I696 L748 I751 P752 A756 R757 L758	I696-L754 HydrophobicContact CD1-CD1 4.01Å; I696-L754 HydrophobicContact CG2-CD1 3.9Å; L748-L754 HydrophobicContact CB-CD2 3.82Å; L748-L754 HydrophobicContact CD1-CD2 4.5Å; L748-L754 HydrophobicContact CD2-CD2 4.35Å; L748-L754 HydrophobicContact CG-CD2 4.46Å; I751-L754 HydrophobicContact CB-CB 4.4Å; I751-L754 HydrophobicContact CB-CD1 4.31Å; I751-L754 HydrophobicContact CD1-CD1 4.06Å; I751-L754 HydrophobicContact CG2-CD1 4.26Å; I751-L754 PolarHBondContact O-N 3.39Å; P752-L754 VanDerWaalsContact C-N 3.28Å; P752-L754 PolarHBondContact O-N 2.9Å; L754-A756 PolarHBondContact O-N 2.93Å; L754-R757 PolarHBondContact O-N 3.31Å; L754-L758 HydrophobicContact CD1-CD1 3.77Å; L754-L758 HydrophobicContact CD1-CD2 4.46Å; L754-L758 HydrophobicContact CD1-CG 3.92Å; L754-L758 HydrophobicContact CG-CD1 3.89Å; L754-L758 HydrophobicContact CG-CG 4.4Å; L754-L758 WeakPolarHBondContact O-CG 3.3Å; L754-L758 PolarHBondContact O-N 3.48Å
755	H	90.5	Very high	88.7	Confident	74 Å²	74	28.4 Å²	28.4	34%	0.343	14%	0.137	S	C	.	.	H	α-helix	trans	-59	-46.6	179.5	178.5	-75.7	0	0	0	111.8	L717 Q753 R757 R759	L717-H755 HydrophobicContact CD1-CB 4.45Å; L717-H755 HydrophobicContact CD2-CB 4.41Å; Q753-H755 VanDerWaalsContact C-N 3.29Å; Q753-H755 PolarHBondContact O-N 2.88Å; H755-R757 VanDerWaalsContact C-N 3.34Å; H755-R757 PolarHBondContact O-N 3.13Å; H755-R759 WeakPolarHBondContact O-CB 3.5Å; H755-R759 VanDerWaalsContact O-CG 3.29Å; H755-R759 WeakPolarHBondContact O-CG 3.33Å; H755-R759 PolarHBondContact O-N 2.87Å; H755-R759 VanDerWaalsContact O-N 3.07Å
756	A	91.3	Very high	89	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-63	-41.2	178.8	0	0	0	0	0	111.4	Q753 L754 L760 Y889 Q892 I893	Q753-A756 HydrophobicContact CB-CB 4.18Å; Q753-A756 PolarHBondContact O-N 3.39Å; L754-A756 PolarHBondContact O-N 2.93Å; A756-L760 VanDerWaalsContact O-CB 3.25Å; A756-L760 WeakPolarHBondContact O-CB 3.31Å; A756-L760 PolarHBondContact O-N 3.23Å; A756-Y889 HydrophobicContact CB-CD1 3.74Å; A756-Y889 HydrophobicContact CB-CG 4.17Å; A756-Q892 HydrophobicContact CB-CB 4.27Å; A756-I893 HydrophobicContact CB-CD1 4.25Å; A756-I893 HydrophobicContact CB-CG1 4.1Å
757	R	91.6	Very high	89.5	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-50.3	177.5	-68.9	178	-177.8	-96.4	1.4	112.3	I696 P752 Q753 L754 H755 R759 L760 W761 I893 E897	I696-R757 HydrophobicContact CG2-CB 4.24Å; P752-R757 PolarHBondContact O-NE 2.88Å; Q753-R757 PolarHBondContact O-N 3.1Å; L754-R757 PolarHBondContact O-N 3.31Å; H755-R757 VanDerWaalsContact C-N 3.34Å; H755-R757 PolarHBondContact O-N 3.13Å; R757-R759 PolarHBondContact O-N 2.82Å; R757-L760 PolarHBondContact O-N 3.28Å; R757-W761 VanDerWaalsContact O-CB 3.27Å; R757-W761 WeakPolarHBondContact O-CB 3.25Å; R757-W761 PolarHBondContact O-N 3.44Å; R757-I893 HydrophobicContact CB-CD1 4.29Å; R757-I893 HydrophobicContact CG-CD1 3.72Å; R757-I893 HydrophobicContact CG-CG1 3.74Å; R757-I893 HydrophobicContact CG-CG2 4.4Å; R757-E897 IonicContact CZ-OE1 3.54Å; R757-E897 IonicContact NH1-OE1 3.68Å; R757-E897 PolarHBondContact NH1-OE1 3.49Å; R757-E897 IonicContact NH2-OE1 3.35Å; R757-E897 PolarHBondContact NH2-OE1 2.66Å
758	L	92.1	Very high	89.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.1	-42.4	-178.9	-68.2	172.1	0	0	0	111.6	I696 M704 I709 V712 L713 L754 W761 L762	I696-L758 HydrophobicContact CD1-CD2 4.01Å; I696-L758 HydrophobicContact CG1-CD2 4.02Å; I696-L758 HydrophobicContact CG2-CD2 4.41Å; M704-L758 HydrophobicContact CE-CD2 4.42Å; I709-L758 HydrophobicContact CG2-CB 4.26Å; I709-L758 HydrophobicContact CG2-CD2 4.1Å; V712-L758 HydrophobicContact CG1-CD1 3.71Å; L713-L758 HydrophobicContact CD1-CB 4.11Å; L713-L758 HydrophobicContact CD1-CD1 4.47Å; L754-L758 HydrophobicContact CD1-CD1 3.77Å; L754-L758 HydrophobicContact CD1-CD2 4.46Å; L754-L758 HydrophobicContact CD1-CG 3.92Å; L754-L758 HydrophobicContact CG-CD1 3.89Å; L754-L758 HydrophobicContact CG-CG 4.4Å; L754-L758 WeakPolarHBondContact O-CG 3.3Å; L754-L758 PolarHBondContact O-N 3.48Å; L758-W761 PolarHBondContact O-N 2.82Å; L758-L762 VanDerWaalsContact O-CB 3.27Å; L758-L762 WeakPolarHBondContact O-CB 3.44Å; L758-L762 PolarHBondContact O-N 2.99Å
759	R	92.4	Very high	90.1	Very high	109 Å²	109	32.5 Å²	32.5	41%	0.411	16%	0.164	S	C	.	.	H	α-helix	trans	-63.4	-47.2	176.8	-73.8	-73.9	-168.5	152.1	-6.3	112.5	L713 H755 R757 W761 L762 F763 Y889	L713-R759 HydrophobicContact CD1-CG 4.11Å; L713-R759 HydrophobicContact CD2-CG 4.48Å; H755-R759 WeakPolarHBondContact O-CB 3.5Å; H755-R759 VanDerWaalsContact O-CG 3.29Å; H755-R759 WeakPolarHBondContact O-CG 3.33Å; H755-R759 PolarHBondContact O-N 2.87Å; H755-R759 VanDerWaalsContact O-N 3.07Å; R757-R759 PolarHBondContact O-N 2.82Å; R759-W761 VanDerWaalsContact C-N 3.34Å; R759-L762 PolarHBondContact O-N 3.28Å; R759-F763 PolarHBondContact O-N 3.46Å; R759-Y889 HydrophobicContact CB-CD2 3.7Å; R759-Y889 HydrophobicContact CB-CE1 4.47Å; R759-Y889 HydrophobicContact CB-CE2 3.43Å; R759-Y889 VanDerWaalsContact CB-CE2 3.43Å; R759-Y889 HydrophobicContact CB-CG 4.36Å; R759-Y889 HydrophobicContact CG-CE2 4.03Å
760	L	92.4	Very high	90.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-45.4	177.3	176.8	58.5	0	0	0	110.8	F699 A756 R757 F763 M764 L890 I893 I905 L909	F699-L760 HydrophobicContact CE1-CD2 4.38Å; F699-L760 HydrophobicContact CE1-CG 4.3Å; F699-L760 HydrophobicContact CZ-CD2 4.19Å; A756-L760 VanDerWaalsContact O-CB 3.25Å; A756-L760 WeakPolarHBondContact O-CB 3.31Å; A756-L760 PolarHBondContact O-N 3.23Å; R757-L760 PolarHBondContact O-N 3.28Å; L760-F763 PolarHBondContact O-N 3.23Å; L760-M764 HydrophobicContact CD1-CG 4.43Å; L760-M764 HydrophobicContact CD1-SD 4.38Å; L760-M764 HydrophobicContact CG-SD 4.25Å; L760-M764 VanDerWaalsContact O-CG 3.26Å; L760-M764 WeakPolarHBondContact O-CG 3.39Å; L760-M764 PolarHBondContact O-N 3.36Å; L760-L890 HydrophobicContact CD2-CB 4.17Å; L760-L890 HydrophobicContact CD2-CD1 4.29Å; L760-I893 HydrophobicContact CB-CD1 4.34Å; L760-I893 HydrophobicContact CD2-CD1 3.5Å; L760-I905 HydrophobicContact CD1-CG2 4.18Å; L760-I905 HydrophobicContact CD2-CD1 4.43Å; L760-I905 HydrophobicContact CD2-CG2 4.09Å; L760-I905 HydrophobicContact CG-CG2 4.43Å; L760-L909 HydrophobicContact CD1-CD1 4.19Å; L760-L909 HydrophobicContact CD1-CD2 4.19Å
761	W	92.5	Very high	91	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-43.2	179.4	-167.3	9	0	0	0	112.3	A695 I696 F699 D700 M704 I709 R757 L758 R759 F763 M764 L765	A695-W761 HydrophobicContact CB-CH2 4.17Å; I696-W761 HydrophobicContact CB-CZ3 4.4Å; I696-W761 HydrophobicContact CG1-CZ3 4Å; F699-W761 HydrophobicContact CD1-CB 3.57Å; F699-W761 AromaticContact CD1-CD1 3.79Å; F699-W761 HydrophobicContact CD1-CD2 4.1Å; F699-W761 AromaticContact CD1-CG 3.54Å; F699-W761 HydrophobicContact CD1-CG 3.54Å; F699-W761 HydrophobicContact CE1-CB 3.69Å; F699-W761 HydrophobicContact CE1-CG 4.19Å; F699-W761 HydrophobicContact CG-CG 4.48Å; D700-W761 VanDerWaalsContact C-CZ2 3.42Å; D700-W761 WeakPolarHBondContact O-CH2 3.35Å; D700-W761 WeakPolarHBondContact O-CZ2 3.27Å; M704-W761 HydrophobicContact CB-CH2 3.84Å; M704-W761 HydrophobicContact CE-CE3 3.83Å; M704-W761 HydrophobicContact CE-CH2 3.49Å; M704-W761 VanDerWaalsContact CE-CH2 3.49Å; M704-W761 HydrophobicContact CE-CZ3 3.01Å; I709-W761 HydrophobicContact CD1-CD2 3.58Å; I709-W761 HydrophobicContact CD1-CE3 3.77Å; I709-W761 HydrophobicContact CD1-CG 4.01Å; I709-W761 HydrophobicContact CD1-CH2 4.31Å; I709-W761 HydrophobicContact CD1-CZ2 4.1Å; I709-W761 HydrophobicContact CD1-CZ3 4.18Å; I709-W761 HydrophobicContact CG1-CD2 4.46Å; I709-W761 HydrophobicContact CG1-CE3 4.17Å; I709-W761 HydrophobicContact CG1-CZ3 4.37Å; R757-W761 VanDerWaalsContact O-CB 3.27Å; R757-W761 WeakPolarHBondContact O-CB 3.25Å; R757-W761 PolarHBondContact O-N 3.44Å; L758-W761 PolarHBondContact O-N 2.82Å; R759-W761 VanDerWaalsContact C-N 3.34Å; W761-F763 VanDerWaalsContact C-N 3.33Å; W761-F763 PolarHBondContact O-N 2.8Å; W761-M764 PolarHBondContact O-N 3.27Å; W761-L765 HydrophobicContact CG-CD1 4.45Å; W761-L765 WeakPolarHBondContact O-CG 3.4Å; W761-L765 PolarHBondContact O-N 3.24Å
762	L	92	Very high	91.4	Very high	27 Å²	27	31.2 Å²	31.2	14%	0.141	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-45.8	176.1	-177.3	61.1	0	0	0	111.4	K706 I709 E710 L713 L758 R759 M764 L765 D766	K706-L762 HydrophobicContact CG-CD1 3.61Å; I709-L762 HydrophobicContact CG2-CB 4.03Å; I709-L762 HydrophobicContact CG2-CD1 4.42Å; E710-L762 HydrophobicContact CG-CD1 3.69Å; E710-L762 HydrophobicContact CG-CD2 3.79Å; E710-L762 HydrophobicContact CG-CG 4.41Å; L713-L762 HydrophobicContact CD2-CD2 4.45Å; L758-L762 VanDerWaalsContact O-CB 3.27Å; L758-L762 WeakPolarHBondContact O-CB 3.44Å; L758-L762 PolarHBondContact O-N 2.99Å; R759-L762 PolarHBondContact O-N 3.28Å; L762-M764 PolarHBondContact O-N 3.43Å; L762-L765 PolarHBondContact O-N 3.01Å; L762-D766 WeakPolarHBondContact O-CB 3.49Å; L762-D766 PolarHBondContact O-N 3.18Å
763	F	93.8	Very high	91.8	Very high	11 Å²	11	33.9 Å²	33.9	5%	0.048	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-45.5	175.4	174.5	-99.3	0	0	0	111.9	R759 L760 W761 L765 D766 Y767 M770 D882 C883 S886 F908 L909	R759-F763 PolarHBondContact O-N 3.46Å; L760-F763 PolarHBondContact O-N 3.23Å; W761-F763 VanDerWaalsContact C-N 3.33Å; W761-F763 PolarHBondContact O-N 2.8Å; F763-L765 VanDerWaalsContact C-N 3.32Å; F763-L765 PolarHBondContact O-N 3.27Å; F763-D766 PolarHBondContact O-N 3.29Å; F763-Y767 HydrophobicContact CE1-CD2 4.22Å; F763-Y767 AromaticContact CE2-CD2 3.99Å; F763-Y767 HydrophobicContact CE2-CD2 3.99Å; F763-Y767 AromaticContact CZ-CD2 3.54Å; F763-Y767 HydrophobicContact CZ-CD2 3.54Å; F763-Y767 HydrophobicContact CZ-CE2 4.15Å; F763-Y767 HydrophobicContact CZ-CG 4.44Å; F763-Y767 WeakPolarHBondContact O-CB 3.49Å; F763-Y767 PolarHBondContact O-N 2.84Å; F763-M770 HydrophobicContact CD2-CE 3.84Å; F763-M770 HydrophobicContact CE2-CE 3.94Å; F763-D882 HydrophobicContact CD2-CB 3.78Å; F763-D882 HydrophobicContact CE2-CB 3.96Å; F763-C883 HydrophobicContact CE1-CB 4.34Å; F763-C883 HydrophobicContact CE2-CB 4.17Å; F763-C883 HydrophobicContact CZ-CB 3.61Å; F763-S886 WeakPolarHBondContact CB-OG 3.21Å; F763-S886 VanDerWaalsContact CD1-OG 3.25Å; F763-S886 WeakPolarHBondContact CD1-OG 3.32Å; F763-S886 VanDerWaalsContact CG-OG 3.26Å; F763-S886 WeakPolarHBondContact CG-OG 3.43Å; F763-F908 HydrophobicContact CE1-CE1 4.47Å; F763-L909 HydrophobicContact CD1-CD2 4.04Å; F763-L909 HydrophobicContact CE1-CD2 3.77Å
764	M	91.1	Very high	92.2	Very high	5 Å²	5	30.1 Å²	30.1	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-61.1	-40.3	179.7	-67.8	178.2	68	0	0	112.6	L406 P407 F409 L760 W761 L762 I905 F908	L406-M764 HydrophobicContact CD2-CB 4.14Å; L406-M764 WeakPolarHBondContact CD2-O 3.36Å; P407-M764 VanDerWaalsContact CD-CE 3.43Å; P407-M764 HydrophobicContact CG-CE 3.68Å; F409-M764 HydrophobicContact CE2-CE 4.35Å; F409-M764 HydrophobicContact CZ-CE 3.88Å; L760-M764 HydrophobicContact CD1-CG 4.43Å; L760-M764 HydrophobicContact CD1-SD 4.38Å; L760-M764 HydrophobicContact CG-SD 4.25Å; L760-M764 VanDerWaalsContact O-CG 3.26Å; L760-M764 WeakPolarHBondContact O-CG 3.39Å; L760-M764 PolarHBondContact O-N 3.36Å; W761-M764 PolarHBondContact O-N 3.27Å; L762-M764 PolarHBondContact O-N 3.43Å; M764-I905 HydrophobicContact CE-CG1 4.37Å; M764-I905 HydrophobicContact SD-CG1 4.35Å; M764-I905 HydrophobicContact SD-CG2 4Å; M764-F908 HydrophobicContact CB-CE1 3.91Å; M764-F908 HydrophobicContact CB-CZ 4.15Å; M764-F908 HydrophobicContact CE-CD1 3.95Å; M764-F908 HydrophobicContact CE-CE1 4.33Å; M764-F908 HydrophobicContact CE-CG 4.09Å; M764-F908 HydrophobicContact CG-CD1 3.87Å; M764-F908 HydrophobicContact CG-CE1 3.57Å; M764-F908 HydrophobicContact CG-CZ 4.29Å
765	L	89.8	Confident	92.5	Very high	35 Å²	35	29.5 Å²	29.5	18%	0.183	14%	0.141	C	C	.	.	H	α-helix	trans	-70.7	-36.6	178.9	-72.5	174.8	0	0	0	112.9	L406 S701 I709 W761 L762 F763	L406-L765 HydrophobicContact CD1-CD2 3.98Å; L406-L765 HydrophobicContact CD2-CD2 4.32Å; S701-L765 WeakPolarHBondContact OG-CD2 3.44Å; I709-L765 HydrophobicContact CD1-CD1 3.38Å; W761-L765 HydrophobicContact CG-CD1 4.45Å; W761-L765 WeakPolarHBondContact O-CG 3.4Å; W761-L765 PolarHBondContact O-N 3.24Å; L762-L765 PolarHBondContact O-N 3.01Å; F763-L765 VanDerWaalsContact C-N 3.32Å; F763-L765 PolarHBondContact O-N 3.27Å
766	D	91.1	Very high	92.8	Very high	27 Å²	27	31 Å²	31	14%	0.144	15%	0.148	C	C	.	.	H	α-helix	trans	-92.9	-13.8	-172.6	-155.6	32.9	0	0	0	114	K706 L762 F763 A768 N769 M770	K706-D766 VanDerWaalsContact CE-CG 3.47Å; K706-D766 WeakPolarHBondContact CE-OD1 3.46Å; K706-D766 WeakPolarHBondContact CE-OD2 3.33Å; K706-D766 IonicContact NZ-OD1 3.93Å; K706-D766 PolarHBondContact NZ-OD1 3.5Å; K706-D766 IonicContact NZ-OD2 3.92Å; K706-D766 PolarHBondContact NZ-OD2 2.8Å; L762-D766 WeakPolarHBondContact O-CB 3.49Å; L762-D766 PolarHBondContact O-N 3.18Å; F763-D766 PolarHBondContact O-N 3.29Å; D766-A768 VanDerWaalsContact C-N 3.3Å; D766-A768 PolarHBondContact O-N 3.46Å; D766-N769 PolarHBondContact O-N 2.74Å; D766-N769 VanDerWaalsContact O-N 3.08Å; D766-N769 PolarHBondContact OD1-ND2 2.96Å; D766-M770 HydrophobicContact CB-CE 4.22Å; D766-M770 PolarHBondContact O-N 3.3Å
767	Y	93.1	Very high	93	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-54.9	-43.4	-174.8	-179.5	-94.2	0	0	0	113.5	P404 F763 N769 M770 E771 M879 C912 R915 I916	P404-Y767 HydrophobicContact CG-CD1 3.71Å; P404-Y767 HydrophobicContact CG-CE1 3.86Å; F763-Y767 HydrophobicContact CE1-CD2 4.22Å; F763-Y767 AromaticContact CE2-CD2 3.99Å; F763-Y767 HydrophobicContact CE2-CD2 3.99Å; F763-Y767 AromaticContact CZ-CD2 3.54Å; F763-Y767 HydrophobicContact CZ-CD2 3.54Å; F763-Y767 HydrophobicContact CZ-CE2 4.15Å; F763-Y767 HydrophobicContact CZ-CG 4.44Å; F763-Y767 WeakPolarHBondContact O-CB 3.49Å; F763-Y767 PolarHBondContact O-N 2.84Å; Y767-N769 VanDerWaalsContact C-N 3.31Å; Y767-N769 PolarHBondContact O-N 2.89Å; Y767-M770 PolarHBondContact O-N 2.86Å; Y767-E771 HydrophobicContact CE1-CB 4.43Å; Y767-E771 WeakPolarHBondContact O-CB 3.23Å; Y767-E771 PolarHBondContact O-N 3.44Å; Y767-M879 HydrophobicContact CD2-CE 4.29Å; Y767-M879 HydrophobicContact CE2-CE 3.82Å; Y767-C912 HydrophobicContact CD2-CB 4.17Å; Y767-C912 HydrophobicContact CE1-CB 4.23Å; Y767-C912 HydrophobicContact CE2-CB 3.71Å; Y767-C912 WeakPolarHBondContact OH-CA 3.32Å; Y767-C912 PolarHBondContact OH-O 3.29Å; Y767-R915 WeakPolarHBondContact OH-CB 3.41Å; Y767-I916 HydrophobicContact CE2-CD1 3.9Å; Y767-I916 HydrophobicContact CE2-CG1 3.92Å
768	A	91	Very high	93.3	Very high	31 Å²	31	31.4 Å²	31.4	26%	0.256	15%	0.151	S	C	.	.	H	α-helix	trans	-61.5	-41	179.8	0	0	0	0	0	111.7	D766 E771 Y772	D766-A768 VanDerWaalsContact C-N 3.3Å; D766-A768 PolarHBondContact O-N 3.46Å; A768-E771 PolarHBondContact O-N 3.24Å; A768-Y772 VanDerWaalsContact O-CD2 3.23Å; A768-Y772 WeakPolarHBondContact O-CD2 3.37Å; A768-Y772 PolarHBondContact O-N 2.8Å; A768-Y772 VanDerWaalsContact O-N 3.09Å
769	N	92.1	Very high	93.5	Very high	83 Å²	83	32.9 Å²	32.9	44%	0.444	16%	0.158	S	C	.	.	H	α-helix	trans	-67.9	-48.4	177.5	-61.5	-27.8	0	0	0	110.9	D766 Y767 E771 Y772 E773	D766-N769 PolarHBondContact O-N 2.74Å; D766-N769 VanDerWaalsContact O-N 3.08Å; D766-N769 PolarHBondContact OD1-ND2 2.96Å; Y767-N769 VanDerWaalsContact C-N 3.31Å; Y767-N769 PolarHBondContact O-N 2.89Å; N769-E771 PolarHBondContact O-N 3.4Å; N769-Y772 PolarHBondContact O-N 3.2Å; N769-Y772 VanDerWaalsContact O-N 3.09Å; N769-E773 WeakPolarHBondContact O-CG 3.22Å; N769-E773 PolarHBondContact O-N 3.39Å
770	M	93	Very high	93.6	Very high	20 Å²	20	28.1 Å²	28.1	10%	0.099	14%	0.141	C	C	.	.	H	α-helix	trans	-57.3	-37.4	177.1	-68.1	-170.9	-73	0	0	111.9	F763 D766 Y767 V774 M879	F763-M770 HydrophobicContact CD2-CE 3.84Å; F763-M770 HydrophobicContact CE2-CE 3.94Å; D766-M770 HydrophobicContact CB-CE 4.22Å; D766-M770 PolarHBondContact O-N 3.3Å; Y767-M770 PolarHBondContact O-N 2.86Å; M770-V774 WeakPolarHBondContact O-CG2 3.37Å; M770-V774 PolarHBondContact O-N 2.89Å; M770-M879 HydrophobicContact CB-CE 4Å; M770-M879 HydrophobicContact CB-CG 3.83Å; M770-M879 HydrophobicContact CB-SD 3.88Å; M770-M879 VanDerWaalsContact O-SD 3.4Å; M770-M879 HydrophobicContact SD-CG 4.11Å
771	E	95.1	Very high	93.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-46.5	175.4	-179.5	175.8	-124.5	0	0	112.4	V507 N508 Y767 A768 N769 V774 A775 M879 R915 L919	V507-E771 HydrophobicContact CG1-CG 3.73Å; N508-E771 PolarHBondContact ND2-OE2 2.95Å; N508-E771 PolarHBondContact OD1-OE2 3.36Å; Y767-E771 HydrophobicContact CE1-CB 4.43Å; Y767-E771 WeakPolarHBondContact O-CB 3.23Å; Y767-E771 PolarHBondContact O-N 3.44Å; A768-E771 PolarHBondContact O-N 3.24Å; N769-E771 PolarHBondContact O-N 3.4Å; E771-V774 PolarHBondContact O-N 2.92Å; E771-A775 VanDerWaalsContact O-CB 3.24Å; E771-A775 WeakPolarHBondContact O-CB 3.4Å; E771-A775 PolarHBondContact O-N 3.32Å; E771-M879 HydrophobicContact CB-CE 4.03Å; E771-R915 IonicContact OE1-CZ 2.66Å; E771-R915 IonicContact OE1-NE 2.99Å; E771-R915 PolarHBondContact OE1-NE 3.38Å; E771-R915 IonicContact OE1-NH2 3.09Å; E771-R915 PolarHBondContact OE1-NH2 3.37Å; E771-R915 IonicContact OE2-CZ 4Å; E771-R915 IonicContact OE2-NE 2.77Å; E771-R915 PolarHBondContact OE2-NE 3.15Å; E771-R915 IonicContact OE2-NH2 2.74Å; E771-R915 PolarHBondContact OE2-NH2 2.89Å; E771-L919 HydrophobicContact CG-CD1 3.97Å
772	Y	93.3	Very high	93.9	Very high	84 Å²	84	28.8 Å²	28.8	33%	0.329	14%	0.144	S	C	.	.	H	α-helix	trans	-62.6	-43.4	176.7	-88.7	-68.9	0	0	0	112.1	N508 D509 A768 N769 V774 A775 E776	N508-Y772 HydrophobicContact CB-CE1 4.16Å; N508-Y772 HydrophobicContact CB-CE2 4.48Å; N508-Y772 VanDerWaalsContact CB-OH 3.28Å; N508-Y772 WeakPolarHBondContact CB-OH 3.47Å; N508-Y772 WeakPolarHBondContact ND2-CE2 3.49Å; D509-Y772 WeakPolarHBondContact OD1-CE1 3.2Å; D509-Y772 PolarHBondContact OD1-OH 2.98Å; A768-Y772 VanDerWaalsContact O-CD2 3.23Å; A768-Y772 WeakPolarHBondContact O-CD2 3.37Å; A768-Y772 PolarHBondContact O-N 2.8Å; A768-Y772 VanDerWaalsContact O-N 3.09Å; N769-Y772 PolarHBondContact O-N 3.2Å; N769-Y772 VanDerWaalsContact O-N 3.09Å; Y772-V774 PolarHBondContact O-N 3.12Å; Y772-V774 VanDerWaalsContact O-N 3.17Å; Y772-A775 PolarHBondContact O-N 3.32Å; Y772-E776 WeakPolarHBondContact O-CB 3.29Å; Y772-E776 PolarHBondContact O-N 2.64Å
773	E	93.6	Very high	94.1	Very high	109 Å²	109	29.9 Å²	29.9	51%	0.509	15%	0.15	S	C	.	.	H	α-helix	trans	-58.6	-27.9	177.6	-74.5	178.3	-179.4	0	0	113.3	N769 P777	N769-E773 WeakPolarHBondContact O-CG 3.22Å; N769-E773 PolarHBondContact O-N 3.39Å; E773-P777 VanDerWaalsContact O-CD 3.24Å; E773-P777 WeakPolarHBondContact O-CD 3.48Å; E773-P777 WeakPolarHBondContact O-CG 3.46Å
774	V	96.3	Very high	94.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-90.3	-41.7	175.1	175.1	0	0	0	0	111.8	M770 E771 Y772 L778 V872 N875 L876 M879 L919	M770-V774 WeakPolarHBondContact O-CG2 3.37Å; M770-V774 PolarHBondContact O-N 2.89Å; E771-V774 PolarHBondContact O-N 2.92Å; Y772-V774 PolarHBondContact O-N 3.12Å; Y772-V774 VanDerWaalsContact O-N 3.17Å; V774-L778 HydrophobicContact CG1-CD1 4.13Å; V774-L778 WeakPolarHBondContact O-CG 3.49Å; V774-V872 HydrophobicContact CG1-CG1 3.99Å; V774-N875 HydrophobicContact CG2-CB 3.94Å; V774-L876 HydrophobicContact CG1-CB 4.17Å; V774-L876 HydrophobicContact CG1-CD1 4.34Å; V774-L876 HydrophobicContact CG1-CD2 4.45Å; V774-L876 HydrophobicContact CG2-CB 4.37Å; V774-M879 HydrophobicContact CG2-SD 3.78Å; V774-L919 HydrophobicContact CG1-CD1 4.36Å; V774-L919 HydrophobicContact CG1-CD2 4.4Å
775	A	95.3	Very high	94.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-73	-39.7	-172.4	0	0	0	0	0	113.1	V507 L510 E771 Y772 L778 M779 L919	V507-A775 HydrophobicContact CB-CB 4.39Å; V507-A775 HydrophobicContact CG1-CB 3.87Å; L510-A775 HydrophobicContact CD1-CB 3.71Å; E771-A775 VanDerWaalsContact O-CB 3.24Å; E771-A775 WeakPolarHBondContact O-CB 3.4Å; E771-A775 PolarHBondContact O-N 3.32Å; Y772-A775 PolarHBondContact O-N 3.32Å; A775-L778 PolarHBondContact O-N 3.2Å; A775-M779 PolarHBondContact O-N 2.96Å; A775-L919 HydrophobicContact CB-CD2 4.02Å
776	E	95.9	Very high	94.5	Very high	105 Å²	105	29.6 Å²	29.6	49%	0.491	15%	0.148	S	C	.	.	H	α-helix	trans	-63	-49.1	-176.8	179.1	-179.8	-160.5	0	0	112.3	Y772 L778 M779 D780	Y772-E776 WeakPolarHBondContact O-CB 3.29Å; Y772-E776 PolarHBondContact O-N 2.64Å; E776-L778 VanDerWaalsContact C-N 3.27Å; E776-L778 PolarHBondContact O-N 3.45Å; E776-M779 WeakPolarHBondContact O-CB 3.42Å; E776-M779 PolarHBondContact O-N 3.3Å; E776-M779 VanDerWaalsContact O-N 3.12Å; E776-D780 PolarHBondContact O-N 2.85Å
777	P	96.6	Very high	94.6	Very high	13 Å²	13	30.8 Å²	30.8	8%	0.084	15%	0.152	C	C	.	.	H	α-helix	trans	-58.6	-34.5	174.2	-30.1	38.2	0	0	0	115.1	E773 D780 L781 V867 F869 V872	E773-P777 VanDerWaalsContact O-CD 3.24Å; E773-P777 WeakPolarHBondContact O-CD 3.48Å; E773-P777 WeakPolarHBondContact O-CG 3.46Å; P777-D780 PolarHBondContact O-N 3.35Å; P777-L781 WeakPolarHBondContact O-CB 3.19Å; P777-L781 PolarHBondContact O-N 3.26Å; P777-V867 HydrophobicContact CB-CB 4.48Å; P777-V867 HydrophobicContact CB-CG1 3.8Å; P777-V867 HydrophobicContact CB-CG2 4.31Å; P777-V867 HydrophobicContact CG-CG1 3.94Å; P777-V867 HydrophobicContact CG-CG2 4.34Å; P777-F869 HydrophobicContact CB-CE1 4.28Å; P777-V872 HydrophobicContact CB-CG2 3.94Å; P777-V872 HydrophobicContact CG-CG2 4.01Å
778	L	96.8	Very high	94.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.9	-36.7	178	-66.2	175.1	0	0	0	111.3	F512 V774 A775 E776 K782 V872 I922 H923 I926	F512-L778 HydrophobicContact CE1-CB 4.2Å; F512-L778 HydrophobicContact CZ-CB 4.24Å; V774-L778 HydrophobicContact CG1-CD1 4.13Å; V774-L778 WeakPolarHBondContact O-CG 3.49Å; A775-L778 PolarHBondContact O-N 3.2Å; E776-L778 VanDerWaalsContact C-N 3.27Å; E776-L778 PolarHBondContact O-N 3.45Å; L778-K782 PolarHBondContact O-N 3.44Å; L778-V872 HydrophobicContact CG-CG1 4.5Å; L778-I922 HydrophobicContact CD1-CG2 4.22Å; L778-H923 HydrophobicContact CD1-CB 3.87Å; L778-H923 HydrophobicContact CD2-CB 4.39Å; L778-I926 HydrophobicContact CD2-CB 4.48Å; L778-I926 HydrophobicContact CD2-CG2 4.21Å
779	M	95.5	Very high	94.6	Very high	30 Å²	30	33 Å²	33	15%	0.148	16%	0.16	C	C	.	.	H	α-helix	trans	-67.8	-42.3	173.3	-173.2	62.1	177.8	0	0	111.2	L510 F512 A775 E776 L781 K782 L783	L510-M779 HydrophobicContact CD1-CB 4.17Å; L510-M779 HydrophobicContact CD2-CB 4.24Å; L510-M779 HydrophobicContact CD2-CG 3.9Å; F512-M779 HydrophobicContact CE1-CB 4.16Å; F512-M779 HydrophobicContact CE1-SD 4.11Å; F512-M779 HydrophobicContact CZ-CB 3.82Å; F512-M779 HydrophobicContact CZ-SD 4.23Å; A775-M779 PolarHBondContact O-N 2.96Å; E776-M779 WeakPolarHBondContact O-CB 3.42Å; E776-M779 PolarHBondContact O-N 3.3Å; E776-M779 VanDerWaalsContact O-N 3.12Å; M779-L781 VanDerWaalsContact C-N 3.33Å; M779-L781 PolarHBondContact O-N 3.4Å; M779-K782 HydrophobicContact CE-CD 4.36Å; M779-K782 VanDerWaalsContact O-CB 3.31Å; M779-K782 WeakPolarHBondContact O-CB 3.28Å; M779-K782 PolarHBondContact O-N 3.43Å; M779-K782 HydrophobicContact SD-CD 3.76Å; M779-L783 HydrophobicContact CE-CD1 4.19Å; M779-L783 HydrophobicContact CE-CD2 4.19Å; M779-L783 HydrophobicContact CE-CG 4.17Å; M779-L783 HydrophobicContact CG-CD1 4.29Å; M779-L783 WeakPolarHBondContact O-CG 3.42Å; M779-L783 PolarHBondContact O-N 2.94Å
780	D	96.2	Very high	94.5	Very high	10 Å²	10	36 Å²	36	5%	0.053	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-41.4	175.4	-85.9	-17.3	0	0	0	112	E776 P777 K782 L783 A784 A860 R863 S864	E776-D780 PolarHBondContact O-N 2.85Å; P777-D780 PolarHBondContact O-N 3.35Å; D780-K782 VanDerWaalsContact C-N 3.32Å; D780-K782 PolarHBondContact O-N 2.93Å; D780-L783 PolarHBondContact O-N 3.45Å; D780-A784 VanDerWaalsContact O-CB 3.23Å; D780-A784 WeakPolarHBondContact O-CB 3.27Å; D780-A784 PolarHBondContact O-N 2.98Å; D780-A860 WeakPolarHBondContact O-CB 3.45Å; D780-R863 VanDerWaalsContact CG-NE 3.26Å; D780-R863 IonicContact OD1-CZ 3.82Å; D780-R863 IonicContact OD1-NE 3.23Å; D780-R863 PolarHBondContact OD1-NE 3.13Å; D780-R863 IonicContact OD1-NH2 2.69Å; D780-R863 PolarHBondContact OD1-NH2 3.42Å; D780-R863 VanDerWaalsContact OD2-CB 3.22Å; D780-R863 WeakPolarHBondContact OD2-CB 3.5Å; D780-R863 WeakPolarHBondContact OD2-CD 3.36Å; D780-R863 IonicContact OD2-CZ 3.78Å; D780-R863 IonicContact OD2-NE 3.99Å; D780-R863 PolarHBondContact OD2-NE 3.44Å; D780-S864 PolarHBondContact O-OG 2.68Å
781	L	96.7	Very high	94.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-38.2	176.1	-175.1	57.1	0	0	0	112.2	P777 M779 A784 M785 S864 F869 I926 I927 F930 I949	P777-L781 WeakPolarHBondContact O-CB 3.19Å; P777-L781 PolarHBondContact O-N 3.26Å; M779-L781 VanDerWaalsContact C-N 3.33Å; M779-L781 PolarHBondContact O-N 3.4Å; L781-A784 PolarHBondContact O-N 3.15Å; L781-M785 WeakPolarHBondContact O-CE 3.41Å; L781-M785 WeakPolarHBondContact O-CG 3.46Å; L781-M785 PolarHBondContact O-N 3.23Å; L781-S864 PolarHBondContact N-OG 2.96Å; L781-F869 HydrophobicContact CB-CE1 3.89Å; L781-F869 HydrophobicContact CB-CZ 3.87Å; L781-F869 HydrophobicContact CD1-CZ 4.23Å; L781-F869 HydrophobicContact CD2-CD1 4.15Å; L781-F869 HydrophobicContact CD2-CE1 3.61Å; L781-F869 HydrophobicContact CD2-CZ 3.9Å; L781-F869 HydrophobicContact CG-CE1 4.28Å; L781-F869 HydrophobicContact CG-CZ 4.22Å; L781-I926 HydrophobicContact CB-CG2 4.17Å; L781-I926 HydrophobicContact CD2-CG2 3.66Å; L781-I926 HydrophobicContact CG-CG2 4Å; L781-I927 HydrophobicContact CD2-CD1 4.47Å; L781-F930 HydrophobicContact CD1-CD2 3.6Å; L781-F930 HydrophobicContact CD1-CE2 3.85Å; L781-F930 HydrophobicContact CD1-CG 4.29Å; L781-F930 HydrophobicContact CD2-CB 4.37Å; L781-F930 HydrophobicContact CD2-CG 4.45Å; L781-F930 HydrophobicContact CG-CD2 4.31Å; L781-I949 HydrophobicContact CD1-CG2 3.52Å; L781-I949 HydrophobicContact CD2-CD1 3.9Å; L781-I949 HydrophobicContact CD2-CG2 3.96Å; L781-I949 HydrophobicContact CG-CG2 4.41Å
782	K	94.3	Very high	94.1	Very high	15 Å²	15	43.7 Å²	43.7	7%	0.065	20%	0.198	C	C	.	.	H	α-helix	trans	-58.2	-53.9	173.1	-176.9	-149.8	173.7	-166	0	110.5	D511 E514 L778 M779 D780 A784 M785 E786 I926	D511-K782 PolarHBondContact O-NZ 3.19Å; E514-K782 VanDerWaalsContact CD-NZ 3.34Å; E514-K782 WeakPolarHBondContact OE1-CE 3.48Å; E514-K782 IonicContact OE1-NZ 2.74Å; E514-K782 WeakPolarHBondContact OE2-CE 3.36Å; E514-K782 IonicContact OE2-NZ 3.21Å; E514-K782 PolarHBondContact OE2-NZ 3.45Å; L778-K782 PolarHBondContact O-N 3.44Å; M779-K782 HydrophobicContact CE-CD 4.36Å; M779-K782 VanDerWaalsContact O-CB 3.31Å; M779-K782 WeakPolarHBondContact O-CB 3.28Å; M779-K782 PolarHBondContact O-N 3.43Å; M779-K782 HydrophobicContact SD-CD 3.76Å; D780-K782 VanDerWaalsContact C-N 3.32Å; D780-K782 PolarHBondContact O-N 2.93Å; K782-A784 VanDerWaalsContact C-N 3.33Å; K782-A784 PolarHBondContact O-N 2.97Å; K782-M785 PolarHBondContact O-N 3.08Å; K782-E786 VanDerWaalsContact CE-OE1 3.28Å; K782-E786 WeakPolarHBondContact CE-OE1 3.47Å; K782-E786 IonicContact NZ-OE1 3.9Å; K782-E786 PolarHBondContact O-N 3.4Å; K782-I926 HydrophobicContact CB-CD1 3.73Å; K782-I926 HydrophobicContact CG-CD1 4.03Å
783	L	95.3	Very high	94	Very high	50 Å²	50	39.9 Å²	39.9	26%	0.262	18%	0.184	S	C	.	.	H	α-helix	trans	-63.7	-38.1	-179.5	-68.4	175.9	0	0	0	111.7	M779 D780 M785 E786 E787 A860	M779-L783 HydrophobicContact CE-CD1 4.19Å; M779-L783 HydrophobicContact CE-CD2 4.19Å; M779-L783 HydrophobicContact CE-CG 4.17Å; M779-L783 HydrophobicContact CG-CD1 4.29Å; M779-L783 WeakPolarHBondContact O-CG 3.42Å; M779-L783 PolarHBondContact O-N 2.94Å; D780-L783 PolarHBondContact O-N 3.45Å; L783-M785 VanDerWaalsContact C-N 3.33Å; L783-M785 PolarHBondContact O-N 3.16Å; L783-E786 CarbonylContact O-C 3.52Å; L783-E786 PolarHBondContact O-N 2.89Å; L783-E787 WeakPolarHBondContact O-CB 3.39Å; L783-E787 WeakPolarHBondContact O-CG 3.06Å; L783-E787 PolarHBondContact O-N 3.38Å; L783-A860 HydrophobicContact CB-CB 3.57Å
784	A	95.9	Very high	93.9	Very high	2 Å²	2	35.1 Å²	35.1	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-42.8	176.9	0	0	0	0	0	111.9	D780 L781 K782 E786 L788 A860 V861	D780-A784 VanDerWaalsContact O-CB 3.23Å; D780-A784 WeakPolarHBondContact O-CB 3.27Å; D780-A784 PolarHBondContact O-N 2.98Å; L781-A784 PolarHBondContact O-N 3.15Å; K782-A784 VanDerWaalsContact C-N 3.33Å; K782-A784 PolarHBondContact O-N 2.97Å; A784-E786 VanDerWaalsContact C-N 3.34Å; A784-E786 PolarHBondContact O-N 3.35Å; A784-L788 WeakPolarHBondContact O-CB 3.42Å; A784-L788 WeakPolarHBondContact O-CG 3.44Å; A784-L788 PolarHBondContact O-N 3.2Å; A784-L788 VanDerWaalsContact O-N 3.09Å; A784-A860 HydrophobicContact CB-CB 4.25Å; A784-V861 HydrophobicContact CB-CB 4.4Å; A784-V861 HydrophobicContact CB-CG2 3.84Å
785	M	94.3	Very high	93.7	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.034	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-39.5	174.6	-68.5	-178.4	-74.1	0	0	112	L781 K782 L783 D789 R929 F930 F933	L781-M785 WeakPolarHBondContact O-CE 3.41Å; L781-M785 WeakPolarHBondContact O-CG 3.46Å; L781-M785 PolarHBondContact O-N 3.23Å; K782-M785 PolarHBondContact O-N 3.08Å; L783-M785 VanDerWaalsContact C-N 3.33Å; L783-M785 PolarHBondContact O-N 3.16Å; M785-D789 VanDerWaalsContact O-CB 3.32Å; M785-D789 WeakPolarHBondContact O-CB 3.48Å; M785-D789 PolarHBondContact O-N 3.05Å; M785-R929 HydrophobicContact CE-CB 4.24Å; M785-R929 HydrophobicContact CE-CG 4.02Å; M785-R929 HydrophobicContact SD-CB 4.42Å; M785-R929 HydrophobicContact SD-CG 4.04Å; M785-F930 HydrophobicContact CG-CD2 4.08Å; M785-F930 WeakPolarHBondContact SD-CA 3.38Å; M785-F930 HydrophobicContact SD-CB 3.95Å; M785-F930 HydrophobicContact SD-CD2 4.08Å; M785-F933 HydrophobicContact CB-CD2 4.36Å; M785-F933 HydrophobicContact CB-CG 4.43Å; M785-F933 HydrophobicContact CG-CB 4.29Å; M785-F933 HydrophobicContact CG-CD1 4.15Å; M785-F933 HydrophobicContact CG-CD2 4.47Å; M785-F933 HydrophobicContact CG-CG 4.05Å; M785-F933 HydrophobicContact SD-CB 3.94Å; M785-F933 HydrophobicContact SD-CG 4.34Å
786	E	92.8	Very high	93.5	Very high	35 Å²	35	41.1 Å²	41.1	16%	0.164	19%	0.189	C	C	.	.	H	α-helix	trans	-70.4	-41.8	178.3	-69.8	-172.9	-142.9	0	0	113.1	K782 L783 A784 L788 D789 K790	K782-E786 VanDerWaalsContact CE-OE1 3.28Å; K782-E786 WeakPolarHBondContact CE-OE1 3.47Å; K782-E786 IonicContact NZ-OE1 3.9Å; K782-E786 PolarHBondContact O-N 3.4Å; L783-E786 CarbonylContact O-C 3.52Å; L783-E786 PolarHBondContact O-N 2.89Å; A784-E786 VanDerWaalsContact C-N 3.34Å; A784-E786 PolarHBondContact O-N 3.35Å; E786-L788 VanDerWaalsContact C-N 3.29Å; E786-L788 PolarHBondContact O-N 2.83Å; E786-D789 PolarHBondContact O-N 3.22Å; E786-K790 VanDerWaalsContact O-CB 3.24Å; E786-K790 WeakPolarHBondContact O-CB 3.09Å; E786-K790 WeakPolarHBondContact O-CG 3.49Å; E786-K790 PolarHBondContact O-N 3.47Å; E786-K790 IonicContact OE2-NZ 2.66Å; E786-K790 PolarHBondContact OE2-NZ 2.86Å
787	E	93.8	Very high	93.4	Very high	52 Å²	52	36.1 Å²	36.1	24%	0.243	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-45.5	174.7	-75.8	176	178.1	0	0	110	L783 S791 M858 G859 A860 V861	L783-E787 WeakPolarHBondContact O-CB 3.39Å; L783-E787 WeakPolarHBondContact O-CG 3.06Å; L783-E787 PolarHBondContact O-N 3.38Å; E787-S791 WeakPolarHBondContact O-CB 3.31Å; E787-S791 PolarHBondContact O-N 3.19Å; E787-M858 VanDerWaalsContact OE2-C 3.3Å; E787-M858 WeakPolarHBondContact OE2-CA 3.29Å; E787-G859 PolarHBondContact OE2-N 3.37Å; E787-A860 WeakPolarHBondContact OE1-CB 3.29Å; E787-A860 PolarHBondContact OE1-N 3.1Å; E787-A860 WeakPolarHBondContact OE2-CB 3.41Å; E787-A860 PolarHBondContact OE2-N 2.95Å; E787-V861 PolarHBondContact OE2-N 3.47Å
788	L	92.5	Very high	93.2	Very high	8 Å²	8	36.8 Å²	36.8	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-68.8	-40.8	178.4	-66.9	172.3	0	0	0	113.1	A784 E786 F794 M858 V861 F933 I956	A784-L788 WeakPolarHBondContact O-CB 3.42Å; A784-L788 WeakPolarHBondContact O-CG 3.44Å; A784-L788 PolarHBondContact O-N 3.2Å; A784-L788 VanDerWaalsContact O-N 3.09Å; E786-L788 VanDerWaalsContact C-N 3.29Å; E786-L788 PolarHBondContact O-N 2.83Å; L788-F794 HydrophobicContact CD2-CD1 4.31Å; L788-F794 HydrophobicContact CD2-CE1 4.18Å; L788-F794 HydrophobicContact CD2-CE2 4.38Å; L788-F794 HydrophobicContact CD2-CG 4.47Å; L788-F794 HydrophobicContact CD2-CZ 4.21Å; L788-F794 WeakPolarHBondContact O-CD1 3.27Å; L788-M858 HydrophobicContact CD2-CE 3.81Å; L788-M858 HydrophobicContact CD2-SD 4.19Å; L788-V861 HydrophobicContact CD1-CG2 4.15Å; L788-V861 HydrophobicContact CD2-CG2 4.06Å; L788-V861 HydrophobicContact CG-CG2 3.86Å; L788-F933 HydrophobicContact CB-CE1 4.44Å; L788-F933 HydrophobicContact CB-CE2 4.49Å; L788-F933 HydrophobicContact CB-CZ 3.69Å; L788-F933 HydrophobicContact CD1-CE1 3.89Å; L788-F933 HydrophobicContact CD1-CZ 3.99Å; L788-I956 HydrophobicContact CD1-CD1 3.78Å; L788-I956 HydrophobicContact CD2-CD1 4.36Å; L788-I956 HydrophobicContact CD2-CG2 3.79Å
789	D	90.7	Very high	93	Very high	70 Å²	70	39.6 Å²	39.6	37%	0.374	19%	0.191	S	C	.	.	H	α-helix	trans	-71.4	-38.2	-179.5	-169	45.7	0	0	0	112.1	M785 E786 Q795 F933 Y936	M785-D789 VanDerWaalsContact O-CB 3.32Å; M785-D789 WeakPolarHBondContact O-CB 3.48Å; M785-D789 PolarHBondContact O-N 3.05Å; E786-D789 PolarHBondContact O-N 3.22Å; D789-Q795 PolarHBondContact O-NE2 2.94Å; D789-F933 HydrophobicContact CB-CE2 4.35Å; D789-Y936 WeakPolarHBondContact OD1-CE1 3.4Å; D789-Y936 PolarHBondContact OD1-OH 3Å
790	K	89.9	Confident	92.9	Very high	146 Å²	146	39 Å²	39	64%	0.635	19%	0.189	S	C	*	.	H	α-helix	trans	-91.5	-16.5	-176	-63.4	172.5	-178.2	165.1	0	114.1	E786 R792	E786-K790 VanDerWaalsContact O-CB 3.24Å; E786-K790 WeakPolarHBondContact O-CB 3.09Å; E786-K790 WeakPolarHBondContact O-CG 3.49Å; E786-K790 PolarHBondContact O-N 3.47Å; E786-K790 IonicContact OE2-NZ 2.66Å; E786-K790 PolarHBondContact OE2-NZ 2.86Å; K790-R792 PolarHBondContact O-N 3Å
791	S	91.1	Very high	92.7	Very high	8 Å²	8	38.8 Å²	38.8	6%	0.056	19%	0.188	C	C	.	.			trans	-68.6	107.5	-179.4	175.7	0	0	0	0	111.1	E787 T793 F794 Q795 E857	E787-S791 WeakPolarHBondContact O-CB 3.31Å; E787-S791 PolarHBondContact O-N 3.19Å; S791-T793 VanDerWaalsContact C-N 3.26Å; S791-T793 PolarHBondContact O-N 3.33Å; S791-F794 PolarHBondContact O-N 2.98Å; S791-F794 WeakPolarHBondContact OG-CB 3.49Å; S791-F794 PolarHBondContact OG-N 3.17Å; S791-Q795 WeakPolarHBondContact O-CG 3.45Å; S791-Q795 PolarHBondContact O-N 3.39Å; S791-Q795 VanDerWaalsContact O-N 3.1Å; S791-E857 PolarHBondContact OG-OE2 3.39Å
792	R	89.9	Confident	92.5	Very high	173 Å²	173	40.6 Å²	40.6	65%	0.653	20%	0.198	S	C	*	.	H	α-helix	trans	-59.5	-39.9	173.2	-176.1	-178.3	179.6	-169.8	1	111.3	K790 Q795 Q796	K790-R792 PolarHBondContact O-N 3Å; R792-Q795 PolarHBondContact O-N 3.16Å; R792-Q796 HydrophobicContact CG-CG 4.46Å; R792-Q796 WeakPolarHBondContact O-CB 3.42Å; R792-Q796 VanDerWaalsContact O-CG 3.28Å; R792-Q796 WeakPolarHBondContact O-CG 3.29Å; R792-Q796 PolarHBondContact O-N 3.2Å
793	T	90	Very high	92.4	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-65.8	-43.3	179.8	-58.8	0	0	0	0	110.5	S791 Q795 Q796 V797 M844 T852 L854	S791-T793 VanDerWaalsContact C-N 3.26Å; S791-T793 PolarHBondContact O-N 3.33Å; T793-Q795 PolarHBondContact O-N 3.31Å; T793-Q796 PolarHBondContact O-N 3.18Å; T793-V797 HydrophobicContact CG2-CG2 4.3Å; T793-V797 WeakPolarHBondContact O-CB 3.21Å; T793-V797 VanDerWaalsContact O-CG2 3.23Å; T793-V797 WeakPolarHBondContact O-CG2 3.5Å; T793-V797 PolarHBondContact O-N 3.3Å; T793-M844 HydrophobicContact CG2-CE 4.49Å; T793-T852 WeakPolarHBondContact CB-OG1 3.27Å; T793-T852 PolarHBondContact OG1-N 2.92Å; T793-T852 PolarHBondContact OG1-OG1 3.35Å; T793-L854 HydrophobicContact CG2-CB 4.37Å; T793-L854 HydrophobicContact CG2-CD1 4.02Å
794	F	92.6	Very high	92.2	Very high	9 Å²	9	42.9 Å²	42.9	4%	0.039	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-48.4	174.3	-177.7	-115.9	0	0	0	111.7	L788 S791 Q796 V797 M798 L854 M858 I956	L788-F794 HydrophobicContact CD2-CD1 4.31Å; L788-F794 HydrophobicContact CD2-CE1 4.18Å; L788-F794 HydrophobicContact CD2-CE2 4.38Å; L788-F794 HydrophobicContact CD2-CG 4.47Å; L788-F794 HydrophobicContact CD2-CZ 4.21Å; L788-F794 WeakPolarHBondContact O-CD1 3.27Å; S791-F794 PolarHBondContact O-N 2.98Å; S791-F794 WeakPolarHBondContact OG-CB 3.49Å; S791-F794 PolarHBondContact OG-N 3.17Å; F794-Q796 VanDerWaalsContact C-N 3.34Å; F794-Q796 PolarHBondContact O-N 3.31Å; F794-V797 PolarHBondContact O-N 3.1Å; F794-M798 HydrophobicContact CD1-CG 4.29Å; F794-M798 HydrophobicContact CD2-CE 4.12Å; F794-M798 HydrophobicContact CD2-CG 4.12Å; F794-M798 HydrophobicContact CE1-CG 3.96Å; F794-M798 HydrophobicContact CE2-CE 3.7Å; F794-M798 HydrophobicContact CE2-CG 3.79Å; F794-M798 HydrophobicContact CE2-SD 3.83Å; F794-M798 HydrophobicContact CG-CG 4.38Å; F794-M798 HydrophobicContact CZ-CE 4.39Å; F794-M798 HydrophobicContact CZ-CG 3.71Å; F794-M798 HydrophobicContact CZ-SD 3.91Å; F794-M798 WeakPolarHBondContact O-CB 3.38Å; F794-M798 VanDerWaalsContact O-CG 3.29Å; F794-M798 WeakPolarHBondContact O-CG 3.43Å; F794-M798 PolarHBondContact O-N 3.37Å; F794-L854 HydrophobicContact CB-CD1 3.78Å; F794-L854 HydrophobicContact CD2-CD1 4.29Å; F794-M858 HydrophobicContact CB-CE 3.66Å; F794-M858 HydrophobicContact CD2-CE 3.5Å; F794-M858 HydrophobicContact CE2-CE 4.32Å; F794-M858 HydrophobicContact CG-CE 3.73Å; F794-I956 HydrophobicContact CE2-CG2 4.38Å
795	Q	91.7	Very high	91.8	Very high	99 Å²	99	43.7 Å²	43.7	46%	0.463	23%	0.227	S	C	.	.	H	α-helix	trans	-58.6	-43.2	177.3	-67.8	175.7	2.7	0	0	112.3	D789 S791 R792 T793 M798 A799	D789-Q795 PolarHBondContact O-NE2 2.94Å; S791-Q795 WeakPolarHBondContact O-CG 3.45Å; S791-Q795 PolarHBondContact O-N 3.39Å; S791-Q795 VanDerWaalsContact O-N 3.1Å; R792-Q795 PolarHBondContact O-N 3.16Å; T793-Q795 PolarHBondContact O-N 3.31Å; Q795-M798 PolarHBondContact O-N 3.03Å; Q795-A799 VanDerWaalsContact O-CB 3.27Å; Q795-A799 WeakPolarHBondContact O-CB 3.48Å; Q795-A799 PolarHBondContact O-N 3.45Å
796	Q	92.2	Very high	91.6	Very high	26 Å²	26	44.9 Å²	44.9	12%	0.121	23%	0.234	C	C	.	.	H	α-helix	trans	-65.7	-41.5	177.4	-73.9	171.2	-22.7	0	0	112.5	R792 T793 F794 A799 T800 M844 F848	R792-Q796 HydrophobicContact CG-CG 4.46Å; R792-Q796 WeakPolarHBondContact O-CB 3.42Å; R792-Q796 VanDerWaalsContact O-CG 3.28Å; R792-Q796 WeakPolarHBondContact O-CG 3.29Å; R792-Q796 PolarHBondContact O-N 3.2Å; T793-Q796 PolarHBondContact O-N 3.18Å; F794-Q796 VanDerWaalsContact C-N 3.34Å; F794-Q796 PolarHBondContact O-N 3.31Å; Q796-A799 PolarHBondContact O-N 2.93Å; Q796-T800 WeakPolarHBondContact O-CB 3.36Å; Q796-T800 PolarHBondContact O-N 2.92Å; Q796-T800 PolarHBondContact O-OG1 3.02Å; Q796-M844 HydrophobicContact CB-CE 3.78Å; Q796-M844 HydrophobicContact CB-SD 4.13Å; Q796-F848 HydrophobicContact CB-CD2 4.36Å; Q796-F848 HydrophobicContact CB-CE2 4.33Å; Q796-F848 HydrophobicContact CG-CD1 4.42Å; Q796-F848 HydrophobicContact CG-CE1 4.33Å; Q796-F848 HydrophobicContact CG-CE2 4.46Å; Q796-F848 HydrophobicContact CG-CZ 4.34Å; Q796-F848 VanDerWaalsContact NE2-CD1 3.33Å
797	V	93	Very high	91.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-45	176.4	176.1	0	0	0	0	110.1	T793 F794 T800 L801 L840 M844 L854 F959 Y963	T793-V797 HydrophobicContact CG2-CG2 4.3Å; T793-V797 WeakPolarHBondContact O-CB 3.21Å; T793-V797 VanDerWaalsContact O-CG2 3.23Å; T793-V797 WeakPolarHBondContact O-CG2 3.5Å; T793-V797 PolarHBondContact O-N 3.3Å; F794-V797 PolarHBondContact O-N 3.1Å; V797-T800 PolarHBondContact O-N 3.34Å; V797-L801 VanDerWaalsContact O-CB 3.3Å; V797-L801 WeakPolarHBondContact O-CB 3.43Å; V797-L801 PolarHBondContact O-N 3.37Å; V797-L840 HydrophobicContact CG1-CD2 3.76Å; V797-L840 HydrophobicContact CG1-CG 4.32Å; V797-M844 HydrophobicContact CG2-CE 3.55Å; V797-M844 HydrophobicContact CG2-CG 4.22Å; V797-M844 HydrophobicContact CG2-SD 3.95Å; V797-L854 HydrophobicContact CG2-CD2 4.47Å; V797-F959 HydrophobicContact CG1-CE1 3.82Å; V797-F959 HydrophobicContact CG1-CZ 3.85Å; V797-Y963 HydrophobicContact CG1-CD2 4.42Å; V797-Y963 HydrophobicContact CG1-CE2 4.33Å; V797-Y963 HydrophobicContact CG2-CE1 4.16Å; V797-Y963 HydrophobicContact CG2-CE2 4.11Å
798	M	93.1	Very high	91.3	Very high	28 Å²	28	54 Å²	54	14%	0.138	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-42.4	176.8	-67.3	-56.3	101	0	0	112.1	F794 Q795 L801 L802 F816 L821 F959	F794-M798 HydrophobicContact CD1-CG 4.29Å; F794-M798 HydrophobicContact CD2-CE 4.12Å; F794-M798 HydrophobicContact CD2-CG 4.12Å; F794-M798 HydrophobicContact CE1-CG 3.96Å; F794-M798 HydrophobicContact CE2-CE 3.7Å; F794-M798 HydrophobicContact CE2-CG 3.79Å; F794-M798 HydrophobicContact CE2-SD 3.83Å; F794-M798 HydrophobicContact CG-CG 4.38Å; F794-M798 HydrophobicContact CZ-CE 4.39Å; F794-M798 HydrophobicContact CZ-CG 3.71Å; F794-M798 HydrophobicContact CZ-SD 3.91Å; F794-M798 WeakPolarHBondContact O-CB 3.38Å; F794-M798 VanDerWaalsContact O-CG 3.29Å; F794-M798 WeakPolarHBondContact O-CG 3.43Å; F794-M798 PolarHBondContact O-N 3.37Å; Q795-M798 PolarHBondContact O-N 3.03Å; M798-L801 PolarHBondContact O-N 3.31Å; M798-L802 WeakPolarHBondContact O-CB 3.1Å; M798-L802 PolarHBondContact O-N 2.99Å; M798-F816 HydrophobicContact SD-CE2 4.46Å; M798-F816 HydrophobicContact SD-CZ 3.95Å; M798-L821 HydrophobicContact CE-CD1 4.3Å; M798-L821 HydrophobicContact CE-CD2 3.8Å; M798-L821 HydrophobicContact SD-CD1 4.33Å; M798-L821 HydrophobicContact SD-CD2 4.02Å; M798-F959 HydrophobicContact CE-CD1 4.35Å; M798-F959 HydrophobicContact CE-CE1 3.62Å; M798-F959 HydrophobicContact CE-CZ 4.11Å
799	A	92.1	Very high	91.1	Very high	58 Å²	58	58.1 Å²	58.1	48%	0.479	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-42.1	177	0	0	0	0	0	112.1	Q795 Q796 L802 S803	Q795-A799 VanDerWaalsContact O-CB 3.27Å; Q795-A799 WeakPolarHBondContact O-CB 3.48Å; Q795-A799 PolarHBondContact O-N 3.45Å; Q796-A799 PolarHBondContact O-N 2.93Å; A799-L802 PolarHBondContact O-N 3.38Å; A799-S803 PolarHBondContact O-N 3.16Å
800	T	92.7	Very high	90.9	Very high	17 Å²	17	58.3 Å²	58.3	10%	0.104	32%	0.317	C	S	.	.	H	α-helix	trans	-65.8	-44.3	176.7	-54.2	0	0	0	0	110.5	Q796 V797 L802 S803 V804 L840 I843	Q796-T800 WeakPolarHBondContact O-CB 3.36Å; Q796-T800 PolarHBondContact O-N 2.92Å; Q796-T800 PolarHBondContact O-OG1 3.02Å; V797-T800 PolarHBondContact O-N 3.34Å; T800-L802 VanDerWaalsContact C-N 3.35Å; T800-L802 PolarHBondContact O-N 3.28Å; T800-S803 PolarHBondContact O-N 2.93Å; T800-V804 WeakPolarHBondContact O-CG2 3.49Å; T800-V804 PolarHBondContact O-N 3.25Å; T800-L840 HydrophobicContact CG2-CD1 3.53Å; T800-I843 HydrophobicContact CG2-CB 4.2Å; T800-I843 HydrophobicContact CG2-CG2 3.63Å
801	L	93.4	Very high	90.6	Very high	6 Å²	6	53.6 Å²	53.6	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-40.9	176.6	-178.9	59	0	0	0	112	V797 M798 V804 G805 F816 L821 V824 L836 L840	V797-L801 VanDerWaalsContact O-CB 3.3Å; V797-L801 WeakPolarHBondContact O-CB 3.43Å; V797-L801 PolarHBondContact O-N 3.37Å; M798-L801 PolarHBondContact O-N 3.31Å; L801-V804 PolarHBondContact O-N 3.43Å; L801-G805 PolarHBondContact O-N 3.45Å; L801-F816 HydrophobicContact CB-CZ 4.41Å; L801-F816 HydrophobicContact CD2-CE1 4.35Å; L801-F816 HydrophobicContact CD2-CE2 4.07Å; L801-F816 HydrophobicContact CD2-CZ 3.61Å; L801-F816 HydrophobicContact CG-CE1 4.23Å; L801-F816 HydrophobicContact CG-CZ 3.98Å; L801-L821 HydrophobicContact CD2-CD2 3.57Å; L801-V824 HydrophobicContact CD1-CG1 4.01Å; L801-V824 HydrophobicContact CD1-CG2 4.18Å; L801-V824 HydrophobicContact CD2-CG2 3.87Å; L801-L836 HydrophobicContact CD1-CD2 4.24Å; L801-L840 HydrophobicContact CB-CD1 4.15Å; L801-L840 HydrophobicContact CB-CD2 4.25Å; L801-L840 HydrophobicContact CD1-CD2 4.41Å
802	L	91.4	Very high	90.5	Very high	39 Å²	39	62.3 Å²	62.3	20%	0.204	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-46.4	174.2	-179.8	64.7	0	0	0	111.4	M798 A799 T800 V804 G805 N806 I813 F816	M798-L802 WeakPolarHBondContact O-CB 3.1Å; M798-L802 PolarHBondContact O-N 2.99Å; A799-L802 PolarHBondContact O-N 3.38Å; T800-L802 VanDerWaalsContact C-N 3.35Å; T800-L802 PolarHBondContact O-N 3.28Å; L802-V804 PolarHBondContact O-N 3.34Å; L802-G805 PolarHBondContact O-N 3.41Å; L802-N806 WeakPolarHBondContact O-CB 3.43Å; L802-N806 VanDerWaalsContact O-CG 3.29Å; L802-N806 PolarHBondContact O-N 3.37Å; L802-I813 HydrophobicContact CD1-CG1 4.19Å; L802-F816 HydrophobicContact CB-CD1 4.38Å; L802-F816 HydrophobicContact CB-CE1 4.07Å; L802-F816 HydrophobicContact CD1-CD1 3.92Å; L802-F816 HydrophobicContact CD1-CE1 4.45Å
803	S	91.8	Very high	90.4	Very high	82 Å²	82	57.8 Å²	57.8	57%	0.573	33%	0.333	S	S	*	.	H	α-helix	trans	-62.1	-43.5	178.7	-172.5	0	0	0	0	112.1	A799 T800 F807	A799-S803 PolarHBondContact O-N 3.16Å; T800-S803 PolarHBondContact O-N 2.93Å; S803-F807 WeakPolarHBondContact O-CB 3.38Å; S803-F807 PolarHBondContact O-N 3.47Å; S803-F807 VanDerWaalsContact O-N 3.1Å
804	V	90.6	Very high	90.2	Very high	30 Å²	30	69.3 Å²	69.3	18%	0.182	38%	0.376	C	S	.	.	H	α-helix	trans	-67.6	-42.2	177.2	175.6	0	0	0	0	110.6	T800 L801 L802 F807 L808 L836 I843	T800-V804 WeakPolarHBondContact O-CG2 3.49Å; T800-V804 PolarHBondContact O-N 3.25Å; L801-V804 PolarHBondContact O-N 3.43Å; L802-V804 PolarHBondContact O-N 3.34Å; V804-F807 PolarHBondContact O-N 3.13Å; V804-L808 HydrophobicContact CG1-CD1 3.92Å; V804-L808 HydrophobicContact CG1-CG 4.28Å; V804-L808 WeakPolarHBondContact O-CG 3.21Å; V804-L808 PolarHBondContact O-N 3.02Å; V804-L836 HydrophobicContact CG1-CD1 3.74Å; V804-I843 HydrophobicContact CG2-CD1 3.96Å
805	G	88.9	Confident	89.8	Confident	20 Å²	20	71.2 Å²	71.2	21%	0.206	40%	0.398	C	S	.	.	H	α-helix	trans	-61.1	-43.7	176.3	0	0	0	0	0	112.8	L801 L802 L808 N809	L801-G805 PolarHBondContact O-N 3.45Å; L802-G805 PolarHBondContact O-N 3.41Å; G805-L808 PolarHBondContact O-N 3.33Å; G805-N809 VanDerWaalsContact O-CB 3.29Å; G805-N809 WeakPolarHBondContact O-CB 3.46Å; G805-N809 VanDerWaalsContact O-CG 3.3Å; G805-N809 PolarHBondContact O-N 2.95Å; G805-N809 PolarHBondContact O-ND2 3.46Å; G805-N809 VanDerWaalsContact O-ND2 3.16Å
806	N	89	Confident	89.8	Confident	31 Å²	31	68.8 Å²	68.8	17%	0.166	39%	0.386	C	S	.	.	H	α-helix	trans	-62.9	-42.2	176.2	-75.2	-4.3	0	0	0	111.7	L802 G810 A811 I813	L802-N806 WeakPolarHBondContact O-CB 3.43Å; L802-N806 VanDerWaalsContact O-CG 3.29Å; L802-N806 PolarHBondContact O-N 3.37Å; N806-G810 PolarHBondContact O-N 2.97Å; N806-A811 VanDerWaalsContact CA-O 3.24Å; N806-A811 WeakPolarHBondContact CA-O 3.36Å; N806-A811 VanDerWaalsContact CB-O 3.26Å; N806-A811 WeakPolarHBondContact CB-O 3.36Å; N806-A811 VanDerWaalsContact CG-O 3.25Å; N806-A811 PolarHBondContact O-N 3.31Å; N806-A811 PolarHBondContact OD1-O 2.89Å; N806-I813 PolarHBondContact ND2-O 2.91Å; N806-I813 WeakPolarHBondContact OD1-CG1 3.27Å; N806-I813 PolarHBondContact OD1-N 2.86Å
807	F	91.8	Very high	89.6	Confident	173 Å²	173	71.9 Å²	71.9	76%	0.759	40%	0.401	S	S	*	.	H	α-helix	trans	-62	-48.2	175.3	175.7	-100.7	0	0	0	112.1	S803 V804 G810	S803-F807 WeakPolarHBondContact O-CB 3.38Å; S803-F807 PolarHBondContact O-N 3.47Å; S803-F807 VanDerWaalsContact O-N 3.1Å; V804-F807 PolarHBondContact O-N 3.13Å; F807-G810 PolarHBondContact O-N 3.45Å
808	L	89.3	Confident	89.4	Confident	105 Å²	105	72.3 Å²	72.3	55%	0.55	40%	0.403	S	S	.	.	H	α-helix	trans	-68.5	-34.1	-178.6	-68.8	177.2	0	0	0	113.1	V804 G805 L836	V804-L808 HydrophobicContact CG1-CD1 3.92Å; V804-L808 HydrophobicContact CG1-CG 4.28Å; V804-L808 WeakPolarHBondContact O-CG 3.21Å; V804-L808 PolarHBondContact O-N 3.02Å; G805-L808 PolarHBondContact O-N 3.33Å; L808-L836 HydrophobicContact CD1-CD1 4.18Å
809	N	87.7	Confident	89.2	Confident	96 Å²	96	74.4 Å²	74.4	51%	0.513	42%	0.415	S	S	.	.	H	α-helix	trans	-86.2	-13.3	179.8	-68.2	-33	0	0	0	113.5	G805 A811	G805-N809 VanDerWaalsContact O-CB 3.29Å; G805-N809 WeakPolarHBondContact O-CB 3.46Å; G805-N809 VanDerWaalsContact O-CG 3.3Å; G805-N809 PolarHBondContact O-N 2.95Å; G805-N809 PolarHBondContact O-ND2 3.46Å; G805-N809 VanDerWaalsContact O-ND2 3.16Å; N809-A811 HydrophobicContact CB-CB 4.42Å; N809-A811 PolarHBondContact O-N 3.42Å
810	G	87.7	Confident	89.1	Confident	74 Å²	74	76.1 Å²	76.1	76%	0.763	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	26.1	-173	0	0	0	0	0	113.4	N806 F807	N806-G810 PolarHBondContact O-N 2.97Å; F807-G810 PolarHBondContact O-N 3.45Å
811	A	83.2	Confident	89.2	Confident	46 Å²	46	75.3 Å²	75.3	38%	0.38	41%	0.405	S	S	.	.			trans	-132.8	137.4	-176.3	0	0	0	0	0	110.4	N806 N809 I813	N806-A811 VanDerWaalsContact CA-O 3.24Å; N806-A811 WeakPolarHBondContact CA-O 3.36Å; N806-A811 VanDerWaalsContact CB-O 3.26Å; N806-A811 WeakPolarHBondContact CB-O 3.36Å; N806-A811 VanDerWaalsContact CG-O 3.25Å; N806-A811 PolarHBondContact O-N 3.31Å; N806-A811 PolarHBondContact OD1-O 2.89Å; N809-A811 HydrophobicContact CB-CB 4.42Å; N809-A811 PolarHBondContact O-N 3.42Å; A811-I813 PolarHBondContact O-N 2.91Å
812	E	87.8	Confident	89.2	Confident	191 Å²	191	77.4 Å²	77.4	89%	0.893	42%	0.423	S	S	*	.			trans	-95.1	80	178.1	-166.6	176	-175.1	0	0	110.1
813	I	87.6	Confident	89.3	Confident	78 Å²	78	81.2 Å²	81.2	40%	0.4	44%	0.438	S	S	.	.			trans	-86.9	146.7	171.6	60.9	168.9	0	0	0	110.1	L802 N806 A811 F816	L802-I813 HydrophobicContact CD1-CG1 4.19Å; N806-I813 PolarHBondContact ND2-O 2.91Å; N806-I813 WeakPolarHBondContact OD1-CG1 3.27Å; N806-I813 PolarHBondContact OD1-N 2.86Å; A811-I813 PolarHBondContact O-N 2.91Å; I813-F816 HydrophobicContact CD1-CB 4.41Å
814	R	86.2	Confident	89.3	Confident	248 Å²	248	77.3 Å²	77.3	94%	0.936	41%	0.41	S	S	*	.	S	Bend	trans	-83.3	-12.1	-179.4	-68.2	-173.3	-71.7	-177.8	-2.9	114
815	G	85.3	Confident	89.4	Confident	49 Å²	49	77.8 Å²	77.8	51%	0.505	41%	0.414	S	S	.	.			trans	-178.3	161.6	-178.2	0	0	0	0	0	111.4
816	F	90.1	Very high	89.5	Confident	48 Å²	48	83.7 Å²	83.7	21%	0.211	44%	0.436	C	S	.	.			trans	-128.9	158.7	176.8	61.2	-92.2	0	0	0	109.7	M798 L801 L802 I813 L821	M798-F816 HydrophobicContact SD-CE2 4.46Å; M798-F816 HydrophobicContact SD-CZ 3.95Å; L801-F816 HydrophobicContact CB-CZ 4.41Å; L801-F816 HydrophobicContact CD2-CE1 4.35Å; L801-F816 HydrophobicContact CD2-CE2 4.07Å; L801-F816 HydrophobicContact CD2-CZ 3.61Å; L801-F816 HydrophobicContact CG-CE1 4.23Å; L801-F816 HydrophobicContact CG-CZ 3.98Å; L802-F816 HydrophobicContact CB-CD1 4.38Å; L802-F816 HydrophobicContact CB-CE1 4.07Å; L802-F816 HydrophobicContact CD1-CD1 3.92Å; L802-F816 HydrophobicContact CD1-CE1 4.45Å; I813-F816 HydrophobicContact CD1-CB 4.41Å; F816-L821 HydrophobicContact CE2-CD2 4Å; F816-L821 HydrophobicContact CZ-CD2 4.42Å
817	Q	89.1	Confident	89.6	Confident	91 Å²	91	84.9 Å²	84.9	43%	0.425	45%	0.445	S	S	.	.			trans	-75.2	140.2	179.5	-65	176.2	17.3	0	0	111	D819 Y820 M939	Q817-D819 PolarHBondContact O-N 3.38Å; Q817-D819 VanDerWaalsContact O-N 3.12Å; Q817-Y820 WeakPolarHBondContact O-CB 3.38Å; Q817-Y820 PolarHBondContact O-N 3.44Å; Q817-M939 HydrophobicContact CB-SD 4.49Å
818	I	88.7	Confident	89.6	Confident	9 Å²	9	83.3 Å²	83.3	5%	0.046	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-54.2	-33.9	-178.7	-71.1	170.2	0	0	0	112.4	Y820 L821 M937 I952 I956	I818-Y820 PolarHBondContact O-N 2.9Å; I818-L821 HydrophobicContact CG2-CD1 4.16Å; I818-L821 VanDerWaalsContact O-CB 3.27Å; I818-L821 WeakPolarHBondContact O-CB 3.41Å; I818-L821 VanDerWaalsContact O-CG 3.28Å; I818-L821 WeakPolarHBondContact O-CG 3.36Å; I818-L821 PolarHBondContact O-N 2.97Å; I818-M937 HydrophobicContact CD1-CB 3.43Å; I818-M937 VanDerWaalsContact CD1-CB 3.43Å; I818-M937 HydrophobicContact CD1-CG 3.61Å; I818-M937 HydrophobicContact CD1-SD 3.97Å; I818-M937 HydrophobicContact CG1-CB 4.29Å; I818-I952 HydrophobicContact CG2-CG2 4.28Å; I818-I956 HydrophobicContact CD1-CD1 4.45Å; I818-I956 HydrophobicContact CG2-CD1 4.12Å; I818-I956 HydrophobicContact CG2-CG1 3.78Å
819	D	88.8	Confident	89.6	Confident	71 Å²	71	80 Å²	80	38%	0.38	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-57	-23.3	179.2	-62	-16.6	0	0	0	113.3	Q817 L821 A822	Q817-D819 PolarHBondContact O-N 3.38Å; Q817-D819 VanDerWaalsContact O-N 3.12Å; D819-L821 PolarHBondContact O-N 3.42Å; D819-A822 PolarHBondContact O-N 2.87Å
820	Y	91.1	Very high	89.8	Confident	95 Å²	95	82 Å²	82	37%	0.373	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-67.1	-22.6	176	-168.9	-103.6	0	0	0	113	Q817 I818 A822 K823 V824	Q817-Y820 WeakPolarHBondContact O-CB 3.38Å; Q817-Y820 PolarHBondContact O-N 3.44Å; I818-Y820 PolarHBondContact O-N 2.9Å; Y820-A822 PolarHBondContact O-N 3.28Å; Y820-A822 VanDerWaalsContact O-N 3.14Å; Y820-K823 HydrophobicContact CD2-CB 4.3Å; Y820-K823 HydrophobicContact CD2-CD 4.09Å; Y820-K823 HydrophobicContact CE2-CB 4.19Å; Y820-K823 HydrophobicContact CE2-CD 4.12Å; Y820-K823 WeakPolarHBondContact O-CB 3.43Å; Y820-K823 PolarHBondContact O-N 3.14Å; Y820-V824 HydrophobicContact CD1-CG2 4.02Å; Y820-V824 HydrophobicContact CE1-CG2 4.1Å; Y820-V824 PolarHBondContact O-N 2.75Å
821	L	93.4	Very high	89.8	Confident	0 Å²	0	83.5 Å²	83.5	0%	0	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-56	-31.2	177.1	-66.5	-177.6	0	0	0	112.4	M798 L801 F816 I818 D819 K823 V824 P825 T955 I956 F959	M798-L821 HydrophobicContact CE-CD1 4.3Å; M798-L821 HydrophobicContact CE-CD2 3.8Å; M798-L821 HydrophobicContact SD-CD1 4.33Å; M798-L821 HydrophobicContact SD-CD2 4.02Å; L801-L821 HydrophobicContact CD2-CD2 3.57Å; F816-L821 HydrophobicContact CE2-CD2 4Å; F816-L821 HydrophobicContact CZ-CD2 4.42Å; I818-L821 HydrophobicContact CG2-CD1 4.16Å; I818-L821 VanDerWaalsContact O-CB 3.27Å; I818-L821 WeakPolarHBondContact O-CB 3.41Å; I818-L821 VanDerWaalsContact O-CG 3.28Å; I818-L821 WeakPolarHBondContact O-CG 3.36Å; I818-L821 PolarHBondContact O-N 2.97Å; D819-L821 PolarHBondContact O-N 3.42Å; L821-K823 PolarHBondContact O-N 3.49Å; L821-V824 HydrophobicContact CD2-CG2 4.49Å; L821-V824 PolarHBondContact O-N 2.89Å; L821-P825 VanDerWaalsContact O-CD 3.31Å; L821-P825 WeakPolarHBondContact O-CD 3.36Å; L821-T955 HydrophobicContact CB-CG2 4.01Å; L821-I956 HydrophobicContact CD1-CG1 4.42Å; L821-F959 HydrophobicContact CB-CB 4.06Å; L821-F959 HydrophobicContact CB-CD2 4.16Å; L821-F959 HydrophobicContact CB-CG 4.07Å; L821-F959 HydrophobicContact CD1-CB 4.43Å; L821-F959 HydrophobicContact CD1-CD1 4.16Å; L821-F959 HydrophobicContact CD1-CG 4.24Å; L821-F959 HydrophobicContact CD2-CD1 4.27Å; L821-F959 HydrophobicContact CD2-CD2 4.12Å; L821-F959 HydrophobicContact CD2-CE1 4.26Å; L821-F959 HydrophobicContact CD2-CE2 4.1Å; L821-F959 HydrophobicContact CD2-CG 4.2Å; L821-F959 HydrophobicContact CD2-CZ 4.17Å; L821-F959 HydrophobicContact CG-CG 4.41Å
822	A	92.9	Very high	90	Very high	50 Å²	50	89.3 Å²	89.3	41%	0.413	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-63.9	-27.4	175.1	0	0	0	0	0	113.3	D819 Y820 T955	D819-A822 PolarHBondContact O-N 2.87Å; Y820-A822 PolarHBondContact O-N 3.28Å; Y820-A822 VanDerWaalsContact O-N 3.14Å; A822-T955 HydrophobicContact CB-CG2 4.26Å
823	K	93.6	Very high	89.9	Confident	119 Å²	119	88 Å²	88	52%	0.517	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-18.8	-179.1	-61.6	-174	179.2	-178.5	0	113.4	Y820 L821 E826 V827	Y820-K823 HydrophobicContact CD2-CB 4.3Å; Y820-K823 HydrophobicContact CD2-CD 4.09Å; Y820-K823 HydrophobicContact CE2-CB 4.19Å; Y820-K823 HydrophobicContact CE2-CD 4.12Å; Y820-K823 WeakPolarHBondContact O-CB 3.43Å; Y820-K823 PolarHBondContact O-N 3.14Å; L821-K823 PolarHBondContact O-N 3.49Å; K823-E826 WeakPolarHBondContact O-CB 3.39Å; K823-E826 PolarHBondContact O-N 3.29Å; K823-V827 PolarHBondContact O-N 3.4Å
824	V	93.1	Very high	90.1	Very high	0 Å²	0	87.2 Å²	87.2	0%	0	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-40.9	-177.7	-176.7	0	0	0	0	112.3	L801 Y820 L821 E826 L836 V837 F959	L801-V824 HydrophobicContact CD1-CG1 4.01Å; L801-V824 HydrophobicContact CD1-CG2 4.18Å; L801-V824 HydrophobicContact CD2-CG2 3.87Å; Y820-V824 HydrophobicContact CD1-CG2 4.02Å; Y820-V824 HydrophobicContact CE1-CG2 4.1Å; Y820-V824 PolarHBondContact O-N 2.75Å; L821-V824 HydrophobicContact CD2-CG2 4.49Å; L821-V824 PolarHBondContact O-N 2.89Å; V824-E826 VanDerWaalsContact C-N 3.25Å; V824-E826 PolarHBondContact O-N 3.37Å; V824-L836 HydrophobicContact CG1-CB 4.15Å; V824-L836 HydrophobicContact CG1-CD2 4.06Å; V824-L836 HydrophobicContact CG1-CG 4.07Å; V824-V837 HydrophobicContact CB-CG2 4.33Å; V824-V837 HydrophobicContact CG1-CG2 3.72Å; V824-F959 HydrophobicContact CB-CE2 4.24Å; V824-F959 HydrophobicContact CG1-CE2 4.14Å
825	P	91.9	Very high	90.5	Very high	39 Å²	39	76.7 Å²	76.7	25%	0.253	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.3	174.6	-21.4	33.3	0	0	0	114.5	L821 S835 V837 E962	L821-P825 VanDerWaalsContact O-CD 3.31Å; L821-P825 WeakPolarHBondContact O-CD 3.36Å; P825-S835 WeakPolarHBondContact O-CB 3.26Å; P825-V837 HydrophobicContact CB-CG2 4.2Å; P825-V837 HydrophobicContact CG-CG2 3.98Å; P825-E962 HydrophobicContact CB-CG 4.48Å; P825-E962 HydrophobicContact CG-CG 4.28Å
826	E	91.2	Very high	90.8	Very high	144 Å²	144	75.2 Å²	75.2	67%	0.673	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-30.2	-176.2	-58	-179.7	-173.2	0	0	112.8	K823 V824 K828	K823-E826 WeakPolarHBondContact O-CB 3.39Å; K823-E826 PolarHBondContact O-N 3.29Å; V824-E826 VanDerWaalsContact C-N 3.25Å; V824-E826 PolarHBondContact O-N 3.37Å; E826-K828 PolarHBondContact O-N 2.86Å
827	V	91.7	Very high	91.1	Very high	57 Å²	57	73 Å²	73	35%	0.345	37%	0.365	S	S	.	.			trans	-71	121.9	178.4	-179.2	0	0	0	0	109	K823 S835 L836	K823-V827 PolarHBondContact O-N 3.4Å; V827-S835 CarbonylContact O-C 3.55Å; V827-S835 VanDerWaalsContact O-CA 3.27Å; V827-S835 WeakPolarHBondContact O-CA 3.44Å; V827-L836 HydrophobicContact CB-CB 4.05Å; V827-L836 HydrophobicContact CB-CD2 4.38Å; V827-L836 HydrophobicContact CG1-CB 4.25Å; V827-L836 HydrophobicContact CG1-CD2 4.37Å; V827-L836 PolarHBondContact O-N 3.08Å
828	K	91.3	Very high	91.3	Very high	140 Å²	140	70.9 Å²	70.9	61%	0.609	35%	0.353	S	S	*	.	B	Isolated β-bridge	trans	-120.8	148.8	179.5	-64.2	178.5	-176.6	-178.8	0	111.3	E826 H834	E826-K828 PolarHBondContact O-N 2.86Å; K828-H834 CarbonylContact C-O 3.59Å; K828-H834 VanDerWaalsContact CA-O 3.23Å; K828-H834 WeakPolarHBondContact CA-O 3.24Å
829	D	90.1	Very high	91.5	Very high	35 Å²	35	73.6 Å²	73.6	19%	0.187	37%	0.365	C	S	.	.			trans	-68.4	163	170.8	77.5	52.2	0	0	0	111.7	V831 Y832 K833 H834 H839	D829-V831 PolarHBondContact OD1-N 3.32Å; D829-Y832 WeakPolarHBondContact OD1-CA 3.37Å; D829-Y832 PolarHBondContact OD1-N 3.24Å; D829-K833 WeakPolarHBondContact O-CA 3.47Å; D829-K833 PolarHBondContact OD1-N 2.97Å; D829-H834 PolarHBondContact N-O 3.15Å; D829-H834 WeakPolarHBondContact OD2-CB 3.47Å; D829-H834 IonicContact OD2-CG 2.73Å; D829-H834 PolarHBondContact OD2-N 3.41Å; D829-H834 VanDerWaalsContact OD2-N 3.15Å; D829-H839 IonicContact OD2-CD2 3.93Å; D829-H839 IonicContact OD2-CE1 3.09Å; D829-H839 IonicContact OD2-NE2 3.76Å; D829-H839 PolarHBondContact OD2-NE2 3.09Å
830	T	90.6	Very high	91.8	Very high	139 Å²	139	70.3 Å²	70.3	85%	0.853	35%	0.348	S	S	*	.	S	Bend	trans	-89	-11.4	-177.9	55.4	0	0	0	0	114
831	V	88.4	Confident	91.9	Very high	105 Å²	105	65.8 Å²	65.8	64%	0.636	33%	0.33	S	S	*	.	S	Bend	trans	-101.4	-57.6	-168.6	-177.8	0	0	0	0	111.2	D829	D829-V831 PolarHBondContact OD1-N 3.32Å
832	Y	86.6	Confident	91.8	Very high	168 Å²	168	66.5 Å²	66.5	66%	0.659	34%	0.335	S	S	*	.	S	Bend	trans	-104.7	-5	-179.2	-56.1	-66.4	0	0	0	112.5	D829 H834	D829-Y832 WeakPolarHBondContact OD1-CA 3.37Å; D829-Y832 PolarHBondContact OD1-N 3.24Å; Y832-H834 PolarHBondContact O-CD2 3.14Å; Y832-H834 PolarHBondContact O-N 2.83Å
833	K	87.3	Confident	91.8	Very high	164 Å²	164	66.5 Å²	66.5	71%	0.713	33%	0.328	S	S	*	.			trans	58.1	25.5	-174.6	-56.5	-176.4	177.7	-178.6	0	113.1	D829	D829-K833 WeakPolarHBondContact O-CA 3.47Å; D829-K833 PolarHBondContact OD1-N 2.97Å
834	H	91.1	Very high	91.7	Very high	60 Å²	60	60.9 Å²	60.9	28%	0.278	30%	0.303	S	S	.	.			trans	-74.8	146.7	174.6	-61.9	168.4	0	0	0	110.4	K828 D829 Y832 Y838	K828-H834 CarbonylContact C-O 3.59Å; K828-H834 VanDerWaalsContact CA-O 3.23Å; K828-H834 WeakPolarHBondContact CA-O 3.24Å; D829-H834 PolarHBondContact N-O 3.15Å; D829-H834 WeakPolarHBondContact OD2-CB 3.47Å; D829-H834 IonicContact OD2-CG 2.73Å; D829-H834 PolarHBondContact OD2-N 3.41Å; D829-H834 VanDerWaalsContact OD2-N 3.15Å; Y832-H834 PolarHBondContact O-CD2 3.14Å; Y832-H834 PolarHBondContact O-N 2.83Å; H834-Y838 HydrophobicContact CB-CD1 3.77Å; H834-Y838 HydrophobicContact CB-CE1 4.44Å; H834-Y838 HydrophobicContact CB-CG 3.85Å; H834-Y838 AromaticContact CE1-CE1 3.76Å; H834-Y838 AromaticContact CE1-CZ 3.65Å; H834-Y838 AromaticContact CG-CD1 3.86Å; H834-Y838 AromaticContact ND1-CD1 3.41Å; H834-Y838 WeakPolarHBondContact ND1-CD1 3.49Å; H834-Y838 AromaticContact ND1-CE1 3.17Å; H834-Y838 WeakPolarHBondContact ND1-CE1 3.23Å; H834-Y838 AromaticContact ND1-CG 3.99Å; H834-Y838 AromaticContact ND1-CZ 3.53Å
835	S	94.1	Very high	91.5	Very high	28 Å²	28	62.1 Å²	62.1	20%	0.196	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-70.2	159	178.1	61.1	0	0	0	0	111.9	P825 V827 V837 Y838 H839	P825-S835 WeakPolarHBondContact O-CB 3.26Å; V827-S835 CarbonylContact O-C 3.55Å; V827-S835 VanDerWaalsContact O-CA 3.27Å; V827-S835 WeakPolarHBondContact O-CA 3.44Å; S835-V837 PolarHBondContact O-N 3.19Å; S835-Y838 WeakPolarHBondContact O-CA 3.33Å; S835-Y838 VanDerWaalsContact O-CB 3.23Å; S835-Y838 WeakPolarHBondContact O-CB 3.29Å; S835-Y838 PolarHBondContact O-N 3.39Å; S835-Y838 PolarHBondContact OG-N 2.96Å; S835-H839 PolarHBondContact O-CD2 2.83Å; S835-H839 PolarHBondContact O-N 2.78Å
836	L	92.5	Very high	91.4	Very high	17 Å²	17	66.1 Å²	66.1	9%	0.089	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-31.8	173.5	-176.5	58.2	0	0	0	111.2	L801 V804 L808 V824 V827 Y838 H839 L840	L801-L836 HydrophobicContact CD1-CD2 4.24Å; V804-L836 HydrophobicContact CG1-CD1 3.74Å; L808-L836 HydrophobicContact CD1-CD1 4.18Å; V824-L836 HydrophobicContact CG1-CB 4.15Å; V824-L836 HydrophobicContact CG1-CD2 4.06Å; V824-L836 HydrophobicContact CG1-CG 4.07Å; V827-L836 HydrophobicContact CB-CB 4.05Å; V827-L836 HydrophobicContact CB-CD2 4.38Å; V827-L836 HydrophobicContact CG1-CB 4.25Å; V827-L836 HydrophobicContact CG1-CD2 4.37Å; V827-L836 PolarHBondContact O-N 3.08Å; L836-Y838 VanDerWaalsContact C-N 3.29Å; L836-Y838 PolarHBondContact O-N 3.19Å; L836-H839 PolarHBondContact O-N 3.45Å; L836-L840 WeakPolarHBondContact O-CB 3.47Å; L836-L840 PolarHBondContact O-N 3.31Å
837	V	95.1	Very high	91.2	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-36.9	171.6	-175.8	0	0	0	0	111.9	V824 P825 S835 L840 A841 F959 Y963 C966	V824-V837 HydrophobicContact CB-CG2 4.33Å; V824-V837 HydrophobicContact CG1-CG2 3.72Å; P825-V837 HydrophobicContact CB-CG2 4.2Å; P825-V837 HydrophobicContact CG-CG2 3.98Å; S835-V837 PolarHBondContact O-N 3.19Å; V837-L840 PolarHBondContact O-N 2.9Å; V837-A841 WeakPolarHBondContact O-CB 3.17Å; V837-A841 PolarHBondContact O-N 3.41Å; V837-F959 HydrophobicContact CG2-CE2 4.45Å; V837-Y963 HydrophobicContact CG1-CD2 4.34Å; V837-C966 HydrophobicContact CG1-CB 3.87Å
838	Y	94.1	Very high	91.1	Very high	47 Å²	47	64.6 Å²	64.6	18%	0.184	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-45.4	175.9	-179.9	-83.1	0	0	0	112	H834 S835 L836 A841 S842 C966 I970 Q973	H834-Y838 HydrophobicContact CB-CD1 3.77Å; H834-Y838 HydrophobicContact CB-CE1 4.44Å; H834-Y838 HydrophobicContact CB-CG 3.85Å; H834-Y838 AromaticContact CE1-CE1 3.76Å; H834-Y838 AromaticContact CE1-CZ 3.65Å; H834-Y838 AromaticContact CG-CD1 3.86Å; H834-Y838 AromaticContact ND1-CD1 3.41Å; H834-Y838 WeakPolarHBondContact ND1-CD1 3.49Å; H834-Y838 AromaticContact ND1-CE1 3.17Å; H834-Y838 WeakPolarHBondContact ND1-CE1 3.23Å; H834-Y838 AromaticContact ND1-CG 3.99Å; H834-Y838 AromaticContact ND1-CZ 3.53Å; S835-Y838 WeakPolarHBondContact O-CA 3.33Å; S835-Y838 VanDerWaalsContact O-CB 3.23Å; S835-Y838 WeakPolarHBondContact O-CB 3.29Å; S835-Y838 PolarHBondContact O-N 3.39Å; S835-Y838 PolarHBondContact OG-N 2.96Å; L836-Y838 VanDerWaalsContact C-N 3.29Å; L836-Y838 PolarHBondContact O-N 3.19Å; Y838-A841 PolarHBondContact O-N 3.09Å; Y838-S842 WeakPolarHBondContact O-CB 3.31Å; Y838-S842 PolarHBondContact O-N 2.87Å; Y838-S842 PolarHBondContact O-OG 3.39Å; Y838-C966 WeakPolarHBondContact CA-SG 3.39Å; Y838-I970 HydrophobicContact CD2-CD1 3.76Å; Y838-I970 HydrophobicContact CD2-CG1 3.57Å; Y838-I970 HydrophobicContact CE2-CD1 3.98Å; Y838-I970 HydrophobicContact CE2-CG1 3.31Å; Y838-I970 HydrophobicContact CG-CD1 4.1Å; Y838-I970 HydrophobicContact CG-CG1 4.34Å; Y838-I970 WeakPolarHBondContact O-CD1 3.35Å; Y838-Q973 PolarHBondContact OH-OE1 2.87Å
839	H	93.6	Very high	90.5	Very high	65 Å²	65	62.1 Å²	62.1	30%	0.301	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-42.8	176.3	-68.8	-63.3	0	0	0	110.9	D829 S835 L836 S842 I843	D829-H839 IonicContact OD2-CD2 3.93Å; D829-H839 IonicContact OD2-CE1 3.09Å; D829-H839 IonicContact OD2-NE2 3.76Å; D829-H839 PolarHBondContact OD2-NE2 3.09Å; S835-H839 PolarHBondContact O-CD2 2.83Å; S835-H839 PolarHBondContact O-N 2.78Å; L836-H839 PolarHBondContact O-N 3.45Å; H839-S842 PolarHBondContact O-N 3.34Å; H839-I843 VanDerWaalsContact O-CG1 3.25Å; H839-I843 WeakPolarHBondContact O-CG1 3.33Å; H839-I843 PolarHBondContact O-N 3.43Å
840	L	94	Very high	89.9	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-58.5	-50.7	175.2	-177.1	62.4	0	0	0	112	V797 T800 L801 L836 V837 S842 I843 M844 F959 Y963	V797-L840 HydrophobicContact CG1-CD2 3.76Å; V797-L840 HydrophobicContact CG1-CG 4.32Å; T800-L840 HydrophobicContact CG2-CD1 3.53Å; L801-L840 HydrophobicContact CB-CD1 4.15Å; L801-L840 HydrophobicContact CB-CD2 4.25Å; L801-L840 HydrophobicContact CD1-CD2 4.41Å; L836-L840 WeakPolarHBondContact O-CB 3.47Å; L836-L840 PolarHBondContact O-N 3.31Å; V837-L840 PolarHBondContact O-N 2.9Å; L840-S842 VanDerWaalsContact C-N 3.31Å; L840-S842 PolarHBondContact O-N 3.27Å; L840-I843 PolarHBondContact O-N 3.41Å; L840-M844 WeakPolarHBondContact O-CB 3.45Å; L840-M844 WeakPolarHBondContact O-CG 3.32Å; L840-M844 PolarHBondContact O-N 3.12Å; L840-F959 HydrophobicContact CD2-CE2 4.39Å; L840-F959 HydrophobicContact CD2-CZ 3.86Å; L840-Y963 HydrophobicContact CD2-CD2 4.44Å; L840-Y963 HydrophobicContact CG-CE2 4.3Å
841	A	93.2	Very high	89.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-34.8	177.9	0	0	0	0	0	112.3	V837 Y838 M844 L845 Y963 R967 I970	V837-A841 WeakPolarHBondContact O-CB 3.17Å; V837-A841 PolarHBondContact O-N 3.41Å; Y838-A841 PolarHBondContact O-N 3.09Å; A841-M844 PolarHBondContact O-N 3.24Å; A841-L845 WeakPolarHBondContact O-CB 3.41Å; A841-L845 VanDerWaalsContact O-CG 3.27Å; A841-L845 WeakPolarHBondContact O-CG 3.24Å; A841-L845 PolarHBondContact O-N 2.9Å; A841-Y963 HydrophobicContact CB-CD2 4.24Å; A841-Y963 HydrophobicContact CB-CE2 3.82Å; A841-R967 HydrophobicContact CB-CB 4.18Å; A841-I970 HydrophobicContact CB-CD1 3.55Å
842	S	92	Very high	89.1	Confident	15 Å²	15	59 Å²	59	11%	0.105	29%	0.292	C	S	.	.	H	α-helix	trans	-65.8	-46.8	175.6	-62.7	0	0	0	0	111.9	Y838 H839 L840 M844 L845 E846 I970	Y838-S842 WeakPolarHBondContact O-CB 3.31Å; Y838-S842 PolarHBondContact O-N 2.87Å; Y838-S842 PolarHBondContact O-OG 3.39Å; H839-S842 PolarHBondContact O-N 3.34Å; L840-S842 VanDerWaalsContact C-N 3.31Å; L840-S842 PolarHBondContact O-N 3.27Å; S842-M844 VanDerWaalsContact C-N 3.33Å; S842-M844 PolarHBondContact O-N 3.31Å; S842-L845 PolarHBondContact O-N 3.49Å; S842-E846 WeakPolarHBondContact O-CG 3.49Å; S842-E846 PolarHBondContact O-N 3.37Å; S842-E846 VanDerWaalsContact O-N 3.14Å; S842-I970 WeakPolarHBondContact OG-CD1 3.47Å
843	I	92	Very high	89.1	Confident	51 Å²	51	52.7 Å²	52.7	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-42.7	176.4	-65.8	164	0	0	0	110.3	T800 V804 H839 L840 L845 E846 N847	T800-I843 HydrophobicContact CG2-CB 4.2Å; T800-I843 HydrophobicContact CG2-CG2 3.63Å; V804-I843 HydrophobicContact CG2-CD1 3.96Å; H839-I843 VanDerWaalsContact O-CG1 3.25Å; H839-I843 WeakPolarHBondContact O-CG1 3.33Å; H839-I843 PolarHBondContact O-N 3.43Å; L840-I843 PolarHBondContact O-N 3.41Å; I843-L845 PolarHBondContact O-N 2.87Å; I843-E846 PolarHBondContact O-N 2.8Å; I843-N847 WeakPolarHBondContact CG2-ND2 3.29Å; I843-N847 WeakPolarHBondContact O-CB 3.48Å; I843-N847 PolarHBondContact O-N 3.21Å
844	M	91.6	Very high	89.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-42.3	177.1	-75.5	-70.9	-56.5	0	0	112.3	T793 Q796 V797 L840 A841 S842 E846 F848 Y963	T793-M844 HydrophobicContact CG2-CE 4.49Å; Q796-M844 HydrophobicContact CB-CE 3.78Å; Q796-M844 HydrophobicContact CB-SD 4.13Å; V797-M844 HydrophobicContact CG2-CE 3.55Å; V797-M844 HydrophobicContact CG2-CG 4.22Å; V797-M844 HydrophobicContact CG2-SD 3.95Å; L840-M844 WeakPolarHBondContact O-CB 3.45Å; L840-M844 WeakPolarHBondContact O-CG 3.32Å; L840-M844 PolarHBondContact O-N 3.12Å; A841-M844 PolarHBondContact O-N 3.24Å; S842-M844 VanDerWaalsContact C-N 3.33Å; S842-M844 PolarHBondContact O-N 3.31Å; M844-E846 VanDerWaalsContact C-N 3.26Å; M844-E846 PolarHBondContact O-N 3.29Å; M844-F848 HydrophobicContact CE-CB 4.39Å; M844-F848 HydrophobicContact CE-CD2 4.01Å; M844-F848 CarbonylContact O-C 3.49Å; M844-F848 VanDerWaalsContact O-C 3.23Å; M844-F848 VanDerWaalsContact O-CA 3.31Å; M844-F848 WeakPolarHBondContact O-CA 3.29Å; M844-F848 WeakPolarHBondContact O-CB 3.47Å; M844-F848 PolarHBondContact O-N 3.37Å; M844-F848 VanDerWaalsContact O-O 3.1Å; M844-F848 HydrophobicContact SD-CD2 3.66Å; M844-F848 HydrophobicContact SD-CE2 4.12Å; M844-Y963 WeakPolarHBondContact CB-OH 3.34Å; M844-Y963 HydrophobicContact CG-CE2 4.32Å; M844-Y963 VanDerWaalsContact CG-OH 3.31Å; M844-Y963 WeakPolarHBondContact CG-OH 3.13Å
845	L	89.3	Confident	89	Confident	26 Å²	26	45 Å²	45	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-66.6	-26.1	176.1	-75.4	169.2	0	0	0	113.4	A841 S842 I843 R967 I970 I971	A841-L845 WeakPolarHBondContact O-CB 3.41Å; A841-L845 VanDerWaalsContact O-CG 3.27Å; A841-L845 WeakPolarHBondContact O-CG 3.24Å; A841-L845 PolarHBondContact O-N 2.9Å; S842-L845 PolarHBondContact O-N 3.49Å; I843-L845 PolarHBondContact O-N 2.87Å; L845-R967 HydrophobicContact CD1-CG 4.14Å; L845-R967 HydrophobicContact CD2-CG 4.08Å; L845-R967 HydrophobicContact CG-CG 4.19Å; L845-I970 HydrophobicContact CD1-CB 4.11Å; L845-I970 HydrophobicContact CD1-CG2 3.66Å; L845-I971 HydrophobicContact CD1-CG1 3.94Å; L845-I971 HydrophobicContact CD2-CD1 4.08Å; L845-I971 HydrophobicContact CD2-CG1 4.08Å
846	E	88.8	Confident	88.7	Confident	123 Å²	123	47.4 Å²	47.4	58%	0.575	25%	0.251	S	S	*	.	H	α-helix	trans	-85.8	-45	179.5	-74.4	168.2	-160	0	0	112.3	S842 I843 M844 R974	S842-E846 WeakPolarHBondContact O-CG 3.49Å; S842-E846 PolarHBondContact O-N 3.37Å; S842-E846 VanDerWaalsContact O-N 3.14Å; I843-E846 PolarHBondContact O-N 2.8Å; M844-E846 VanDerWaalsContact C-N 3.26Å; M844-E846 PolarHBondContact O-N 3.29Å; E846-R974 IonicContact OE1-CZ 3.86Å; E846-R974 IonicContact OE1-NH2 3.83Å; E846-R974 PolarHBondContact OE1-NH2 2.94Å
847	N	88.4	Confident	88.5	Confident	105 Å²	105	49.8 Å²	49.8	56%	0.561	26%	0.262	S	S	*	.	H	α-helix	trans	-87.6	-28.2	-176	-69.1	-18.4	0	0	0	113.3	I843	I843-N847 WeakPolarHBondContact CG2-ND2 3.29Å; I843-N847 WeakPolarHBondContact O-CB 3.48Å; I843-N847 PolarHBondContact O-N 3.21Å
848	F	88.8	Confident	88.2	Confident	65 Å²	65	49.8 Å²	49.8	29%	0.285	26%	0.262	S	S	.	.			trans	-133.8	69.3	-175.5	-51.4	-70.4	0	0	0	110.4	Q796 M844 D850 S851	Q796-F848 HydrophobicContact CB-CD2 4.36Å; Q796-F848 HydrophobicContact CB-CE2 4.33Å; Q796-F848 HydrophobicContact CG-CD1 4.42Å; Q796-F848 HydrophobicContact CG-CE1 4.33Å; Q796-F848 HydrophobicContact CG-CE2 4.46Å; Q796-F848 HydrophobicContact CG-CZ 4.34Å; Q796-F848 VanDerWaalsContact NE2-CD1 3.33Å; M844-F848 HydrophobicContact CE-CB 4.39Å; M844-F848 HydrophobicContact CE-CD2 4.01Å; M844-F848 CarbonylContact O-C 3.49Å; M844-F848 VanDerWaalsContact O-C 3.23Å; M844-F848 VanDerWaalsContact O-CA 3.31Å; M844-F848 WeakPolarHBondContact O-CA 3.29Å; M844-F848 WeakPolarHBondContact O-CB 3.47Å; M844-F848 PolarHBondContact O-N 3.37Å; M844-F848 VanDerWaalsContact O-O 3.1Å; M844-F848 HydrophobicContact SD-CD2 3.66Å; M844-F848 HydrophobicContact SD-CE2 4.12Å; F848-D850 PolarHBondContact O-N 3.31Å; F848-S851 WeakPolarHBondContact O-CB 3.34Å; F848-S851 PolarHBondContact O-N 3.29Å; F848-S851 PolarHBondContact O-OG 3.49Å
849	P	78.4	Confident	88.1	Confident	88 Å²	88	49.2 Å²	49.2	57%	0.571	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-28.8	-179.5	25.1	-34.5	0	0	0	112.8	S851	P849-S851 PolarHBondContact O-N 2.94Å
850	D	78.3	Confident	88.1	Confident	150 Å²	150	46.1 Å²	46.1	80%	0.802	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	5.4	177.1	-55.8	-31.1	0	0	0	113.6	F848 T852	F848-D850 PolarHBondContact O-N 3.31Å; D850-T852 PolarHBondContact O-N 2.92Å
851	S	81	Confident	88.2	Confident	7 Å²	7	46 Å²	46	5%	0.049	26%	0.255	C	S	.	.			trans	-60	132.5	174.8	56.9	0	0	0	0	111.5	F848 P849 R967	F848-S851 WeakPolarHBondContact O-CB 3.34Å; F848-S851 PolarHBondContact O-N 3.29Å; F848-S851 PolarHBondContact O-OG 3.49Å; P849-S851 PolarHBondContact O-N 2.94Å; S851-R967 PolarHBondContact O-NH2 3.5Å
852	T	81.7	Confident	88.2	Confident	55 Å²	55	46.8 Å²	46.8	34%	0.337	26%	0.261	S	S	.	.			trans	-79.7	174.2	179.2	52	0	0	0	0	111.8	T793 D850 L854 E857	T793-T852 WeakPolarHBondContact CB-OG1 3.27Å; T793-T852 PolarHBondContact OG1-N 2.92Å; T793-T852 PolarHBondContact OG1-OG1 3.35Å; D850-T852 PolarHBondContact O-N 2.92Å; T852-L854 PolarHBondContact O-N 3.05Å; T852-E857 WeakPolarHBondContact CB-OE1 3.42Å; T852-E857 WeakPolarHBondContact CG2-OE1 3.1Å; T852-E857 PolarHBondContact OG1-OE1 3.11Å; T852-E857 PolarHBondContact OG1-OE2 3.13Å
853	D	85.1	Confident	88.4	Confident	37 Å²	37	51.9 Å²	51.9	20%	0.198	28%	0.278	C	S	.	.			trans	-78.2	103.8	172.6	178.8	19.7	0	0	0	110.6	Y855 S856 E857 R964	D853-Y855 VanDerWaalsContact C-N 3.27Å; D853-Y855 PolarHBondContact O-N 3.41Å; D853-Y855 PolarHBondContact OD1-N 3.05Å; D853-S856 PolarHBondContact O-N 3.37Å; D853-S856 WeakPolarHBondContact OD2-CB 3.08Å; D853-S856 PolarHBondContact OD2-OG 3.35Å; D853-E857 PolarHBondContact O-N 2.92Å; D853-E857 VanDerWaalsContact O-N 3.15Å; D853-R964 WeakPolarHBondContact OD1-CD 3.29Å; D853-R964 VanDerWaalsContact OD1-CG 3.27Å; D853-R964 WeakPolarHBondContact OD1-CG 3.43Å; D853-R964 WeakPolarHBondContact OD2-CD 3.36Å; D853-R964 IonicContact OD2-CZ 2.72Å; D853-R964 IonicContact OD2-NE 3.14Å; D853-R964 PolarHBondContact OD2-NE 2.85Å; D853-R964 IonicContact OD2-NH1 3.64Å
854	L	87.2	Confident	88.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-50.7	-43.4	-176.6	-170.2	70.5	0	0	0	113.1	T793 F794 V797 T852 E857 M858 F959 A960 Y963	T793-L854 HydrophobicContact CG2-CB 4.37Å; T793-L854 HydrophobicContact CG2-CD1 4.02Å; F794-L854 HydrophobicContact CB-CD1 3.78Å; F794-L854 HydrophobicContact CD2-CD1 4.29Å; V797-L854 HydrophobicContact CG2-CD2 4.47Å; T852-L854 PolarHBondContact O-N 3.05Å; L854-E857 PolarHBondContact O-N 3.37Å; L854-M858 HydrophobicContact CD1-CE 3.32Å; L854-M858 HydrophobicContact CD1-SD 4.37Å; L854-M858 HydrophobicContact CD2-CE 4.41Å; L854-M858 HydrophobicContact CG-CE 3.68Å; L854-M858 HydrophobicContact CG-SD 4.1Å; L854-M858 VanDerWaalsContact O-CG 3.26Å; L854-M858 WeakPolarHBondContact O-CG 3.48Å; L854-F959 HydrophobicContact CD2-CE1 4.32Å; L854-A960 HydrophobicContact CD2-CB 4.08Å; L854-A960 HydrophobicContact CG-CB 4.17Å; L854-Y963 HydrophobicContact CB-CD1 3.97Å; L854-Y963 HydrophobicContact CB-CE1 4.25Å; L854-Y963 HydrophobicContact CD2-CD1 3.98Å; L854-Y963 HydrophobicContact CD2-CG 4.38Å
855	Y	89.7	Confident	88.7	Confident	62 Å²	62	50.2 Å²	50.2	24%	0.243	27%	0.272	C	S	.	.	H	α-helix	trans	-71.9	-34.9	-178.3	-174.8	-94.1	0	0	0	112.2	D853 E857 M858 A960 L961	D853-Y855 VanDerWaalsContact C-N 3.27Å; D853-Y855 PolarHBondContact O-N 3.41Å; D853-Y855 PolarHBondContact OD1-N 3.05Å; Y855-E857 VanDerWaalsContact C-N 3.29Å; Y855-E857 PolarHBondContact O-N 2.9Å; Y855-M858 PolarHBondContact O-N 3.19Å; Y855-A960 HydrophobicContact CD2-CB 4.04Å; Y855-L961 HydrophobicContact CD1-CD1 4.31Å; Y855-L961 HydrophobicContact CD2-CB 3.72Å; Y855-L961 HydrophobicContact CD2-CD1 4.16Å; Y855-L961 HydrophobicContact CE1-CD1 4.23Å; Y855-L961 HydrophobicContact CE2-CB 3.77Å; Y855-L961 HydrophobicContact CE2-CD1 4.09Å; Y855-L961 HydrophobicContact CE2-CG 4.37Å; Y855-L961 HydrophobicContact CG-CB 4.49Å; Y855-L961 HydrophobicContact CG-CD1 4.26Å
856	S	87.8	Confident	88.9	Confident	78 Å²	78	58 Å²	58	55%	0.545	31%	0.305	S	S	.	.	H	α-helix	trans	-72	-22.9	178.4	-66.1	0	0	0	0	112.8	D853	D853-S856 PolarHBondContact O-N 3.37Å; D853-S856 WeakPolarHBondContact OD2-CB 3.08Å; D853-S856 PolarHBondContact OD2-OG 3.35Å
857	E	87.5	Confident	89.2	Confident	68 Å²	68	53.8 Å²	53.8	32%	0.318	29%	0.287	S	S	.	.	H	α-helix	trans	-78.6	-16.7	172.1	-67	-168.4	161.3	0	0	113.9	S791 T852 D853 L854 Y855	S791-E857 PolarHBondContact OG-OE2 3.39Å; T852-E857 WeakPolarHBondContact CB-OE1 3.42Å; T852-E857 WeakPolarHBondContact CG2-OE1 3.1Å; T852-E857 PolarHBondContact OG1-OE1 3.11Å; T852-E857 PolarHBondContact OG1-OE2 3.13Å; D853-E857 PolarHBondContact O-N 2.92Å; D853-E857 VanDerWaalsContact O-N 3.15Å; L854-E857 PolarHBondContact O-N 3.37Å; Y855-E857 VanDerWaalsContact C-N 3.29Å; Y855-E857 PolarHBondContact O-N 2.9Å
858	M	89.9	Confident	89.5	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	28%	0.276	C	S	.	.			trans	-107.3	43.7	-169.6	-69.4	-179.6	-179.1	0	0	112.5	E787 L788 F794 L854 Y855 V861 A862 I956 A960	E787-M858 VanDerWaalsContact OE2-C 3.3Å; E787-M858 WeakPolarHBondContact OE2-CA 3.29Å; L788-M858 HydrophobicContact CD2-CE 3.81Å; L788-M858 HydrophobicContact CD2-SD 4.19Å; F794-M858 HydrophobicContact CB-CE 3.66Å; F794-M858 HydrophobicContact CD2-CE 3.5Å; F794-M858 HydrophobicContact CE2-CE 4.32Å; F794-M858 HydrophobicContact CG-CE 3.73Å; L854-M858 HydrophobicContact CD1-CE 3.32Å; L854-M858 HydrophobicContact CD1-SD 4.37Å; L854-M858 HydrophobicContact CD2-CE 4.41Å; L854-M858 HydrophobicContact CG-CE 3.68Å; L854-M858 HydrophobicContact CG-SD 4.1Å; L854-M858 VanDerWaalsContact O-CG 3.26Å; L854-M858 WeakPolarHBondContact O-CG 3.48Å; Y855-M858 PolarHBondContact O-N 3.19Å; M858-V861 HydrophobicContact CB-CB 4.09Å; M858-V861 HydrophobicContact CB-CG2 4.09Å; M858-V861 HydrophobicContact CG-CG2 4.33Å; M858-V861 PolarHBondContact O-N 3.3Å; M858-A862 PolarHBondContact O-N 3.15Å; M858-I956 HydrophobicContact SD-CG2 4.06Å; M858-A960 HydrophobicContact SD-CB 3.89Å
859	G	91.2	Very high	89.7	Confident	35 Å²	35	49.1 Å²	49.1	36%	0.361	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-45.8	-177.3	0	0	0	0	0	112.6	E787 A862 R863	E787-G859 PolarHBondContact OE2-N 3.37Å; G859-A862 PolarHBondContact O-N 3.43Å; G859-R863 PolarHBondContact O-N 2.98Å; G859-R863 VanDerWaalsContact O-N 3.1Å
860	A	94.4	Very high	90.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-70.6	-32.9	-179.8	0	0	0	0	0	112.2	D780 L783 A784 E787 R863 S864	D780-A860 WeakPolarHBondContact O-CB 3.45Å; L783-A860 HydrophobicContact CB-CB 3.57Å; A784-A860 HydrophobicContact CB-CB 4.25Å; E787-A860 WeakPolarHBondContact OE1-CB 3.29Å; E787-A860 PolarHBondContact OE1-N 3.1Å; E787-A860 WeakPolarHBondContact OE2-CB 3.41Å; E787-A860 PolarHBondContact OE2-N 2.95Å; A860-R863 PolarHBondContact O-N 3.4Å; A860-S864 VanDerWaalsContact O-CB 3.3Å; A860-S864 WeakPolarHBondContact O-CB 3.38Å; A860-S864 PolarHBondContact O-N 3.48Å; A860-S864 PolarHBondContact O-OG 3.48Å
861	V	94.9	Very high	91.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-45.6	172.6	-176	0	0	0	0	110.7	A784 E787 L788 M858 R863 S864 A865 C953 I956	A784-V861 HydrophobicContact CB-CB 4.4Å; A784-V861 HydrophobicContact CB-CG2 3.84Å; E787-V861 PolarHBondContact OE2-N 3.47Å; L788-V861 HydrophobicContact CD1-CG2 4.15Å; L788-V861 HydrophobicContact CD2-CG2 4.06Å; L788-V861 HydrophobicContact CG-CG2 3.86Å; M858-V861 HydrophobicContact CB-CB 4.09Å; M858-V861 HydrophobicContact CB-CG2 4.09Å; M858-V861 HydrophobicContact CG-CG2 4.33Å; M858-V861 PolarHBondContact O-N 3.3Å; V861-R863 PolarHBondContact O-N 2.86Å; V861-S864 PolarHBondContact O-N 3.42Å; V861-A865 WeakPolarHBondContact O-CB 3.21Å; V861-A865 PolarHBondContact O-N 2.91Å; V861-C953 HydrophobicContact CG1-CB 4.24Å; V861-I956 HydrophobicContact CG1-CB 4.29Å; V861-I956 HydrophobicContact CG1-CG2 4.2Å
862	A	94.5	Very high	92	Very high	16 Å²	16	47.4 Å²	47.4	13%	0.132	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-34.4	179.5	0	0	0	0	0	112.9	M858 G859	M858-A862 PolarHBondContact O-N 3.15Å; G859-A862 PolarHBondContact O-N 3.43Å
863	R	94.9	Very high	92.7	Very high	122 Å²	122	49.5 Å²	49.5	46%	0.46	25%	0.251	S	S	.	.	H	α-helix	trans	-68.8	-47.8	171.5	-68.7	-167.3	-63.5	-140.4	-4.9	111.4	D780 G859 A860 V861 A865 K866	D780-R863 VanDerWaalsContact CG-NE 3.26Å; D780-R863 IonicContact OD1-CZ 3.82Å; D780-R863 IonicContact OD1-NE 3.23Å; D780-R863 PolarHBondContact OD1-NE 3.13Å; D780-R863 IonicContact OD1-NH2 2.69Å; D780-R863 PolarHBondContact OD1-NH2 3.42Å; D780-R863 VanDerWaalsContact OD2-CB 3.22Å; D780-R863 WeakPolarHBondContact OD2-CB 3.5Å; D780-R863 WeakPolarHBondContact OD2-CD 3.36Å; D780-R863 IonicContact OD2-CZ 3.78Å; D780-R863 IonicContact OD2-NE 3.99Å; D780-R863 PolarHBondContact OD2-NE 3.44Å; G859-R863 PolarHBondContact O-N 2.98Å; G859-R863 VanDerWaalsContact O-N 3.1Å; A860-R863 PolarHBondContact O-N 3.4Å; V861-R863 PolarHBondContact O-N 2.86Å; R863-A865 PolarHBondContact O-N 3.38Å; R863-K866 PolarHBondContact O-N 3.07Å
864	S	95.5	Very high	93.2	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-28.8	178.4	-60.8	0	0	0	0	113.3	D780 L781 A860 V861 K866 V867	D780-S864 PolarHBondContact O-OG 2.68Å; L781-S864 PolarHBondContact N-OG 2.96Å; A860-S864 VanDerWaalsContact O-CB 3.3Å; A860-S864 WeakPolarHBondContact O-CB 3.38Å; A860-S864 PolarHBondContact O-N 3.48Å; A860-S864 PolarHBondContact O-OG 3.48Å; V861-S864 PolarHBondContact O-N 3.42Å; S864-K866 PolarHBondContact O-N 3.21Å; S864-V867 PolarHBondContact O-N 3.08Å
865	A	94.6	Very high	93.6	Very high	16 Å²	16	51.8 Å²	51.8	13%	0.132	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22	176	0	0	0	0	0	114	V861 R863 C953 K954	V861-A865 WeakPolarHBondContact O-CB 3.21Å; V861-A865 PolarHBondContact O-N 2.91Å; R863-A865 PolarHBondContact O-N 3.38Å; A865-C953 HydrophobicContact CB-CB 3.97Å; A865-K954 HydrophobicContact CB-CB 4.14Å
866	K	94.1	Very high	93.9	Very high	190 Å²	190	49.2 Å²	49.2	83%	0.826	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-11.3	-177	-61.6	179.6	-176.6	-179.1	0	113.7	R863 S864	R863-K866 PolarHBondContact O-N 3.07Å; S864-K866 PolarHBondContact O-N 3.21Å
867	V	94.8	Very high	94.3	Very high	33 Å²	33	50.3 Å²	50.3	20%	0.2	25%	0.253	C	S	.	.			trans	-92.5	135.6	-175.8	-176.2	0	0	0	0	111.1	P777 S864 F869 V872 N950	P777-V867 HydrophobicContact CB-CB 4.48Å; P777-V867 HydrophobicContact CB-CG1 3.8Å; P777-V867 HydrophobicContact CB-CG2 4.31Å; P777-V867 HydrophobicContact CG-CG1 3.94Å; P777-V867 HydrophobicContact CG-CG2 4.34Å; S864-V867 PolarHBondContact O-N 3.08Å; V867-F869 HydrophobicContact CB-CE2 4.27Å; V867-V872 HydrophobicContact CG1-CG2 3.68Å; V867-N950 WeakPolarHBondContact O-CB 3.41Å
868	D	94.5	Very high	94.7	Very high	61 Å²	61	52.3 Å²	52.3	33%	0.326	26%	0.258	S	S	.	.			trans	-87.9	105.7	167	-166.6	-14.7	0	0	0	110.6	D870 E871 V872	D868-D870 PolarHBondContact O-N 2.83Å; D868-D870 VanDerWaalsContact OD1-CB 3.31Å; D868-D870 WeakPolarHBondContact OD1-CB 3.45Å; D868-D870 PolarHBondContact OD1-N 3.3Å; D868-E871 HydrophobicContact CB-CB 4.04Å; D868-E871 WeakPolarHBondContact O-CB 3.35Å; D868-E871 PolarHBondContact O-N 3.48Å; D868-E871 VanDerWaalsContact O-N 3.11Å; D868-V872 PolarHBondContact O-N 3.44Å
869	F	94.3	Very high	94.9	Very high	12 Å²	12	52.3 Å²	52.3	5%	0.053	26%	0.257	C	S	.	.	H	α-helix	trans	-69.9	-17.9	179	-69.6	-89.4	0	0	0	113.2	P777 L781 V867 E871 K873 I949	P777-F869 HydrophobicContact CB-CE1 4.28Å; L781-F869 HydrophobicContact CB-CE1 3.89Å; L781-F869 HydrophobicContact CB-CZ 3.87Å; L781-F869 HydrophobicContact CD1-CZ 4.23Å; L781-F869 HydrophobicContact CD2-CD1 4.15Å; L781-F869 HydrophobicContact CD2-CE1 3.61Å; L781-F869 HydrophobicContact CD2-CZ 3.9Å; L781-F869 HydrophobicContact CG-CE1 4.28Å; L781-F869 HydrophobicContact CG-CZ 4.22Å; V867-F869 HydrophobicContact CB-CE2 4.27Å; F869-E871 VanDerWaalsContact C-N 3.35Å; F869-K873 PolarHBondContact O-N 2.87Å; F869-K873 VanDerWaalsContact O-N 3.11Å; F869-I949 HydrophobicContact CB-CD1 4.07Å; F869-I949 HydrophobicContact CD1-CD1 4.26Å; F869-I949 HydrophobicContact CD2-CB 3.65Å; F869-I949 HydrophobicContact CD2-CD1 4.2Å; F869-I949 HydrophobicContact CD2-CG1 4.44Å; F869-I949 HydrophobicContact CD2-CG2 3.67Å; F869-I949 HydrophobicContact CE2-CB 4.01Å; F869-I949 HydrophobicContact CE2-CG2 3.48Å; F869-I949 VanDerWaalsContact CE2-CG2 3.48Å; F869-I949 HydrophobicContact CG-CB 4.25Å; F869-I949 HydrophobicContact CG-CD1 3.9Å; F869-I949 HydrophobicContact CG-CG2 4.37Å; F869-I949 HydrophobicContact CZ-CG2 4.05Å
870	D	94.3	Very high	95	Very high	90 Å²	90	51.9 Å²	51.9	48%	0.481	25%	0.246	S	C	.	.	H	α-helix	trans	-69.9	-36.8	170.5	-65	-39.3	0	0	0	110.2	D868 T874 K948	D868-D870 PolarHBondContact O-N 2.83Å; D868-D870 VanDerWaalsContact OD1-CB 3.31Å; D868-D870 WeakPolarHBondContact OD1-CB 3.45Å; D868-D870 PolarHBondContact OD1-N 3.3Å; D870-T874 PolarHBondContact O-N 2.73Å; D870-T874 PolarHBondContact O-OG1 3.25Å; D870-K948 IonicContact OD2-NZ 2.93Å; D870-K948 PolarHBondContact OD2-NZ 3.42Å
871	E	94.6	Very high	95	Very high	113 Å²	113	59.1 Å²	59.1	53%	0.528	28%	0.278	S	S	.	.	H	α-helix	trans	-69.8	-42.8	173.7	-173.9	172.6	-171.2	0	0	111.5	D868 F869 K873 T874 N875	D868-E871 HydrophobicContact CB-CB 4.04Å; D868-E871 WeakPolarHBondContact O-CB 3.35Å; D868-E871 PolarHBondContact O-N 3.48Å; D868-E871 VanDerWaalsContact O-N 3.11Å; F869-E871 VanDerWaalsContact C-N 3.35Å; E871-K873 VanDerWaalsContact C-N 3.28Å; E871-K873 PolarHBondContact O-N 3.47Å; E871-T874 CarbonylContact O-C 3.51Å; E871-T874 WeakPolarHBondContact O-CA 3.46Å; E871-T874 WeakPolarHBondContact O-CB 3.42Å; E871-T874 PolarHBondContact O-N 2.88Å; E871-N875 WeakPolarHBondContact O-CB 3.45Å; E871-N875 VanDerWaalsContact O-CG 3.3Å; E871-N875 PolarHBondContact O-N 3.45Å
872	V	96.1	Very high	95	Very high	5 Å²	5	61.7 Å²	61.7	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-55.5	-44.9	174.3	174.9	0	0	0	0	111.1	V774 P777 L778 V867 D868 N875 L876	V774-V872 HydrophobicContact CG1-CG1 3.99Å; P777-V872 HydrophobicContact CB-CG2 3.94Å; P777-V872 HydrophobicContact CG-CG2 4.01Å; L778-V872 HydrophobicContact CG-CG1 4.5Å; V867-V872 HydrophobicContact CG1-CG2 3.68Å; D868-V872 PolarHBondContact O-N 3.44Å; V872-N875 PolarHBondContact O-N 3.28Å; V872-L876 PolarHBondContact O-N 3.41Å
873	K	95.7	Very high	94.9	Very high	100 Å²	100	61 Å²	61	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-45	174.7	-178.4	-174.8	169.1	-165.7	0	111.7	F869 E871 N875 L876 E877	F869-K873 PolarHBondContact O-N 2.87Å; F869-K873 VanDerWaalsContact O-N 3.11Å; E871-K873 VanDerWaalsContact C-N 3.28Å; E871-K873 PolarHBondContact O-N 3.47Å; K873-N875 VanDerWaalsContact C-N 3.34Å; K873-N875 PolarHBondContact O-N 2.82Å; K873-L876 PolarHBondContact O-N 3.44Å; K873-E877 WeakPolarHBondContact CE-OE1 3.48Å; K873-E877 IonicContact NZ-OE1 2.88Å; K873-E877 WeakPolarHBondContact O-CG 3.47Å; K873-E877 PolarHBondContact O-N 3.47Å
874	T	96.8	Very high	94.8	Very high	69 Å²	69	57.7 Å²	57.7	42%	0.423	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-39.1	179.2	-56.8	0	0	0	0	111.7	D870 E871 E877 R878	D870-T874 PolarHBondContact O-N 2.73Å; D870-T874 PolarHBondContact O-OG1 3.25Å; E871-T874 CarbonylContact O-C 3.51Å; E871-T874 WeakPolarHBondContact O-CA 3.46Å; E871-T874 WeakPolarHBondContact O-CB 3.42Å; E871-T874 PolarHBondContact O-N 2.88Å; T874-E877 PolarHBondContact O-N 3.36Å; T874-R878 WeakPolarHBondContact O-CB 3.34Å; T874-R878 PolarHBondContact O-N 3.32Å
875	N	94.9	Very high	94.7	Very high	16 Å²	16	59 Å²	59	9%	0.086	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-43.5	175.3	-71.1	-9.5	0	0	0	110.6	V774 E871 V872 K873 E877 R878 M879	V774-N875 HydrophobicContact CG2-CB 3.94Å; E871-N875 WeakPolarHBondContact O-CB 3.45Å; E871-N875 VanDerWaalsContact O-CG 3.3Å; E871-N875 PolarHBondContact O-N 3.45Å; V872-N875 PolarHBondContact O-N 3.28Å; K873-N875 VanDerWaalsContact C-N 3.34Å; K873-N875 PolarHBondContact O-N 2.82Å; N875-E877 PolarHBondContact O-N 2.75Å; N875-R878 WeakPolarHBondContact O-CB 3.23Å; N875-R878 PolarHBondContact O-N 2.97Å; N875-R878 PolarHBondContact OD1-NH1 2.83Å; N875-R878 PolarHBondContact OD1-NH2 2.78Å; N875-M879 VanDerWaalsContact O-CG 3.3Å; N875-M879 WeakPolarHBondContact O-CG 3.4Å; N875-M879 PolarHBondContact O-N 3.15Å
876	L	96.5	Very high	94.6	Very high	7 Å²	7	58.3 Å²	58.3	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-41.7	175.2	-178.4	56.6	0	0	0	112.7	V774 V872 K873 R878 M879 E880 I916 L919 K920 H923	V774-L876 HydrophobicContact CG1-CB 4.17Å; V774-L876 HydrophobicContact CG1-CD1 4.34Å; V774-L876 HydrophobicContact CG1-CD2 4.45Å; V774-L876 HydrophobicContact CG2-CB 4.37Å; V872-L876 PolarHBondContact O-N 3.41Å; K873-L876 PolarHBondContact O-N 3.44Å; L876-R878 VanDerWaalsContact C-N 3.34Å; L876-M879 PolarHBondContact O-N 2.89Å; L876-E880 PolarHBondContact O-N 2.7Å; L876-E880 VanDerWaalsContact O-N 3.12Å; L876-I916 HydrophobicContact CD1-CG2 4.28Å; L876-L919 HydrophobicContact CD1-CB 3.84Å; L876-L919 HydrophobicContact CD1-CD1 4.4Å; L876-K920 HydrophobicContact CD1-CG 4.13Å; L876-K920 HydrophobicContact CD2-CB 4.5Å; L876-K920 HydrophobicContact CD2-CG 3.83Å; L876-K920 HydrophobicContact CG-CG 3.98Å; L876-H923 HydrophobicContact CD2-CB 3.84Å
877	E	96.5	Very high	94.5	Very high	102 Å²	102	50 Å²	50	48%	0.477	24%	0.243	S	C	.	.	H	α-helix	trans	-65.2	-37.4	174.3	-71.9	175.4	178.8	0	0	112	K873 T874 N875 E880 K881	K873-E877 WeakPolarHBondContact CE-OE1 3.48Å; K873-E877 IonicContact NZ-OE1 2.88Å; K873-E877 WeakPolarHBondContact O-CG 3.47Å; K873-E877 PolarHBondContact O-N 3.47Å; T874-E877 PolarHBondContact O-N 3.36Å; N875-E877 PolarHBondContact O-N 2.75Å; E877-E880 PolarHBondContact O-N 2.74Å; E877-K881 PolarHBondContact O-N 3.45Å
878	R	95	Very high	94.2	Very high	110 Å²	110	50.8 Å²	50.8	42%	0.415	25%	0.246	S	C	.	.	H	α-helix	trans	-64.4	-46.7	174.1	-170.7	-168.6	-50.4	135.6	11.2	111.3	T874 N875 L876 E880 K881 D882	T874-R878 WeakPolarHBondContact O-CB 3.34Å; T874-R878 PolarHBondContact O-N 3.32Å; N875-R878 WeakPolarHBondContact O-CB 3.23Å; N875-R878 PolarHBondContact O-N 2.97Å; N875-R878 PolarHBondContact OD1-NH1 2.83Å; N875-R878 PolarHBondContact OD1-NH2 2.78Å; L876-R878 VanDerWaalsContact C-N 3.34Å; R878-E880 VanDerWaalsContact C-N 3.29Å; R878-E880 PolarHBondContact O-N 2.83Å; R878-K881 WeakPolarHBondContact O-CB 3.35Å; R878-K881 PolarHBondContact O-N 3.27Å; R878-K881 VanDerWaalsContact O-N 3.1Å; R878-D882 WeakPolarHBondContact O-CB 3.28Å; R878-D882 PolarHBondContact O-N 3.27Å
879	M	94.1	Very high	94.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-56.5	-42.8	176	-72	172.7	75.1	0	0	111.9	Y767 M770 E771 V774 N875 L876 C883 I916 L919	Y767-M879 HydrophobicContact CD2-CE 4.29Å; Y767-M879 HydrophobicContact CE2-CE 3.82Å; M770-M879 HydrophobicContact CB-CE 4Å; M770-M879 HydrophobicContact CB-CG 3.83Å; M770-M879 HydrophobicContact CB-SD 3.88Å; M770-M879 VanDerWaalsContact O-SD 3.4Å; M770-M879 HydrophobicContact SD-CG 4.11Å; E771-M879 HydrophobicContact CB-CE 4.03Å; V774-M879 HydrophobicContact CG2-SD 3.78Å; N875-M879 VanDerWaalsContact O-CG 3.3Å; N875-M879 WeakPolarHBondContact O-CG 3.4Å; N875-M879 PolarHBondContact O-N 3.15Å; L876-M879 PolarHBondContact O-N 2.89Å; M879-C883 VanDerWaalsContact O-CB 3.24Å; M879-C883 WeakPolarHBondContact O-CB 3.23Å; M879-C883 PolarHBondContact O-N 3.47Å; M879-I916 HydrophobicContact CB-CD1 4.37Å; M879-I916 HydrophobicContact CB-CG1 4.37Å; M879-I916 HydrophobicContact CE-CG1 4.4Å; M879-I916 WeakPolarHBondContact O-CD1 3.4Å; M879-L919 HydrophobicContact CE-CD1 4.38Å
880	E	94.8	Very high	93.9	Very high	27 Å²	27	49.9 Å²	49.9	13%	0.126	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-48.7	174.2	171.1	169.9	-171.6	0	0	111.8	W494 L876 E877 R878 D882 C883 K884 I916 K920	W494-E880 HydrophobicContact CH2-CB 4.21Å; W494-E880 HydrophobicContact CH2-CG 3.74Å; W494-E880 HydrophobicContact CZ2-CB 4.33Å; W494-E880 HydrophobicContact CZ2-CG 3.54Å; L876-E880 PolarHBondContact O-N 2.7Å; L876-E880 VanDerWaalsContact O-N 3.12Å; E877-E880 PolarHBondContact O-N 2.74Å; R878-E880 VanDerWaalsContact C-N 3.29Å; R878-E880 PolarHBondContact O-N 2.83Å; E880-D882 VanDerWaalsContact C-N 3.34Å; E880-D882 PolarHBondContact O-N 2.89Å; E880-C883 PolarHBondContact O-N 3.45Å; E880-K884 HydrophobicContact CG-CD 4.35Å; E880-K884 WeakPolarHBondContact O-CG 3.46Å; E880-K884 PolarHBondContact O-N 3Å; E880-K884 WeakPolarHBondContact OE1-CE 3.44Å; E880-K884 IonicContact OE1-NZ 2.69Å; E880-K884 PolarHBondContact OE1-NZ 3.2Å; E880-I916 HydrophobicContact CB-CG2 3.97Å; E880-K920 IonicContact OE1-NZ 2.84Å; E880-K920 IonicContact OE2-NZ 3.41Å; E880-K920 PolarHBondContact OE2-NZ 3.11Å
881	K	94.3	Very high	93.5	Very high	151 Å²	151	51.8 Å²	51.8	66%	0.657	24%	0.239	S	C	*	.	H	α-helix	trans	-60.6	-44.6	179.6	-177.7	-175.9	176	-176.3	0	111.6	E877 R878 K884 A885	E877-K881 PolarHBondContact O-N 3.45Å; R878-K881 WeakPolarHBondContact O-CB 3.35Å; R878-K881 PolarHBondContact O-N 3.27Å; R878-K881 VanDerWaalsContact O-N 3.1Å; K881-K884 PolarHBondContact O-N 3.41Å; K881-A885 WeakPolarHBondContact O-CB 3.48Å; K881-A885 PolarHBondContact O-N 3.33Å
882	D	93.3	Very high	93.2	Very high	55 Å²	55	49.8 Å²	49.8	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-72.1	-33.3	-177.6	-68.6	-15.3	0	0	0	111.6	F763 R878 E880 A885 S886	F763-D882 HydrophobicContact CD2-CB 3.78Å; F763-D882 HydrophobicContact CE2-CB 3.96Å; R878-D882 WeakPolarHBondContact O-CB 3.28Å; R878-D882 PolarHBondContact O-N 3.27Å; E880-D882 VanDerWaalsContact C-N 3.34Å; E880-D882 PolarHBondContact O-N 2.89Å; D882-A885 PolarHBondContact O-N 3.43Å; D882-S886 VanDerWaalsContact O-CB 3.28Å; D882-S886 WeakPolarHBondContact O-CB 3.1Å; D882-S886 PolarHBondContact O-N 3.18Å; D882-S886 PolarHBondContact O-OG 3.27Å
883	C	94	Very high	92.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-45.5	171.3	-171.4	0	0	0	0	111.6	W494 F763 M879 E880 A885 S886 W887 I916	W494-C883 HydrophobicContact CZ3-CB 4.05Å; F763-C883 HydrophobicContact CE1-CB 4.34Å; F763-C883 HydrophobicContact CE2-CB 4.17Å; F763-C883 HydrophobicContact CZ-CB 3.61Å; M879-C883 VanDerWaalsContact O-CB 3.24Å; M879-C883 WeakPolarHBondContact O-CB 3.23Å; M879-C883 PolarHBondContact O-N 3.47Å; E880-C883 PolarHBondContact O-N 3.45Å; C883-A885 PolarHBondContact O-N 3.14Å; C883-S886 WeakPolarHBondContact O-CB 3.29Å; C883-S886 PolarHBondContact O-N 3.4Å; C883-W887 PolarHBondContact O-N 2.96Å; C883-I916 HydrophobicContact CB-CD1 3.47Å; C883-I916 VanDerWaalsContact CB-CD1 3.47Å
884	K	92.8	Very high	92.2	Very high	54 Å²	54	46.3 Å²	46.3	24%	0.235	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-43	174.7	-70.8	177.9	-173.8	173.1	0	112.1	W494 E880 K881 S886 W887 D888	W494-K884 HydrophobicContact CD2-CD 4.32Å; W494-K884 HydrophobicContact CD2-CG 4.07Å; W494-K884 HydrophobicContact CE3-CD 4.41Å; W494-K884 HydrophobicContact CE3-CG 3.67Å; W494-K884 HydrophobicContact CZ3-CG 4.05Å; E880-K884 HydrophobicContact CG-CD 4.35Å; E880-K884 WeakPolarHBondContact O-CG 3.46Å; E880-K884 PolarHBondContact O-N 3Å; E880-K884 WeakPolarHBondContact OE1-CE 3.44Å; E880-K884 IonicContact OE1-NZ 2.69Å; E880-K884 PolarHBondContact OE1-NZ 3.2Å; K881-K884 PolarHBondContact O-N 3.41Å; K884-S886 VanDerWaalsContact C-N 3.28Å; K884-S886 PolarHBondContact O-N 3.44Å; K884-W887 WeakPolarHBondContact O-CB 3.45Å; K884-W887 PolarHBondContact O-N 3.12Å; K884-D888 PolarHBondContact O-N 2.83Å
885	A	92.5	Very high	91.5	Very high	26 Å²	26	50.8 Å²	50.8	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-35	174.9	0	0	0	0	0	112.1	K881 D882 C883 W887 D888 Y889	K881-A885 WeakPolarHBondContact O-CB 3.48Å; K881-A885 PolarHBondContact O-N 3.33Å; D882-A885 PolarHBondContact O-N 3.43Å; C883-A885 PolarHBondContact O-N 3.14Å; A885-W887 VanDerWaalsContact C-N 3.31Å; A885-W887 PolarHBondContact O-N 3.19Å; A885-D888 WeakPolarHBondContact O-CB 3.27Å; A885-D888 PolarHBondContact O-N 3.41Å; A885-D888 VanDerWaalsContact O-N 3.09Å; A885-Y889 HydrophobicContact CB-CE2 4.07Å; A885-Y889 WeakPolarHBondContact O-CD2 3.47Å; A885-Y889 PolarHBondContact O-N 3Å
886	S	92.7	Very high	90.7	Very high	3 Å²	3	55 Å²	55	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-34.5	176.6	-66	0	0	0	0	112.8	F763 D882 C883 K884 Y889 L890	F763-S886 WeakPolarHBondContact CB-OG 3.21Å; F763-S886 VanDerWaalsContact CD1-OG 3.25Å; F763-S886 WeakPolarHBondContact CD1-OG 3.32Å; F763-S886 VanDerWaalsContact CG-OG 3.26Å; F763-S886 WeakPolarHBondContact CG-OG 3.43Å; D882-S886 VanDerWaalsContact O-CB 3.28Å; D882-S886 WeakPolarHBondContact O-CB 3.1Å; D882-S886 PolarHBondContact O-N 3.18Å; D882-S886 PolarHBondContact O-OG 3.27Å; C883-S886 WeakPolarHBondContact O-CB 3.29Å; C883-S886 PolarHBondContact O-N 3.4Å; K884-S886 VanDerWaalsContact C-N 3.28Å; K884-S886 PolarHBondContact O-N 3.44Å; S886-Y889 PolarHBondContact O-N 3.39Å; S886-L890 WeakPolarHBondContact O-CB 3.21Å; S886-L890 PolarHBondContact O-N 2.93Å
887	W	91.3	Very high	89.9	Confident	14 Å²	14	57.1 Å²	57.1	5%	0.053	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-42.3	169.1	-79.3	106.1	0	0	0	112.5	Q493 C883 K884 A885 Y889 L890 R891 S906 L909	Q493-W887 HydrophobicContact CB-CD2 4.15Å; Q493-W887 HydrophobicContact CB-CE3 4.46Å; Q493-W887 HydrophobicContact CB-CH2 4.49Å; Q493-W887 HydrophobicContact CB-CZ2 4.2Å; Q493-W887 HydrophobicContact CG-CD2 4.18Å; Q493-W887 HydrophobicContact CG-CE3 3.98Å; Q493-W887 HydrophobicContact CG-CH2 4.2Å; Q493-W887 HydrophobicContact CG-CZ2 4.4Å; Q493-W887 HydrophobicContact CG-CZ3 4Å; C883-W887 PolarHBondContact O-N 2.96Å; K884-W887 WeakPolarHBondContact O-CB 3.45Å; K884-W887 PolarHBondContact O-N 3.12Å; A885-W887 VanDerWaalsContact C-N 3.31Å; A885-W887 PolarHBondContact O-N 3.19Å; W887-Y889 VanDerWaalsContact C-N 3.32Å; W887-Y889 PolarHBondContact O-N 3.03Å; W887-L890 HydrophobicContact CE3-CD2 4.1Å; W887-L890 HydrophobicContact CZ3-CD2 4.01Å; W887-L890 PolarHBondContact O-N 3.33Å; W887-R891 PolarHBondContact O-N 3.13Å; W887-S906 WeakPolarHBondContact CH2-O 3.37Å; W887-S906 VanDerWaalsContact CH2-OG 3.26Å; W887-S906 WeakPolarHBondContact CH2-OG 3.45Å; W887-S906 WeakPolarHBondContact CZ3-OG 3.44Å; W887-L909 HydrophobicContact CD2-CB 4.11Å; W887-L909 HydrophobicContact CD2-CD1 3.83Å; W887-L909 VanDerWaalsContact CE2-CB 3.46Å; W887-L909 HydrophobicContact CE3-CD1 4.1Å; W887-L909 HydrophobicContact CG-CD1 4.09Å; W887-L909 HydrophobicContact CH2-CB 4.15Å; W887-L909 HydrophobicContact CZ2-CB 3.5Å
888	D	90.1	Very high	88.9	Confident	51 Å²	51	56 Å²	56	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-65.7	-34.7	176.3	-66.8	-24.1	0	0	0	111.9	S490 K884 A885 Q892	S490-D888 VanDerWaalsContact CB-OD1 3.31Å; S490-D888 WeakPolarHBondContact CB-OD1 3.46Å; S490-D888 PolarHBondContact OG-OD1 3.13Å; K884-D888 PolarHBondContact O-N 2.83Å; A885-D888 WeakPolarHBondContact O-CB 3.27Å; A885-D888 PolarHBondContact O-N 3.41Å; A885-D888 VanDerWaalsContact O-N 3.09Å; D888-Q892 WeakPolarHBondContact O-CG 3.33Å; D888-Q892 PolarHBondContact O-N 3.47Å; D888-Q892 PolarHBondContact O-NE2 2.98Å; D888-Q892 VanDerWaalsContact O-NE2 3.15Å
889	Y	91.2	Very high	88	Confident	47 Å²	47	58 Å²	58	18%	0.184	28%	0.279	C	S	.	.	H	α-helix	trans	-68.5	-44.7	172.8	-64.4	-41.9	0	0	0	111.8	A756 R759 A885 S886 W887 R891 Q892 I893	A756-Y889 HydrophobicContact CB-CD1 3.74Å; A756-Y889 HydrophobicContact CB-CG 4.17Å; R759-Y889 HydrophobicContact CB-CD2 3.7Å; R759-Y889 HydrophobicContact CB-CE1 4.47Å; R759-Y889 HydrophobicContact CB-CE2 3.43Å; R759-Y889 VanDerWaalsContact CB-CE2 3.43Å; R759-Y889 HydrophobicContact CB-CG 4.36Å; R759-Y889 HydrophobicContact CG-CE2 4.03Å; A885-Y889 HydrophobicContact CB-CE2 4.07Å; A885-Y889 WeakPolarHBondContact O-CD2 3.47Å; A885-Y889 PolarHBondContact O-N 3Å; S886-Y889 PolarHBondContact O-N 3.39Å; W887-Y889 VanDerWaalsContact C-N 3.32Å; W887-Y889 PolarHBondContact O-N 3.03Å; Y889-R891 PolarHBondContact O-N 3.16Å; Y889-Q892 WeakPolarHBondContact O-CB 3.23Å; Y889-Q892 PolarHBondContact O-N 2.83Å; Y889-Q892 VanDerWaalsContact O-N 3.08Å; Y889-I893 WeakPolarHBondContact O-CD1 3.44Å; Y889-I893 VanDerWaalsContact O-CG1 3.29Å; Y889-I893 WeakPolarHBondContact O-CG1 3.42Å; Y889-I893 PolarHBondContact O-N 3.34Å
890	L	90.1	Very high	87.4	Confident	6 Å²	6	59.5 Å²	59.5	3%	0.031	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-40.2	175.3	179.7	61.2	0	0	0	111.2	L760 S886 W887 Q892 I893 A894 K902 I905 L909	L760-L890 HydrophobicContact CD2-CB 4.17Å; L760-L890 HydrophobicContact CD2-CD1 4.29Å; S886-L890 WeakPolarHBondContact O-CB 3.21Å; S886-L890 PolarHBondContact O-N 2.93Å; W887-L890 HydrophobicContact CE3-CD2 4.1Å; W887-L890 HydrophobicContact CZ3-CD2 4.01Å; W887-L890 PolarHBondContact O-N 3.33Å; L890-Q892 VanDerWaalsContact C-N 3.32Å; L890-Q892 PolarHBondContact O-N 3.48Å; L890-I893 PolarHBondContact O-N 3.44Å; L890-A894 VanDerWaalsContact O-CB 3.25Å; L890-A894 WeakPolarHBondContact O-CB 3.45Å; L890-A894 PolarHBondContact O-N 2.84Å; L890-K902 HydrophobicContact CD1-CG 4.33Å; L890-I905 HydrophobicContact CD1-CB 3.97Å; L890-I905 HydrophobicContact CD1-CD1 4.22Å; L890-I905 HydrophobicContact CD1-CG2 3.92Å; L890-I905 HydrophobicContact CD2-CB 4.38Å; L890-I905 HydrophobicContact CD2-CG2 4.1Å; L890-I905 HydrophobicContact CG-CG2 4.5Å; L890-L909 HydrophobicContact CB-CD1 4.2Å; L890-L909 HydrophobicContact CD2-CD1 3.91Å
891	R	86.6	Confident	86.8	Confident	130 Å²	130	58.4 Å²	58.4	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-60.3	-39.3	175.8	-172.1	-178.7	-170.5	-173.9	1.6	113	E489 W887 Y889	E489-R891 WeakPolarHBondContact OE2-CD 3.32Å; E489-R891 IonicContact OE2-CZ 3.51Å; E489-R891 IonicContact OE2-NE 3.62Å; E489-R891 PolarHBondContact OE2-NE 3.14Å; W887-R891 PolarHBondContact O-N 3.13Å; Y889-R891 PolarHBondContact O-N 3.16Å
892	Q	87.1	Confident	86.3	Confident	72 Å²	72	54.9 Å²	54.9	34%	0.336	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-41.1	176.8	-69.9	169.7	68.2	0	0	111.3	Q753 A756 D888 Y889 L890	Q753-Q892 HydrophobicContact CG-CB 4.28Å; A756-Q892 HydrophobicContact CB-CB 4.27Å; D888-Q892 WeakPolarHBondContact O-CG 3.33Å; D888-Q892 PolarHBondContact O-N 3.47Å; D888-Q892 PolarHBondContact O-NE2 2.98Å; D888-Q892 VanDerWaalsContact O-NE2 3.15Å; Y889-Q892 WeakPolarHBondContact O-CB 3.23Å; Y889-Q892 PolarHBondContact O-N 2.83Å; Y889-Q892 VanDerWaalsContact O-N 3.08Å; L890-Q892 VanDerWaalsContact C-N 3.32Å; L890-Q892 PolarHBondContact O-N 3.48Å
893	I	86.3	Confident	86	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-71.4	-37.9	-179	-63	161.4	0	0	0	111.5	F699 Q753 A756 R757 L760 Y889 L890 K895 H896 E897	F699-I893 HydrophobicContact CZ-CD1 4.46Å; Q753-I893 HydrophobicContact CB-CG1 4.47Å; A756-I893 HydrophobicContact CB-CD1 4.25Å; A756-I893 HydrophobicContact CB-CG1 4.1Å; R757-I893 HydrophobicContact CB-CD1 4.29Å; R757-I893 HydrophobicContact CG-CD1 3.72Å; R757-I893 HydrophobicContact CG-CG1 3.74Å; R757-I893 HydrophobicContact CG-CG2 4.4Å; L760-I893 HydrophobicContact CB-CD1 4.34Å; L760-I893 HydrophobicContact CD2-CD1 3.5Å; Y889-I893 WeakPolarHBondContact O-CD1 3.44Å; Y889-I893 VanDerWaalsContact O-CG1 3.29Å; Y889-I893 WeakPolarHBondContact O-CG1 3.42Å; Y889-I893 PolarHBondContact O-N 3.34Å; L890-I893 PolarHBondContact O-N 3.44Å; I893-K895 PolarHBondContact O-N 2.98Å; I893-H896 PolarHBondContact O-N 3.27Å; I893-E897 HydrophobicContact CG2-CB 4.38Å; I893-E897 HydrophobicContact CG2-CG 3.62Å; I893-E897 PolarHBondContact O-N 3.08Å
894	A	84.5	Confident	85.7	Confident	29 Å²	29	60.1 Å²	60.1	24%	0.24	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.2	-177.8	0	0	0	0	0	114.4	L890 H896 K902	L890-A894 VanDerWaalsContact O-CB 3.25Å; L890-A894 WeakPolarHBondContact O-CB 3.45Å; L890-A894 PolarHBondContact O-N 2.84Å; A894-H896 PolarHBondContact O-N 3.38Å; A894-K902 HydrophobicContact CB-CD 3.78Å; A894-K902 HydrophobicContact CB-CG 4.1Å
895	K	82.1	Confident	85.6	Confident	163 Å²	163	57.6 Å²	57.6	71%	0.709	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.3	174	-63.9	-179.9	-178.2	178.3	0	113.5	I893	I893-K895 PolarHBondContact O-N 2.98Å
896	H	79.3	Confident	85.5	Confident	103 Å²	103	58 Å²	58	48%	0.477	29%	0.29	S	S	.	.	S	Bend	trans	-128.6	4.3	-170.2	-60.9	-77.1	0	0	0	113.7	P752 I893 A894	P752-H896 HydrophobicContact CB-CB 4.26Å; P752-H896 HydrophobicContact CG-CB 4.04Å; I893-H896 PolarHBondContact O-N 3.27Å; A894-H896 PolarHBondContact O-N 3.38Å
897	E	79.1	Confident	85.4	Confident	52 Å²	52	64.1 Å²	64.1	24%	0.243	32%	0.322	C	S	.	.	S	Bend	trans	-124.5	160.6	-170.3	-81.8	-61.7	164.4	0	0	113.7	R757 I893 L901	R757-E897 IonicContact CZ-OE1 3.54Å; R757-E897 IonicContact NH1-OE1 3.68Å; R757-E897 PolarHBondContact NH1-OE1 3.49Å; R757-E897 IonicContact NH2-OE1 3.35Å; R757-E897 PolarHBondContact NH2-OE1 2.66Å; I893-E897 HydrophobicContact CG2-CB 4.38Å; I893-E897 HydrophobicContact CG2-CG 3.62Å; I893-E897 PolarHBondContact O-N 3.08Å; E897-L901 HydrophobicContact CG-CD2 4.16Å
898	S	74.8	Confident	85.4	Confident	79 Å²	79	64 Å²	64	55%	0.552	32%	0.322	S	S	*	.			trans	-66.2	143.6	174.5	-179.6	0	0	0	0	111.8	G900 L901 K902	S898-G900 PolarHBondContact O-N 3.34Å; S898-L901 PolarHBondContact O-N 2.95Å; S898-K902 PolarHBondContact O-N 3.11Å
899	H	77.1	Confident	85.6	Confident	151 Å²	151	61.6 Å²	61.6	70%	0.699	31%	0.309	S	S	*	.	H	α-helix	trans	-52.6	-40.1	-179.9	-73.4	-79.8	0	0	0	112.7	L901 K902 D903	H899-L901 PolarHBondContact O-N 3.13Å; H899-K902 WeakPolarHBondContact O-CB 3.24Å; H899-K902 PolarHBondContact O-N 3.42Å; H899-D903 PolarHBondContact O-N 3.27Å
900	G	81.5	Confident	85.6	Confident	34 Å²	34	61.3 Å²	61.3	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-66.3	-34.2	-177.4	0	0	0	0	0	115.1	S898 K904	S898-G900 PolarHBondContact O-N 3.34Å; G900-K904 WeakPolarHBondContact O-CG 3.37Å; G900-K904 PolarHBondContact O-N 2.79Å
901	L	81.8	Confident	85.6	Confident	4 Å²	4	63 Å²	63	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-70.1	-42.6	176.3	-179	65.6	0	0	0	110.6	F409 F699 E897 S898 H899 D903 K904 I905	F409-L901 HydrophobicContact CD1-CD1 3.41Å; F409-L901 VanDerWaalsContact CD1-CD1 3.41Å; F409-L901 HydrophobicContact CE1-CD1 3.33Å; F409-L901 HydrophobicContact CZ-CD1 4.4Å; F699-L901 HydrophobicContact CD2-CD1 4.28Å; F699-L901 HydrophobicContact CD2-CD2 4.2Å; F699-L901 HydrophobicContact CE2-CD2 4.07Å; E897-L901 HydrophobicContact CG-CD2 4.16Å; S898-L901 PolarHBondContact O-N 2.95Å; H899-L901 PolarHBondContact O-N 3.13Å; L901-D903 VanDerWaalsContact C-N 3.32Å; L901-D903 PolarHBondContact O-N 2.73Å; L901-K904 PolarHBondContact O-N 3.03Å; L901-I905 HydrophobicContact CD1-CD1 4.11Å; L901-I905 HydrophobicContact CG-CD1 3.97Å; L901-I905 WeakPolarHBondContact O-CG1 3.4Å; L901-I905 PolarHBondContact O-N 2.98Å; L901-I905 VanDerWaalsContact O-N 3.11Å
902	K	84.4	Confident	85.9	Confident	77 Å²	77	56.8 Å²	56.8	34%	0.335	30%	0.299	S	S	.	.	H	α-helix	trans	-58.1	-45.4	176.1	-175.6	-165.1	177	-171.5	0	111.1	L890 A894 S898 H899 I905 S906	L890-K902 HydrophobicContact CD1-CG 4.33Å; A894-K902 HydrophobicContact CB-CD 3.78Å; A894-K902 HydrophobicContact CB-CG 4.1Å; S898-K902 PolarHBondContact O-N 3.11Å; H899-K902 WeakPolarHBondContact O-CB 3.24Å; H899-K902 PolarHBondContact O-N 3.42Å; K902-I905 PolarHBondContact O-N 2.73Å; K902-S906 WeakPolarHBondContact O-CB 3.25Å; K902-S906 PolarHBondContact O-N 3.1Å
903	D	87.6	Confident	86.2	Confident	97 Å²	97	53.4 Å²	53.4	52%	0.519	28%	0.283	S	S	.	.	H	α-helix	trans	-65.6	-42.7	-177.7	-64	-22.9	0	0	0	111.9	H899 L901 I905 S906 L907	H899-D903 PolarHBondContact O-N 3.27Å; L901-D903 VanDerWaalsContact C-N 3.32Å; L901-D903 PolarHBondContact O-N 2.73Å; D903-I905 PolarHBondContact O-N 3.3Å; D903-S906 PolarHBondContact O-N 3.48Å; D903-L907 WeakPolarHBondContact O-CB 3.5Å; D903-L907 PolarHBondContact O-N 3.5Å
904	K	87.7	Confident	86.5	Confident	68 Å²	68	55.2 Å²	55.2	30%	0.296	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-46.2	174.9	-76.8	-177.7	-179	-175.9	0	112.4	P407 D408 N411 G900 L901 L907 F908	P407-K904 HydrophobicContact CB-CB 4.06Å; P407-K904 HydrophobicContact CB-CD 4.47Å; D408-K904 PolarHBondContact O-NZ 3.14Å; N411-K904 PolarHBondContact O-NZ 3.26Å; G900-K904 WeakPolarHBondContact O-CG 3.37Å; G900-K904 PolarHBondContact O-N 2.79Å; L901-K904 PolarHBondContact O-N 3.03Å; K904-L907 PolarHBondContact O-N 2.9Å; K904-F908 PolarHBondContact O-N 3.1Å; K904-F908 VanDerWaalsContact O-N 3.16Å
905	I	89.6	Confident	86.9	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-70.6	-39.2	179.6	-59.9	168.2	0	0	0	110.7	F409 F699 L760 M764 L890 L901 K902 D903 L907 F908 L909	F409-I905 HydrophobicContact CE1-CG1 4.2Å; F409-I905 HydrophobicContact CZ-CG1 4.23Å; F699-I905 HydrophobicContact CD2-CD1 4.29Å; F699-I905 HydrophobicContact CE2-CD1 3.83Å; F699-I905 HydrophobicContact CZ-CD1 3.98Å; L760-I905 HydrophobicContact CD1-CG2 4.18Å; L760-I905 HydrophobicContact CD2-CD1 4.43Å; L760-I905 HydrophobicContact CD2-CG2 4.09Å; L760-I905 HydrophobicContact CG-CG2 4.43Å; M764-I905 HydrophobicContact CE-CG1 4.37Å; M764-I905 HydrophobicContact SD-CG1 4.35Å; M764-I905 HydrophobicContact SD-CG2 4Å; L890-I905 HydrophobicContact CD1-CB 3.97Å; L890-I905 HydrophobicContact CD1-CD1 4.22Å; L890-I905 HydrophobicContact CD1-CG2 3.92Å; L890-I905 HydrophobicContact CD2-CB 4.38Å; L890-I905 HydrophobicContact CD2-CG2 4.1Å; L890-I905 HydrophobicContact CG-CG2 4.5Å; L901-I905 HydrophobicContact CD1-CD1 4.11Å; L901-I905 HydrophobicContact CG-CD1 3.97Å; L901-I905 WeakPolarHBondContact O-CG1 3.4Å; L901-I905 PolarHBondContact O-N 2.98Å; L901-I905 VanDerWaalsContact O-N 3.11Å; K902-I905 PolarHBondContact O-N 2.73Å; D903-I905 PolarHBondContact O-N 3.3Å; I905-L907 VanDerWaalsContact C-N 3.3Å; I905-L907 PolarHBondContact O-N 2.87Å; I905-F908 PolarHBondContact O-N 3.3Å; I905-L909 HydrophobicContact CG2-CD1 4.17Å; I905-L909 HydrophobicContact CG2-CG 4.16Å; I905-L909 WeakPolarHBondContact O-CG 3.31Å; I905-L909 PolarHBondContact O-N 2.91Å
906	S	90.4	Very high	87.5	Confident	34 Å²	34	46.1 Å²	46.1	24%	0.238	25%	0.247	C	C	.	.	H	α-helix	trans	-58.5	-41.8	175.1	-176.6	0	0	0	0	111.7	W887 K902 D903 S910	W887-S906 WeakPolarHBondContact CH2-O 3.37Å; W887-S906 VanDerWaalsContact CH2-OG 3.26Å; W887-S906 WeakPolarHBondContact CH2-OG 3.45Å; W887-S906 WeakPolarHBondContact CZ3-OG 3.44Å; K902-S906 WeakPolarHBondContact O-CB 3.25Å; K902-S906 PolarHBondContact O-N 3.1Å; D903-S906 PolarHBondContact O-N 3.48Å; S906-S910 WeakPolarHBondContact O-CB 3.37Å; S906-S910 PolarHBondContact O-N 2.92Å
907	L	90.6	Very high	88.2	Confident	131 Å²	131	42.1 Å²	42.1	69%	0.686	23%	0.229	S	C	*	.	H	α-helix	trans	-64	-45.2	176.1	-176.9	63.8	0	0	0	111.7	D903 K904 I905 S910 D911	D903-L907 WeakPolarHBondContact O-CB 3.5Å; D903-L907 PolarHBondContact O-N 3.5Å; K904-L907 PolarHBondContact O-N 2.9Å; I905-L907 VanDerWaalsContact C-N 3.3Å; I905-L907 PolarHBondContact O-N 2.87Å; L907-S910 PolarHBondContact O-N 3.36Å; L907-D911 PolarHBondContact O-N 3.24Å
908	F	92	Very high	88.8	Confident	13 Å²	13	39.7 Å²	39.7	6%	0.057	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-49.3	175.9	175.8	-90.3	0	0	0	111.9	P404 P407 F763 M764 K904 I905 S910 D911 C912	P404-F908 HydrophobicContact CB-CD2 4.24Å; P404-F908 HydrophobicContact CB-CE2 3.82Å; P404-F908 HydrophobicContact CG-CE2 4.4Å; P407-F908 HydrophobicContact CG-CB 3.97Å; P407-F908 HydrophobicContact CG-CD2 4.43Å; P407-F908 HydrophobicContact CG-CG 4.38Å; F763-F908 HydrophobicContact CE1-CE1 4.47Å; M764-F908 HydrophobicContact CB-CE1 3.91Å; M764-F908 HydrophobicContact CB-CZ 4.15Å; M764-F908 HydrophobicContact CE-CD1 3.95Å; M764-F908 HydrophobicContact CE-CE1 4.33Å; M764-F908 HydrophobicContact CE-CG 4.09Å; M764-F908 HydrophobicContact CG-CD1 3.87Å; M764-F908 HydrophobicContact CG-CE1 3.57Å; M764-F908 HydrophobicContact CG-CZ 4.29Å; K904-F908 PolarHBondContact O-N 3.1Å; K904-F908 VanDerWaalsContact O-N 3.16Å; I905-F908 PolarHBondContact O-N 3.3Å; F908-S910 VanDerWaalsContact C-N 3.25Å; F908-S910 PolarHBondContact O-N 3Å; F908-D911 PolarHBondContact O-N 3.49Å; F908-C912 WeakPolarHBondContact CE1-SG 3.46Å; F908-C912 VanDerWaalsContact CZ-SG 3.54Å; F908-C912 PolarHBondContact O-N 3.12Å; F908-C912 PolarHBondContact O-SG 3.34Å; F908-C912 VanDerWaalsContact O-SG 3.33Å
909	L	93	Very high	89.7	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-31.8	179.2	-67.6	-178.5	0	0	0	112.4	L760 F763 W887 L890 I905 A913	L760-L909 HydrophobicContact CD1-CD1 4.19Å; L760-L909 HydrophobicContact CD1-CD2 4.19Å; F763-L909 HydrophobicContact CD1-CD2 4.04Å; F763-L909 HydrophobicContact CE1-CD2 3.77Å; W887-L909 HydrophobicContact CD2-CB 4.11Å; W887-L909 HydrophobicContact CD2-CD1 3.83Å; W887-L909 VanDerWaalsContact CE2-CB 3.46Å; W887-L909 HydrophobicContact CE3-CD1 4.1Å; W887-L909 HydrophobicContact CG-CD1 4.09Å; W887-L909 HydrophobicContact CH2-CB 4.15Å; W887-L909 HydrophobicContact CZ2-CB 3.5Å; L890-L909 HydrophobicContact CB-CD1 4.2Å; L890-L909 HydrophobicContact CD2-CD1 3.91Å; I905-L909 HydrophobicContact CG2-CD1 4.17Å; I905-L909 HydrophobicContact CG2-CG 4.16Å; I905-L909 WeakPolarHBondContact O-CG 3.31Å; I905-L909 PolarHBondContact O-N 2.91Å; L909-A913 WeakPolarHBondContact O-CB 3.33Å; L909-A913 PolarHBondContact O-N 3.46Å
910	S	91.1	Very high	90.6	Very high	41 Å²	41	32.7 Å²	32.7	29%	0.287	18%	0.175	S	C	.	.	H	α-helix	trans	-67.5	-44.2	174.3	-173.5	0	0	0	0	111.8	S906 L907 F908 A913 Q914	S906-S910 WeakPolarHBondContact O-CB 3.37Å; S906-S910 PolarHBondContact O-N 2.92Å; L907-S910 PolarHBondContact O-N 3.36Å; F908-S910 VanDerWaalsContact C-N 3.25Å; F908-S910 PolarHBondContact O-N 3Å; S910-A913 PolarHBondContact O-N 3.5Å; S910-Q914 PolarHBondContact O-N 3.08Å; S910-Q914 VanDerWaalsContact O-N 3.08Å
911	D	90.5	Very high	91.1	Very high	40 Å²	40	32.8 Å²	32.8	21%	0.214	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-46.2	173.5	-177.9	59.1	0	0	0	110.8	P404 R503 L907 F908 A913 Q914 R915	P404-D911 WeakPolarHBondContact CB-OD2 3.47Å; R503-D911 IonicContact NH2-OD1 3.51Å; R503-D911 PolarHBondContact NH2-OD1 2.74Å; L907-D911 PolarHBondContact O-N 3.24Å; F908-D911 PolarHBondContact O-N 3.49Å; D911-A913 VanDerWaalsContact C-N 3.3Å; D911-A913 PolarHBondContact O-N 3.02Å; D911-Q914 PolarHBondContact O-N 3.01Å; D911-R915 WeakPolarHBondContact O-CB 3.33Å; D911-R915 WeakPolarHBondContact O-CG 3.47Å; D911-R915 PolarHBondContact O-N 3.38Å; D911-R915 VanDerWaalsContact OD2-CD 3.28Å; D911-R915 WeakPolarHBondContact OD2-CD 3.42Å
912	C	93.3	Very high	91.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-55.3	-43.8	174.8	-69.8	0	0	0	0	112.4	Y767 F908 R915 I916	Y767-C912 HydrophobicContact CD2-CB 4.17Å; Y767-C912 HydrophobicContact CE1-CB 4.23Å; Y767-C912 HydrophobicContact CE2-CB 3.71Å; Y767-C912 WeakPolarHBondContact OH-CA 3.32Å; Y767-C912 PolarHBondContact OH-O 3.29Å; F908-C912 WeakPolarHBondContact CE1-SG 3.46Å; F908-C912 VanDerWaalsContact CZ-SG 3.54Å; F908-C912 PolarHBondContact O-N 3.12Å; F908-C912 PolarHBondContact O-SG 3.34Å; F908-C912 VanDerWaalsContact O-SG 3.33Å; C912-R915 PolarHBondContact O-N 3.36Å; C912-I916 WeakPolarHBondContact O-CB 3.46Å; C912-I916 WeakPolarHBondContact O-CD1 3.26Å; C912-I916 WeakPolarHBondContact O-CG1 3.32Å; C912-I916 PolarHBondContact O-N 2.91Å
913	A	93.6	Very high	92.2	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-46.9	178.4	0	0	0	0	0	111.7	W494 A497 L909 S910 D911 R915 I916 L917	W494-A913 HydrophobicContact CE3-CB 3.97Å; W494-A913 HydrophobicContact CH2-CB 4.38Å; W494-A913 HydrophobicContact CZ3-CB 3.71Å; A497-A913 HydrophobicContact CB-CB 3.83Å; L909-A913 WeakPolarHBondContact O-CB 3.33Å; L909-A913 PolarHBondContact O-N 3.46Å; S910-A913 PolarHBondContact O-N 3.5Å; D911-A913 VanDerWaalsContact C-N 3.3Å; D911-A913 PolarHBondContact O-N 3.02Å; A913-R915 VanDerWaalsContact C-N 3.32Å; A913-R915 PolarHBondContact O-N 3.49Å; A913-I916 PolarHBondContact O-N 3.27Å; A913-L917 VanDerWaalsContact O-CG 3.28Å; A913-L917 WeakPolarHBondContact O-CG 3.37Å; A913-L917 PolarHBondContact O-N 3.44Å
914	Q	92.4	Very high	92.5	Very high	42 Å²	42	30.1 Å²	30.1	20%	0.196	15%	0.151	C	C	.	.	H	α-helix	trans	-61.9	-39.2	176.5	-71.8	-174.3	-26.9	0	0	112.4	A497 S500 L501 S910 D911 L917 T918	A497-Q914 HydrophobicContact CB-CG 4.36Å; S500-Q914 PolarHBondContact O-NE2 3.26Å; S500-Q914 PolarHBondContact OG-NE2 3.28Å; S500-Q914 VanDerWaalsContact OG-NE2 3.09Å; L501-Q914 HydrophobicContact CD1-CB 4.34Å; L501-Q914 WeakPolarHBondContact CD1-O 3.33Å; S910-Q914 PolarHBondContact O-N 3.08Å; S910-Q914 VanDerWaalsContact O-N 3.08Å; D911-Q914 PolarHBondContact O-N 3.01Å; Q914-L917 PolarHBondContact O-N 3.34Å; Q914-T918 WeakPolarHBondContact O-CB 3.48Å; Q914-T918 PolarHBondContact O-N 2.95Å; Q914-T918 PolarHBondContact O-OG1 3.42Å
915	R	92.9	Very high	92.9	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-68.1	-42.2	177.2	-70.9	179.9	74.5	104	15.2	112.5	P402 R503 N508 Y767 E771 D911 C912 A913 L917 T918 L919	P402-R915 PolarHBondContact O-NH1 2.83Å; R503-R915 VanDerWaalsContact CZ-CG 3.49Å; N508-R915 PolarHBondContact OD1-NH2 3.43Å; Y767-R915 WeakPolarHBondContact OH-CB 3.41Å; E771-R915 IonicContact OE1-CZ 2.66Å; E771-R915 IonicContact OE1-NE 2.99Å; E771-R915 PolarHBondContact OE1-NE 3.38Å; E771-R915 IonicContact OE1-NH2 3.09Å; E771-R915 PolarHBondContact OE1-NH2 3.37Å; E771-R915 IonicContact OE2-CZ 4Å; E771-R915 IonicContact OE2-NE 2.77Å; E771-R915 PolarHBondContact OE2-NE 3.15Å; E771-R915 IonicContact OE2-NH2 2.74Å; E771-R915 PolarHBondContact OE2-NH2 2.89Å; D911-R915 WeakPolarHBondContact O-CB 3.33Å; D911-R915 WeakPolarHBondContact O-CG 3.47Å; D911-R915 PolarHBondContact O-N 3.38Å; D911-R915 VanDerWaalsContact OD2-CD 3.28Å; D911-R915 WeakPolarHBondContact OD2-CD 3.42Å; C912-R915 PolarHBondContact O-N 3.36Å; A913-R915 VanDerWaalsContact C-N 3.32Å; A913-R915 PolarHBondContact O-N 3.49Å; R915-L917 VanDerWaalsContact C-N 3.34Å; R915-L917 PolarHBondContact O-N 3.34Å; R915-T918 WeakPolarHBondContact O-CB 3.43Å; R915-T918 PolarHBondContact O-N 3.44Å; R915-L919 PolarHBondContact O-N 3.47Å
916	I	94.8	Very high	93.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-45.6	172.4	-69.8	160	0	0	0	110.4	W494 Y767 L876 M879 E880 C883 C912 A913 T918 L919 K920	W494-I916 HydrophobicContact CH2-CB 4.18Å; W494-I916 HydrophobicContact CH2-CD1 4.2Å; W494-I916 HydrophobicContact CH2-CG2 3.91Å; W494-I916 HydrophobicContact CZ2-CG2 4.28Å; Y767-I916 HydrophobicContact CE2-CD1 3.9Å; Y767-I916 HydrophobicContact CE2-CG1 3.92Å; L876-I916 HydrophobicContact CD1-CG2 4.28Å; M879-I916 HydrophobicContact CB-CD1 4.37Å; M879-I916 HydrophobicContact CB-CG1 4.37Å; M879-I916 HydrophobicContact CE-CG1 4.4Å; M879-I916 WeakPolarHBondContact O-CD1 3.4Å; E880-I916 HydrophobicContact CB-CG2 3.97Å; C883-I916 HydrophobicContact CB-CD1 3.47Å; C883-I916 VanDerWaalsContact CB-CD1 3.47Å; C912-I916 WeakPolarHBondContact O-CB 3.46Å; C912-I916 WeakPolarHBondContact O-CD1 3.26Å; C912-I916 WeakPolarHBondContact O-CG1 3.32Å; C912-I916 PolarHBondContact O-N 2.91Å; A913-I916 PolarHBondContact O-N 3.27Å; I916-T918 VanDerWaalsContact C-N 3.31Å; I916-T918 PolarHBondContact O-N 3.38Å; I916-L919 PolarHBondContact O-N 3.35Å; I916-K920 HydrophobicContact CG2-CD 4.45Å; I916-K920 WeakPolarHBondContact O-CG 3.27Å; I916-K920 PolarHBondContact O-N 3.4Å
917	L	93.3	Very high	93.2	Very high	19 Å²	19	27.2 Å²	27.2	10%	0.099	14%	0.135	C	C	.	.	H	α-helix	trans	-60.5	-42.3	176.4	-71	168.4	0	0	0	111.8	W494 A497 V498 L501 A913 Q914 R915 K920 I921	W494-L917 HydrophobicContact CZ2-CD2 4.09Å; W494-L917 HydrophobicContact CZ2-CG 4.26Å; A497-L917 HydrophobicContact CB-CD1 4.02Å; V498-L917 HydrophobicContact CB-CD1 4.35Å; V498-L917 HydrophobicContact CG2-CD1 3.63Å; V498-L917 HydrophobicContact CG2-CD2 3.8Å; V498-L917 HydrophobicContact CG2-CG 4.38Å; L501-L917 HydrophobicContact CD1-CB 3.97Å; L501-L917 HydrophobicContact CD2-CB 3.96Å; A913-L917 VanDerWaalsContact O-CG 3.28Å; A913-L917 WeakPolarHBondContact O-CG 3.37Å; A913-L917 PolarHBondContact O-N 3.44Å; Q914-L917 PolarHBondContact O-N 3.34Å; R915-L917 VanDerWaalsContact C-N 3.34Å; R915-L917 PolarHBondContact O-N 3.34Å; L917-K920 WeakPolarHBondContact O-CB 3.36Å; L917-K920 PolarHBondContact O-N 3.44Å; L917-I921 WeakPolarHBondContact O-CG1 3.28Å; L917-I921 PolarHBondContact O-N 3.26Å
918	T	92.2	Very high	93.3	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-59.7	-47.3	174.4	-55.9	0	0	0	0	111	L505 Q914 R915 I916 K920 I921 I922	L505-T918 HydrophobicContact CD2-CG2 3.82Å; Q914-T918 WeakPolarHBondContact O-CB 3.48Å; Q914-T918 PolarHBondContact O-N 2.95Å; Q914-T918 PolarHBondContact O-OG1 3.42Å; R915-T918 WeakPolarHBondContact O-CB 3.43Å; R915-T918 PolarHBondContact O-N 3.44Å; I916-T918 VanDerWaalsContact C-N 3.31Å; I916-T918 PolarHBondContact O-N 3.38Å; T918-K920 VanDerWaalsContact C-N 3.32Å; T918-K920 PolarHBondContact O-N 3Å; T918-I921 WeakPolarHBondContact O-CB 3.41Å; T918-I921 PolarHBondContact O-N 3.29Å; T918-I921 VanDerWaalsContact O-N 3.15Å; T918-I922 HydrophobicContact CG2-CD1 3.95Å; T918-I922 WeakPolarHBondContact O-CG1 3.49Å; T918-I922 PolarHBondContact O-N 2.57Å
919	L	94.5	Very high	93.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.1	-37.1	175.1	-83.9	176.8	0	0	0	112.9	V507 E771 V774 A775 L876 M879 R915 I916 I921 I922 H923	V507-L919 HydrophobicContact CG1-CD2 4.3Å; V507-L919 HydrophobicContact CG2-CD2 3.91Å; V507-L919 HydrophobicContact CG2-CG 4.31Å; E771-L919 HydrophobicContact CG-CD1 3.97Å; V774-L919 HydrophobicContact CG1-CD1 4.36Å; V774-L919 HydrophobicContact CG1-CD2 4.4Å; A775-L919 HydrophobicContact CB-CD2 4.02Å; L876-L919 HydrophobicContact CD1-CB 3.84Å; L876-L919 HydrophobicContact CD1-CD1 4.4Å; M879-L919 HydrophobicContact CE-CD1 4.38Å; R915-L919 PolarHBondContact O-N 3.47Å; I916-L919 PolarHBondContact O-N 3.35Å; L919-I921 VanDerWaalsContact C-N 3.33Å; L919-I921 PolarHBondContact O-N 3.43Å; L919-I922 PolarHBondContact O-N 3.29Å; L919-H923 VanDerWaalsContact O-CB 3.23Å; L919-H923 WeakPolarHBondContact O-CB 3.32Å; L919-H923 PolarHBondContact O-N 3.41Å
920	K	95.3	Very high	93.4	Very high	83 Å²	83	24.6 Å²	24.6	36%	0.361	12%	0.116	S	C	.	.	H	α-helix	trans	-63.2	-39.7	174	-72.3	-176.8	73.2	165.9	0	112.3	L876 E880 I916 L917 T918 K924	L876-K920 HydrophobicContact CD1-CG 4.13Å; L876-K920 HydrophobicContact CD2-CB 4.5Å; L876-K920 HydrophobicContact CD2-CG 3.83Å; L876-K920 HydrophobicContact CG-CG 3.98Å; E880-K920 IonicContact OE1-NZ 2.84Å; E880-K920 IonicContact OE2-NZ 3.41Å; E880-K920 PolarHBondContact OE2-NZ 3.11Å; I916-K920 HydrophobicContact CG2-CD 4.45Å; I916-K920 WeakPolarHBondContact O-CG 3.27Å; I916-K920 PolarHBondContact O-N 3.4Å; L917-K920 WeakPolarHBondContact O-CB 3.36Å; L917-K920 PolarHBondContact O-N 3.44Å; T918-K920 VanDerWaalsContact C-N 3.32Å; T918-K920 PolarHBondContact O-N 3Å; K920-K924 VanDerWaalsContact O-CB 3.3Å; K920-K924 WeakPolarHBondContact O-CB 3.44Å; K920-K924 PolarHBondContact O-N 3.29Å
921	I	92.6	Very high	93.4	Very high	35 Å²	35	26.1 Å²	26.1	18%	0.179	12%	0.116	C	C	.	.	H	α-helix	trans	-64.1	-50.2	173.8	-65.8	170.1	0	0	0	109.8	L501 L505 L917 T918 L919 H923 K924 R925	L501-I921 HydrophobicContact CD2-CD1 3.57Å; L505-I921 HydrophobicContact CD2-CG2 4.23Å; L917-I921 WeakPolarHBondContact O-CG1 3.28Å; L917-I921 PolarHBondContact O-N 3.26Å; T918-I921 WeakPolarHBondContact O-CB 3.41Å; T918-I921 PolarHBondContact O-N 3.29Å; T918-I921 VanDerWaalsContact O-N 3.15Å; L919-I921 VanDerWaalsContact C-N 3.33Å; L919-I921 PolarHBondContact O-N 3.43Å; I921-H923 PolarHBondContact O-N 3.36Å; I921-K924 PolarHBondContact O-N 3.34Å; I921-R925 HydrophobicContact CG2-CG 4.29Å; I921-R925 WeakPolarHBondContact O-CB 3.33Å; I921-R925 WeakPolarHBondContact O-CG 3.43Å; I921-R925 PolarHBondContact O-N 3.14Å
922	I	93.5	Very high	93.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.5	-52.6	179.1	-67.5	163.6	0	0	0	110.7	L505 V507 F512 L515 L778 T918 L919 K924 R925 I926	L505-I922 HydrophobicContact CB-CD1 4.4Å; L505-I922 HydrophobicContact CB-CG1 4.31Å; L505-I922 HydrophobicContact CD2-CG1 4.2Å; V507-I922 HydrophobicContact CG2-CD1 3.57Å; F512-I922 HydrophobicContact CB-CD1 4.14Å; F512-I922 HydrophobicContact CB-CG1 4.04Å; F512-I922 HydrophobicContact CB-CG2 4.29Å; F512-I922 HydrophobicContact CD1-CG2 3.48Å; F512-I922 VanDerWaalsContact CD1-CG2 3.48Å; F512-I922 HydrophobicContact CD2-CD1 3.63Å; F512-I922 HydrophobicContact CD2-CG1 4.28Å; F512-I922 HydrophobicContact CD2-CG2 4.04Å; F512-I922 HydrophobicContact CE1-CG2 3.62Å; F512-I922 HydrophobicContact CE2-CD1 4.2Å; F512-I922 HydrophobicContact CE2-CG2 4.16Å; F512-I922 HydrophobicContact CG-CD1 3.99Å; F512-I922 HydrophobicContact CG-CG1 4.13Å; F512-I922 HydrophobicContact CG-CG2 3.68Å; F512-I922 HydrophobicContact CZ-CG2 3.95Å; L515-I922 HydrophobicContact CD1-CG2 4.2Å; L778-I922 HydrophobicContact CD1-CG2 4.22Å; T918-I922 HydrophobicContact CG2-CD1 3.95Å; T918-I922 WeakPolarHBondContact O-CG1 3.49Å; T918-I922 PolarHBondContact O-N 2.57Å; L919-I922 PolarHBondContact O-N 3.29Å; I922-K924 VanDerWaalsContact C-N 3.34Å; I922-K924 PolarHBondContact O-N 3.38Å; I922-R925 PolarHBondContact O-N 3.38Å; I922-I926 HydrophobicContact CG2-CG1 4.07Å; I922-I926 WeakPolarHBondContact O-CB 3.42Å; I922-I926 WeakPolarHBondContact O-CG1 3.4Å; I922-I926 PolarHBondContact O-N 2.92Å
923	H	95.9	Very high	93.2	Very high	26 Å²	26	31.3 Å²	31.3	12%	0.12	14%	0.137	C	C	.	.	H	α-helix	trans	-52.6	-52.8	177.4	174.5	-79.5	0	0	0	110.5	L778 L876 L919 I921 R925 I926 I927	L778-H923 HydrophobicContact CD1-CB 3.87Å; L778-H923 HydrophobicContact CD2-CB 4.39Å; L876-H923 HydrophobicContact CD2-CB 3.84Å; L919-H923 VanDerWaalsContact O-CB 3.23Å; L919-H923 WeakPolarHBondContact O-CB 3.32Å; L919-H923 PolarHBondContact O-N 3.41Å; I921-H923 PolarHBondContact O-N 3.36Å; H923-R925 PolarHBondContact O-N 3.46Å; H923-I926 PolarHBondContact O-N 3.15Å; H923-I927 WeakPolarHBondContact O-CB 3.5Å; H923-I927 WeakPolarHBondContact O-CG1 3.34Å; H923-I927 PolarHBondContact O-N 2.93Å
924	K	94.3	Very high	93.1	Very high	96 Å²	96	31.3 Å²	31.3	42%	0.417	14%	0.136	S	C	.	.	H	α-helix	trans	-57.9	-47.5	179.3	-176.4	-173.6	172.4	-163	0	112.1	D520 K920 I921 I922 I927 N928	D520-K924 WeakPolarHBondContact O-CE 3.41Å; D520-K924 PolarHBondContact O-NZ 2.73Å; K920-K924 VanDerWaalsContact O-CB 3.3Å; K920-K924 WeakPolarHBondContact O-CB 3.44Å; K920-K924 PolarHBondContact O-N 3.29Å; I921-K924 PolarHBondContact O-N 3.34Å; I922-K924 VanDerWaalsContact C-N 3.34Å; I922-K924 PolarHBondContact O-N 3.38Å; K924-I927 PolarHBondContact O-N 3.5Å; K924-N928 WeakPolarHBondContact O-CB 3.24Å; K924-N928 PolarHBondContact O-N 3.37Å
925	R	94.3	Very high	92.9	Very high	19 Å²	19	31.7 Å²	31.7	7%	0.072	14%	0.139	C	C	.	.	H	α-helix	trans	-66.9	-42.8	-177.8	-72	-176.6	-177.4	-174.5	-3.9	112.4	L515 N516 D517 D519 D520 I921 I922 H923 N928 R929	L515-R925 HydrophobicContact CB-CB 4.26Å; L515-R925 HydrophobicContact CD1-CB 3.96Å; L515-R925 HydrophobicContact CD2-CB 4.41Å; L515-R925 HydrophobicContact CG-CB 4.45Å; L515-R925 PolarHBondContact O-NH1 3.04Å; N516-R925 VanDerWaalsContact C-CZ 3.46Å; N516-R925 PolarHBondContact O-NE 2.87Å; D517-R925 IonicContact OD1-CZ 3.57Å; D517-R925 IonicContact OD1-NH1 3.93Å; D517-R925 IonicContact OD1-NH2 2.78Å; D517-R925 PolarHBondContact OD1-NH2 3.01Å; D519-R925 HydrophobicContact CB-CB 3.84Å; D519-R925 HydrophobicContact CB-CG 3.84Å; D520-R925 WeakPolarHBondContact OD1-CG 3.41Å; D520-R925 IonicContact OD1-CZ 3.01Å; D520-R925 IonicContact OD1-NE 3.65Å; D520-R925 PolarHBondContact OD1-NE 2.89Å; D520-R925 IonicContact OD1-NH2 2.6Å; D520-R925 IonicContact OD2-CZ 3.61Å; D520-R925 IonicContact OD2-NE 3.6Å; D520-R925 PolarHBondContact OD2-NE 2.89Å; D520-R925 IonicContact OD2-NH2 3.34Å; D520-R925 PolarHBondContact OD2-NH2 3.25Å; I921-R925 HydrophobicContact CG2-CG 4.29Å; I921-R925 WeakPolarHBondContact O-CB 3.33Å; I921-R925 WeakPolarHBondContact O-CG 3.43Å; I921-R925 PolarHBondContact O-N 3.14Å; I922-R925 PolarHBondContact O-N 3.38Å; H923-R925 PolarHBondContact O-N 3.46Å; R925-N928 PolarHBondContact O-N 2.89Å; R925-R929 WeakPolarHBondContact O-CB 3.38Å; R925-R929 PolarHBondContact O-N 2.75Å
926	I	94.7	Very high	92.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.1	-45.1	176.3	-71.6	-63.2	0	0	0	111.1	F512 L515 L778 L781 K782 I922 H923 N928 R929 F930	F512-I926 HydrophobicContact CD1-CD1 4.33Å; F512-I926 HydrophobicContact CD1-CG1 4.41Å; F512-I926 HydrophobicContact CE1-CG1 4.46Å; L515-I926 HydrophobicContact CD1-CD1 3.76Å; L515-I926 HydrophobicContact CD1-CG1 3.79Å; L515-I926 HydrophobicContact CD2-CD1 3.92Å; L515-I926 HydrophobicContact CG-CD1 4.38Å; L778-I926 HydrophobicContact CD2-CB 4.48Å; L778-I926 HydrophobicContact CD2-CG2 4.21Å; L781-I926 HydrophobicContact CB-CG2 4.17Å; L781-I926 HydrophobicContact CD2-CG2 3.66Å; L781-I926 HydrophobicContact CG-CG2 4Å; K782-I926 HydrophobicContact CB-CD1 3.73Å; K782-I926 HydrophobicContact CG-CD1 4.03Å; I922-I926 HydrophobicContact CG2-CG1 4.07Å; I922-I926 WeakPolarHBondContact O-CB 3.42Å; I922-I926 WeakPolarHBondContact O-CG1 3.4Å; I922-I926 PolarHBondContact O-N 2.92Å; H923-I926 PolarHBondContact O-N 3.15Å; I926-N928 VanDerWaalsContact C-N 3.34Å; I926-N928 PolarHBondContact O-N 3.05Å; I926-R929 PolarHBondContact O-N 3.47Å; I926-F930 WeakPolarHBondContact O-CB 3.15Å; I926-F930 PolarHBondContact O-N 3.49Å
927	I	93.7	Very high	92.2	Very high	24 Å²	24	40.6 Å²	40.6	12%	0.123	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-41.1	178.1	-62.6	-67.9	0	0	0	111	L781 H923 K924 F930 R931 I949	L781-I927 HydrophobicContact CD2-CD1 4.47Å; H923-I927 WeakPolarHBondContact O-CB 3.5Å; H923-I927 WeakPolarHBondContact O-CG1 3.34Å; H923-I927 PolarHBondContact O-N 2.93Å; K924-I927 PolarHBondContact O-N 3.5Å; I927-F930 PolarHBondContact O-N 2.8Å; I927-R931 WeakPolarHBondContact O-CG 3.38Å; I927-R931 PolarHBondContact O-N 2.87Å; I927-I949 HydrophobicContact CD1-CD1 3.33Å
928	N	92.5	Very high	91.7	Very high	10 Å²	10	42 Å²	42	5%	0.053	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-41.4	174.7	-77.3	-12.7	0	0	0	112.1	D519 D520 P523 K924 R925 I926 F930 R931 K932	D519-N928 WeakPolarHBondContact O-CB 3.22Å; D519-N928 PolarHBondContact O-ND2 3.49Å; D520-N928 PolarHBondContact O-ND2 2.99Å; P523-N928 WeakPolarHBondContact CG-O 3.15Å; K924-N928 WeakPolarHBondContact O-CB 3.24Å; K924-N928 PolarHBondContact O-N 3.37Å; R925-N928 PolarHBondContact O-N 2.89Å; I926-N928 VanDerWaalsContact C-N 3.34Å; I926-N928 PolarHBondContact O-N 3.05Å; N928-F930 VanDerWaalsContact C-N 3.33Å; N928-F930 PolarHBondContact O-N 2.98Å; N928-R931 PolarHBondContact O-N 3.21Å; N928-K932 WeakPolarHBondContact O-CB 3.47Å; N928-K932 PolarHBondContact O-N 3.34Å
929	R	92.3	Very high	91.4	Very high	68 Å²	68	42.2 Å²	42.2	26%	0.257	20%	0.196	S	C	.	.	H	α-helix	trans	-64.2	-39.2	175.9	-171.2	168	174.3	176.9	-13.8	111.5	E514 M785 R925 I926 K932 F933	E514-R929 IonicContact OE1-CZ 2.78Å; E514-R929 VanDerWaalsContact OE1-CZ 3.23Å; E514-R929 IonicContact OE1-NH1 3.12Å; E514-R929 PolarHBondContact OE1-NH1 3.46Å; E514-R929 IonicContact OE1-NH2 3.34Å; E514-R929 PolarHBondContact OE1-NH2 3.36Å; M785-R929 HydrophobicContact CE-CB 4.24Å; M785-R929 HydrophobicContact CE-CG 4.02Å; M785-R929 HydrophobicContact SD-CB 4.42Å; M785-R929 HydrophobicContact SD-CG 4.04Å; R925-R929 WeakPolarHBondContact O-CB 3.38Å; R925-R929 PolarHBondContact O-N 2.75Å; I926-R929 PolarHBondContact O-N 3.47Å; R929-K932 WeakPolarHBondContact O-CB 3.49Å; R929-K932 PolarHBondContact O-N 3.23Å; R929-F933 WeakPolarHBondContact O-CB 3.4Å; R929-F933 PolarHBondContact O-N 3.26Å
930	F	93.1	Very high	90.9	Very high	10 Å²	10	44 Å²	44	4%	0.044	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-45.5	173.3	-175	-101.7	0	0	0	112	L781 M785 I926 I927 N928 K932 F933 L934 I949 I952	L781-F930 HydrophobicContact CD1-CD2 3.6Å; L781-F930 HydrophobicContact CD1-CE2 3.85Å; L781-F930 HydrophobicContact CD1-CG 4.29Å; L781-F930 HydrophobicContact CD2-CB 4.37Å; L781-F930 HydrophobicContact CD2-CG 4.45Å; L781-F930 HydrophobicContact CG-CD2 4.31Å; M785-F930 HydrophobicContact CG-CD2 4.08Å; M785-F930 WeakPolarHBondContact SD-CA 3.38Å; M785-F930 HydrophobicContact SD-CB 3.95Å; M785-F930 HydrophobicContact SD-CD2 4.08Å; I926-F930 WeakPolarHBondContact O-CB 3.15Å; I926-F930 PolarHBondContact O-N 3.49Å; I927-F930 PolarHBondContact O-N 2.8Å; N928-F930 VanDerWaalsContact C-N 3.33Å; N928-F930 PolarHBondContact O-N 2.98Å; F930-K932 VanDerWaalsContact C-N 3.3Å; F930-K932 PolarHBondContact O-N 2.73Å; F930-F933 CarbonylContact O-C 3.41Å; F930-F933 WeakPolarHBondContact O-CA 3.44Å; F930-F933 VanDerWaalsContact O-CB 3.32Å; F930-F933 WeakPolarHBondContact O-CB 3.39Å; F930-F933 PolarHBondContact O-N 3.45Å; F930-L934 HydrophobicContact CD1-CD1 4.03Å; F930-L934 HydrophobicContact CD1-CG 4.14Å; F930-L934 HydrophobicContact CE1-CD1 3.53Å; F930-L934 HydrophobicContact CE1-CD2 3.96Å; F930-L934 HydrophobicContact CE1-CG 3.8Å; F930-L934 HydrophobicContact CE2-CD2 4.27Å; F930-L934 HydrophobicContact CZ-CD1 4.19Å; F930-L934 HydrophobicContact CZ-CD2 3.75Å; F930-L934 HydrophobicContact CZ-CG 4.12Å; F930-L934 WeakPolarHBondContact O-CG 3.24Å; F930-L934 PolarHBondContact O-N 2.89Å; F930-I949 HydrophobicContact CD1-CB 4.46Å; F930-I949 HydrophobicContact CD1-CD1 4.11Å; F930-I949 HydrophobicContact CD1-CG1 3.74Å; F930-I949 HydrophobicContact CD1-CG2 4.28Å; F930-I949 HydrophobicContact CD2-CG2 4.45Å; F930-I949 HydrophobicContact CE1-CB 3.93Å; F930-I949 HydrophobicContact CE1-CD1 4.42Å; F930-I949 HydrophobicContact CE1-CG1 3.58Å; F930-I949 HydrophobicContact CE1-CG2 3.85Å; F930-I949 HydrophobicContact CE2-CG2 4.04Å; F930-I949 HydrophobicContact CZ-CB 4.2Å; F930-I949 HydrophobicContact CZ-CG1 4.33Å; F930-I949 HydrophobicContact CZ-CG2 3.72Å; F930-I952 HydrophobicContact CE1-CD1 4.16Å; F930-I952 HydrophobicContact CZ-CB 4.46Å; F930-I952 HydrophobicContact CZ-CD1 4.04Å
931	R	91.9	Very high	90.2	Very high	73 Å²	73	42.7 Å²	42.7	28%	0.275	20%	0.203	S	C	.	.	H	α-helix	trans	-59.4	-41.4	174.2	-70.8	171.3	178.4	179.7	2.3	112.2	D522 P523 I927 N928 F933 L934 L935 V944	D522-R931 IonicContact OD1-NH1 3.18Å; D522-R931 IonicContact OD2-NH1 3.78Å; D522-R931 PolarHBondContact OD2-NH1 3.44Å; P523-R931 HydrophobicContact CG-CB 3.65Å; I927-R931 WeakPolarHBondContact O-CG 3.38Å; I927-R931 PolarHBondContact O-N 2.87Å; N928-R931 PolarHBondContact O-N 3.21Å; R931-F933 VanDerWaalsContact C-N 3.3Å; R931-L934 PolarHBondContact O-N 3.49Å; R931-L935 WeakPolarHBondContact O-CG 3.06Å; R931-L935 PolarHBondContact O-N 3.06Å; R931-L935 VanDerWaalsContact O-N 3.11Å; R931-V944 HydrophobicContact CB-CG1 3.92Å; R931-V944 HydrophobicContact CG-CG1 3.92Å
932	K	89.5	Confident	89.8	Confident	131 Å²	131	46.2 Å²	46.2	57%	0.57	22%	0.218	S	C	*	.	H	α-helix	trans	-63	-39.7	174.3	-174.1	-178.4	177.4	-175	0	111.1	P523 N928 R929 F930 L935 Y936	P523-K932 HydrophobicContact CB-CB 4.11Å; P523-K932 HydrophobicContact CG-CB 4.15Å; N928-K932 WeakPolarHBondContact O-CB 3.47Å; N928-K932 PolarHBondContact O-N 3.34Å; R929-K932 WeakPolarHBondContact O-CB 3.49Å; R929-K932 PolarHBondContact O-N 3.23Å; F930-K932 VanDerWaalsContact C-N 3.3Å; F930-K932 PolarHBondContact O-N 2.73Å; K932-L935 PolarHBondContact O-N 3.35Å; K932-Y936 WeakPolarHBondContact O-CB 3.42Å; K932-Y936 PolarHBondContact O-N 3.21Å
933	F	90.7	Very high	89.3	Confident	19 Å²	19	47.3 Å²	47.3	8%	0.083	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-40	175	-178	-99.3	0	0	0	112.1	M785 L788 D789 R929 F930 R931 L935 Y936 M937	M785-F933 HydrophobicContact CB-CD2 4.36Å; M785-F933 HydrophobicContact CB-CG 4.43Å; M785-F933 HydrophobicContact CG-CB 4.29Å; M785-F933 HydrophobicContact CG-CD1 4.15Å; M785-F933 HydrophobicContact CG-CD2 4.47Å; M785-F933 HydrophobicContact CG-CG 4.05Å; M785-F933 HydrophobicContact SD-CB 3.94Å; M785-F933 HydrophobicContact SD-CG 4.34Å; L788-F933 HydrophobicContact CB-CE1 4.44Å; L788-F933 HydrophobicContact CB-CE2 4.49Å; L788-F933 HydrophobicContact CB-CZ 3.69Å; L788-F933 HydrophobicContact CD1-CE1 3.89Å; L788-F933 HydrophobicContact CD1-CZ 3.99Å; D789-F933 HydrophobicContact CB-CE2 4.35Å; R929-F933 WeakPolarHBondContact O-CB 3.4Å; R929-F933 PolarHBondContact O-N 3.26Å; F930-F933 CarbonylContact O-C 3.41Å; F930-F933 WeakPolarHBondContact O-CA 3.44Å; F930-F933 VanDerWaalsContact O-CB 3.32Å; F930-F933 WeakPolarHBondContact O-CB 3.39Å; F930-F933 PolarHBondContact O-N 3.45Å; R931-F933 VanDerWaalsContact C-N 3.3Å; F933-L935 PolarHBondContact O-N 3.38Å; F933-Y936 HydrophobicContact CD2-CD1 4.07Å; F933-Y936 HydrophobicContact CE2-CD1 4.13Å; F933-Y936 HydrophobicContact CE2-CE1 4.41Å; F933-Y936 CarbonylContact O-C 3.5Å; F933-Y936 WeakPolarHBondContact O-CB 3.37Å; F933-Y936 PolarHBondContact O-N 2.95Å; F933-Y936 VanDerWaalsContact O-N 3.17Å; F933-M937 HydrophobicContact CD1-CG 4.09Å; F933-M937 HydrophobicContact CE1-CG 3.67Å; F933-M937 HydrophobicContact CE1-SD 4.24Å; F933-M937 HydrophobicContact CE2-CE 4Å; F933-M937 HydrophobicContact CE2-CG 4.39Å; F933-M937 HydrophobicContact CZ-CE 3.93Å; F933-M937 HydrophobicContact CZ-CG 3.83Å; F933-M937 HydrophobicContact CZ-SD 3.89Å; F933-M937 VanDerWaalsContact O-CG 3.32Å; F933-M937 WeakPolarHBondContact O-CG 3.26Å; F933-M937 PolarHBondContact O-N 3.13Å
934	L	90.5	Very high	88.8	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-40.3	174.6	-63.5	-173.7	0	0	0	113	F930 R931 Y936 M937 G938 M939 V944 I952	F930-L934 HydrophobicContact CD1-CD1 4.03Å; F930-L934 HydrophobicContact CD1-CG 4.14Å; F930-L934 HydrophobicContact CE1-CD1 3.53Å; F930-L934 HydrophobicContact CE1-CD2 3.96Å; F930-L934 HydrophobicContact CE1-CG 3.8Å; F930-L934 HydrophobicContact CE2-CD2 4.27Å; F930-L934 HydrophobicContact CZ-CD1 4.19Å; F930-L934 HydrophobicContact CZ-CD2 3.75Å; F930-L934 HydrophobicContact CZ-CG 4.12Å; F930-L934 WeakPolarHBondContact O-CG 3.24Å; F930-L934 PolarHBondContact O-N 2.89Å; R931-L934 PolarHBondContact O-N 3.49Å; L934-Y936 VanDerWaalsContact C-N 3.3Å; L934-M937 PolarHBondContact O-N 3.42Å; L934-G938 PolarHBondContact O-N 2.87Å; L934-M939 HydrophobicContact CB-CB 4.25Å; L934-M939 HydrophobicContact CB-CG 4.27Å; L934-M939 WeakPolarHBondContact O-CB 3.47Å; L934-M939 PolarHBondContact O-N 3.43Å; L934-V944 HydrophobicContact CB-CG1 4.3Å; L934-V944 HydrophobicContact CB-CG2 3.98Å; L934-V944 HydrophobicContact CD1-CG1 4.15Å; L934-I952 HydrophobicContact CD1-CD1 3.42Å; L934-I952 VanDerWaalsContact CD1-CD1 3.42Å; L934-I952 HydrophobicContact CD2-CD1 3.45Å; L934-I952 VanDerWaalsContact CD2-CD1 3.45Å; L934-I952 HydrophobicContact CD2-CG1 4.49Å; L934-I952 HydrophobicContact CD2-CG2 4.2Å; L934-I952 HydrophobicContact CG-CD1 4.06Å
935	L	87.7	Confident	88.2	Confident	49 Å²	49	46.9 Å²	46.9	26%	0.257	23%	0.226	S	C	.	.	H	α-helix	trans	-62.5	-40.9	172.6	-66.2	171.6	0	0	0	111.1	P523 L524 R931 K932 F933 M937 G938 Q941 V944	P523-L935 HydrophobicContact CB-CD1 4.09Å; L524-L935 HydrophobicContact CD2-CD1 4.19Å; L524-L935 HydrophobicContact CD2-CD2 4.3Å; R931-L935 WeakPolarHBondContact O-CG 3.06Å; R931-L935 PolarHBondContact O-N 3.06Å; R931-L935 VanDerWaalsContact O-N 3.11Å; K932-L935 PolarHBondContact O-N 3.35Å; F933-L935 PolarHBondContact O-N 3.38Å; L935-M937 VanDerWaalsContact C-N 3.31Å; L935-M937 PolarHBondContact O-N 2.98Å; L935-G938 PolarHBondContact O-N 3.04Å; L935-G938 VanDerWaalsContact O-N 3.13Å; L935-Q941 HydrophobicContact CD2-CG 3.9Å; L935-V944 HydrophobicContact CD2-CG2 3.97Å; L935-V944 HydrophobicContact CG-CG2 4.38Å
936	Y	86.6	Confident	87.6	Confident	146 Å²	146	52.5 Å²	52.5	57%	0.573	26%	0.257	S	S	*	.	H	α-helix	trans	-61.9	-37.4	174.8	169.2	-113.9	0	0	0	112.5	D789 K932 F933 L934 G938	D789-Y936 WeakPolarHBondContact OD1-CE1 3.4Å; D789-Y936 PolarHBondContact OD1-OH 3Å; K932-Y936 WeakPolarHBondContact O-CB 3.42Å; K932-Y936 PolarHBondContact O-N 3.21Å; F933-Y936 HydrophobicContact CD2-CD1 4.07Å; F933-Y936 HydrophobicContact CE2-CD1 4.13Å; F933-Y936 HydrophobicContact CE2-CE1 4.41Å; F933-Y936 CarbonylContact O-C 3.5Å; F933-Y936 WeakPolarHBondContact O-CB 3.37Å; F933-Y936 PolarHBondContact O-N 2.95Å; F933-Y936 VanDerWaalsContact O-N 3.17Å; L934-Y936 VanDerWaalsContact C-N 3.3Å; Y936-G938 PolarHBondContact O-N 3.33Å
937	M	86.6	Confident	87.2	Confident	43 Å²	43	54.1 Å²	54.1	21%	0.212	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-2.2	175	-68.6	-72.5	107.3	0	0	114.5	I818 F933 L934 L935	I818-M937 HydrophobicContact CD1-CB 3.43Å; I818-M937 VanDerWaalsContact CD1-CB 3.43Å; I818-M937 HydrophobicContact CD1-CG 3.61Å; I818-M937 HydrophobicContact CD1-SD 3.97Å; I818-M937 HydrophobicContact CG1-CB 4.29Å; F933-M937 HydrophobicContact CD1-CG 4.09Å; F933-M937 HydrophobicContact CE1-CG 3.67Å; F933-M937 HydrophobicContact CE1-SD 4.24Å; F933-M937 HydrophobicContact CE2-CE 4Å; F933-M937 HydrophobicContact CE2-CG 4.39Å; F933-M937 HydrophobicContact CZ-CE 3.93Å; F933-M937 HydrophobicContact CZ-CG 3.83Å; F933-M937 HydrophobicContact CZ-SD 3.89Å; F933-M937 VanDerWaalsContact O-CG 3.32Å; F933-M937 WeakPolarHBondContact O-CG 3.26Å; F933-M937 PolarHBondContact O-N 3.13Å; L934-M937 PolarHBondContact O-N 3.42Å; L935-M937 VanDerWaalsContact C-N 3.31Å; L935-M937 PolarHBondContact O-N 2.98Å
938	G	84.3	Confident	87.1	Confident	47 Å²	47	58 Å²	58	49%	0.485	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	13.9	175.5	0	0	0	0	0	115.9	L934 L935 Y936	L934-G938 PolarHBondContact O-N 2.87Å; L935-G938 PolarHBondContact O-N 3.04Å; L935-G938 VanDerWaalsContact O-N 3.13Å; Y936-G938 PolarHBondContact O-N 3.33Å
939	M	85.2	Confident	87.1	Confident	7 Å²	7	58.4 Å²	58.4	3%	0.034	29%	0.285	C	S	.	.			trans	-73.1	136.7	173.2	-67.4	-79.2	-81.7	0	0	111	Q817 L934 A943 V944 T947	Q817-M939 HydrophobicContact CB-SD 4.49Å; L934-M939 HydrophobicContact CB-CB 4.25Å; L934-M939 HydrophobicContact CB-CG 4.27Å; L934-M939 WeakPolarHBondContact O-CB 3.47Å; L934-M939 PolarHBondContact O-N 3.43Å; M939-A943 HydrophobicContact CE-CB 4.48Å; M939-V944 HydrophobicContact CB-CG2 3.72Å; M939-T947 HydrophobicContact CE-CG2 4.02Å; M939-T947 WeakPolarHBondContact CE-OG1 3.24Å
940	P	83.8	Confident	87.1	Confident	38 Å²	38	57.3 Å²	57.3	25%	0.247	28%	0.284	C	S	.	.			trans	-72.5	146.9	178.3	29.8	-33.7	0	0	0	111.7	H942 A943 V944	P940-H942 VanDerWaalsContact C-N 3.25Å; P940-H942 PolarHBondContact O-N 3.13Å; P940-H942 VanDerWaalsContact O-N 3.09Å; P940-A943 HydrophobicContact CG-CB 3.82Å; P940-A943 PolarHBondContact O-N 3.13Å; P940-V944 PolarHBondContact O-N 3.31Å
941	Q	81.3	Confident	87.1	Confident	55 Å²	55	59 Å²	59	26%	0.257	30%	0.3	S	S	.	.	H	α-helix	trans	-55.2	-34.1	-171.9	-64.6	176.2	31.5	0	0	115	L524 A527 E531 L935	L524-Q941 HydrophobicContact CD2-CB 4.34Å; A527-Q941 VanDerWaalsContact CB-CD 3.42Å; A527-Q941 HydrophobicContact CB-CG 4.1Å; E531-Q941 PolarHBondContact OE1-NE2 2.84Å; L935-Q941 HydrophobicContact CD2-CG 3.9Å
942	H	83	Confident	87.1	Confident	108 Å²	108	55.6 Å²	55.6	50%	0.5	29%	0.287	S	S	.	.	H	α-helix	trans	-71.4	-36.7	179.2	60.4	-93.2	0	0	0	111.7	P940	P940-H942 VanDerWaalsContact C-N 3.25Å; P940-H942 PolarHBondContact O-N 3.13Å; P940-H942 VanDerWaalsContact O-N 3.09Å
943	A	84.1	Confident	87.3	Confident	23 Å²	23	49.5 Å²	49.5	19%	0.19	26%	0.261	C	S	.	.	H	α-helix	trans	-69.7	-40.2	178.8	0	0	0	0	0	111.4	M939 P940 K945 D946 T947	M939-A943 HydrophobicContact CE-CB 4.48Å; P940-A943 HydrophobicContact CG-CB 3.82Å; P940-A943 PolarHBondContact O-N 3.13Å; A943-K945 PolarHBondContact O-N 3.39Å; A943-D946 PolarHBondContact O-N 3.37Å; A943-T947 PolarHBondContact O-N 3.18Å; A943-T947 PolarHBondContact O-OG1 3.26Å
944	V	85	Confident	87.5	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-55.1	-27.6	-176.6	175.1	0	0	0	0	113.6	L524 R931 L934 L935 M939 P940	L524-V944 HydrophobicContact CD1-CG1 4.17Å; L524-V944 HydrophobicContact CD2-CB 4.03Å; L524-V944 HydrophobicContact CD2-CG1 3.92Å; L524-V944 HydrophobicContact CG-CG1 4.45Å; R931-V944 HydrophobicContact CB-CG1 3.92Å; R931-V944 HydrophobicContact CG-CG1 3.92Å; L934-V944 HydrophobicContact CB-CG1 4.3Å; L934-V944 HydrophobicContact CB-CG2 3.98Å; L934-V944 HydrophobicContact CD1-CG1 4.15Å; L935-V944 HydrophobicContact CD2-CG2 3.97Å; L935-V944 HydrophobicContact CG-CG2 4.38Å; M939-V944 HydrophobicContact CB-CG2 3.72Å; P940-V944 PolarHBondContact O-N 3.31Å
945	K	80.6	Confident	87.7	Confident	108 Å²	108	54.8 Å²	54.8	47%	0.47	29%	0.286	S	S	.	.	H	α-helix	trans	-73.6	-36.7	176.4	-69.4	-169.8	177.2	-174.3	0	113.4	L524 A943	L524-K945 HydrophobicContact CD1-CD 4.17Å; L524-K945 HydrophobicContact CD1-CG 3.4Å; A943-K945 PolarHBondContact O-N 3.39Å
946	D	82.9	Confident	88	Confident	138 Å²	138	52.6 Å²	52.6	74%	0.738	27%	0.274	S	S	*	.	H	α-helix	trans	-94	-15.5	-173.5	-59.8	-31	0	0	0	111.5	A943 K948	A943-D946 PolarHBondContact O-N 3.37Å; D946-K948 PolarHBondContact O-N 3.31Å
947	T	86.4	Confident	88.4	Confident	33 Å²	33	46.3 Å²	46.3	20%	0.202	25%	0.252	C	S	.	.			trans	-74.1	123.7	178.9	-38.3	0	0	0	0	111.5	M939 A943 I952	M939-T947 HydrophobicContact CE-CG2 4.02Å; M939-T947 WeakPolarHBondContact CE-OG1 3.24Å; A943-T947 PolarHBondContact O-N 3.18Å; A943-T947 PolarHBondContact O-OG1 3.26Å; T947-I952 HydrophobicContact CG2-CD1 3.23Å; T947-I952 HydrophobicContact CG2-CG1 3.48Å; T947-I952 VanDerWaalsContact CG2-CG1 3.48Å
948	K	90.9	Very high	88.8	Confident	105 Å²	105	48.6 Å²	48.6	46%	0.457	26%	0.262	S	S	.	.			trans	-76.7	139.3	171.1	-57.8	-165.2	167.7	-140.1	0	111.1	D870 D946 N950 A951 I952	D870-K948 IonicContact OD2-NZ 2.93Å; D870-K948 PolarHBondContact OD2-NZ 3.42Å; D946-K948 PolarHBondContact O-N 3.31Å; K948-N950 VanDerWaalsContact C-N 3.33Å; K948-N950 WeakPolarHBondContact CB-OD1 3.39Å; K948-N950 PolarHBondContact O-N 3.03Å; K948-A951 HydrophobicContact CB-CB 4.3Å; K948-A951 WeakPolarHBondContact O-CB 3.47Å; K948-A951 PolarHBondContact O-N 3.2Å; K948-I952 PolarHBondContact O-N 2.69Å
949	I	91.8	Very high	89.3	Confident	19 Å²	19	46.6 Å²	46.6	10%	0.097	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-45.6	-177.6	-57.5	-179.5	0	0	0	111.2	L781 F869 I927 F930 A951 I952 C953	L781-I949 HydrophobicContact CD1-CG2 3.52Å; L781-I949 HydrophobicContact CD2-CD1 3.9Å; L781-I949 HydrophobicContact CD2-CG2 3.96Å; L781-I949 HydrophobicContact CG-CG2 4.41Å; F869-I949 HydrophobicContact CB-CD1 4.07Å; F869-I949 HydrophobicContact CD1-CD1 4.26Å; F869-I949 HydrophobicContact CD2-CB 3.65Å; F869-I949 HydrophobicContact CD2-CD1 4.2Å; F869-I949 HydrophobicContact CD2-CG1 4.44Å; F869-I949 HydrophobicContact CD2-CG2 3.67Å; F869-I949 HydrophobicContact CE2-CB 4.01Å; F869-I949 HydrophobicContact CE2-CG2 3.48Å; F869-I949 VanDerWaalsContact CE2-CG2 3.48Å; F869-I949 HydrophobicContact CG-CB 4.25Å; F869-I949 HydrophobicContact CG-CD1 3.9Å; F869-I949 HydrophobicContact CG-CG2 4.37Å; F869-I949 HydrophobicContact CZ-CG2 4.05Å; I927-I949 HydrophobicContact CD1-CD1 3.33Å; F930-I949 HydrophobicContact CD1-CB 4.46Å; F930-I949 HydrophobicContact CD1-CD1 4.11Å; F930-I949 HydrophobicContact CD1-CG1 3.74Å; F930-I949 HydrophobicContact CD1-CG2 4.28Å; F930-I949 HydrophobicContact CD2-CG2 4.45Å; F930-I949 HydrophobicContact CE1-CB 3.93Å; F930-I949 HydrophobicContact CE1-CD1 4.42Å; F930-I949 HydrophobicContact CE1-CG1 3.58Å; F930-I949 HydrophobicContact CE1-CG2 3.85Å; F930-I949 HydrophobicContact CE2-CG2 4.04Å; F930-I949 HydrophobicContact CZ-CB 4.2Å; F930-I949 HydrophobicContact CZ-CG1 4.33Å; F930-I949 HydrophobicContact CZ-CG2 3.72Å; I949-A951 VanDerWaalsContact C-N 3.3Å; I949-A951 PolarHBondContact O-N 3.17Å; I949-I952 PolarHBondContact O-N 3.45Å; I949-C953 PolarHBondContact O-N 2.97Å; I949-C953 VanDerWaalsContact O-N 3.1Å; I949-C953 PolarHBondContact O-SG 3.04Å
950	N	92.7	Very high	89.8	Confident	45 Å²	45	46.2 Å²	46.2	24%	0.241	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-35.9	179.3	64.4	-35.3	0	0	0	112.3	V867 K948 C953 K954	V867-N950 WeakPolarHBondContact O-CB 3.41Å; K948-N950 VanDerWaalsContact C-N 3.33Å; K948-N950 WeakPolarHBondContact CB-OD1 3.39Å; K948-N950 PolarHBondContact O-N 3.03Å; N950-C953 PolarHBondContact O-N 3.1Å; N950-K954 WeakPolarHBondContact O-CB 3.38Å; N950-K954 PolarHBondContact O-N 3.23Å
951	A	92.6	Very high	90.3	Very high	45 Å²	45	47.7 Å²	47.7	37%	0.372	24%	0.243	S	C	.	.	H	α-helix	trans	-62.5	-46.3	178.8	0	0	0	0	0	111.7	K948 I949 K954 T955	K948-A951 HydrophobicContact CB-CB 4.3Å; K948-A951 WeakPolarHBondContact O-CB 3.47Å; K948-A951 PolarHBondContact O-N 3.2Å; I949-A951 VanDerWaalsContact C-N 3.3Å; I949-A951 PolarHBondContact O-N 3.17Å; A951-K954 PolarHBondContact O-N 3.23Å; A951-T955 PolarHBondContact O-N 3.14Å; A951-T955 PolarHBondContact O-OG1 3.43Å; A951-T955 VanDerWaalsContact O-OG1 3.09Å
952	I	92.1	Very high	90.9	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-47.7	178.1	-67.2	155.4	0	0	0	111.1	I818 F930 L934 T947 K948 I949 K954 T955 I956	I818-I952 HydrophobicContact CG2-CG2 4.28Å; F930-I952 HydrophobicContact CE1-CD1 4.16Å; F930-I952 HydrophobicContact CZ-CB 4.46Å; F930-I952 HydrophobicContact CZ-CD1 4.04Å; L934-I952 HydrophobicContact CD1-CD1 3.42Å; L934-I952 VanDerWaalsContact CD1-CD1 3.42Å; L934-I952 HydrophobicContact CD2-CD1 3.45Å; L934-I952 VanDerWaalsContact CD2-CD1 3.45Å; L934-I952 HydrophobicContact CD2-CG1 4.49Å; L934-I952 HydrophobicContact CD2-CG2 4.2Å; L934-I952 HydrophobicContact CG-CD1 4.06Å; T947-I952 HydrophobicContact CG2-CD1 3.23Å; T947-I952 HydrophobicContact CG2-CG1 3.48Å; T947-I952 VanDerWaalsContact CG2-CG1 3.48Å; K948-I952 PolarHBondContact O-N 2.69Å; I949-I952 PolarHBondContact O-N 3.45Å; I952-K954 PolarHBondContact O-N 2.77Å; I952-T955 PolarHBondContact O-N 2.87Å; I952-I956 HydrophobicContact CG2-CD1 3.89Å; I952-I956 WeakPolarHBondContact O-CG1 3.49Å; I952-I956 PolarHBondContact O-N 3.47Å
953	C	94.3	Very high	91.4	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-38.1	178.5	-63.4	0	0	0	0	111	V861 A865 I949 N950 I956 S957	V861-C953 HydrophobicContact CG1-CB 4.24Å; A865-C953 HydrophobicContact CB-CB 3.97Å; I949-C953 PolarHBondContact O-N 2.97Å; I949-C953 VanDerWaalsContact O-N 3.1Å; I949-C953 PolarHBondContact O-SG 3.04Å; N950-C953 PolarHBondContact O-N 3.1Å; C953-I956 PolarHBondContact O-N 3.46Å; C953-S957 WeakPolarHBondContact O-CB 3.27Å; C953-S957 PolarHBondContact O-N 2.79Å
954	K	95.3	Very high	91.8	Very high	109 Å²	109	48 Å²	48	47%	0.474	24%	0.237	S	C	.	.	H	α-helix	trans	-64.4	-48.8	174.9	-178.7	175.1	176.6	178.6	0	111.8	A865 N950 A951 I952 I956 S957 E958	A865-K954 HydrophobicContact CB-CB 4.14Å; N950-K954 WeakPolarHBondContact O-CB 3.38Å; N950-K954 PolarHBondContact O-N 3.23Å; A951-K954 PolarHBondContact O-N 3.23Å; I952-K954 PolarHBondContact O-N 2.77Å; K954-I956 VanDerWaalsContact C-N 3.28Å; K954-I956 PolarHBondContact O-N 2.82Å; K954-S957 PolarHBondContact O-N 3.13Å; K954-E958 WeakPolarHBondContact CE-OE1 3.31Å; K954-E958 HydrophobicContact CG-CG 4.18Å; K954-E958 IonicContact NZ-OE1 3.52Å; K954-E958 WeakPolarHBondContact O-CB 3.43Å; K954-E958 WeakPolarHBondContact O-CG 3.45Å; K954-E958 PolarHBondContact O-N 3.43Å
955	T	94.6	Very high	92.2	Very high	22 Å²	22	50.5 Å²	50.5	14%	0.135	25%	0.252	C	S	.	.	H	α-helix	trans	-56.4	-43	176.7	-63.4	0	0	0	0	112.1	L821 A822 A951 I952 F959	L821-T955 HydrophobicContact CB-CG2 4.01Å; A822-T955 HydrophobicContact CB-CG2 4.26Å; A951-T955 PolarHBondContact O-N 3.14Å; A951-T955 PolarHBondContact O-OG1 3.43Å; A951-T955 VanDerWaalsContact O-OG1 3.09Å; I952-T955 PolarHBondContact O-N 2.87Å; T955-F959 WeakPolarHBondContact O-CB 3.1Å; T955-F959 PolarHBondContact O-N 3.22Å; T955-F959 VanDerWaalsContact O-N 3.09Å
956	I	94.4	Very high	92.7	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-45.3	177.8	-62.1	168.7	0	0	0	111.1	L788 F794 I818 L821 M858 V861 I952 C953 K954 F959 A960	L788-I956 HydrophobicContact CD1-CD1 3.78Å; L788-I956 HydrophobicContact CD2-CD1 4.36Å; L788-I956 HydrophobicContact CD2-CG2 3.79Å; F794-I956 HydrophobicContact CE2-CG2 4.38Å; I818-I956 HydrophobicContact CD1-CD1 4.45Å; I818-I956 HydrophobicContact CG2-CD1 4.12Å; I818-I956 HydrophobicContact CG2-CG1 3.78Å; L821-I956 HydrophobicContact CD1-CG1 4.42Å; M858-I956 HydrophobicContact SD-CG2 4.06Å; V861-I956 HydrophobicContact CG1-CB 4.29Å; V861-I956 HydrophobicContact CG1-CG2 4.2Å; I952-I956 HydrophobicContact CG2-CD1 3.89Å; I952-I956 WeakPolarHBondContact O-CG1 3.49Å; I952-I956 PolarHBondContact O-N 3.47Å; C953-I956 PolarHBondContact O-N 3.46Å; K954-I956 VanDerWaalsContact C-N 3.28Å; K954-I956 PolarHBondContact O-N 2.82Å; I956-F959 PolarHBondContact O-N 3.1Å; I956-A960 WeakPolarHBondContact O-CB 3.36Å; I956-A960 PolarHBondContact O-N 3.32Å
957	S	93.9	Very high	93.2	Very high	14 Å²	14	41.3 Å²	41.3	10%	0.098	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-41.5	-179.6	-177.6	0	0	0	0	112.3	C953 K954 A960 L961	C953-S957 WeakPolarHBondContact O-CB 3.27Å; C953-S957 PolarHBondContact O-N 2.79Å; K954-S957 PolarHBondContact O-N 3.13Å; S957-A960 PolarHBondContact O-N 3.06Å; S957-L961 WeakPolarHBondContact O-CB 3.39Å; S957-L961 PolarHBondContact O-N 3.36Å
958	E	95.4	Very high	93.4	Very high	92 Å²	92	44.9 Å²	44.9	43%	0.43	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-47.8	176	-73.1	175.4	164.1	0	0	110.4	K954 A960 L961 E962	K954-E958 WeakPolarHBondContact CE-OE1 3.31Å; K954-E958 HydrophobicContact CG-CG 4.18Å; K954-E958 IonicContact NZ-OE1 3.52Å; K954-E958 WeakPolarHBondContact O-CB 3.43Å; K954-E958 WeakPolarHBondContact O-CG 3.45Å; K954-E958 PolarHBondContact O-N 3.43Å; E958-A960 VanDerWaalsContact C-N 3.29Å; E958-A960 PolarHBondContact O-N 2.9Å; E958-L961 PolarHBondContact O-N 3.25Å; E958-L961 VanDerWaalsContact O-N 3.16Å; E958-E962 WeakPolarHBondContact O-CB 3.35Å; E958-E962 PolarHBondContact O-N 3.22Å
959	F	95.5	Very high	93.5	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-42.5	174.8	173.2	-97.2	0	0	0	112.3	V797 M798 L821 V824 V837 L840 L854 T955 I956 L961 E962 Y963	V797-F959 HydrophobicContact CG1-CE1 3.82Å; V797-F959 HydrophobicContact CG1-CZ 3.85Å; M798-F959 HydrophobicContact CE-CD1 4.35Å; M798-F959 HydrophobicContact CE-CE1 3.62Å; M798-F959 HydrophobicContact CE-CZ 4.11Å; L821-F959 HydrophobicContact CB-CB 4.06Å; L821-F959 HydrophobicContact CB-CD2 4.16Å; L821-F959 HydrophobicContact CB-CG 4.07Å; L821-F959 HydrophobicContact CD1-CB 4.43Å; L821-F959 HydrophobicContact CD1-CD1 4.16Å; L821-F959 HydrophobicContact CD1-CG 4.24Å; L821-F959 HydrophobicContact CD2-CD1 4.27Å; L821-F959 HydrophobicContact CD2-CD2 4.12Å; L821-F959 HydrophobicContact CD2-CE1 4.26Å; L821-F959 HydrophobicContact CD2-CE2 4.1Å; L821-F959 HydrophobicContact CD2-CG 4.2Å; L821-F959 HydrophobicContact CD2-CZ 4.17Å; L821-F959 HydrophobicContact CG-CG 4.41Å; V824-F959 HydrophobicContact CB-CE2 4.24Å; V824-F959 HydrophobicContact CG1-CE2 4.14Å; V837-F959 HydrophobicContact CG2-CE2 4.45Å; L840-F959 HydrophobicContact CD2-CE2 4.39Å; L840-F959 HydrophobicContact CD2-CZ 3.86Å; L854-F959 HydrophobicContact CD2-CE1 4.32Å; T955-F959 WeakPolarHBondContact O-CB 3.1Å; T955-F959 PolarHBondContact O-N 3.22Å; T955-F959 VanDerWaalsContact O-N 3.09Å; I956-F959 PolarHBondContact O-N 3.1Å; F959-L961 PolarHBondContact O-N 3.14Å; F959-E962 PolarHBondContact O-N 2.9Å; F959-Y963 VanDerWaalsContact O-CB 3.23Å; F959-Y963 WeakPolarHBondContact O-CB 3.35Å; F959-Y963 PolarHBondContact O-N 3.2Å
960	A	94.9	Very high	93.5	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-39.4	178	0	0	0	0	0	112.2	L854 Y855 M858 I956 S957 E958 R964	L854-A960 HydrophobicContact CD2-CB 4.08Å; L854-A960 HydrophobicContact CG-CB 4.17Å; Y855-A960 HydrophobicContact CD2-CB 4.04Å; M858-A960 HydrophobicContact SD-CB 3.89Å; I956-A960 WeakPolarHBondContact O-CB 3.36Å; I956-A960 PolarHBondContact O-N 3.32Å; S957-A960 PolarHBondContact O-N 3.06Å; E958-A960 VanDerWaalsContact C-N 3.29Å; E958-A960 PolarHBondContact O-N 2.9Å; A960-R964 WeakPolarHBondContact O-CB 3.21Å; A960-R964 PolarHBondContact O-N 3.49Å
961	L	94	Very high	93.3	Very high	68 Å²	68	45.5 Å²	45.5	36%	0.356	22%	0.223	S	C	.	.	H	α-helix	trans	-67.8	-44.1	176.8	-174.4	60.8	0	0	0	111.9	Y855 S957 E958 F959 R964 T965	Y855-L961 HydrophobicContact CD1-CD1 4.31Å; Y855-L961 HydrophobicContact CD2-CB 3.72Å; Y855-L961 HydrophobicContact CD2-CD1 4.16Å; Y855-L961 HydrophobicContact CE1-CD1 4.23Å; Y855-L961 HydrophobicContact CE2-CB 3.77Å; Y855-L961 HydrophobicContact CE2-CD1 4.09Å; Y855-L961 HydrophobicContact CE2-CG 4.37Å; Y855-L961 HydrophobicContact CG-CB 4.49Å; Y855-L961 HydrophobicContact CG-CD1 4.26Å; S957-L961 WeakPolarHBondContact O-CB 3.39Å; S957-L961 PolarHBondContact O-N 3.36Å; E958-L961 PolarHBondContact O-N 3.25Å; E958-L961 VanDerWaalsContact O-N 3.16Å; F959-L961 PolarHBondContact O-N 3.14Å; L961-R964 PolarHBondContact O-N 3.38Å; L961-T965 WeakPolarHBondContact O-CB 3.41Å; L961-T965 PolarHBondContact O-N 3.21Å; L961-T965 PolarHBondContact O-OG1 3.22Å
962	E	93.6	Very high	93.3	Very high	90 Å²	90	47.8 Å²	47.8	42%	0.421	23%	0.226	S	C	.	.	H	α-helix	trans	-62.4	-44.3	175.7	-109.7	48.9	-143.1	0	0	110.9	P825 E958 F959 T965 C966	P825-E962 HydrophobicContact CB-CG 4.48Å; P825-E962 HydrophobicContact CG-CG 4.28Å; E958-E962 WeakPolarHBondContact O-CB 3.35Å; E958-E962 PolarHBondContact O-N 3.22Å; F959-E962 PolarHBondContact O-N 2.9Å; E962-T965 PolarHBondContact O-N 3.29Å; E962-C966 VanDerWaalsContact O-CB 3.23Å; E962-C966 WeakPolarHBondContact O-CB 3.31Å; E962-C966 PolarHBondContact O-N 2.86Å
963	Y	94.2	Very high	93.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-48.9	175.5	176.9	-96	0	0	0	111.6	V797 V837 L840 A841 M844 L854 F959 T965 C966 R967	V797-Y963 HydrophobicContact CG1-CD2 4.42Å; V797-Y963 HydrophobicContact CG1-CE2 4.33Å; V797-Y963 HydrophobicContact CG2-CE1 4.16Å; V797-Y963 HydrophobicContact CG2-CE2 4.11Å; V837-Y963 HydrophobicContact CG1-CD2 4.34Å; L840-Y963 HydrophobicContact CD2-CD2 4.44Å; L840-Y963 HydrophobicContact CG-CE2 4.3Å; A841-Y963 HydrophobicContact CB-CD2 4.24Å; A841-Y963 HydrophobicContact CB-CE2 3.82Å; M844-Y963 WeakPolarHBondContact CB-OH 3.34Å; M844-Y963 HydrophobicContact CG-CE2 4.32Å; M844-Y963 VanDerWaalsContact CG-OH 3.31Å; M844-Y963 WeakPolarHBondContact CG-OH 3.13Å; L854-Y963 HydrophobicContact CB-CD1 3.97Å; L854-Y963 HydrophobicContact CB-CE1 4.25Å; L854-Y963 HydrophobicContact CD2-CD1 3.98Å; L854-Y963 HydrophobicContact CD2-CG 4.38Å; F959-Y963 VanDerWaalsContact O-CB 3.23Å; F959-Y963 WeakPolarHBondContact O-CB 3.35Å; F959-Y963 PolarHBondContact O-N 3.2Å; Y963-T965 PolarHBondContact O-N 3.33Å; Y963-C966 PolarHBondContact O-N 2.65Å; Y963-R967 VanDerWaalsContact O-CB 3.31Å; Y963-R967 WeakPolarHBondContact O-CB 3.19Å; Y963-R967 PolarHBondContact O-N 2.77Å
964	R	93	Very high	92.9	Very high	104 Å²	104	55.7 Å²	55.7	39%	0.392	26%	0.258	S	S	.	.	H	α-helix	trans	-56.4	-50.7	175.7	172.6	-176.8	171.3	175.9	2	111.3	D853 A960 L961 C966 R967 E968	D853-R964 WeakPolarHBondContact OD1-CD 3.29Å; D853-R964 VanDerWaalsContact OD1-CG 3.27Å; D853-R964 WeakPolarHBondContact OD1-CG 3.43Å; D853-R964 WeakPolarHBondContact OD2-CD 3.36Å; D853-R964 IonicContact OD2-CZ 2.72Å; D853-R964 IonicContact OD2-NE 3.14Å; D853-R964 PolarHBondContact OD2-NE 2.85Å; D853-R964 IonicContact OD2-NH1 3.64Å; A960-R964 WeakPolarHBondContact O-CB 3.21Å; A960-R964 PolarHBondContact O-N 3.49Å; L961-R964 PolarHBondContact O-N 3.38Å; R964-C966 VanDerWaalsContact C-N 3.29Å; R964-C966 PolarHBondContact O-N 2.8Å; R964-R967 PolarHBondContact O-N 3.03Å; R964-E968 PolarHBondContact O-N 3.2Å
965	T	92.9	Very high	92.7	Very high	57 Å²	57	56.7 Å²	56.7	35%	0.35	26%	0.263	S	S	.	.	H	α-helix	trans	-61.4	-41.1	-178.6	-58.7	0	0	0	0	111	L961 E962 Y963 K969	L961-T965 WeakPolarHBondContact O-CB 3.41Å; L961-T965 PolarHBondContact O-N 3.21Å; L961-T965 PolarHBondContact O-OG1 3.22Å; E962-T965 PolarHBondContact O-N 3.29Å; Y963-T965 PolarHBondContact O-N 3.33Å; T965-K969 HydrophobicContact CG2-CD 4.39Å; T965-K969 VanDerWaalsContact O-CG 3.29Å; T965-K969 WeakPolarHBondContact O-CG 3.15Å; T965-K969 PolarHBondContact O-N 2.73Å; T965-K969 VanDerWaalsContact O-N 3.1Å
966	C	92	Very high	92.5	Very high	16 Å²	16	63 Å²	63	11%	0.108	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-45.3	177.4	-159.5	0	0	0	0	112.1	V837 Y838 E962 Y963 R964 E968 K969 I970	V837-C966 HydrophobicContact CG1-CB 3.87Å; Y838-C966 WeakPolarHBondContact CA-SG 3.39Å; E962-C966 VanDerWaalsContact O-CB 3.23Å; E962-C966 WeakPolarHBondContact O-CB 3.31Å; E962-C966 PolarHBondContact O-N 2.86Å; Y963-C966 PolarHBondContact O-N 2.65Å; R964-C966 VanDerWaalsContact C-N 3.29Å; R964-C966 PolarHBondContact O-N 2.8Å; C966-E968 PolarHBondContact O-N 3.43Å; C966-K969 WeakPolarHBondContact O-CB 3.38Å; C966-K969 PolarHBondContact O-N 2.93Å; C966-I970 WeakPolarHBondContact O-CD1 3.25Å; C966-I970 WeakPolarHBondContact O-CG1 3.41Å; C966-I970 PolarHBondContact O-N 3.4Å
967	R	92.1	Very high	92.2	Very high	37 Å²	37	67.8 Å²	67.8	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-57.5	-46.7	175.9	-177.5	178.2	176.6	-89.3	7.7	111.4	A841 L845 S851 Y963 R964 I970 I971	A841-R967 HydrophobicContact CB-CB 4.18Å; L845-R967 HydrophobicContact CD1-CG 4.14Å; L845-R967 HydrophobicContact CD2-CG 4.08Å; L845-R967 HydrophobicContact CG-CG 4.19Å; S851-R967 PolarHBondContact O-NH2 3.5Å; Y963-R967 VanDerWaalsContact O-CB 3.31Å; Y963-R967 WeakPolarHBondContact O-CB 3.19Å; Y963-R967 PolarHBondContact O-N 2.77Å; R964-R967 PolarHBondContact O-N 3.03Å; R967-I970 PolarHBondContact O-N 2.87Å; R967-I971 HydrophobicContact CG-CD1 4.09Å; R967-I971 WeakPolarHBondContact O-CG1 2.9Å; R967-I971 PolarHBondContact O-N 3.16Å
968	E	92.2	Very high	91.7	Very high	108 Å²	108	72 Å²	72	51%	0.505	33%	0.325	S	S	.	.	H	α-helix	trans	-65	-41.3	179.3	-167.5	57.8	-149.5	0	0	111.8	R964 C966 I970 I971 Q972	R964-E968 PolarHBondContact O-N 3.2Å; C966-E968 PolarHBondContact O-N 3.43Å; E968-I970 VanDerWaalsContact C-N 3.31Å; E968-I970 PolarHBondContact O-N 3.4Å; E968-I971 PolarHBondContact O-N 2.9Å; E968-Q972 WeakPolarHBondContact O-CB 3.31Å; E968-Q972 PolarHBondContact O-N 3.09Å
969	K	91.7	Very high	91.4	Very high	124 Å²	124	70.3 Å²	70.3	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-58.1	-42.8	172.8	-75.4	174.1	-179	178.5	0	111.6	T965 C966 Q972 Q973	T965-K969 HydrophobicContact CG2-CD 4.39Å; T965-K969 VanDerWaalsContact O-CG 3.29Å; T965-K969 WeakPolarHBondContact O-CG 3.15Å; T965-K969 PolarHBondContact O-N 2.73Å; T965-K969 VanDerWaalsContact O-N 3.1Å; C966-K969 WeakPolarHBondContact O-CB 3.38Å; C966-K969 PolarHBondContact O-N 2.93Å; K969-Q972 PolarHBondContact O-N 3.31Å; K969-Q973 WeakPolarHBondContact O-CB 3.28Å; K969-Q973 VanDerWaalsContact O-CG 3.22Å; K969-Q973 WeakPolarHBondContact O-CG 3.2Å; K969-Q973 PolarHBondContact O-N 3.1Å
970	I	91.5	Very high	90.8	Very high	1 Å²	1	76.8 Å²	76.8	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-46.5	177.3	-67.2	157.2	0	0	0	111.1	Y838 A841 S842 L845 C966 R967 E968 Q972 Q973 R974	Y838-I970 HydrophobicContact CD2-CD1 3.76Å; Y838-I970 HydrophobicContact CD2-CG1 3.57Å; Y838-I970 HydrophobicContact CE2-CD1 3.98Å; Y838-I970 HydrophobicContact CE2-CG1 3.31Å; Y838-I970 HydrophobicContact CG-CD1 4.1Å; Y838-I970 HydrophobicContact CG-CG1 4.34Å; Y838-I970 WeakPolarHBondContact O-CD1 3.35Å; A841-I970 HydrophobicContact CB-CD1 3.55Å; S842-I970 WeakPolarHBondContact OG-CD1 3.47Å; L845-I970 HydrophobicContact CD1-CB 4.11Å; L845-I970 HydrophobicContact CD1-CG2 3.66Å; C966-I970 WeakPolarHBondContact O-CD1 3.25Å; C966-I970 WeakPolarHBondContact O-CG1 3.41Å; C966-I970 PolarHBondContact O-N 3.4Å; R967-I970 PolarHBondContact O-N 2.87Å; E968-I970 VanDerWaalsContact C-N 3.31Å; E968-I970 PolarHBondContact O-N 3.4Å; I970-Q972 VanDerWaalsContact C-N 3.33Å; I970-Q972 PolarHBondContact O-N 3.49Å; I970-Q973 PolarHBondContact O-N 2.91Å; I970-R974 HydrophobicContact CG2-CG 4.33Å; I970-R974 WeakPolarHBondContact O-CB 3.44Å; I970-R974 WeakPolarHBondContact O-CG 3.47Å; I970-R974 PolarHBondContact O-N 2.84Å
971	I	90	Very high	90.3	Very high	56 Å²	56	84.4 Å²	84.4	29%	0.287	38%	0.375	S	S	.	.	H	α-helix	trans	-58.9	-47.2	177.6	-67.9	167.3	0	0	0	110.1	L845 R967 E968 Q973 R974 K975	L845-I971 HydrophobicContact CD1-CG1 3.94Å; L845-I971 HydrophobicContact CD2-CD1 4.08Å; L845-I971 HydrophobicContact CD2-CG1 4.08Å; R967-I971 HydrophobicContact CG-CD1 4.09Å; R967-I971 WeakPolarHBondContact O-CG1 2.9Å; R967-I971 PolarHBondContact O-N 3.16Å; E968-I971 PolarHBondContact O-N 2.9Å; I971-Q973 PolarHBondContact O-N 3.07Å; I971-R974 PolarHBondContact O-N 3.39Å; I971-K975 WeakPolarHBondContact O-CB 3.41Å; I971-K975 PolarHBondContact O-N 3.24Å
972	Q	91.9	Very high	89.7	Confident	94 Å²	94	85.7 Å²	85.7	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-40.7	178.9	-163.2	-176	31.5	0	0	111.9	E968 K969 I970 K975 R976	E968-Q972 WeakPolarHBondContact O-CB 3.31Å; E968-Q972 PolarHBondContact O-N 3.09Å; K969-Q972 PolarHBondContact O-N 3.31Å; I970-Q972 VanDerWaalsContact C-N 3.33Å; I970-Q972 PolarHBondContact O-N 3.49Å; Q972-K975 PolarHBondContact O-N 3.11Å; Q972-R976 VanDerWaalsContact CD-NH2 3.3Å; Q972-R976 WeakPolarHBondContact O-CB 3.46Å; Q972-R976 VanDerWaalsContact O-CG 3.27Å; Q972-R976 WeakPolarHBondContact O-CG 3.43Å; Q972-R976 PolarHBondContact O-N 2.68Å
973	Q	89.5	Confident	89.1	Confident	80 Å²	80	90 Å²	90	37%	0.374	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-45.8	174.4	-76.5	176.4	-0.4	0	0	111.8	Y838 K969 I970 I971 R976 Q977	Y838-Q973 PolarHBondContact OH-OE1 2.87Å; K969-Q973 WeakPolarHBondContact O-CB 3.28Å; K969-Q973 VanDerWaalsContact O-CG 3.22Å; K969-Q973 WeakPolarHBondContact O-CG 3.2Å; K969-Q973 PolarHBondContact O-N 3.1Å; I970-Q973 PolarHBondContact O-N 2.91Å; I971-Q973 PolarHBondContact O-N 3.07Å; Q973-R976 PolarHBondContact O-N 3.17Å; Q973-Q977 VanDerWaalsContact O-CG 3.31Å; Q973-Q977 WeakPolarHBondContact O-CG 3.4Å; Q973-Q977 PolarHBondContact O-N 3.09Å
974	R	89.2	Confident	88.4	Confident	92 Å²	92	94.6 Å²	94.6	35%	0.347	42%	0.417	S	S	.	.	H	α-helix	trans	-61.1	-44.5	176.5	-73.5	179.4	-177.8	-166.3	-4.5	111.2	E846 I970 I971 Q977 Q978	E846-R974 IonicContact OE1-CZ 3.86Å; E846-R974 IonicContact OE1-NH2 3.83Å; E846-R974 PolarHBondContact OE1-NH2 2.94Å; I970-R974 HydrophobicContact CG2-CG 4.33Å; I970-R974 WeakPolarHBondContact O-CB 3.44Å; I970-R974 WeakPolarHBondContact O-CG 3.47Å; I970-R974 PolarHBondContact O-N 2.84Å; I971-R974 PolarHBondContact O-N 3.39Å; R974-Q977 PolarHBondContact O-N 3.1Å; R974-Q978 WeakPolarHBondContact O-CB 3.41Å; R974-Q978 PolarHBondContact O-N 3.49Å
975	K	89.9	Confident	87.8	Confident	130 Å²	130	96.9 Å²	96.9	57%	0.565	43%	0.429	S	S	*	.	H	α-helix	trans	-61.2	-48.5	175.9	-173.9	175.7	-179.2	176.9	0	112	I971 Q972 Q977 Q978 D979	I971-K975 WeakPolarHBondContact O-CB 3.41Å; I971-K975 PolarHBondContact O-N 3.24Å; Q972-K975 PolarHBondContact O-N 3.11Å; K975-Q977 VanDerWaalsContact C-N 3.28Å; K975-Q977 PolarHBondContact O-N 3.37Å; K975-Q978 PolarHBondContact O-N 3.25Å; K975-Q978 VanDerWaalsContact O-N 3.13Å; K975-D979 WeakPolarHBondContact O-CB 3.32Å; K975-D979 VanDerWaalsContact O-CG 3.25Å; K975-D979 PolarHBondContact O-N 3.06Å
976	R	90.5	Very high	86.9	Confident	153 Å²	153	98.7 Å²	98.7	58%	0.577	44%	0.441	S	S	*	.	H	α-helix	trans	-58.5	-39.6	175.9	-73.2	174.8	-173.8	-176.2	6	112.1	Q972 Q973 K980	Q972-R976 VanDerWaalsContact CD-NH2 3.3Å; Q972-R976 WeakPolarHBondContact O-CB 3.46Å; Q972-R976 VanDerWaalsContact O-CG 3.27Å; Q972-R976 WeakPolarHBondContact O-CG 3.43Å; Q972-R976 PolarHBondContact O-N 2.68Å; Q973-R976 PolarHBondContact O-N 3.17Å; R976-K980 VanDerWaalsContact O-CB 3.29Å; R976-K980 WeakPolarHBondContact O-CB 3.28Å; R976-K980 PolarHBondContact O-N 2.76Å
977	Q	87.8	Confident	85.6	Confident	103 Å²	103	106.4 Å²	106.4	48%	0.481	47%	0.467	S	S	.	.	H	α-helix	trans	-69.1	-39.1	176.3	-71.8	179.5	18.7	0	0	112.2	Q973 R974 K975 K980 R981	Q973-Q977 VanDerWaalsContact O-CG 3.31Å; Q973-Q977 WeakPolarHBondContact O-CG 3.4Å; Q973-Q977 PolarHBondContact O-N 3.09Å; R974-Q977 PolarHBondContact O-N 3.1Å; K975-Q977 VanDerWaalsContact C-N 3.28Å; K975-Q977 PolarHBondContact O-N 3.37Å; Q977-K980 PolarHBondContact O-N 3.32Å; Q977-R981 VanDerWaalsContact O-CG 3.24Å; Q977-R981 WeakPolarHBondContact O-CG 3.49Å; Q977-R981 PolarHBondContact O-N 2.91Å
978	Q	84.9	Confident	84.2	Confident	104 Å²	104	106.2 Å²	106.2	49%	0.486	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-50.1	174	-179.6	174.1	-3.9	0	0	111.1	R974 K975 K980 R981 E982	R974-Q978 WeakPolarHBondContact O-CB 3.41Å; R974-Q978 PolarHBondContact O-N 3.49Å; K975-Q978 PolarHBondContact O-N 3.25Å; K975-Q978 VanDerWaalsContact O-N 3.13Å; Q978-K980 VanDerWaalsContact C-N 3.25Å; Q978-K980 PolarHBondContact O-N 3.06Å; Q978-R981 CarbonylContact O-C 3.38Å; Q978-R981 WeakPolarHBondContact O-CA 3.47Å; Q978-R981 WeakPolarHBondContact O-CB 3.23Å; Q978-R981 PolarHBondContact O-N 2.82Å; Q978-E982 HydrophobicContact CG-CG 4.44Å; Q978-E982 WeakPolarHBondContact CG-OE1 3.19Å; Q978-E982 PolarHBondContact NE2-OE1 2.82Å; Q978-E982 PolarHBondContact O-N 3.37Å
979	D	87.5	Confident	82.6	Confident	56 Å²	56	108 Å²	108	30%	0.299	48%	0.483	S	S	.	.	H	α-helix	trans	-57.6	-40.5	176.9	-67.2	-12.8	0	0	0	110.9	K975 E982 R983	K975-D979 WeakPolarHBondContact O-CB 3.32Å; K975-D979 VanDerWaalsContact O-CG 3.25Å; K975-D979 PolarHBondContact O-N 3.06Å; D979-E982 PolarHBondContact O-N 3.28Å; D979-R983 VanDerWaalsContact O-CB 3.28Å; D979-R983 WeakPolarHBondContact O-CB 3.33Å; D979-R983 WeakPolarHBondContact O-CG 3.06Å; D979-R983 PolarHBondContact O-N 3.49Å
980	K	84	Confident	81	Confident	139 Å²	139	108 Å²	108	60%	0.604	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-41.7	174.6	-172.7	176	-178.4	177.3	0	111.8	R976 Q977 Q978 N984	R976-K980 VanDerWaalsContact O-CB 3.29Å; R976-K980 WeakPolarHBondContact O-CB 3.28Å; R976-K980 PolarHBondContact O-N 2.76Å; Q977-K980 PolarHBondContact O-N 3.32Å; Q978-K980 VanDerWaalsContact C-N 3.25Å; Q978-K980 PolarHBondContact O-N 3.06Å; K980-N984 VanDerWaalsContact O-CB 3.29Å; K980-N984 WeakPolarHBondContact O-CB 3.37Å; K980-N984 PolarHBondContact O-N 3.47Å; K980-N984 PolarHBondContact O-OD1 2.66Å
981	R	84.9	Confident	79.4	Confident	161 Å²	161	112.3 Å²	112.3	61%	0.608	51%	0.51	S	S	*	.	H	α-helix	trans	-65.9	-41.2	176.1	-72.8	169.2	-174.2	174.3	4.2	111.5	Q977 Q978 N984 K985	Q977-R981 VanDerWaalsContact O-CG 3.24Å; Q977-R981 WeakPolarHBondContact O-CG 3.49Å; Q977-R981 PolarHBondContact O-N 2.91Å; Q978-R981 CarbonylContact O-C 3.38Å; Q978-R981 WeakPolarHBondContact O-CA 3.47Å; Q978-R981 WeakPolarHBondContact O-CB 3.23Å; Q978-R981 PolarHBondContact O-N 2.82Å; R981-N984 PolarHBondContact O-N 3.02Å; R981-K985 WeakPolarHBondContact O-CG 3.37Å; R981-K985 PolarHBondContact O-N 3.42Å
982	E	81	Confident	78	Confident	94 Å²	94	113.4 Å²	113.4	44%	0.439	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-47.7	176.2	-72.9	179.9	-167.6	0	0	111.3	Q978 D979 N984 K985 T986	Q978-E982 HydrophobicContact CG-CG 4.44Å; Q978-E982 WeakPolarHBondContact CG-OE1 3.19Å; Q978-E982 PolarHBondContact NE2-OE1 2.82Å; Q978-E982 PolarHBondContact O-N 3.37Å; D979-E982 PolarHBondContact O-N 3.28Å; E982-N984 VanDerWaalsContact C-N 3.27Å; E982-N984 PolarHBondContact O-N 3.37Å; E982-K985 WeakPolarHBondContact O-CB 3.38Å; E982-K985 PolarHBondContact O-N 3.33Å; E982-K985 VanDerWaalsContact O-N 3.09Å; E982-T986 PolarHBondContact O-N 3.08Å; E982-T986 PolarHBondContact O-OG1 2.63Å
983	R	80.5	Confident	76.3	Confident	180 Å²	180	113.1 Å²	113.1	68%	0.679	52%	0.521	S	S	*	.	H	α-helix	trans	-56.8	-40.5	172.1	-73.3	175.3	-168.2	-176	4.6	111.9	D979 T986 R987	D979-R983 VanDerWaalsContact O-CB 3.28Å; D979-R983 WeakPolarHBondContact O-CB 3.33Å; D979-R983 WeakPolarHBondContact O-CG 3.06Å; D979-R983 PolarHBondContact O-N 3.49Å; R983-T986 PolarHBondContact O-N 3.06Å; R983-R987 WeakPolarHBondContact O-CB 3.22Å; R983-R987 PolarHBondContact O-N 3.24Å
984	N	78.7	Confident	74.8	Confident	98 Å²	98	112 Å²	112	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-67.4	-37.9	176.2	-75.7	-5.8	0	0	0	112.5	K980 R981 E982 G988	K980-N984 VanDerWaalsContact O-CB 3.29Å; K980-N984 WeakPolarHBondContact O-CB 3.37Å; K980-N984 PolarHBondContact O-N 3.47Å; K980-N984 PolarHBondContact O-OD1 2.66Å; R981-N984 PolarHBondContact O-N 3.02Å; E982-N984 VanDerWaalsContact C-N 3.27Å; E982-N984 PolarHBondContact O-N 3.37Å; N984-G988 PolarHBondContact O-N 2.91Å
985	K	80.4	Confident	73.2	Confident	152 Å²	152	114.4 Å²	114.4	66%	0.661	54%	0.538	S	S	*	.	H	α-helix	trans	-65.5	-44.8	173.2	-73.7	173.7	-179.4	-178.5	0	111.4	R981 E982 G988 K989	R981-K985 WeakPolarHBondContact O-CG 3.37Å; R981-K985 PolarHBondContact O-N 3.42Å; E982-K985 WeakPolarHBondContact O-CB 3.38Å; E982-K985 PolarHBondContact O-N 3.33Å; E982-K985 VanDerWaalsContact O-N 3.09Å; K985-G988 PolarHBondContact O-N 3.12Å; K985-K989 PolarHBondContact O-N 2.88Å
986	T	75.2	Confident	71.5	Confident	95 Å²	95	113.6 Å²	113.6	58%	0.583	54%	0.54	S	S	*	.	H	α-helix	trans	-70.1	-41.3	179.9	-50.9	0	0	0	0	111.8	E982 R983 G988 K989 L990	E982-T986 PolarHBondContact O-N 3.08Å; E982-T986 PolarHBondContact O-OG1 2.63Å; R983-T986 PolarHBondContact O-N 3.06Å; T986-G988 VanDerWaalsContact C-N 3.34Å; T986-K989 PolarHBondContact O-N 2.85Å; T986-L990 PolarHBondContact O-N 3.01Å
987	R	65.4	Low	69.5	Low	178 Å²	178	115.1 Å²	115.1	67%	0.672	55%	0.546	S	S	*	.	H	α-helix	trans	-64.5	-39.5	172.7	-178.3	177.3	164.9	138.2	-1.7	111.3	R983 L990 I991	R983-R987 WeakPolarHBondContact O-CB 3.22Å; R983-R987 PolarHBondContact O-N 3.24Å; R987-L990 PolarHBondContact O-N 3.18Å; R987-I991 HydrophobicContact CG-CD1 4.08Å; R987-I991 VanDerWaalsContact O-CG1 3.26Å; R987-I991 WeakPolarHBondContact O-CG1 3.35Å; R987-I991 PolarHBondContact O-N 3.34Å
988	G	61.6	Low	68	Low	33 Å²	33	114.5 Å²	114.5	34%	0.34	55%	0.549	S	S	.	.	H	α-helix	trans	-59.5	-45.6	173.1	0	0	0	0	0	112.2	N984 K985 T986 I991 T992	N984-G988 PolarHBondContact O-N 2.91Å; K985-G988 PolarHBondContact O-N 3.12Å; T986-G988 VanDerWaalsContact C-N 3.34Å; G988-I991 PolarHBondContact O-N 3.29Å; G988-T992 PolarHBondContact O-N 3.12Å; G988-T992 VanDerWaalsContact O-N 3.1Å; G988-T992 PolarHBondContact O-OG1 3.07Å
989	K	58.6	Low	66.5	Low	146 Å²	146	116.3 Å²	116.3	64%	0.635	56%	0.558	S	S	*	*	H	α-helix	trans	-60.1	-43.7	173.2	-78.2	-174.7	174	-172.9	0	112.5	K985 T986 I991 T992 D993	K985-K989 PolarHBondContact O-N 2.88Å; T986-K989 PolarHBondContact O-N 2.85Å; K989-I991 VanDerWaalsContact C-N 3.29Å; K989-I991 PolarHBondContact O-N 2.81Å; K989-T992 WeakPolarHBondContact CA-OG1 3.42Å; K989-T992 PolarHBondContact O-N 2.84Å; K989-T992 PolarHBondContact O-OG1 2.8Å; K989-D993 WeakPolarHBondContact O-CB 3.39Å; K989-D993 VanDerWaalsContact O-CG 3.28Å; K989-D993 PolarHBondContact O-N 2.77Å
990	L	57.4	Low	64.9	Low	123 Å²	123	116.5 Å²	116.5	64%	0.644	57%	0.567	S	S	*	*	H	α-helix	trans	-63.8	-35.3	177.9	-159.6	78.6	0	0	0	112.2	T986 R987 D993 A994	T986-L990 PolarHBondContact O-N 3.01Å; R987-L990 PolarHBondContact O-N 3.18Å; L990-D993 PolarHBondContact O-N 3.19Å; L990-A994 VanDerWaalsContact O-CB 3.23Å; L990-A994 WeakPolarHBondContact O-CB 3.31Å; L990-A994 PolarHBondContact O-N 2.98Å
991	I	58.8	Low	63.2	Low	91 Å²	91	114.6 Å²	114.6	47%	0.467	56%	0.563	S	S	.	*	H	α-helix	trans	-68.6	-38.3	176.2	-67.9	164	0	0	0	111.2	R987 G988 K989 K995	R987-I991 HydrophobicContact CG-CD1 4.08Å; R987-I991 VanDerWaalsContact O-CG1 3.26Å; R987-I991 WeakPolarHBondContact O-CG1 3.35Å; R987-I991 PolarHBondContact O-N 3.34Å; G988-I991 PolarHBondContact O-N 3.29Å; K989-I991 VanDerWaalsContact C-N 3.29Å; K989-I991 PolarHBondContact O-N 2.81Å; I991-K995 PolarHBondContact O-N 3.14Å; I991-K995 VanDerWaalsContact O-N 3.14Å
992	T	60.8	Low	61.7	Low	79 Å²	79	111.8 Å²	111.8	49%	0.485	56%	0.56	S	S	.	*	H	α-helix	trans	-70.3	-39.6	174.3	48.9	0	0	0	0	112	G988 K989 K995 N996	G988-T992 PolarHBondContact O-N 3.12Å; G988-T992 VanDerWaalsContact O-N 3.1Å; G988-T992 PolarHBondContact O-OG1 3.07Å; K989-T992 WeakPolarHBondContact CA-OG1 3.42Å; K989-T992 PolarHBondContact O-N 2.84Å; K989-T992 PolarHBondContact O-OG1 2.8Å; T992-K995 PolarHBondContact O-N 3.41Å; T992-N996 PolarHBondContact O-N 3.46Å; T992-N996 PolarHBondContact O-OD1 2.93Å
993	D	56.9	Low	60.4	Low	89 Å²	89	112.5 Å²	112.5	48%	0.476	57%	0.571	S	S	.	*	H	α-helix	trans	-66.6	-41.3	177	-67.7	-17.3	0	0	0	110.7	K989 L990 K995 N996 W997	K989-D993 WeakPolarHBondContact O-CB 3.39Å; K989-D993 VanDerWaalsContact O-CG 3.28Å; K989-D993 PolarHBondContact O-N 2.77Å; L990-D993 PolarHBondContact O-N 3.19Å; D993-K995 VanDerWaalsContact C-N 3.31Å; D993-K995 PolarHBondContact O-N 2.7Å; D993-N996 PolarHBondContact O-N 3.13Å; D993-N996 VanDerWaalsContact O-N 3.13Å; D993-W997 VanDerWaalsContact O-CD1 3.24Å; D993-W997 PolarHBondContact O-N 3.07Å
994	A	57.4	Low	59.1	Low	55 Å²	55	106 Å²	106	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-60.7	-38.2	174.2	0	0	0	0	0	112.5	L990 W997 T998	L990-A994 VanDerWaalsContact O-CB 3.23Å; L990-A994 WeakPolarHBondContact O-CB 3.31Å; L990-A994 PolarHBondContact O-N 2.98Å; A994-W997 PolarHBondContact O-N 3.45Å; A994-T998 PolarHBondContact O-N 3.4Å; A994-T998 PolarHBondContact O-OG1 3.16Å
995	K	56	Low	57.5	Low	143 Å²	143	107.7 Å²	107.7	62%	0.622	56%	0.56	S	S	*	*	H	α-helix	trans	-66	-38.9	173.5	-88.8	-173	174.2	-176.6	0	112.6	I991 T992 D993 W997 T998 H999	I991-K995 PolarHBondContact O-N 3.14Å; I991-K995 VanDerWaalsContact O-N 3.14Å; T992-K995 PolarHBondContact O-N 3.41Å; D993-K995 VanDerWaalsContact C-N 3.31Å; D993-K995 PolarHBondContact O-N 2.7Å; K995-W997 VanDerWaalsContact C-N 3.31Å; K995-W997 PolarHBondContact O-N 3.01Å; K995-T998 WeakPolarHBondContact CA-OG1 3.31Å; K995-T998 PolarHBondContact O-N 3.37Å; K995-T998 PolarHBondContact O-OG1 3.35Å; K995-H999 PolarHBondContact O-N 3.02Å; K995-H999 VanDerWaalsContact O-N 3.12Å
996	N	52.6	Low	55.9	Low	114 Å²	114	110.6 Å²	110.6	61%	0.61	57%	0.567	S	S	*	*	H	α-helix	trans	-65.9	-35.8	174.9	-80.6	27	0	0	0	111.8	T992 D993 H999 A1000	T992-N996 PolarHBondContact O-N 3.46Å; T992-N996 PolarHBondContact O-OD1 2.93Å; D993-N996 PolarHBondContact O-N 3.13Å; D993-N996 VanDerWaalsContact O-N 3.13Å; N996-H999 PolarHBondContact O-N 3.35Å; N996-A1000 WeakPolarHBondContact O-CB 3.43Å; N996-A1000 PolarHBondContact O-N 3.27Å
997	W	48.5	Very low	54.8	Low	185 Å²	185	108.9 Å²	108.9	70%	0.701	56%	0.559	S	S	*	*	H	α-helix	trans	-65.5	-39.7	172.7	-86.6	75	0	0	0	112.7	D993 A994 K995 H999 A1000 N1001	D993-W997 VanDerWaalsContact O-CD1 3.24Å; D993-W997 PolarHBondContact O-N 3.07Å; A994-W997 PolarHBondContact O-N 3.45Å; K995-W997 VanDerWaalsContact C-N 3.31Å; K995-W997 PolarHBondContact O-N 3.01Å; W997-H999 VanDerWaalsContact C-N 3.32Å; W997-H999 PolarHBondContact O-N 2.95Å; W997-A1000 PolarHBondContact O-N 2.97Å; W997-N1001 PolarHBondContact O-N 3.45Å
998	T	57.1	Low	54.3	Low	89 Å²	89	105.1 Å²	105.1	55%	0.546	55%	0.553	S	S	.	*	H	α-helix	trans	-63.7	-37.5	175.3	50.3	0	0	0	0	112.3	A994 K995 D1002	A994-T998 PolarHBondContact O-N 3.4Å; A994-T998 PolarHBondContact O-OG1 3.16Å; K995-T998 WeakPolarHBondContact CA-OG1 3.31Å; K995-T998 PolarHBondContact O-N 3.37Å; K995-T998 PolarHBondContact O-OG1 3.35Å; T998-D1002 PolarHBondContact O-N 3.09Å
999	H	53.2	Low	53.7	Low	143 Å²	143	109.3 Å²	109.3	66%	0.662	56%	0.561	S	S	*	*	H	α-helix	trans	-74.1	-33.4	176.1	-103.4	-62	0	0	0	113.6	K995 N996 W997	K995-H999 PolarHBondContact O-N 3.02Å; K995-H999 VanDerWaalsContact O-N 3.12Å; N996-H999 PolarHBondContact O-N 3.35Å; W997-H999 VanDerWaalsContact C-N 3.32Å; W997-H999 PolarHBondContact O-N 2.95Å
1000	A	53.6	Low	53.8	Low	60 Å²	60	105.3 Å²	105.3	50%	0.496	56%	0.555	S	S	.	*	H	α-helix	trans	-69.8	-35.4	176.3	0	0	0	0	0	112.1	N996 W997 V1003 A1004	N996-A1000 WeakPolarHBondContact O-CB 3.43Å; N996-A1000 PolarHBondContact O-N 3.27Å; W997-A1000 PolarHBondContact O-N 2.97Å; A1000-V1003 PolarHBondContact O-N 2.77Å; A1000-A1004 PolarHBondContact O-N 3.46Å; A1000-A1004 VanDerWaalsContact O-N 3.14Å
1001	N	49.8	Very low	53.8	Low	98 Å²	98	106.1 Å²	106.1	52%	0.524	55%	0.554	S	S	.	*	H	α-helix	trans	-73.5	-32.4	178.7	-102.3	6.2	0	0	0	113.7	W997 V1003 A1004 Q1005	W997-N1001 PolarHBondContact O-N 3.45Å; N1001-V1003 VanDerWaalsContact C-N 3.26Å; N1001-V1003 PolarHBondContact O-N 3.31Å; N1001-A1004 PolarHBondContact O-N 3.33Å; N1001-Q1005 VanDerWaalsContact O-CB 3.24Å; N1001-Q1005 WeakPolarHBondContact O-CB 3.16Å; N1001-Q1005 PolarHBondContact O-N 3.28Å
1002	D	52	Low	53.7	Low	103 Å²	103	104.6 Å²	104.6	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-65.2	-32.2	174.8	-86	-19.7	0	0	0	112.1	T998	T998-D1002 PolarHBondContact O-N 3.09Å
1003	V	54.5	Low	53.4	Low	108 Å²	108	106 Å²	106	66%	0.655	56%	0.555	S	S	*	*	H	α-helix	trans	-78.5	-36.6	177.1	-178	0	0	0	0	111.7	A1000 N1001 S1007	A1000-V1003 PolarHBondContact O-N 2.77Å; N1001-V1003 VanDerWaalsContact C-N 3.26Å; N1001-V1003 PolarHBondContact O-N 3.31Å; V1003-S1007 PolarHBondContact O-N 3.06Å
1004	A	53.5	Low	53.8	Low	43 Å²	43	109.5 Å²	109.5	36%	0.355	57%	0.567	S	S	.	*	H	α-helix	trans	-69.8	-38.4	176.2	0	0	0	0	0	112.2	A1000 N1001 W1006 S1007 D1008	A1000-A1004 PolarHBondContact O-N 3.46Å; A1000-A1004 VanDerWaalsContact O-N 3.14Å; N1001-A1004 PolarHBondContact O-N 3.33Å; A1004-W1006 VanDerWaalsContact C-N 3.31Å; A1004-W1006 PolarHBondContact O-N 2.99Å; A1004-S1007 PolarHBondContact O-N 3.08Å; A1004-D1008 PolarHBondContact O-N 3.05Å
1005	Q	44.9	Very low	53.8	Low	135 Å²	135	114 Å²	114	63%	0.631	58%	0.576	S	S	*	*	H	α-helix	trans	-67.5	-28.6	-177.6	-168.3	169	-1.2	0	0	112.8	N1001 K1009	N1001-Q1005 VanDerWaalsContact O-CB 3.24Å; N1001-Q1005 WeakPolarHBondContact O-CB 3.16Å; N1001-Q1005 PolarHBondContact O-N 3.28Å; Q1005-K1009 WeakPolarHBondContact O-CB 3.32Å; Q1005-K1009 PolarHBondContact O-N 3.37Å
1006	W	45.7	Very low	53.7	Low	212 Å²	212	113.2 Å²	113.2	80%	0.803	57%	0.574	S	S	*	*	H	α-helix	trans	-76.1	-35.6	171.7	-89.1	-18.7	0	0	0	114	A1004 A1010	A1004-W1006 VanDerWaalsContact C-N 3.31Å; A1004-W1006 PolarHBondContact O-N 2.99Å; W1006-A1010 PolarHBondContact O-N 3.14Å
1007	S	53.9	Low	54.4	Low	60 Å²	60	112.9 Å²	112.9	42%	0.42	57%	0.569	S	S	.	*	H	α-helix	trans	-66	-42.5	174.4	164	0	0	0	0	111.8	V1003 A1004 A1010 K1011	V1003-S1007 PolarHBondContact O-N 3.06Å; A1004-S1007 PolarHBondContact O-N 3.08Å; S1007-A1010 PolarHBondContact O-N 3.34Å; S1007-K1011 PolarHBondContact O-N 2.99Å
1008	D	53.2	Low	54.9	Low	99 Å²	99	110.5 Å²	110.5	53%	0.529	57%	0.566	S	S	.	*	H	α-helix	trans	-78.4	-28.8	-177.7	-72.7	-20.6	0	0	0	112.6	A1004 K1011 A1012	A1004-D1008 PolarHBondContact O-N 3.05Å; D1008-K1011 PolarHBondContact O-N 3.49Å; D1008-A1012 WeakPolarHBondContact O-CB 3.47Å; D1008-A1012 PolarHBondContact O-N 3.13Å
1009	K	50.7	Low	54.5	Low	120 Å²	120	111 Å²	111	52%	0.522	57%	0.565	S	S	.	*	H	α-helix	trans	-64.9	-39.7	170.9	-168.9	173.5	179.2	-176.9	0	112	Q1005 K1011 A1012 E1013	Q1005-K1009 WeakPolarHBondContact O-CB 3.32Å; Q1005-K1009 PolarHBondContact O-N 3.37Å; K1009-K1011 PolarHBondContact O-N 3.21Å; K1009-A1012 PolarHBondContact O-N 3.3Å; K1009-E1013 WeakPolarHBondContact CE-OE1 3.39Å; K1009-E1013 HydrophobicContact CG-CG 4.45Å; K1009-E1013 WeakPolarHBondContact O-CB 3.46Å; K1009-E1013 WeakPolarHBondContact O-CG 3.12Å; K1009-E1013 PolarHBondContact O-N 3.36Å
1010	A	60.3	Low	54.2	Low	62 Å²	62	105.9 Å²	105.9	51%	0.512	55%	0.545	S	S	.	.	H	α-helix	trans	-66.2	-36.2	176.1	0	0	0	0	0	112.8	W1006 S1007 K1014	W1006-A1010 PolarHBondContact O-N 3.14Å; S1007-A1010 PolarHBondContact O-N 3.34Å; A1010-K1014 PolarHBondContact O-N 3.19Å
1011	K	56.7	Low	54.2	Low	141 Å²	141	111.8 Å²	111.8	61%	0.613	55%	0.554	S	S	*	*	H	α-helix	trans	-74.8	-36.3	174.8	-76.3	178	-179.4	170.3	0	112.6	S1007 D1008 K1009 K1014 K1015	S1007-K1011 PolarHBondContact O-N 2.99Å; D1008-K1011 PolarHBondContact O-N 3.49Å; K1009-K1011 PolarHBondContact O-N 3.21Å; K1011-K1014 PolarHBondContact O-N 3.34Å; K1011-K1015 PolarHBondContact O-N 3.26Å
1012	A	55.9	Low	54.4	Low	58 Å²	58	111.9 Å²	111.9	48%	0.479	56%	0.558	S	S	.	*	H	α-helix	trans	-70	-38.7	176.4	0	0	0	0	0	111.6	D1008 K1009 K1015 H1016	D1008-A1012 WeakPolarHBondContact O-CB 3.47Å; D1008-A1012 PolarHBondContact O-N 3.13Å; K1009-A1012 PolarHBondContact O-N 3.3Å; A1012-K1015 PolarHBondContact O-N 2.88Å; A1012-H1016 WeakPolarHBondContact O-CB 3.34Å; A1012-H1016 PolarHBondContact O-N 3.41Å
1013	E	56.5	Low	53.8	Low	108 Å²	108	113 Å²	113	51%	0.505	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-39.7	173.6	-80.5	173.8	179.6	0	0	111.3	K1009 K1015 H1016 E1017	K1009-E1013 WeakPolarHBondContact CE-OE1 3.39Å; K1009-E1013 HydrophobicContact CG-CG 4.45Å; K1009-E1013 WeakPolarHBondContact O-CB 3.46Å; K1009-E1013 WeakPolarHBondContact O-CG 3.12Å; K1009-E1013 PolarHBondContact O-N 3.36Å; E1013-K1015 PolarHBondContact O-N 2.81Å; E1013-H1016 PolarHBondContact O-N 3.17Å; E1013-E1017 WeakPolarHBondContact O-CB 3.2Å; E1013-E1017 PolarHBondContact O-N 3.3Å
1014	K	63.5	Low	52.9	Low	163 Å²	163	116.8 Å²	116.8	71%	0.709	57%	0.571	S	S	*	*	H	α-helix	trans	-64.9	-41.2	175.5	-141.9	178.9	-173.2	-177.7	0	112.3	A1010 K1011 E1018	A1010-K1014 PolarHBondContact O-N 3.19Å; K1011-K1014 PolarHBondContact O-N 3.34Å; K1014-E1018 WeakPolarHBondContact O-CB 3.39Å; K1014-E1018 PolarHBondContact O-N 3.05Å; K1014-E1018 VanDerWaalsContact O-N 3.13Å
1015	K	58.9	Low	52.1	Low	151 Å²	151	120.1 Å²	120.1	66%	0.657	59%	0.587	S	S	*	*	H	α-helix	trans	-69.8	-34.6	173.7	-81.3	-174.1	173.6	-177.7	0	112.7	K1011 A1012 E1013 E1018 L1019	K1011-K1015 PolarHBondContact O-N 3.26Å; A1012-K1015 PolarHBondContact O-N 2.88Å; E1013-K1015 PolarHBondContact O-N 2.81Å; K1015-E1018 PolarHBondContact O-N 3.42Å; K1015-L1019 WeakPolarHBondContact O-CB 3.3Å; K1015-L1019 PolarHBondContact O-N 2.99Å
1016	H	54	Low	51.5	Low	125 Å²	125	121.5 Å²	121.5	58%	0.579	60%	0.599	S	S	*	*	H	α-helix	trans	-71.3	-38.2	177.9	-175.4	66.7	0	0	0	111.2	A1012 E1013 E1018 L1019 S1020	A1012-H1016 WeakPolarHBondContact O-CB 3.34Å; A1012-H1016 PolarHBondContact O-N 3.41Å; E1013-H1016 PolarHBondContact O-N 3.17Å; H1016-E1018 VanDerWaalsContact C-N 3.33Å; H1016-L1019 PolarHBondContact O-N 3.45Å; H1016-S1020 WeakPolarHBondContact O-CB 3.13Å; H1016-S1020 PolarHBondContact O-N 3.47Å; H1016-S1020 PolarHBondContact O-OG 3.02Å
1017	E	66	Low	50.9	Low	107 Å²	107	115 Å²	115	50%	0.5	60%	0.598	S	S	.	*	H	α-helix	trans	-65.4	-39	173.3	-164.1	67.9	-152.2	0	0	111	E1013 S1020 R1021	E1013-E1017 WeakPolarHBondContact O-CB 3.2Å; E1013-E1017 PolarHBondContact O-N 3.3Å; E1017-S1020 PolarHBondContact O-N 3.35Å; E1017-R1021 PolarHBondContact O-N 3.22Å
1018	E	58.8	Low	49.7	Very low	135 Å²	135	122.4 Å²	122.4	63%	0.631	62%	0.622	S	S	*	*	H	α-helix	trans	-68.8	-41.9	177.1	-165.3	156	-159.6	0	0	112.1	K1014 K1015 H1016 R1021 V1022	K1014-E1018 WeakPolarHBondContact O-CB 3.39Å; K1014-E1018 PolarHBondContact O-N 3.05Å; K1014-E1018 VanDerWaalsContact O-N 3.13Å; K1015-E1018 PolarHBondContact O-N 3.42Å; H1016-E1018 VanDerWaalsContact C-N 3.33Å; E1018-R1021 PolarHBondContact O-N 3.04Å; E1018-V1022 PolarHBondContact O-N 2.87Å
1019	L	49	Very low	48.6	Very low	101 Å²	101	122 Å²	122	53%	0.529	63%	0.633	S	S	.	*	H	α-helix	trans	-69.8	-30.6	171.5	-88.3	152.7	0	0	0	113	K1015 H1016 R1021 V1022 L1023	K1015-L1019 WeakPolarHBondContact O-CB 3.3Å; K1015-L1019 PolarHBondContact O-N 2.99Å; H1016-L1019 PolarHBondContact O-N 3.45Å; L1019-R1021 VanDerWaalsContact C-N 3.34Å; L1019-V1022 PolarHBondContact O-N 3.41Å; L1019-L1023 PolarHBondContact O-N 2.79Å
1020	S	47.2	Very low	47.4	Very low	35 Å²	35	124.8 Å²	124.8	25%	0.245	65%	0.648	C	S	.	*	H	α-helix	trans	-72.3	-26.9	176.2	-64.6	0	0	0	0	112.6	H1016 E1017 K1024	H1016-S1020 WeakPolarHBondContact O-CB 3.13Å; H1016-S1020 PolarHBondContact O-N 3.47Å; H1016-S1020 PolarHBondContact O-OG 3.02Å; E1017-S1020 PolarHBondContact O-N 3.35Å; S1020-K1024 PolarHBondContact O-N 3.43Å
1021	R	53.5	Low	46.1	Very low	184 Å²	184	128.8 Å²	128.8	69%	0.694	66%	0.66	S	S	*	*	H	α-helix	trans	-70.4	-35.1	168	-78.4	-166.9	-171.9	106.1	6.5	112.3	E1017 E1018 L1019	E1017-R1021 PolarHBondContact O-N 3.22Å; E1018-R1021 PolarHBondContact O-N 3.04Å; L1019-R1021 VanDerWaalsContact C-N 3.34Å
1022	V	54.3	Low	44.7	Very low	99 Å²	99	126.8 Å²	126.8	60%	0.6	66%	0.664	S	S	*	*	H	α-helix	trans	-74.3	-31.4	178.6	175.8	0	0	0	0	111.9	E1018 L1019	E1018-V1022 PolarHBondContact O-N 2.87Å; L1019-V1022 PolarHBondContact O-N 3.41Å
1023	L	38.4	Very low	43.1	Very low	127 Å²	127	134.6 Å²	134.6	67%	0.665	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	5.6	-175.7	-68.2	169.8	0	0	0	115	L1019 T1025	L1019-L1023 PolarHBondContact O-N 2.79Å; L1023-T1025 PolarHBondContact O-N 3.3Å
1024	K	35.6	Very low	41.6	Very low	188 Å²	188	136.6 Å²	136.6	82%	0.817	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	10.4	169.6	-90	178.9	179.4	173.7	0	114.3	S1020	S1020-K1024 PolarHBondContact O-N 3.43Å
1025	T	36.5	Very low	39.7	Very low	112 Å²	112	138.1 Å²	138.1	69%	0.687	70%	0.703	S	S	*	*	S	Bend	trans	-99.8	120.4	159.7	56.7	0	0	0	0	109.4	L1023	L1023-T1025 PolarHBondContact O-N 3.3Å
1026	N	33.6	Very low	38	Very low	165 Å²	165	136.3 Å²	136.3	88%	0.882	71%	0.709	S	S	*	*	S	Bend	trans	80.4	93.7	175.2	-95.8	19	0	0	0	119.4
1027	G	32.2	Very low	36.5	Very low	76 Å²	76	140 Å²	140	78%	0.784	72%	0.724	S	S	*	*				80.1	83	109.1	0	0	0	0	0	121.1
1028	K	28.5	Very low	34.7	Very low	214 Å²	214	140.6 Å²	140.6	93%	0.93	74%	0.737	S	S	*	*			trans	52.1	138.2	132.8	-77.1	-176.5	175.2	179.5	0	124
1029	A	30	Very low	33.1	Very low	90 Å²	90	137.6 Å²	137.6	74%	0.744	74%	0.743	S	S	*	*			trans	89.7	94.4	152.8	0	0	0	0	0	116.5
1030	E	26.3	Very low	32	Very low	179 Å²	179	137.3 Å²	137.3	84%	0.836	76%	0.755	S	S	*	*				62.8	100.1	74.1	-68.5	-168.6	161.7	0	0	114.7
1031	N	32.1	Very low	31.1	Very low	146 Å²	146	145.8 Å²	145.8	78%	0.781	79%	0.787	S	S	*	*				-178.8	121.8	104.2	-101.9	-7.8	0	0	0	112.9
1032	S	27.1	Very low	29.7	Very low	100 Å²	100	143.5 Å²	143.5	70%	0.699	79%	0.794	S	S	*	*			trans	-84.3	125.1	178.9	152.2	0	0	0	0	110.9
1033	W	23.4	Very low	28.3	Very low	222 Å²	222	147.4 Å²	147.4	84%	0.841	81%	0.805	S	S	*	*			trans	-101.1	98.8	166.1	-69.4	74.7	0	0	0	108.8
1034	N	25.8	Very low	27.6	Very low	150 Å²	150	148.9 Å²	148.9	80%	0.802	81%	0.813	S	S	*	*			trans	-123.5	104	170.6	-98.8	-11.4	0	0	0	109.2
1035	F	22.8	Very low	27.1	Very low	194 Å²	194	151.3 Å²	151.3	85%	0.851	82%	0.817	S	S	*	*			trans	-84.3	117.2	163.3	-92.9	-89.6	0	0	0	108.4
1036	S	23.6	Very low	26.5	Very low	114 Å²	114	154.2 Å²	154.2	80%	0.797	83%	0.825	S	S	*	*			trans	-117.9	120.9	170.7	-161.4	0	0	0	0	109.6
1037	F	22.4	Very low	26.1	Very low	202 Å²	202	153.6 Å²	153.6	89%	0.886	82%	0.822	S	S	*	*			trans	-69.8	135.7	169.1	-95.5	-99.1	0	0	0	111.1
1038	P	28.3	Very low	25.8	Very low	120 Å²	120	157.9 Å²	157.9	78%	0.779	83%	0.826	S	S	*	*			trans	-113.6	117	163	27.9	-11.9	0	0	0	112.1
1039	G	25.4	Very low	25.7	Very low	72 Å²	72	153.7 Å²	153.7	74%	0.742	82%	0.819	S	S	*	*				59.1	101	121.4	0	0	0	0	0	120.4
1040	A	24.1	Very low	25.5	Very low	95 Å²	95	157.7 Å²	157.7	79%	0.785	82%	0.822	S	S	*	*				49.7	115.9	122.7	0	0	0	0	0	119.8
1041	K	28.7	Very low	25.7	Very low	212 Å²	212	155 Å²	155	92%	0.922	82%	0.82	S	S	*	*			trans	-148.8	113	132.1	-107.9	169.1	-170.5	178.1	0	111.1
1042	T	24.3	Very low	25.5	Very low	137 Å²	137	152.7 Å²	152.7	84%	0.84	82%	0.821	S	S	*	*			trans	-60.8	126.5	173.4	-10	0	0	0	0	111.2
1043	Q	25.4	Very low	25.7	Very low	180 Å²	180	156 Å²	156	84%	0.841	83%	0.825	S	S	*	*			trans	-139	108.3	152.7	-79.7	-154.2	-3.8	0	0	111
1044	L	24	Very low	26.3	Very low	158 Å²	158	147.8 Å²	147.8	83%	0.827	80%	0.802	S	S	*	*			trans	51.9	70.9	136	-58.7	169.3	0	0	0	117.3	M1046	L1044-M1046 PolarHBondContact O-N 2.72Å
1045	R	24.1	Very low	27	Very low	239 Å²	239	145.1 Å²	145.1	90%	0.902	79%	0.792	S	S	*	*			trans	-79.5	104.5	157.5	-168.8	172.2	179.9	169.1	-1.8	108.1	N1047	R1045-N1047 PolarHBondContact O-N 3.37Å
1046	M	25.2	Very low	28.2	Very low	173 Å²	173	139.2 Å²	139.2	85%	0.852	77%	0.77	S	S	*	*			trans	-51.3	120.2	165.8	-68.1	-95.7	-155.6	0	0	108.4	L1044 L1048	L1044-M1046 PolarHBondContact O-N 2.72Å; M1046-L1048 VanDerWaalsContact C-N 3.35Å; M1046-L1048 PolarHBondContact O-N 3.22Å
1047	N	24.3	Very low	29.8	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	74%	0.74	S	S	*	*			trans	-63	96.4	170.3	-84.4	-14.8	0	0	0	108.5	R1045 T1049	R1045-N1047 PolarHBondContact O-N 3.37Å; N1047-T1049 PolarHBondContact O-N 3.23Å
1048	L	27.1	Very low	32	Very low	167 Å²	167	132.7 Å²	132.7	87%	0.874	73%	0.731	S	S	*	*			trans	-69.6	90.7	154	-80.1	159.8	0	0	0	106	M1046 E1050	M1046-L1048 VanDerWaalsContact C-N 3.35Å; M1046-L1048 PolarHBondContact O-N 3.22Å; L1048-E1050 PolarHBondContact O-N 2.85Å; L1048-E1050 VanDerWaalsContact O-N 3.12Å
1049	T	25.7	Very low	34.1	Very low	126 Å²	126	132.1 Å²	132.1	77%	0.773	72%	0.72	S	S	*	*			trans	-56.5	113	167.4	-36	0	0	0	0	107.1	N1047	N1047-T1049 PolarHBondContact O-N 3.23Å
1050	E	25.4	Very low	36.4	Very low	174 Å²	174	130 Å²	130	81%	0.813	69%	0.691	S	S	*	*			trans	-51	129.1	170	-76.6	175.1	148.2	0	0	108.5	L1048 A1052	L1048-E1050 PolarHBondContact O-N 2.85Å; L1048-E1050 VanDerWaalsContact O-N 3.12Å; E1050-A1052 PolarHBondContact O-N 3.1Å; E1050-A1052 VanDerWaalsContact O-N 3.08Å
1051	P	30.6	Very low	39	Very low	122 Å²	122	128 Å²	128	79%	0.792	67%	0.668	S	S	*	*			trans	-65.6	116.6	177.5	25.9	-29.6	0	0	0	107.6	E1053	P1051-E1053 PolarHBondContact O-N 3.42Å
1052	A	28.3	Very low	41.1	Very low	97 Å²	97	119.8 Å²	119.8	80%	0.802	64%	0.642	S	S	*	*			trans	-40.5	120.7	179.3	0	0	0	0	0	111.2	E1050 S1054	E1050-A1052 PolarHBondContact O-N 3.1Å; E1050-A1052 VanDerWaalsContact O-N 3.08Å; A1052-S1054 PolarHBondContact O-N 3.44Å; A1052-S1054 VanDerWaalsContact O-N 3.14Å
1053	E	30.3	Very low	43.6	Very low	170 Å²	170	116.7 Å²	116.7	79%	0.794	62%	0.621	S	S	*	*			trans	-52.1	118	169.5	-66.7	177.9	152.6	0	0	107.9	P1051	P1051-E1053 PolarHBondContact O-N 3.42Å
1054	S	36.8	Very low	46.1	Very low	49 Å²	49	108.1 Å²	108.1	34%	0.343	58%	0.581	S	S	.	*			trans	-63.9	140.6	179.3	-164.5	0	0	0	0	108.1	A1052 D1056 D1057	A1052-S1054 PolarHBondContact O-N 3.44Å; A1052-S1054 VanDerWaalsContact O-N 3.14Å; S1054-D1056 PolarHBondContact O-N 2.76Å; S1054-D1056 PolarHBondContact OG-OD2 3.05Å; S1054-D1057 PolarHBondContact O-N 3.31Å; S1054-D1057 VanDerWaalsContact O-N 3.13Å
1055	P	40.1	Very low	48.8	Very low	94 Å²	94	108 Å²	108	61%	0.61	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.3	-16.8	177.7	-26.7	34.1	0	0	0	115.2	E1058	P1055-E1058 WeakPolarHBondContact O-CB 3.46Å; P1055-E1058 WeakPolarHBondContact O-CG 3.3Å
1056	D	47.1	Very low	51.4	Low	70 Å²	70	99.3 Å²	99.3	37%	0.374	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.4	-12.7	-174.3	-41.1	-69.9	0	0	0	114.4	S1054 E1058	S1054-D1056 PolarHBondContact O-N 2.76Å; S1054-D1056 PolarHBondContact OG-OD2 3.05Å; D1056-E1058 PolarHBondContact O-N 2.91Å
1057	D	58.8	Low	53.6	Low	33 Å²	33	91.1 Å²	91.1	18%	0.176	51%	0.512	C	S	.	.	H	α-helix	trans	-66.3	-11.7	169.6	-63.2	-27.9	0	0	0	110.9	K113 R152 S1054 I1059 L1060 D1061	K113-D1057 IonicContact NZ-OD1 2.94Å; K113-D1057 PolarHBondContact NZ-OD1 3.4Å; R152-D1057 IonicContact CZ-OD1 3.94Å; R152-D1057 IonicContact CZ-OD2 3.97Å; R152-D1057 IonicContact NE-OD1 2.71Å; R152-D1057 IonicContact NH2-OD1 2.68Å; R152-D1057 PolarHBondContact NH2-OD1 3.08Å; R152-D1057 IonicContact NH2-OD2 2.91Å; R152-D1057 PolarHBondContact NH2-OD2 2.57Å; S1054-D1057 PolarHBondContact O-N 3.31Å; S1054-D1057 VanDerWaalsContact O-N 3.13Å; D1057-I1059 VanDerWaalsContact C-N 3.31Å; D1057-I1059 PolarHBondContact O-N 3.34Å; D1057-L1060 PolarHBondContact O-N 2.99Å; D1057-D1061 VanDerWaalsContact O-CB 3.25Å; D1057-D1061 WeakPolarHBondContact O-CB 3.44Å; D1057-D1061 PolarHBondContact O-N 3.11Å
1058	E	68.5	Low	56.1	Low	147 Å²	147	85 Å²	85	69%	0.687	48%	0.48	S	S	*	.	H	α-helix	trans	-58.5	-31.7	176	-76.2	-173.9	-178.3	0	0	114.3	P1055 D1056 G1062	P1055-E1058 WeakPolarHBondContact O-CB 3.46Å; P1055-E1058 WeakPolarHBondContact O-CG 3.3Å; D1056-E1058 PolarHBondContact O-N 2.91Å; E1058-G1062 WeakPolarHBondContact O-CA 3.44Å; E1058-G1062 PolarHBondContact O-N 2.77Å
1059	I	71.7	Confident	58.3	Low	107 Å²	107	79.3 Å²	79.3	55%	0.549	46%	0.458	S	S	.	.	H	α-helix	trans	-74.3	-49	-179.9	-61.5	176.3	0	0	0	110.2	L159 D1057 D1061 G1062 L1063	L159-I1059 HydrophobicContact CD1-CG2 4.27Å; L159-I1059 HydrophobicContact CD2-CG2 3.95Å; D1057-I1059 VanDerWaalsContact C-N 3.31Å; D1057-I1059 PolarHBondContact O-N 3.34Å; I1059-D1061 VanDerWaalsContact C-N 3.31Å; I1059-D1061 PolarHBondContact O-N 3.46Å; I1059-G1062 CarbonylContact O-C 3.45Å; I1059-G1062 WeakPolarHBondContact O-CA 3.5Å; I1059-G1062 PolarHBondContact O-N 3.24Å; I1059-G1062 VanDerWaalsContact O-N 3.14Å; I1059-L1063 WeakPolarHBondContact O-CG 3.45Å; I1059-L1063 PolarHBondContact O-N 3.36Å
1060	L	73.4	Confident	59.7	Low	27 Å²	27	76.7 Å²	76.7	14%	0.141	44%	0.441	C	S	.	.	H	α-helix	trans	-62.8	-43.8	177.2	-176.6	67.4	0	0	0	110	L195 V198 D1057 G1062 L1063 V1064	L195-L1060 HydrophobicContact CD2-CD1 4.13Å; L195-L1060 HydrophobicContact CD2-CD2 4.23Å; V198-L1060 HydrophobicContact CG2-CD1 3.88Å; D1057-L1060 PolarHBondContact O-N 2.99Å; L1060-G1062 VanDerWaalsContact C-N 3.27Å; L1060-G1062 PolarHBondContact O-N 3.27Å; L1060-L1063 PolarHBondContact O-N 3.02Å; L1060-V1064 WeakPolarHBondContact O-CB 3.28Å; L1060-V1064 WeakPolarHBondContact O-CG2 3.35Å; L1060-V1064 PolarHBondContact O-N 3.01Å
1061	D	78.8	Confident	60.9	Low	55 Å²	55	73.4 Å²	73.4	29%	0.294	43%	0.433	S	S	.	.	H	α-helix	trans	-65.2	-33.2	174.9	-75.6	-10.2	0	0	0	111.9	K194 D1057 I1059 K1065	K194-D1061 IonicContact NZ-OD1 3.36Å; K194-D1061 PolarHBondContact NZ-OD1 3.06Å; K194-D1061 IonicContact NZ-OD2 3.54Å; D1057-D1061 VanDerWaalsContact O-CB 3.25Å; D1057-D1061 WeakPolarHBondContact O-CB 3.44Å; D1057-D1061 PolarHBondContact O-N 3.11Å; I1059-D1061 VanDerWaalsContact C-N 3.31Å; I1059-D1061 PolarHBondContact O-N 3.46Å; D1061-K1065 WeakPolarHBondContact O-CB 3.31Å; D1061-K1065 PolarHBondContact O-N 2.76Å
1062	G	73.7	Confident	61.8	Low	38 Å²	38	70.4 Å²	70.4	39%	0.392	43%	0.425	S	S	.	.	H	α-helix	trans	-64	-45	172.8	0	0	0	0	0	112.5	E1058 I1059 L1060 K1065 A1066	E1058-G1062 WeakPolarHBondContact O-CA 3.44Å; E1058-G1062 PolarHBondContact O-N 2.77Å; I1059-G1062 CarbonylContact O-C 3.45Å; I1059-G1062 WeakPolarHBondContact O-CA 3.5Å; I1059-G1062 PolarHBondContact O-N 3.24Å; I1059-G1062 VanDerWaalsContact O-N 3.14Å; L1060-G1062 VanDerWaalsContact C-N 3.27Å; L1060-G1062 PolarHBondContact O-N 3.27Å; G1062-K1065 PolarHBondContact O-N 2.96Å; G1062-A1066 WeakPolarHBondContact O-CB 3.47Å; G1062-A1066 PolarHBondContact O-N 2.94Å
1063	L	75.9	Confident	62.8	Low	73 Å²	73	68.6 Å²	68.6	38%	0.382	40%	0.4	S	S	.	.	H	α-helix	trans	-66.6	-43.1	175.9	-70	174.8	0	0	0	111.8	L159 V198 I1059 L1060 K1065 A1066 A1067	L159-L1063 HydrophobicContact CD2-CD1 3.41Å; L159-L1063 VanDerWaalsContact CD2-CD1 3.41Å; V198-L1063 HydrophobicContact CG1-CD1 4.2Å; V198-L1063 HydrophobicContact CG2-CB 3.93Å; I1059-L1063 WeakPolarHBondContact O-CG 3.45Å; I1059-L1063 PolarHBondContact O-N 3.36Å; L1060-L1063 PolarHBondContact O-N 3.02Å; L1063-K1065 VanDerWaalsContact C-N 3.3Å; L1063-K1065 PolarHBondContact O-N 2.97Å; L1063-A1066 PolarHBondContact O-N 3.16Å; L1063-A1067 WeakPolarHBondContact O-CB 3.29Å; L1063-A1067 PolarHBondContact O-N 3.22Å
1064	V	78.1	Confident	63.9	Low	0 Å²	0	68.3 Å²	68.3	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-62.5	-41.2	174.3	171.5	0	0	0	0	110.3	K194 L197 V198 Y244 L1060 A1066 A1067 T1068	K194-V1064 HydrophobicContact CB-CG2 3.62Å; K194-V1064 HydrophobicContact CD-CG2 4.2Å; K194-V1064 HydrophobicContact CG-CB 4.45Å; K194-V1064 HydrophobicContact CG-CG1 4.01Å; K194-V1064 HydrophobicContact CG-CG2 3.72Å; L197-V1064 HydrophobicContact CD1-CG1 4.31Å; V198-V1064 HydrophobicContact CG2-CG2 3.96Å; Y244-V1064 HydrophobicContact CD1-CG1 4.17Å; Y244-V1064 HydrophobicContact CE1-CG1 3.66Å; Y244-V1064 HydrophobicContact CE2-CG1 4.44Å; L1060-V1064 WeakPolarHBondContact O-CB 3.28Å; L1060-V1064 WeakPolarHBondContact O-CG2 3.35Å; L1060-V1064 PolarHBondContact O-N 3.01Å; V1064-A1066 VanDerWaalsContact C-N 3.34Å; V1064-A1067 PolarHBondContact O-N 3.4Å; V1064-T1068 HydrophobicContact CG1-CG2 4.44Å; V1064-T1068 WeakPolarHBondContact O-CB 3.43Å; V1064-T1068 VanDerWaalsContact O-CG2 3.29Å; V1064-T1068 WeakPolarHBondContact O-CG2 3.3Å; V1064-T1068 PolarHBondContact O-N 3.03Å; V1064-T1068 PolarHBondContact O-OG1 3.46Å
1065	K	81.4	Confident	64.8	Low	156 Å²	156	67.4 Å²	67.4	68%	0.678	39%	0.391	S	S	*	.	H	α-helix	trans	-67.1	-36.1	177.6	-169.8	172.4	-174.4	173.5	0	112	D1061 G1062 L1063 T1068 A1069	D1061-K1065 WeakPolarHBondContact O-CB 3.31Å; D1061-K1065 PolarHBondContact O-N 2.76Å; G1062-K1065 PolarHBondContact O-N 2.96Å; L1063-K1065 VanDerWaalsContact C-N 3.3Å; L1063-K1065 PolarHBondContact O-N 2.97Å; K1065-T1068 VanDerWaalsContact CA-OG1 3.29Å; K1065-T1068 WeakPolarHBondContact CA-OG1 3.45Å; K1065-T1068 PolarHBondContact O-N 2.74Å; K1065-T1068 PolarHBondContact O-OG1 3.1Å; K1065-A1069 WeakPolarHBondContact O-CB 3.32Å; K1065-A1069 PolarHBondContact O-N 3.47Å
1066	A	78.1	Confident	66	Low	55 Å²	55	68 Å²	68	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-65.1	-46.1	171.5	0	0	0	0	0	111.3	G1062 L1063 V1064 T1068 A1069	G1062-A1066 WeakPolarHBondContact O-CB 3.47Å; G1062-A1066 PolarHBondContact O-N 2.94Å; L1063-A1066 PolarHBondContact O-N 3.16Å; V1064-A1066 VanDerWaalsContact C-N 3.34Å; A1066-T1068 VanDerWaalsContact C-N 3.25Å; A1066-T1068 PolarHBondContact O-N 3.39Å; A1066-A1069 PolarHBondContact O-N 2.9Å
1067	A	72.3	Confident	66.7	Low	1 Å²	1	72.5 Å²	72.5	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-64.3	-29.2	177.7	0	0	0	0	0	112.9	L197 E201 T247 K251 L1063 V1064	L197-A1067 HydrophobicContact CB-CB 4.49Å; E201-A1067 HydrophobicContact CB-CB 4.26Å; E201-A1067 HydrophobicContact CG-CB 4.16Å; T247-A1067 VanDerWaalsContact CG2-O 3.31Å; T247-A1067 WeakPolarHBondContact CG2-O 3.22Å; K251-A1067 WeakPolarHBondContact CE-O 3.28Å; L1063-A1067 WeakPolarHBondContact O-CB 3.29Å; L1063-A1067 PolarHBondContact O-N 3.22Å; V1064-A1067 PolarHBondContact O-N 3.4Å
1068	T	76.6	Confident	67.5	Low	24 Å²	24	71.6 Å²	71.6	15%	0.147	39%	0.394	C	S	.	.	H	α-helix	trans	-91.7	-15.2	179.1	50.8	0	0	0	0	113.6	L197 I243 Y244 T247 V1064 K1065 A1066 T1070	L197-T1068 HydrophobicContact CD1-CG2 4.11Å; I243-T1068 HydrophobicContact CG2-CG2 4.42Å; Y244-T1068 HydrophobicContact CD1-CG2 3.55Å; Y244-T1068 HydrophobicContact CE1-CG2 3.78Å; T247-T1068 HydrophobicContact CG2-CG2 4.02Å; V1064-T1068 HydrophobicContact CG1-CG2 4.44Å; V1064-T1068 WeakPolarHBondContact O-CB 3.43Å; V1064-T1068 VanDerWaalsContact O-CG2 3.29Å; V1064-T1068 WeakPolarHBondContact O-CG2 3.3Å; V1064-T1068 PolarHBondContact O-N 3.03Å; V1064-T1068 PolarHBondContact O-OG1 3.46Å; K1065-T1068 VanDerWaalsContact CA-OG1 3.29Å; K1065-T1068 WeakPolarHBondContact CA-OG1 3.45Å; K1065-T1068 PolarHBondContact O-N 2.74Å; K1065-T1068 PolarHBondContact O-OG1 3.1Å; A1066-T1068 VanDerWaalsContact C-N 3.25Å; A1066-T1068 PolarHBondContact O-N 3.39Å; T1068-T1070 PolarHBondContact O-N 3.4Å
1069	A	72.1	Confident	67.4	Low	48 Å²	48	74.5 Å²	74.5	40%	0.397	40%	0.399	S	S	.	.	S	Bend	trans	-69.2	117.3	171.8	0	0	0	0	0	109.4	K1065 A1066 T1071	K1065-A1069 WeakPolarHBondContact O-CB 3.32Å; K1065-A1069 PolarHBondContact O-N 3.47Å; A1066-A1069 PolarHBondContact O-N 2.9Å; A1069-T1071 VanDerWaalsContact C-N 3.25Å; A1069-T1071 PolarHBondContact O-N 2.86Å
1070	T	56.2	Low	66.9	Low	71 Å²	71	75.5 Å²	75.5	44%	0.436	40%	0.395	S	S	.	.			trans	-70.6	78.7	179.5	47.6	0	0	0	0	110.5	E291 T1068 G1072	E291-T1070 HydrophobicContact CB-CG2 4.44Å; E291-T1070 HydrophobicContact CG-CG2 3.68Å; T1068-T1070 PolarHBondContact O-N 3.4Å; T1070-G1072 VanDerWaalsContact C-N 3.3Å; T1070-G1072 PolarHBondContact O-N 3.44Å
1071	T	49.4	Very low	66	Low	105 Å²	105	77.8 Å²	77.8	64%	0.644	42%	0.418	S	S	*	.			trans	-83.9	72.1	177.2	48.4	0	0	0	0	110.2	A1069 E1073	A1069-T1071 VanDerWaalsContact C-N 3.25Å; A1069-T1071 PolarHBondContact O-N 2.86Å; T1071-E1073 PolarHBondContact O-N 3.03Å
1072	G	49.7	Very low	64.9	Low	59 Å²	59	83 Å²	83	61%	0.608	43%	0.434	S	S	*	.			trans	43.4	37.6	165.5	0	0	0	0	0	115.9	T1070 H1074	T1070-G1072 VanDerWaalsContact C-N 3.3Å; T1070-G1072 PolarHBondContact O-N 3.44Å; G1072-H1074 PolarHBondContact O-CD2 2.87Å; G1072-H1074 PolarHBondContact O-N 2.96Å
1073	E	50.5	Low	63.8	Low	59 Å²	59	90.8 Å²	90.8	28%	0.276	46%	0.46	S	S	.	.			trans	-59.9	102.5	179.9	-80.8	-169.2	-173.1	0	0	107.7	K251 N254 T1071	K251-E1073 IonicContact NZ-OE1 2.66Å; K251-E1073 PolarHBondContact NZ-OE1 3.32Å; N254-E1073 PolarHBondContact ND2-OE2 3.01Å; T1071-E1073 PolarHBondContact O-N 3.03Å
1074	H	53	Low	62.7	Low	164 Å²	164	95.9 Å²	95.9	76%	0.759	48%	0.479	S	S	*	.			trans	-68.9	135.4	177.7	-78.6	-75.4	0	0	0	108.6	G1072 R1076	G1072-H1074 PolarHBondContact O-CD2 2.87Å; G1072-H1074 PolarHBondContact O-N 2.96Å; H1074-R1076 PolarHBondContact O-N 3.5Å
1075	P	56.2	Low	61.7	Low	30 Å²	30	99.2 Å²	99.2	20%	0.195	50%	0.497	C	S	.	.			trans	-56.8	115.4	175.6	-24.1	32.5	0	0	0	110.3	V299 K302	V299-P1075 HydrophobicContact CG2-CB 4.3Å; V299-P1075 HydrophobicContact CG2-CG 4.24Å; K302-P1075 HydrophobicContact CD-CB 3.35Å; K302-P1075 HydrophobicContact CD-CG 3.95Å; K302-P1075 PolarHBondContact NZ-O 3.48Å
1076	R	63.9	Low	61.1	Low	107 Å²	107	94.9 Å²	94.9	40%	0.404	48%	0.476	S	S	.	.			trans	-67.9	147.2	-177.8	-168.2	178.9	-174.5	160.9	8.5	111	E204 H1074 R1078	E204-R1076 IonicContact OE1-NH1 3.64Å; E204-R1076 IonicContact OE2-CZ 3.55Å; E204-R1076 IonicContact OE2-NH1 2.81Å; E204-R1076 PolarHBondContact OE2-NH1 2.99Å; E204-R1076 IonicContact OE2-NH2 2.75Å; E204-R1076 PolarHBondContact OE2-NH2 3.42Å; H1074-R1076 PolarHBondContact O-N 3.5Å; R1076-R1078 PolarHBondContact O-N 3.12Å
1077	E	62.7	Low	60.8	Low	164 Å²	164	94.2 Å²	94.2	77%	0.766	46%	0.463	S	S	*	.			trans	-82.6	111.2	172.8	-160.9	167.1	-179.5	0	0	109.4
1078	R	76.3	Confident	61	Low	14 Å²	14	94.2 Å²	94.2	5%	0.053	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-88.2	148.2	-178.3	-65.6	177.3	-151.1	-94.5	4.5	112	L253 V256 Q259 E303 R1076 R1080	L253-R1078 PolarHBondContact O-NH1 3.05Å; L253-R1078 PolarHBondContact O-NH2 2.8Å; V256-R1078 PolarHBondContact O-NH1 2.91Å; Q259-R1078 HydrophobicContact CB-CB 4.4Å; E303-R1078 VanDerWaalsContact OE1-CD 3.32Å; E303-R1078 WeakPolarHBondContact OE1-CD 3.23Å; E303-R1078 IonicContact OE1-NE 2.73Å; E303-R1078 PolarHBondContact OE1-NE 3.36Å; R1076-R1078 PolarHBondContact O-N 3.12Å; R1078-R1080 PolarHBondContact O-N 3.41Å
1079	R	65.7	Low	60.9	Low	208 Å²	208	95 Å²	95	79%	0.785	47%	0.466	S	S	*	.	B	Isolated β-bridge	trans	-70.3	122.3	178.7	-174.4	178.1	174.8	-176.6	-2.2	110.3	P257 Q259	P257-R1079 PolarHBondContact O-N 3.29Å; Q259-R1079 PolarHBondContact N-O 3.34Å
1080	R	62	Low	61	Low	128 Å²	128	95.3 Å²	95.3	48%	0.483	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-81.3	119.5	175.1	-53.8	-168.7	-179.4	154.7	2.5	110.2	R1078	R1078-R1080 PolarHBondContact O-N 3.41Å
1081	A	54.3	Low	61.5	Low	74 Å²	74	95.3 Å²	95.3	61%	0.612	45%	0.449	S	S	*	.			trans	-84.3	-25.1	179.3	0	0	0	0	0	113.1
1082	R	54.3	Low	62.5	Low	166 Å²	166	93 Å²	93	63%	0.626	44%	0.435	S	S	*	.			trans	-121.6	145	-175.8	-57.8	-177.6	-167	-158.8	-0.8	111.1	D260 F1084	D260-R1082 IonicContact OD2-CZ 3.87Å; D260-R1082 IonicContact OD2-NE 2.76Å; D260-R1082 PolarHBondContact OD2-NE 3.01Å; D260-R1082 IonicContact OD2-NH2 2.83Å; R1082-F1084 PolarHBondContact O-N 3.32Å
1083	Q	50.6	Low	63.6	Low	201 Å²	201	96.3 Å²	96.3	94%	0.939	43%	0.429	S	S	*	.	S	Bend	trans	-67.9	-21.4	171.2	-86	179.9	-28.6	0	0	112.9
1084	F	52.6	Low	64.2	Low	180 Å²	180	96.9 Å²	96.9	79%	0.789	44%	0.436	S	S	*	.	S	Bend	trans	-87.4	124.9	176.5	-68.6	-79.8	0	0	0	110	R1082 R1086	R1082-F1084 PolarHBondContact O-N 3.32Å; F1084-R1086 PolarHBondContact O-N 3.15Å
1085	N	58.8	Low	64.5	Low	69 Å²	69	92.7 Å²	92.7	37%	0.369	42%	0.419	S	S	.	.			trans	-68.9	90.5	-177.1	-150.6	6.8	0	0	0	109.6
1086	R	68.8	Low	64.6	Low	65 Å²	65	97.5 Å²	97.5	25%	0.245	44%	0.437	C	S	.	.			trans	-64.3	132.1	170.8	-177.7	179.2	175.7	-176.9	-1.5	107.5	D260 Y263 D264 D267 F1084	D260-R1086 PolarHBondContact O-NH1 3.05Å; Y263-R1086 VanDerWaalsContact CB-CZ 3.46Å; Y263-R1086 HydrophobicContact CD2-CB 4.18Å; Y263-R1086 HydrophobicContact CD2-CG 3.93Å; Y263-R1086 HydrophobicContact CE2-CB 4.32Å; Y263-R1086 HydrophobicContact CE2-CG 4.44Å; Y263-R1086 WeakPolarHBondContact CE2-O 3.49Å; Y263-R1086 HydrophobicContact CG-CG 4.27Å; Y263-R1086 VanDerWaalsContact CZ-O 3.29Å; Y263-R1086 PolarHBondContact OH-O 3.38Å; D264-R1086 IonicContact OD1-CZ 3.08Å; D264-R1086 IonicContact OD1-NH1 2.68Å; D264-R1086 PolarHBondContact OD1-NH1 3.2Å; D264-R1086 IonicContact OD1-NH2 3.94Å; D264-R1086 PolarHBondContact OD1-NH2 2.92Å; D267-R1086 IonicContact OD2-CZ 2.65Å; D267-R1086 IonicContact OD2-NE 2.8Å; D267-R1086 IonicContact OD2-NH2 2.95Å; D267-R1086 PolarHBondContact OD2-NH2 2.94Å; F1084-R1086 PolarHBondContact O-N 3.15Å
1087	K	71.7	Confident	64.1	Low	42 Å²	42	97.7 Å²	97.7	18%	0.183	45%	0.446	C	S	.	.			trans	-115.3	157.2	177.6	-67.2	177.1	175.6	175.7	0	108.7	E306 R1091 L1095	E306-K1087 IonicContact OE1-NZ 2.72Å; E306-K1087 PolarHBondContact OE1-NZ 3.03Å; K1087-R1091 HydrophobicContact CB-CB 4.28Å; K1087-R1091 HydrophobicContact CB-CG 4.42Å; K1087-R1091 HydrophobicContact CD-CG 4.2Å; K1087-L1095 HydrophobicContact CD-CD1 4.22Å
1088	S	76.7	Confident	63.7	Low	0 Å²	0	93.6 Å²	93.6	0%	0	43%	0.431	C	S	.	.			trans	-57.3	154	176.7	67	0	0	0	0	112.6	D304 R1090 R1091 T1092	D304-S1088 PolarHBondContact OD1-N 3.32Å; D304-S1088 PolarHBondContact OD1-OG 3.34Å; D304-S1088 PolarHBondContact OD2-OG 3.47Å; S1088-R1090 PolarHBondContact O-N 3.36Å; S1088-R1091 PolarHBondContact O-N 2.84Å; S1088-R1091 WeakPolarHBondContact OG-CB 3.17Å; S1088-R1091 PolarHBondContact OG-N 3.26Å; S1088-R1091 VanDerWaalsContact OG-N 3.12Å; S1088-T1092 PolarHBondContact O-N 3.17Å; S1088-T1092 PolarHBondContact O-OG1 3.17Å
1089	L	73.5	Confident	62.5	Low	40 Å²	40	98.6 Å²	98.6	21%	0.209	46%	0.455	C	S	.	.	H	α-helix	trans	-54.4	-38.9	172.4	-178	64.1	0	0	0	111.6	D267 E270 E271 T1092 R1093	D267-L1089 HydrophobicContact CB-CB 4.33Å; D267-L1089 VanDerWaalsContact OD1-CB 3.25Å; D267-L1089 WeakPolarHBondContact OD1-CB 3.4Å; D267-L1089 PolarHBondContact OD1-N 3.06Å; E270-L1089 HydrophobicContact CB-CD2 4.47Å; E271-L1089 HydrophobicContact CG-CD2 3.71Å; L1089-T1092 PolarHBondContact O-N 2.65Å; L1089-R1093 WeakPolarHBondContact O-CG 3.45Å; L1089-R1093 PolarHBondContact O-N 3.3Å
1090	R	74.9	Confident	62	Low	55 Å²	55	93.8 Å²	93.8	21%	0.208	45%	0.445	C	S	.	.	H	α-helix	trans	-60.1	-50.5	176.3	-168.9	176.5	-178.8	-168.9	3.1	111.5	E275 E297 S1088 T1092 R1093 T1094	E275-R1090 IonicContact OE1-CZ 3.79Å; E275-R1090 IonicContact OE1-NE 3.03Å; E275-R1090 PolarHBondContact OE1-NE 3.44Å; E275-R1090 IonicContact OE1-NH2 3.36Å; E275-R1090 PolarHBondContact OE1-NH2 2.68Å; E275-R1090 IonicContact OE2-NE 3.39Å; E297-R1090 IonicContact OE1-CZ 3.19Å; E297-R1090 IonicContact OE1-NH1 2.79Å; E297-R1090 PolarHBondContact OE1-NH1 3.26Å; E297-R1090 IonicContact OE1-NH2 2.77Å; E297-R1090 IonicContact OE2-CZ 4Å; E297-R1090 IonicContact OE2-NH1 3.87Å; E297-R1090 PolarHBondContact OE2-NH1 3.5Å; S1088-R1090 PolarHBondContact O-N 3.36Å; R1090-T1092 VanDerWaalsContact C-N 3.34Å; R1090-T1092 PolarHBondContact O-N 3.49Å; R1090-R1093 PolarHBondContact O-N 2.75Å; R1090-T1094 WeakPolarHBondContact O-CG2 3.09Å; R1090-T1094 PolarHBondContact O-N 3.21Å; R1090-T1094 PolarHBondContact O-OG1 3.43Å
1091	R	66.6	Low	61.5	Low	72 Å²	72	94.7 Å²	94.7	27%	0.272	46%	0.455	S	S	.	.	H	α-helix	trans	-64.4	-38.9	177.1	-170.2	158.9	-178.3	173.1	-13.5	112.1	D304 K1087 S1088 R1093 T1094 L1095	D304-R1091 PolarHBondContact O-NH1 2.96Å; K1087-R1091 HydrophobicContact CB-CB 4.28Å; K1087-R1091 HydrophobicContact CB-CG 4.42Å; K1087-R1091 HydrophobicContact CD-CG 4.2Å; S1088-R1091 PolarHBondContact O-N 2.84Å; S1088-R1091 WeakPolarHBondContact OG-CB 3.17Å; S1088-R1091 PolarHBondContact OG-N 3.26Å; S1088-R1091 VanDerWaalsContact OG-N 3.12Å; R1091-R1093 PolarHBondContact O-N 2.97Å; R1091-T1094 WeakPolarHBondContact CA-OG1 3.5Å; R1091-T1094 PolarHBondContact O-N 2.71Å; R1091-T1094 PolarHBondContact O-OG1 3.17Å; R1091-L1095 HydrophobicContact CG-CD1 4.22Å; R1091-L1095 HydrophobicContact CG-CG 4.46Å; R1091-L1095 WeakPolarHBondContact O-CB 3.34Å; R1091-L1095 WeakPolarHBondContact O-CG 3.29Å; R1091-L1095 PolarHBondContact O-N 3.31Å
1092	T	70.7	Confident	61.4	Low	57 Å²	57	96.2 Å²	96.2	35%	0.35	45%	0.452	S	S	.	.	H	α-helix	trans	-63.2	-39.4	176	-54	0	0	0	0	112.2	S1088 L1089 R1090 K1096	S1088-T1092 PolarHBondContact O-N 3.17Å; S1088-T1092 PolarHBondContact O-OG1 3.17Å; L1089-T1092 PolarHBondContact O-N 2.65Å; R1090-T1092 VanDerWaalsContact C-N 3.34Å; R1090-T1092 PolarHBondContact O-N 3.49Å; T1092-K1096 PolarHBondContact O-N 3.47Å; T1092-K1096 VanDerWaalsContact O-N 3.13Å
1093	R	70.9	Confident	61.4	Low	128 Å²	128	93.4 Å²	93.4	48%	0.483	45%	0.449	S	S	.	.	H	α-helix	trans	-64.9	-45.5	173.1	-75.1	175	178.1	171.6	1.9	111.8	L1089 R1090 R1091 K1096 L1097	L1089-R1093 WeakPolarHBondContact O-CG 3.45Å; L1089-R1093 PolarHBondContact O-N 3.3Å; R1090-R1093 PolarHBondContact O-N 2.75Å; R1091-R1093 PolarHBondContact O-N 2.97Å; R1093-K1096 PolarHBondContact O-N 3.34Å; R1093-L1097 WeakPolarHBondContact O-CG 3.49Å; R1093-L1097 PolarHBondContact O-N 3.03Å
1094	T	63.5	Low	61.3	Low	71 Å²	71	86.8 Å²	86.8	44%	0.436	43%	0.434	S	S	.	.	H	α-helix	trans	-64.9	-40	178.7	59	0	0	0	0	112.7	R1090 R1091 L1097 V1098	R1090-T1094 WeakPolarHBondContact O-CG2 3.09Å; R1090-T1094 PolarHBondContact O-N 3.21Å; R1090-T1094 PolarHBondContact O-OG1 3.43Å; R1091-T1094 WeakPolarHBondContact CA-OG1 3.5Å; R1091-T1094 PolarHBondContact O-N 2.71Å; R1091-T1094 PolarHBondContact O-OG1 3.17Å; T1094-L1097 PolarHBondContact O-N 2.99Å; T1094-V1098 WeakPolarHBondContact O-CG2 3.41Å; T1094-V1098 PolarHBondContact O-N 3.07Å
1095	L	59.6	Low	61	Low	75 Å²	75	85.5 Å²	85.5	39%	0.393	44%	0.436	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.9	-74.6	172.6	0	0	0	111.9	K1087 R1091 L1097 V1098 E1099	K1087-L1095 HydrophobicContact CD-CD1 4.22Å; R1091-L1095 HydrophobicContact CG-CD1 4.22Å; R1091-L1095 HydrophobicContact CG-CG 4.46Å; R1091-L1095 WeakPolarHBondContact O-CB 3.34Å; R1091-L1095 WeakPolarHBondContact O-CG 3.29Å; R1091-L1095 PolarHBondContact O-N 3.31Å; L1095-L1097 VanDerWaalsContact C-N 3.34Å; L1095-L1097 PolarHBondContact O-N 3.33Å; L1095-V1098 PolarHBondContact O-N 3.37Å; L1095-E1099 PolarHBondContact O-N 3.23Å
1096	K	58	Low	59.9	Low	131 Å²	131	90.4 Å²	90.4	57%	0.57	47%	0.468	S	S	*	.	H	α-helix	trans	-63.1	-38.3	173.6	-79.6	-176	177.1	176.9	0	112.8	T1092 R1093 V1098 E1099 D1100	T1092-K1096 PolarHBondContact O-N 3.47Å; T1092-K1096 VanDerWaalsContact O-N 3.13Å; R1093-K1096 PolarHBondContact O-N 3.34Å; K1096-V1098 VanDerWaalsContact C-N 3.33Å; K1096-E1099 PolarHBondContact O-N 3.37Å; K1096-D1100 VanDerWaalsContact O-CB 3.29Å; K1096-D1100 WeakPolarHBondContact O-CB 3.42Å; K1096-D1100 PolarHBondContact O-N 3.02Å
1097	L	52.9	Low	59.4	Low	112 Å²	112	91.7 Å²	91.7	59%	0.586	48%	0.479	S	S	*	.	H	α-helix	trans	-65.8	-37.5	174.8	-76.5	165.7	0	0	0	111.9	R1093 T1094 L1095 Q1101	R1093-L1097 WeakPolarHBondContact O-CG 3.49Å; R1093-L1097 PolarHBondContact O-N 3.03Å; T1094-L1097 PolarHBondContact O-N 2.99Å; L1095-L1097 VanDerWaalsContact C-N 3.34Å; L1095-L1097 PolarHBondContact O-N 3.33Å; L1097-Q1101 WeakPolarHBondContact O-CB 3.11Å; L1097-Q1101 WeakPolarHBondContact O-CG 3.3Å; L1097-Q1101 PolarHBondContact O-N 2.88Å
1098	V	56.1	Low	58.8	Low	77 Å²	77	94.3 Å²	94.3	47%	0.467	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-43.7	174.1	173.6	0	0	0	0	110.5	T1094 L1095 K1096 Q1101 I1102	T1094-V1098 WeakPolarHBondContact O-CG2 3.41Å; T1094-V1098 PolarHBondContact O-N 3.07Å; L1095-V1098 PolarHBondContact O-N 3.37Å; K1096-V1098 VanDerWaalsContact C-N 3.33Å; V1098-Q1101 PolarHBondContact O-N 2.65Å; V1098-I1102 HydrophobicContact CG1-CD1 3.83Å; V1098-I1102 WeakPolarHBondContact O-CB 3.3Å; V1098-I1102 WeakPolarHBondContact O-CD1 3.09Å; V1098-I1102 WeakPolarHBondContact O-CG1 3.45Å; V1098-I1102 PolarHBondContact O-N 3.22Å
1099	E	51	Low	57.8	Low	119 Å²	119	99.5 Å²	99.5	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-40.7	174.2	-78	-179.1	170.9	0	0	112.5	L1095 K1096 I1102 N1103	L1095-E1099 PolarHBondContact O-N 3.23Å; K1096-E1099 PolarHBondContact O-N 3.37Å; E1099-I1102 PolarHBondContact O-N 2.92Å; E1099-N1103 VanDerWaalsContact O-CB 3.31Å; E1099-N1103 WeakPolarHBondContact O-CB 3.47Å; E1099-N1103 PolarHBondContact O-N 2.91Å
1100	D	53.9	Low	56.9	Low	108 Å²	108	103 Å²	103	58%	0.578	54%	0.54	S	S	*	.	H	α-helix	trans	-69.6	-32.5	175.9	-78.8	-19.2	0	0	0	111.8	K1096 G1104	K1096-D1100 VanDerWaalsContact O-CB 3.29Å; K1096-D1100 WeakPolarHBondContact O-CB 3.42Å; K1096-D1100 PolarHBondContact O-N 3.02Å; D1100-G1104 WeakPolarHBondContact O-CA 3.4Å; D1100-G1104 PolarHBondContact O-N 3.4Å
1101	Q	52	Low	55.7	Low	147 Å²	147	106 Å²	106	69%	0.687	56%	0.561	S	S	*	*	H	α-helix	trans	-69.5	-36.3	171.1	-81.9	-168.4	-5.5	0	0	112.1	L1097 V1098 N1105	L1097-Q1101 WeakPolarHBondContact O-CB 3.11Å; L1097-Q1101 WeakPolarHBondContact O-CG 3.3Å; L1097-Q1101 PolarHBondContact O-N 2.88Å; V1098-Q1101 PolarHBondContact O-N 2.65Å; Q1101-N1105 PolarHBondContact O-N 3.46Å
1102	I	52.9	Low	55	Low	105 Å²	105	108.3 Å²	108.3	54%	0.538	58%	0.581	S	S	.	*	H	α-helix	trans	-69.8	-46.1	175.2	-68.3	164.7	0	0	0	109.9	V1098 E1099 N1105	V1098-I1102 HydrophobicContact CG1-CD1 3.83Å; V1098-I1102 WeakPolarHBondContact O-CB 3.3Å; V1098-I1102 WeakPolarHBondContact O-CD1 3.09Å; V1098-I1102 WeakPolarHBondContact O-CG1 3.45Å; V1098-I1102 PolarHBondContact O-N 3.22Å; E1099-I1102 PolarHBondContact O-N 2.92Å; I1102-N1105 PolarHBondContact O-N 3.4Å
1103	N	53.4	Low	53.9	Low	108 Å²	108	111.9 Å²	111.9	58%	0.578	60%	0.597	S	S	*	*	H	α-helix	trans	-76.9	-20.9	-179.5	-74.9	-14.7	0	0	0	113.9	E1099 N1105	E1099-N1103 VanDerWaalsContact O-CB 3.31Å; E1099-N1103 WeakPolarHBondContact O-CB 3.47Å; E1099-N1103 PolarHBondContact O-N 2.91Å; N1103-N1105 VanDerWaalsContact C-N 3.32Å
1104	G	49.6	Very low	52.6	Low	61 Å²	61	110.7 Å²	110.7	63%	0.629	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-11.7	173.1	0	0	0	0	0	113.9	D1100	D1100-G1104 WeakPolarHBondContact O-CA 3.4Å; D1100-G1104 PolarHBondContact O-N 3.4Å
1105	N	44.4	Very low	51.7	Low	154 Å²	154	114 Å²	114	82%	0.824	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	7.9	173.4	-98.3	-1.5	0	0	0	113.4	Q1101 I1102 N1103	Q1101-N1105 PolarHBondContact O-N 3.46Å; I1102-N1105 PolarHBondContact O-N 3.4Å; N1103-N1105 VanDerWaalsContact C-N 3.32Å
1106	V	36.4	Very low	51	Low	171 Å²	171	117.5 Å²	117.5	100%	1.036	64%	0.641	S	S	*	*			trans	-107.9	0	167.8	-174.9	0	0	0	0	108.2

Retrieved 1,106 of 1,106 residues in 226.3 ms (Link to these results)

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