A0A077ZCL8_TRITR Loading...

PH and RabGAP-TBC domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZCL8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 870 aa.

						>A0A077ZCL8_TRITR|A0A077ZCL8
MKQSAMQQHADGNCFAGYLKQIEAIGPLKSTRRRWFVLEDDAHFVYYYRVEKDKQPLGRIYLPSAIFSFDPKQQSTFEIHSNGEVYVLEAPDEQARFSWLQALQNQRRQCIETQMKEFADEPADSMKLPDLSEFLPGYSTCPENTDSAGTAAAHSESLSVFYINESGQLKKNSLECPTGGGKRFPIFKQDNCSVTAAPTKLPPGEHSETAAVGKSDGFKIGSLTSRRGCKNCSEVRLCNLTAQLIKVSLFFLKLVSVVNSLKERCLDLHDELAASRELIQVLQHSIVVNKDQSAALQRLINATESESQRLQFYLETEMQRSQLQSENADYKSRLKEAEEKLKQLEERIVKKNTDIESFRQCVRSKDELIVQLADECRQQTESGAPVDEWLTDAIEPCCEEIQVTDASEQEIDRLRDLVAGYERQNQFLNKELLELHGLLHTLENREIKHVRRYYDMEGQYYQLKSRYLLLLNHFQPNKSTPLPSHISVISIRHLTFCLALSPNAIEELVKEAKKTLLSGDSQKNTFTDDLGFYLTTWHGVSPDCKDDLLLMAGELQRKSDQIYLKRKKESDELYLDWLTKWDSFLVNFADKLMVPNPELKDLIRSGVPHSYRSRVWKDLIHYWVKEELSDVGTGYFACLCRQAMAICSESYDPAFKQIDLDLTRTLPHNRYFEDLHAEKVEPLRRVLYAYRQHNSDIGYCQGLNRLAAVALLYLSEEDAFWALVAIIEHLQPHNYYGRTVLAAQADQRVLEDLVQEKVPKVYAHLRYYDVDLSVFTFNWFLTIFVDNFPHQTYLNIWDCFLLEGNKILFRFALAALKLREEEILACKSCGALHSFLSKIGEQLCDYKKLAQVGGGKLLISLSIPHYRTYL
					

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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	31	Very low	37.7	Very low	236 Å²	236	144 Å²	144	100%	1.163	76%	0.761	S	S	*	*				0	12.6	0	-74.5	-176	-173.8	0	0	114.4	Q3	M1-Q3 PolarHBondContact O-N 3.06Å
2	K	34.3	Very low	38.4	Very low	218 Å²	218	135.4 Å²	135.4	95%	0.948	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	6.5	-175.3	-82.1	-172.4	174.8	-176.5	0	116.1
3	Q	31.7	Very low	39.7	Very low	201 Å²	201	134.2 Å²	134.2	94%	0.939	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	10.6	-171.8	-90.2	-178.2	-17.7	0	0	116.1	M1	M1-Q3 PolarHBondContact O-N 3.06Å
4	S	33.8	Very low	41.5	Very low	92 Å²	92	128.2 Å²	128.2	64%	0.643	70%	0.698	S	S	*	*			trans	-112.1	21.5	-167.3	77.3	0	0	0	0	117.3
5	A	40.9	Very low	44.2	Very low	77 Å²	77	122.5 Å²	122.5	64%	0.636	66%	0.664	S	S	*	*			trans	-96	0.2	-171	0	0	0	0	0	116.5
6	M	38.6	Very low	46.7	Very low	97 Å²	97	116.3 Å²	116.3	48%	0.478	64%	0.635	S	S	.	*			trans	-114.9	89.4	172.5	-95.1	177.8	148	0	0	109.1	F15 A95	M6-F15 HydrophobicContact CE-CE1 4.44Å; M6-F15 HydrophobicContact CE-CE2 4Å; M6-F15 HydrophobicContact CE-CZ 3.5Å; M6-A95 HydrophobicContact CE-CB 4.35Å; M6-A95 HydrophobicContact SD-CB 4.5Å
7	Q	42.5	Very low	49.1	Very low	121 Å²	121	109.8 Å²	109.8	57%	0.565	60%	0.6	S	S	*	*			trans	-94.1	102.1	173	-79.8	169.5	-44.2	0	0	108.5	H9	Q7-H9 VanDerWaalsContact C-N 3.29Å; Q7-H9 PolarHBondContact O-N 3.21Å; Q7-H9 VanDerWaalsContact O-N 3.08Å
8	Q	40.4	Very low	51.3	Low	167 Å²	167	107.4 Å²	107.4	78%	0.78	58%	0.582	S	S	*	*			trans	-67.1	97.6	153.1	-74.8	177.8	-15	0	0	105.7	A10	Q8-A10 PolarHBondContact O-N 3.44Å
9	H	38.3	Very low	53.3	Low	108 Å²	108	101.8 Å²	101.8	50%	0.5	55%	0.552	S	S	.	*			trans	-64.7	120.2	174.7	-92.5	-89.2	0	0	0	108.3	Q7 D11 G12	Q7-H9 VanDerWaalsContact C-N 3.29Å; Q7-H9 PolarHBondContact O-N 3.21Å; Q7-H9 VanDerWaalsContact O-N 3.08Å; H9-D11 PolarHBondContact O-N 3.16Å; H9-G12 PolarHBondContact O-N 3.11Å
10	A	39.8	Very low	55	Low	100 Å²	100	101.1 Å²	101.1	83%	0.826	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-5.2	-177.2	0	0	0	0	0	114.2	Q8	Q8-A10 PolarHBondContact O-N 3.44Å
11	D	43.1	Very low	56.6	Low	167 Å²	167	97 Å²	97	89%	0.893	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	14.7	-174.8	-69.6	-30.7	0	0	0	114.2	H9	H9-D11 PolarHBondContact O-N 3.16Å
12	G	46.5	Very low	59.2	Low	41 Å²	41	86.7 Å²	86.7	42%	0.423	47%	0.47	S	S	.	.	S	Bend	trans	163.8	117.2	175	0	0	0	0	0	108.5	H9 C14	H9-G12 PolarHBondContact O-N 3.11Å; G12-C14 PolarHBondContact O-N 2.73Å
13	N	55.3	Low	61	Low	119 Å²	119	80 Å²	80	64%	0.636	44%	0.442	S	S	*	.			trans	-71	31.2	-162.9	-103.7	-4.8	0	0	0	115.2	F15 D40	N13-F15 PolarHBondContact O-N 3.02Å; N13-D40 WeakPolarHBondContact CB-OD2 3.39Å
14	C	65.4	Low	62.4	Low	51 Å²	51	72 Å²	72	35%	0.345	41%	0.41	S	S	.	.			trans	-65.9	124.7	178.3	-62.5	0	0	0	0	111.4	G12 A16 L38	G12-C14 PolarHBondContact O-N 2.73Å; C14-A16 PolarHBondContact O-N 2.71Å; C14-L38 WeakPolarHBondContact CA-O 3.44Å
15	F	80.8	Confident	63.4	Low	43 Å²	43	74.9 Å²	74.9	19%	0.189	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	102.9	175.1	-169.5	-94.2	0	0	0	109.3	M6 N13 L38 W99 A102	M6-F15 HydrophobicContact CE-CE1 4.44Å; M6-F15 HydrophobicContact CE-CE2 4Å; M6-F15 HydrophobicContact CE-CZ 3.5Å; N13-F15 PolarHBondContact O-N 3.02Å; F15-L38 HydrophobicContact CB-CB 4.15Å; F15-L38 HydrophobicContact CB-CD2 4.22Å; F15-L38 PolarHBondContact N-O 3.08Å; F15-L38 VanDerWaalsContact O-CB 3.25Å; F15-L38 WeakPolarHBondContact O-CB 3.32Å; F15-L38 PolarHBondContact O-N 3.44Å; F15-W99 HydrophobicContact CD1-CD2 4.11Å; F15-W99 AromaticContact CD1-CE3 3.88Å; F15-W99 HydrophobicContact CD1-CE3 3.88Å; F15-W99 AromaticContact CD1-CH2 3.94Å; F15-W99 HydrophobicContact CD1-CH2 3.94Å; F15-W99 HydrophobicContact CD1-CZ2 4.16Å; F15-W99 AromaticContact CD1-CZ3 3.79Å; F15-W99 HydrophobicContact CD1-CZ3 3.79Å; F15-W99 HydrophobicContact CE1-CB 4.43Å; F15-W99 AromaticContact CE1-CD2 3.45Å; F15-W99 HydrophobicContact CE1-CD2 3.45Å; F15-W99 VanDerWaalsContact CE1-CD2 3.45Å; F15-W99 AromaticContact CE1-CE2 3.64Å; F15-W99 AromaticContact CE1-CE3 3.65Å; F15-W99 HydrophobicContact CE1-CE3 3.65Å; F15-W99 AromaticContact CE1-CG 3.81Å; F15-W99 HydrophobicContact CE1-CG 3.81Å; F15-W99 HydrophobicContact CE1-CH2 4.19Å; F15-W99 HydrophobicContact CE1-CZ2 4.03Å; F15-W99 HydrophobicContact CE1-CZ3 4.01Å; F15-W99 HydrophobicContact CZ-CD2 4.47Å; F15-W99 HydrophobicContact CZ-CG 4.47Å; F15-A102 HydrophobicContact CD1-CB 3.75Å; F15-A102 HydrophobicContact CD2-CB 4.32Å; F15-A102 HydrophobicContact CE1-CB 3.81Å; F15-A102 HydrophobicContact CE2-CB 4.38Å; F15-A102 HydrophobicContact CG-CB 4Å; F15-A102 HydrophobicContact CZ-CB 4.13Å
16	A	85.4	Confident	64.2	Low	23 Å²	23	72.9 Å²	72.9	19%	0.19	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	153.4	-175.6	0	0	0	0	0	112.6	C14 W35 F36 V37	C14-A16 PolarHBondContact O-N 2.71Å; A16-W35 HydrophobicContact CB-CH2 4.17Å; A16-W35 HydrophobicContact CB-CZ2 3.42Å; A16-W35 VanDerWaalsContact CB-CZ2 3.42Å; A16-F36 CarbonylContact C-O 3.48Å; A16-F36 VanDerWaalsContact CA-O 3.22Å; A16-F36 WeakPolarHBondContact CA-O 3.38Å; A16-V37 HydrophobicContact CB-CB 4.44Å; A16-V37 HydrophobicContact CB-CG1 4.37Å; A16-V37 HydrophobicContact CB-CG2 4.11Å
17	G	87	Confident	65.2	Low	5 Å²	5	75.1 Å²	75.1	5%	0.052	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.3	158.5	-177.2	0	0	0	0	0	114.6	F36	G17-F36 PolarHBondContact N-O 3.22Å; G17-F36 PolarHBondContact O-N 2.72Å
18	Y	88.4	Confident	65.9	Low	67 Å²	67	76.4 Å²	76.4	26%	0.263	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	123.1	174.1	-80.5	-73.8	0	0	0	110.8	R33 R34 W35 E51	Y18-R33 HydrophobicContact CD1-CG 3.85Å; Y18-R33 HydrophobicContact CG-CG 4.44Å; Y18-R33 VanDerWaalsContact CG-NH2 3.33Å; Y18-R34 WeakPolarHBondContact CA-O 3.47Å; Y18-W35 HydrophobicContact CD1-CB 4.22Å; Y18-W35 AromaticContact CD1-CE3 3.88Å; Y18-W35 HydrophobicContact CD1-CE3 3.88Å; Y18-W35 AromaticContact CD2-CE3 3.27Å; Y18-W35 HydrophobicContact CD2-CE3 3.27Å; Y18-W35 AromaticContact CD2-CZ3 3.33Å; Y18-W35 HydrophobicContact CD2-CZ3 3.33Å; Y18-W35 HydrophobicContact CE1-CB 3.95Å; Y18-W35 HydrophobicContact CE1-CE3 4.02Å; Y18-W35 HydrophobicContact CE2-CD2 4.37Å; Y18-W35 AromaticContact CE2-CE3 3.39Å; Y18-W35 HydrophobicContact CE2-CE3 3.39Å; Y18-W35 AromaticContact CE2-CZ3 3.59Å; Y18-W35 HydrophobicContact CE2-CZ3 3.59Å; Y18-W35 AromaticContact CG-CE3 3.52Å; Y18-W35 HydrophobicContact CG-CE3 3.52Å; Y18-W35 AromaticContact CG-CZ3 3.96Å; Y18-W35 HydrophobicContact CG-CZ3 3.96Å; Y18-W35 AromaticContact CZ-CE3 3.78Å; Y18-W35 VanDerWaalsContact N-CE3 3.33Å; Y18-W35 VanDerWaalsContact N-CZ3 3.35Å; Y18-E51 HydrophobicContact CE2-CB 4.48Å; Y18-E51 WeakPolarHBondContact OH-CB 3.47Å; Y18-E51 PolarHBondContact OH-N 3.41Å
19	L	89.6	Confident	66.9	Low	2 Å²	2	75.1 Å²	75.1	1%	0.01	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	150.8	172.2	-61.7	173.1	0	0	0	109.4	R34 F36 F77 L88 A90 W99	L19-R34 PolarHBondContact N-O 2.83Å; L19-R34 PolarHBondContact O-N 2.81Å; L19-F36 HydrophobicContact CB-CD2 3.7Å; L19-F36 HydrophobicContact CB-CE2 3.87Å; L19-F36 HydrophobicContact CD1-CB 4.19Å; L19-F36 HydrophobicContact CD1-CD2 3.85Å; L19-F36 HydrophobicContact CD1-CE2 4.38Å; L19-F36 HydrophobicContact CD1-CG 3.96Å; L19-F36 HydrophobicContact CG-CD2 4.09Å; L19-F77 HydrophobicContact CD1-CE1 4.33Å; L19-F77 HydrophobicContact CD1-CZ 3.84Å; L19-F77 HydrophobicContact CD2-CE1 4.27Å; L19-L88 HydrophobicContact CD1-CB 4.49Å; L19-L88 HydrophobicContact CD1-CD1 3.94Å; L19-A90 HydrophobicContact CD2-CB 4.07Å; L19-W99 HydrophobicContact CD1-CD2 3.99Å; L19-W99 HydrophobicContact CD1-CE3 4.39Å; L19-W99 HydrophobicContact CD1-CG 4.46Å; L19-W99 HydrophobicContact CD1-CZ2 4.15Å; L19-W99 HydrophobicContact CG-CZ2 4.41Å
20	K	88.2	Confident	68.7	Low	86 Å²	86	72.2 Å²	72.2	37%	0.374	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.9	169.7	-49.6	175.7	-166.6	153.7	0	108.9	R32 L88 E89	K20-R32 CarbonylContact C-O 3.52Å; K20-R32 WeakPolarHBondContact CA-O 3.48Å; K20-L88 CarbonylContact O-C 3.58Å; K20-L88 WeakPolarHBondContact O-CA 3.21Å; K20-E89 HydrophobicContact CB-CB 4.09Å; K20-E89 PolarHBondContact N-O 2.96Å; K20-E89 IonicContact NZ-OE1 3.44Å; K20-E89 PolarHBondContact NZ-OE1 2.73Å; K20-E89 IonicContact NZ-OE2 2.95Å; K20-E89 PolarHBondContact O-N 2.92Å
21	Q	88.3	Confident	70.7	Confident	16 Å²	16	71 Å²	71	8%	0.075	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.1	172.4	-176.2	171.6	-4.3	0	0	109.7	T31 R32 R34 L88	Q21-T31 WeakPolarHBondContact O-CA 3.03Å; Q21-R32 PolarHBondContact N-O 2.83Å; Q21-R32 PolarHBondContact O-N 2.85Å; Q21-R34 VanDerWaalsContact OE1-CZ 3.22Å; Q21-L88 HydrophobicContact CB-CD2 3.81Å; Q21-L88 HydrophobicContact CG-CD2 3.92Å
22	I	84.4	Confident	72.8	Confident	20 Å²	20	69.7 Å²	69.7	10%	0.103	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	112	176.6	-58.7	165.3	0	0	0	107	T31 T76 V87	I22-T31 HydrophobicContact CG1-CG2 3.91Å; I22-T76 HydrophobicContact CD1-CG2 4.33Å; I22-V87 HydrophobicContact CB-CB 4.2Å; I22-V87 HydrophobicContact CB-CG1 4.41Å; I22-V87 HydrophobicContact CD1-CG1 3.82Å; I22-V87 PolarHBondContact N-O 3.43Å
23	E	72.4	Confident	74.8	Confident	76 Å²	76	75.7 Å²	75.7	36%	0.355	39%	0.394	S	S	.	.			trans	-92.6	-28.5	-174.4	-71.5	172.8	179.9	0	0	112.9	S30 R32 R34	E23-S30 PolarHBondContact N-O 2.87Å; E23-R32 WeakPolarHBondContact OE1-CD 3.48Å; E23-R32 IonicContact OE1-NE 3.52Å; E23-R32 PolarHBondContact OE1-NE 2.88Å; E23-R32 IonicContact OE2-CZ 3.07Å; E23-R32 IonicContact OE2-NE 2.67Å; E23-R32 PolarHBondContact OE2-NE 2.96Å; E23-R32 IonicContact OE2-NH2 3.25Å; E23-R34 IonicContact OE1-CZ 2.73Å; E23-R34 IonicContact OE1-NE 2.96Å; E23-R34 IonicContact OE1-NH2 3.72Å; E23-R34 PolarHBondContact OE1-NH2 3.26Å
24	A	62.1	Low	76.5	Confident	34 Å²	34	71.6 Å²	71.6	28%	0.281	37%	0.37	S	S	.	.			trans	-125	114.4	-174.6	0	0	0	0	0	111.5	G26	A24-G26 PolarHBondContact O-N 3.46Å
25	I	54.8	Low	77.6	Confident	152 Å²	152	70.7 Å²	70.7	78%	0.779	36%	0.359	S	S	*	.			trans	-88.6	59.4	166.4	-46.9	174.6	0	0	0	107.6
26	G	56.6	Low	78.1	Confident	35 Å²	35	68.8 Å²	68.8	36%	0.361	35%	0.351	S	S	.	.	S	Bend	trans	-119.5	-178	173.4	0	0	0	0	0	110.9	A24 L28	A24-G26 PolarHBondContact O-N 3.46Å; G26-L28 PolarHBondContact O-N 2.76Å
27	P	60.4	Low	78.2	Confident	145 Å²	145	68.6 Å²	68.6	94%	0.942	35%	0.347	S	S	*	.	S	Bend	trans	-58.3	-20.5	174.4	23.5	-32.4	0	0	0	112.7
28	L	57.7	Low	78.1	Confident	148 Å²	148	68.7 Å²	68.7	78%	0.775	35%	0.346	S	S	*	.	S	Bend	trans	-107.8	90.6	173.1	-68.5	156	0	0	0	109.2	G26 S30	G26-L28 PolarHBondContact O-N 2.76Å; L28-S30 PolarHBondContact O-N 2.92Å
29	K	61.5	Low	77.8	Confident	140 Å²	140	69.6 Å²	69.6	61%	0.609	35%	0.353	S	S	*	.			trans	-66	104.8	170	-71	-171.5	179.6	-174.9	0	109.2
30	S	74.8	Confident	77	Confident	47 Å²	47	73.8 Å²	73.8	33%	0.329	38%	0.376	S	S	.	.			trans	-86	127.1	166.2	66.8	0	0	0	0	109	E23 L28	E23-S30 PolarHBondContact N-O 2.87Å; L28-S30 PolarHBondContact O-N 2.92Å
31	T	81.8	Confident	76	Confident	74 Å²	74	74.5 Å²	74.5	45%	0.454	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.7	174.4	64.1	0	0	0	0	109.1	Q21 I22	Q21-T31 WeakPolarHBondContact O-CA 3.03Å; I22-T31 HydrophobicContact CG1-CG2 3.91Å
32	R	87.6	Confident	75.5	Confident	140 Å²	140	74.6 Å²	74.6	53%	0.528	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	125.3	175.6	-60.8	-160.4	-165.4	-131.1	-0.3	109.6	K20 Q21 E23 R34	K20-R32 CarbonylContact C-O 3.52Å; K20-R32 WeakPolarHBondContact CA-O 3.48Å; Q21-R32 PolarHBondContact N-O 2.83Å; Q21-R32 PolarHBondContact O-N 2.85Å; E23-R32 WeakPolarHBondContact OE1-CD 3.48Å; E23-R32 IonicContact OE1-NE 3.52Å; E23-R32 PolarHBondContact OE1-NE 2.88Å; E23-R32 IonicContact OE2-CZ 3.07Å; E23-R32 IonicContact OE2-NE 2.67Å; E23-R32 PolarHBondContact OE2-NE 2.96Å; E23-R32 IonicContact OE2-NH2 3.25Å; R32-R34 PolarHBondContact O-N 3.35Å
33	R	89	Confident	75.4	Confident	166 Å²	166	76.2 Å²	76.2	63%	0.626	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	121.1	171.8	-172.3	176.8	175.1	-157.1	-4.5	108.9	Y18	Y18-R33 HydrophobicContact CD1-CG 3.85Å; Y18-R33 HydrophobicContact CG-CG 4.44Å; Y18-R33 VanDerWaalsContact CG-NH2 3.33Å
34	R	89.5	Confident	76.1	Confident	33 Å²	33	75 Å²	75	13%	0.125	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.2	-178.9	-68.4	176.4	179.4	-155	-7.2	109.7	Y18 L19 Q21 E23 R32 F36 Y48 L57	Y18-R34 WeakPolarHBondContact CA-O 3.47Å; L19-R34 PolarHBondContact N-O 2.83Å; L19-R34 PolarHBondContact O-N 2.81Å; Q21-R34 VanDerWaalsContact OE1-CZ 3.22Å; E23-R34 IonicContact OE1-CZ 2.73Å; E23-R34 IonicContact OE1-NE 2.96Å; E23-R34 IonicContact OE1-NH2 3.72Å; E23-R34 PolarHBondContact OE1-NH2 3.26Å; R32-R34 PolarHBondContact O-N 3.35Å; R34-F36 HydrophobicContact CB-CD2 4.34Å; R34-F36 HydrophobicContact CB-CE2 3.81Å; R34-Y48 WeakPolarHBondContact CA-O 3.45Å; R34-Y48 WeakPolarHBondContact CB-O 3.27Å; R34-L57 HydrophobicContact CG-CD1 4.46Å
35	W	90.1	Very high	77.4	Confident	33 Å²	33	73.4 Å²	73.4	13%	0.125	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.2	177.3	-179.9	-109.1	0	0	0	109.1	A16 Y18 V37 Y47 Y48 E51	A16-W35 HydrophobicContact CB-CH2 4.17Å; A16-W35 HydrophobicContact CB-CZ2 3.42Å; A16-W35 VanDerWaalsContact CB-CZ2 3.42Å; Y18-W35 HydrophobicContact CD1-CB 4.22Å; Y18-W35 AromaticContact CD1-CE3 3.88Å; Y18-W35 HydrophobicContact CD1-CE3 3.88Å; Y18-W35 AromaticContact CD2-CE3 3.27Å; Y18-W35 HydrophobicContact CD2-CE3 3.27Å; Y18-W35 AromaticContact CD2-CZ3 3.33Å; Y18-W35 HydrophobicContact CD2-CZ3 3.33Å; Y18-W35 HydrophobicContact CE1-CB 3.95Å; Y18-W35 HydrophobicContact CE1-CE3 4.02Å; Y18-W35 HydrophobicContact CE2-CD2 4.37Å; Y18-W35 AromaticContact CE2-CE3 3.39Å; Y18-W35 HydrophobicContact CE2-CE3 3.39Å; Y18-W35 AromaticContact CE2-CZ3 3.59Å; Y18-W35 HydrophobicContact CE2-CZ3 3.59Å; Y18-W35 AromaticContact CG-CE3 3.52Å; Y18-W35 HydrophobicContact CG-CE3 3.52Å; Y18-W35 AromaticContact CG-CZ3 3.96Å; Y18-W35 HydrophobicContact CG-CZ3 3.96Å; Y18-W35 AromaticContact CZ-CE3 3.78Å; Y18-W35 VanDerWaalsContact N-CE3 3.33Å; Y18-W35 VanDerWaalsContact N-CZ3 3.35Å; W35-V37 VanDerWaalsContact CD1-CG2 3.44Å; W35-V37 VanDerWaalsContact NE1-CG2 3.28Å; W35-Y47 CarbonylContact O-C 3.53Å; W35-Y47 VanDerWaalsContact O-CA 3.26Å; W35-Y47 WeakPolarHBondContact O-CA 3.37Å; W35-Y48 PolarHBondContact N-O 3.18Å; W35-Y48 PolarHBondContact O-N 2.87Å; W35-E51 HydrophobicContact CD2-CB 4Å; W35-E51 HydrophobicContact CD2-CG 4.22Å; W35-E51 HydrophobicContact CE3-CB 4.47Å; W35-E51 HydrophobicContact CG-CB 4.11Å; W35-E51 HydrophobicContact CH2-CG 4.5Å; W35-E51 HydrophobicContact CZ2-CG 3.94Å
36	F	90.5	Very high	79	Confident	3 Å²	3	68.8 Å²	68.8	1%	0.013	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	137.8	178.5	-75.1	-103.7	0	0	0	109.4	A16 G17 L19 R34 V45 Y46 Y47 I60 L88 W99	A16-F36 CarbonylContact C-O 3.48Å; A16-F36 VanDerWaalsContact CA-O 3.22Å; A16-F36 WeakPolarHBondContact CA-O 3.38Å; G17-F36 PolarHBondContact N-O 3.22Å; G17-F36 PolarHBondContact O-N 2.72Å; L19-F36 HydrophobicContact CB-CD2 3.7Å; L19-F36 HydrophobicContact CB-CE2 3.87Å; L19-F36 HydrophobicContact CD1-CB 4.19Å; L19-F36 HydrophobicContact CD1-CD2 3.85Å; L19-F36 HydrophobicContact CD1-CE2 4.38Å; L19-F36 HydrophobicContact CD1-CG 3.96Å; L19-F36 HydrophobicContact CG-CD2 4.09Å; R34-F36 HydrophobicContact CB-CD2 4.34Å; R34-F36 HydrophobicContact CB-CE2 3.81Å; F36-V45 HydrophobicContact CD1-CG1 4.04Å; F36-Y46 WeakPolarHBondContact CA-O 3.42Å; F36-Y47 AromaticContact CE1-CD1 3.95Å; F36-Y47 HydrophobicContact CE1-CD1 3.95Å; F36-Y47 AromaticContact CE1-CG 3.98Å; F36-Y47 HydrophobicContact CE1-CG 3.98Å; F36-Y47 HydrophobicContact CZ-CD1 4.43Å; F36-Y47 HydrophobicContact CZ-CG 4.15Å; F36-I60 HydrophobicContact CE1-CD1 4.32Å; F36-L88 HydrophobicContact CD1-CD1 4.43Å; F36-L88 HydrophobicContact CE1-CD1 3.89Å; F36-L88 HydrophobicContact CE1-CD2 4.18Å; F36-L88 HydrophobicContact CE2-CD2 3.96Å; F36-L88 HydrophobicContact CZ-CD1 3.96Å; F36-L88 HydrophobicContact CZ-CD2 3.46Å; F36-L88 VanDerWaalsContact CZ-CD2 3.46Å; F36-L88 HydrophobicContact CZ-CG 4.4Å; F36-W99 HydrophobicContact CB-CH2 3.68Å; F36-W99 HydrophobicContact CB-CZ2 4.23Å; F36-W99 HydrophobicContact CB-CZ3 4.25Å
37	V	88.5	Confident	80.5	Confident	18 Å²	18	68.3 Å²	68.3	11%	0.109	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124	179.7	-174.9	0	0	0	0	108.7	A16 W35 E39 Y46 Y48	A16-V37 HydrophobicContact CB-CB 4.44Å; A16-V37 HydrophobicContact CB-CG1 4.37Å; A16-V37 HydrophobicContact CB-CG2 4.11Å; W35-V37 VanDerWaalsContact CD1-CG2 3.44Å; W35-V37 VanDerWaalsContact NE1-CG2 3.28Å; V37-E39 HydrophobicContact CG1-CG 4.04Å; V37-Y46 PolarHBondContact N-O 3.06Å; V37-Y46 PolarHBondContact O-N 2.78Å; V37-Y46 VanDerWaalsContact O-N 3.11Å; V37-Y48 HydrophobicContact CB-CE2 4.07Å; V37-Y48 HydrophobicContact CG2-CD2 3.94Å; V37-Y48 HydrophobicContact CG2-CE2 3.69Å
38	L	84.8	Confident	81.9	Confident	7 Å²	7	62.9 Å²	62.9	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	104.1	169.4	-170.4	73.2	0	0	0	107.3	C14 F15 V45 L62 A102 L103 Q106	C14-L38 WeakPolarHBondContact CA-O 3.44Å; F15-L38 HydrophobicContact CB-CB 4.15Å; F15-L38 HydrophobicContact CB-CD2 4.22Å; F15-L38 PolarHBondContact N-O 3.08Å; F15-L38 VanDerWaalsContact O-CB 3.25Å; F15-L38 WeakPolarHBondContact O-CB 3.32Å; F15-L38 PolarHBondContact O-N 3.44Å; L38-V45 HydrophobicContact CD1-CG2 3.8Å; L38-L62 HydrophobicContact CD1-CD1 3.68Å; L38-A102 HydrophobicContact CD2-CB 3.93Å; L38-L103 HydrophobicContact CD1-CD2 4.05Å; L38-Q106 HydrophobicContact CD1-CB 4.09Å; L38-Q106 HydrophobicContact CD1-CG 3.81Å; L38-Q106 HydrophobicContact CD2-CB 4.03Å; L38-Q106 HydrophobicContact CD2-CG 4.43Å; L38-Q106 HydrophobicContact CG-CB 4.33Å; L38-Q106 HydrophobicContact CG-CG 4.18Å
39	E	81	Confident	83.3	Confident	86 Å²	86	64.3 Å²	64.3	40%	0.402	29%	0.291	S	S	.	.			trans	-81.5	148.5	173.4	-68.8	180	167.3	0	0	110.2	V37 A42 Q106	V37-E39 HydrophobicContact CG1-CG 4.04Å; E39-A42 HydrophobicContact CB-CB 3.82Å; E39-A42 WeakPolarHBondContact O-CB 3.29Å; E39-A42 PolarHBondContact O-N 3.47Å; E39-Q106 PolarHBondContact O-NE2 3.3Å
40	D	72.5	Confident	84.4	Confident	91 Å²	91	60.9 Å²	60.9	49%	0.487	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	140.9	173.9	-72.2	-26.4	0	0	0	110.3	N13 A42	N13-D40 WeakPolarHBondContact CB-OD2 3.39Å; D40-A42 PolarHBondContact O-N 2.93Å
41	D	68	Low	84.7	Confident	101 Å²	101	63.2 Å²	63.2	54%	0.54	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	4.1	-175	-70.9	-35.8	0	0	0	117.4	H43 Q106	D41-H43 PolarHBondContact O-N 3.34Å; D41-Q106 VanDerWaalsContact CA-NE2 3.3Å
42	A	77.2	Confident	84.6	Confident	17 Å²	17	68.8 Å²	68.8	14%	0.14	31%	0.305	C	S	.	.			trans	-73.3	130.8	176	0	0	0	0	0	112.3	E39 D40 F44 Q106 C110	E39-A42 HydrophobicContact CB-CB 3.82Å; E39-A42 WeakPolarHBondContact O-CB 3.29Å; E39-A42 PolarHBondContact O-N 3.47Å; D40-A42 PolarHBondContact O-N 2.93Å; A42-F44 PolarHBondContact O-N 2.68Å; A42-Q106 VanDerWaalsContact N-NE2 3.1Å; A42-Q106 PolarHBondContact O-NE2 3.07Å; A42-Q106 VanDerWaalsContact O-NE2 3.16Å; A42-C110 VanDerWaalsContact C-SG 3.58Å; A42-C110 PolarHBondContact O-SG 2.94Å
43	H	82.5	Confident	84.2	Confident	55 Å²	55	65.3 Å²	65.3	26%	0.255	30%	0.297	S	S	.	.	S	Bend	trans	-71.2	-6.9	172.6	-61.5	-38.6	0	0	0	114.3	D41 Y61 L62 P63 C110 Q114	D41-H43 PolarHBondContact O-N 3.34Å; H43-Y61 HydrophobicContact CB-CE2 4.35Å; H43-L62 PolarHBondContact O-N 3.09Å; H43-P63 WeakPolarHBondContact O-CD 3.37Å; H43-C110 WeakPolarHBondContact ND1-CB 3.29Å; H43-C110 PolarHBondContact ND1-SG 3.02Å; H43-Q114 PolarHBondContact CE1-NE2 3.45Å
44	F	86.9	Confident	83.6	Confident	50 Å²	50	66 Å²	66	22%	0.219	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.8	-173.2	-65.2	-82.4	0	0	0	111.3	A42 Y46 R59 I60 Y61	A42-F44 PolarHBondContact O-N 2.68Å; F44-Y46 HydrophobicContact CB-CE1 4.24Å; F44-Y46 HydrophobicContact CB-CE2 4Å; F44-R59 HydrophobicContact CB-CB 4.2Å; F44-R59 HydrophobicContact CD1-CB 4.05Å; F44-R59 HydrophobicContact CD1-CG 3.94Å; F44-R59 HydrophobicContact CE1-CG 4.33Å; F44-R59 HydrophobicContact CG-CB 4.38Å; F44-I60 CarbonylContact C-O 3.57Å; F44-I60 VanDerWaalsContact CA-O 3.25Å; F44-I60 WeakPolarHBondContact CA-O 3.44Å; F44-Y61 HydrophobicContact CD1-CD2 4.08Å; F44-Y61 AromaticContact CE1-CD2 3.49Å; F44-Y61 HydrophobicContact CE1-CD2 3.49Å; F44-Y61 VanDerWaalsContact CE1-CD2 3.49Å; F44-Y61 HydrophobicContact CE1-CE2 4.49Å; F44-Y61 HydrophobicContact CE1-CG 4.11Å; F44-Y61 HydrophobicContact CE2-CD2 4.4Å; F44-Y61 AromaticContact CZ-CD2 3.67Å; F44-Y61 HydrophobicContact CZ-CD2 3.67Å; F44-Y61 HydrophobicContact CZ-CE2 4.26Å
45	V	88.8	Confident	83.1	Confident	1 Å²	1	70 Å²	70	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.2	161.8	-170.5	0	0	0	0	108.3	F36 L38 R59 I60 L62 L103	F36-V45 HydrophobicContact CD1-CG1 4.04Å; L38-V45 HydrophobicContact CD1-CG2 3.8Å; V45-R59 CarbonylContact O-C 3.52Å; V45-R59 VanDerWaalsContact O-CA 3.23Å; V45-R59 WeakPolarHBondContact O-CA 3.45Å; V45-I60 HydrophobicContact CB-CB 4.3Å; V45-I60 PolarHBondContact N-O 3.04Å; V45-I60 PolarHBondContact O-N 3.4Å; V45-L62 HydrophobicContact CG2-CD1 3.74Å; V45-L62 HydrophobicContact CG2-CD2 3.46Å; V45-L62 VanDerWaalsContact CG2-CD2 3.46Å; V45-L62 HydrophobicContact CG2-CG 3.62Å; V45-L103 HydrophobicContact CG2-CD2 3.61Å
46	Y	88.5	Confident	82.8	Confident	54 Å²	54	71.1 Å²	71.1	21%	0.212	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	140.6	176.3	-63.9	-77.1	0	0	0	110.5	F36 V37 F44 P56 R59	F36-Y46 WeakPolarHBondContact CA-O 3.42Å; V37-Y46 PolarHBondContact N-O 3.06Å; V37-Y46 PolarHBondContact O-N 2.78Å; V37-Y46 VanDerWaalsContact O-N 3.11Å; F44-Y46 HydrophobicContact CB-CE1 4.24Å; F44-Y46 HydrophobicContact CB-CE2 4Å; Y46-P56 HydrophobicContact CD1-CB 3.87Å; Y46-P56 HydrophobicContact CD1-CG 3.89Å; Y46-P56 HydrophobicContact CE1-CG 4.47Å; Y46-P56 HydrophobicContact CG-CB 4.38Å; Y46-R59 HydrophobicContact CD1-CB 3.8Å; Y46-R59 HydrophobicContact CE1-CB 3.77Å
47	Y	89.3	Confident	82.5	Confident	25 Å²	25	75.1 Å²	75.1	10%	0.098	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.8	172.9	62.4	-97.3	0	0	0	111.8	W35 F36 P56 L57 G58 I60 Y86	W35-Y47 CarbonylContact O-C 3.53Å; W35-Y47 VanDerWaalsContact O-CA 3.26Å; W35-Y47 WeakPolarHBondContact O-CA 3.37Å; F36-Y47 AromaticContact CE1-CD1 3.95Å; F36-Y47 HydrophobicContact CE1-CD1 3.95Å; F36-Y47 AromaticContact CE1-CG 3.98Å; F36-Y47 HydrophobicContact CE1-CG 3.98Å; F36-Y47 HydrophobicContact CZ-CD1 4.43Å; F36-Y47 HydrophobicContact CZ-CG 4.15Å; Y47-P56 CarbonylContact O-C 3.55Å; Y47-P56 WeakPolarHBondContact O-CA 3.27Å; Y47-L57 HydrophobicContact CD2-CB 3.65Å; Y47-L57 HydrophobicContact CD2-CD1 4.37Å; Y47-L57 HydrophobicContact CE2-CB 3.44Å; Y47-L57 VanDerWaalsContact CE2-CB 3.44Å; Y47-L57 WeakPolarHBondContact O-CB 3.47Å; Y47-L57 PolarHBondContact O-N 3.01Å; Y47-G58 VanDerWaalsContact CE1-C 3.44Å; Y47-G58 VanDerWaalsContact CZ-CA 3.4Å; Y47-G58 PolarHBondContact N-O 3.46Å; Y47-G58 VanDerWaalsContact N-O 3.13Å; Y47-G58 WeakPolarHBondContact OH-CA 3.42Å; Y47-I60 HydrophobicContact CD1-CG1 4.42Å; Y47-I60 HydrophobicContact CE1-CG1 4.32Å; Y47-Y86 HydrophobicContact CE1-CE1 4.38Å
48	Y	89.5	Confident	82.3	Confident	32 Å²	32	75.1 Å²	75.1	13%	0.125	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	161.1	-171.4	-57.6	-100.4	0	0	0	110.4	R34 W35 V37 D53 Q55 P56	R34-Y48 WeakPolarHBondContact CA-O 3.45Å; R34-Y48 WeakPolarHBondContact CB-O 3.27Å; W35-Y48 PolarHBondContact N-O 3.18Å; W35-Y48 PolarHBondContact O-N 2.87Å; V37-Y48 HydrophobicContact CB-CE2 4.07Å; V37-Y48 HydrophobicContact CG2-CD2 3.94Å; V37-Y48 HydrophobicContact CG2-CE2 3.69Å; Y48-D53 HydrophobicContact CD1-CB 4.16Å; Y48-D53 WeakPolarHBondContact CD1-O 3.49Å; Y48-Q55 VanDerWaalsContact CD1-O 3.29Å; Y48-Q55 WeakPolarHBondContact CD1-O 3.25Å; Y48-P56 HydrophobicContact CD1-CB 4.22Å; Y48-P56 VanDerWaalsContact CE1-CA 3.5Å; Y48-P56 HydrophobicContact CE1-CB 3.77Å; Y48-P56 HydrophobicContact CE1-CG 4.37Å; Y48-P56 VanDerWaalsContact CE1-N 3.31Å; Y48-P56 HydrophobicContact CE2-CB 4.39Å
49	R	86.2	Confident	82.5	Confident	178 Å²	178	82.1 Å²	82.1	67%	0.672	39%	0.387	S	S	*	.	S	Bend	trans	-72.8	-42.4	175.3	-164.4	179.4	179.2	166	-1.2	110.3	D53 L57	R49-D53 VanDerWaalsContact CB-OD2 3.25Å; R49-D53 WeakPolarHBondContact CB-OD2 3.36Å; R49-D53 PolarHBondContact N-OD2 2.96Å; R49-L57 HydrophobicContact CB-CD1 3.88Å; R49-L57 HydrophobicContact CB-CD2 4.5Å; R49-L57 HydrophobicContact CB-CG 4.33Å
50	V	86.2	Confident	82.8	Confident	67 Å²	67	78 Å²	78	41%	0.406	37%	0.368	S	S	.	.	S	Bend	trans	-138.7	153.3	177.4	-167.4	0	0	0	0	109.9	K52 D53	V50-K52 PolarHBondContact O-N 2.91Å; V50-K52 VanDerWaalsContact O-N 3.16Å; V50-D53 PolarHBondContact N-OD2 3.44Å; V50-D53 WeakPolarHBondContact O-CB 3.3Å; V50-D53 PolarHBondContact O-N 3.45Å
51	E	80.5	Confident	83.5	Confident	96 Å²	96	77 Å²	77	45%	0.449	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-32.6	178.5	-179.8	-176.9	178.8	0	0	114.2	Y18 W35 D53	Y18-E51 HydrophobicContact CE2-CB 4.48Å; Y18-E51 WeakPolarHBondContact OH-CB 3.47Å; Y18-E51 PolarHBondContact OH-N 3.41Å; W35-E51 HydrophobicContact CD2-CB 4Å; W35-E51 HydrophobicContact CD2-CG 4.22Å; W35-E51 HydrophobicContact CE3-CB 4.47Å; W35-E51 HydrophobicContact CG-CB 4.11Å; W35-E51 HydrophobicContact CH2-CG 4.5Å; W35-E51 HydrophobicContact CZ2-CG 3.94Å; E51-D53 VanDerWaalsContact C-N 3.32Å
52	K	79.6	Confident	84.4	Confident	191 Å²	191	72.2 Å²	72.2	83%	0.83	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.2	-179.8	-62.5	-173.9	179.7	-176.9	0	114.1	V50	V50-K52 PolarHBondContact O-N 2.91Å; V50-K52 VanDerWaalsContact O-N 3.16Å
53	D	79.6	Confident	84.6	Confident	68 Å²	68	72.6 Å²	72.6	36%	0.364	33%	0.333	S	S	.	.			trans	-73.7	134.7	179.5	-76.3	-30.6	0	0	0	111.2	Y48 R49 V50 E51	Y48-D53 HydrophobicContact CD1-CB 4.16Å; Y48-D53 WeakPolarHBondContact CD1-O 3.49Å; R49-D53 VanDerWaalsContact CB-OD2 3.25Å; R49-D53 WeakPolarHBondContact CB-OD2 3.36Å; R49-D53 PolarHBondContact N-OD2 2.96Å; V50-D53 PolarHBondContact N-OD2 3.44Å; V50-D53 WeakPolarHBondContact O-CB 3.3Å; V50-D53 PolarHBondContact O-N 3.45Å; E51-D53 VanDerWaalsContact C-N 3.32Å
54	K	76	Confident	84.5	Confident	181 Å²	181	72.2 Å²	72.2	79%	0.787	34%	0.336	S	S	*	.	S	Bend	trans	-82.9	-23.7	176.8	-62.9	-172.5	178.2	-172.7	0	113.4
55	Q	78.1	Confident	84.5	Confident	117 Å²	117	69.9 Å²	69.9	55%	0.547	33%	0.326	S	S	.	.	S	Bend	trans	-106.4	125.2	-176.7	-77.8	-178.3	-32.8	0	0	110.8	Y48	Y48-Q55 VanDerWaalsContact CD1-O 3.29Å; Y48-Q55 WeakPolarHBondContact CD1-O 3.25Å
56	P	84.6	Confident	84.3	Confident	55 Å²	55	73.7 Å²	73.7	36%	0.357	35%	0.346	S	S	.	.			trans	-69.7	138.9	174	29.2	-32.7	0	0	0	109.9	Y46 Y47 Y48 G58	Y46-P56 HydrophobicContact CD1-CB 3.87Å; Y46-P56 HydrophobicContact CD1-CG 3.89Å; Y46-P56 HydrophobicContact CE1-CG 4.47Å; Y46-P56 HydrophobicContact CG-CB 4.38Å; Y47-P56 CarbonylContact O-C 3.55Å; Y47-P56 WeakPolarHBondContact O-CA 3.27Å; Y48-P56 HydrophobicContact CD1-CB 4.22Å; Y48-P56 VanDerWaalsContact CE1-CA 3.5Å; Y48-P56 HydrophobicContact CE1-CB 3.77Å; Y48-P56 HydrophobicContact CE1-CG 4.37Å; Y48-P56 VanDerWaalsContact CE1-N 3.31Å; Y48-P56 HydrophobicContact CE2-CB 4.39Å; P56-G58 PolarHBondContact O-N 3.24Å
57	L	83.5	Confident	84.2	Confident	87 Å²	87	71.1 Å²	71.1	46%	0.455	34%	0.336	S	S	.	.	S	Bend	trans	-67.9	-24.5	170.2	-69.7	173.5	0	0	0	111.6	R34 Y47 R49	R34-L57 HydrophobicContact CG-CD1 4.46Å; Y47-L57 HydrophobicContact CD2-CB 3.65Å; Y47-L57 HydrophobicContact CD2-CD1 4.37Å; Y47-L57 HydrophobicContact CE2-CB 3.44Å; Y47-L57 VanDerWaalsContact CE2-CB 3.44Å; Y47-L57 WeakPolarHBondContact O-CB 3.47Å; Y47-L57 PolarHBondContact O-N 3.01Å; R49-L57 HydrophobicContact CB-CD1 3.88Å; R49-L57 HydrophobicContact CB-CD2 4.5Å; R49-L57 HydrophobicContact CB-CG 4.33Å
58	G	85.9	Confident	84	Confident	18 Å²	18	71.2 Å²	71.2	19%	0.186	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-178.9	174	0	0	0	0	0	112.2	Y47 P56	Y47-G58 VanDerWaalsContact CE1-C 3.44Å; Y47-G58 VanDerWaalsContact CZ-CA 3.4Å; Y47-G58 PolarHBondContact N-O 3.46Å; Y47-G58 VanDerWaalsContact N-O 3.13Å; Y47-G58 WeakPolarHBondContact OH-CA 3.42Å; P56-G58 PolarHBondContact O-N 3.24Å
59	R	87.6	Confident	83.9	Confident	154 Å²	154	70 Å²	70	58%	0.581	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.6	-174.1	63.3	-177.1	177.5	-177.3	-1.3	111.2	F44 V45 Y46	F44-R59 HydrophobicContact CB-CB 4.2Å; F44-R59 HydrophobicContact CD1-CB 4.05Å; F44-R59 HydrophobicContact CD1-CG 3.94Å; F44-R59 HydrophobicContact CE1-CG 4.33Å; F44-R59 HydrophobicContact CG-CB 4.38Å; V45-R59 CarbonylContact O-C 3.52Å; V45-R59 VanDerWaalsContact O-CA 3.23Å; V45-R59 WeakPolarHBondContact O-CA 3.45Å; Y46-R59 HydrophobicContact CD1-CB 3.8Å; Y46-R59 HydrophobicContact CE1-CB 3.77Å
60	I	87.9	Confident	83.7	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.9	176.4	-53.7	175.8	0	0	0	108.1	F36 F44 V45 Y47 L62 I79 Y86	F36-I60 HydrophobicContact CE1-CD1 4.32Å; F44-I60 CarbonylContact C-O 3.57Å; F44-I60 VanDerWaalsContact CA-O 3.25Å; F44-I60 WeakPolarHBondContact CA-O 3.44Å; V45-I60 HydrophobicContact CB-CB 4.3Å; V45-I60 PolarHBondContact N-O 3.04Å; V45-I60 PolarHBondContact O-N 3.4Å; Y47-I60 HydrophobicContact CD1-CG1 4.42Å; Y47-I60 HydrophobicContact CE1-CG1 4.32Å; I60-L62 PolarHBondContact O-N 3.03Å; I60-I79 HydrophobicContact CD1-CD1 4.21Å; I60-I79 HydrophobicContact CG2-CG2 4.01Å; I60-Y86 HydrophobicContact CD1-CD1 3.97Å; I60-Y86 HydrophobicContact CD1-CD2 3.83Å; I60-Y86 HydrophobicContact CD1-CE1 4.25Å; I60-Y86 HydrophobicContact CD1-CE2 4.11Å; I60-Y86 HydrophobicContact CD1-CG 3.76Å; I60-Y86 HydrophobicContact CG1-CD1 4.41Å; I60-Y86 HydrophobicContact CG1-CD2 4.13Å; I60-Y86 HydrophobicContact CG1-CE1 4.19Å; I60-Y86 HydrophobicContact CG1-CE2 3.88Å; I60-Y86 HydrophobicContact CG1-CG 4.39Å; I60-Y86 HydrophobicContact CG2-CD2 4.33Å; I60-Y86 HydrophobicContact CG2-CE2 4.15Å
61	Y	88	Confident	83.2	Confident	70 Å²	70	61.7 Å²	61.7	28%	0.275	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	110.7	-179	-175.6	-118.2	0	0	0	110.4	H43 F44 P63 S64 S81	H43-Y61 HydrophobicContact CB-CE2 4.35Å; F44-Y61 HydrophobicContact CD1-CD2 4.08Å; F44-Y61 AromaticContact CE1-CD2 3.49Å; F44-Y61 HydrophobicContact CE1-CD2 3.49Å; F44-Y61 VanDerWaalsContact CE1-CD2 3.49Å; F44-Y61 HydrophobicContact CE1-CE2 4.49Å; F44-Y61 HydrophobicContact CE1-CG 4.11Å; F44-Y61 HydrophobicContact CE2-CD2 4.4Å; F44-Y61 AromaticContact CZ-CD2 3.67Å; F44-Y61 HydrophobicContact CZ-CD2 3.67Å; F44-Y61 HydrophobicContact CZ-CE2 4.26Å; Y61-P63 HydrophobicContact CD1-CB 4.48Å; Y61-P63 HydrophobicContact CD2-CG 4.31Å; Y61-P63 HydrophobicContact CE1-CB 3.74Å; Y61-P63 HydrophobicContact CE1-CG 4Å; Y61-P63 HydrophobicContact CE2-CB 4.35Å; Y61-P63 HydrophobicContact CE2-CG 3.69Å; Y61-S64 WeakPolarHBondContact CD1-OG 3.33Å; Y61-S81 PolarHBondContact O-OG 3.45Å
62	L	86.5	Confident	83	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	-69.6	-40	-173.5	-76.1	166.9	0	0	0	114.9	L38 H43 V45 I60 S64 A65 F67 L103 Q106 R107	L38-L62 HydrophobicContact CD1-CD1 3.68Å; H43-L62 PolarHBondContact O-N 3.09Å; V45-L62 HydrophobicContact CG2-CD1 3.74Å; V45-L62 HydrophobicContact CG2-CD2 3.46Å; V45-L62 VanDerWaalsContact CG2-CD2 3.46Å; V45-L62 HydrophobicContact CG2-CG 3.62Å; I60-L62 PolarHBondContact O-N 3.03Å; L62-S64 PolarHBondContact O-N 3.43Å; L62-A65 WeakPolarHBondContact O-CB 3.47Å; L62-A65 PolarHBondContact O-N 3.03Å; L62-F67 HydrophobicContact CD2-CZ 4.15Å; L62-L103 HydrophobicContact CD2-CD2 3.85Å; L62-Q106 HydrophobicContact CD1-CB 4.26Å; L62-Q106 HydrophobicContact CD1-CG 3.61Å; L62-R107 WeakPolarHBondContact O-CD 3.42Å; L62-R107 WeakPolarHBondContact O-CG 3.42Å
63	P	81.3	Confident	82.9	Confident	25 Å²	25	58.1 Å²	58.1	16%	0.162	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-29	-175.3	-28.5	36.9	0	0	0	114.7	H43 Y61 C110 I111	H43-P63 WeakPolarHBondContact O-CD 3.37Å; Y61-P63 HydrophobicContact CD1-CB 4.48Å; Y61-P63 HydrophobicContact CD2-CG 4.31Å; Y61-P63 HydrophobicContact CE1-CB 3.74Å; Y61-P63 HydrophobicContact CE1-CG 4Å; Y61-P63 HydrophobicContact CE2-CB 4.35Å; Y61-P63 HydrophobicContact CE2-CG 3.69Å; P63-C110 HydrophobicContact CG-CB 4.32Å; P63-I111 HydrophobicContact CB-CG1 4.18Å
64	S	79.9	Confident	82.6	Confident	46 Å²	46	63.2 Å²	63.2	32%	0.322	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	3.8	174.8	72.3	0	0	0	0	113.9	Y61 L62 N82	Y61-S64 WeakPolarHBondContact CD1-OG 3.33Å; L62-S64 PolarHBondContact O-N 3.43Å; S64-N82 PolarHBondContact OG-OD1 3.39Å
65	A	86.2	Confident	82.8	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	28%	0.277	C	S	.	.			trans	-79.4	139.9	-174.5	0	0	0	0	0	112.6	L62 F67 I79 H80 R107	L62-A65 WeakPolarHBondContact O-CB 3.47Å; L62-A65 PolarHBondContact O-N 3.03Å; A65-F67 HydrophobicContact CB-CE1 3.97Å; A65-F67 HydrophobicContact CB-CZ 3.92Å; A65-I79 HydrophobicContact CB-CG2 4.03Å; A65-H80 CarbonylContact C-O 3.58Å; A65-H80 VanDerWaalsContact CA-O 3.25Å; A65-H80 WeakPolarHBondContact CA-O 3.48Å; A65-R107 WeakPolarHBondContact O-CD 3.45Å; A65-R107 PolarHBondContact O-NH1 3.01Å
66	I	84.7	Confident	83.2	Confident	81 Å²	81	50.4 Å²	50.4	42%	0.415	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.9	173.9	-57.4	168.3	0	0	0	108.7	H80 L435	I66-H80 HydrophobicContact CB-CB 4.28Å; I66-H80 PolarHBondContact N-O 3.42Å; I66-H80 PolarHBondContact O-N 2.91Å; I66-L435 HydrophobicContact CG1-CD1 4.49Å; I66-L435 HydrophobicContact CG2-CD1 4.33Å
67	F	88	Confident	83.4	Confident	1 Å²	1	47.8 Å²	47.8	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.3	-174.8	-46.5	-67.9	0	0	0	112	L62 A65 E78 I79 L100 L103 Q104 F427	L62-F67 HydrophobicContact CD2-CZ 4.15Å; A65-F67 HydrophobicContact CB-CE1 3.97Å; A65-F67 HydrophobicContact CB-CZ 3.92Å; F67-E78 WeakPolarHBondContact CA-O 3.28Å; F67-I79 HydrophobicContact CD1-CB 4.39Å; F67-I79 HydrophobicContact CD1-CG1 4.07Å; F67-I79 HydrophobicContact CD1-CG2 3.99Å; F67-I79 HydrophobicContact CE1-CG1 4.32Å; F67-I79 HydrophobicContact CE1-CG2 3.76Å; F67-L100 HydrophobicContact CB-CD2 3.76Å; F67-L100 HydrophobicContact CG-CD2 4.45Å; F67-L103 HydrophobicContact CD1-CB 4.39Å; F67-L103 HydrophobicContact CD1-CD1 4.3Å; F67-L103 HydrophobicContact CE1-CB 3.78Å; F67-L103 HydrophobicContact CE1-CD1 4.04Å; F67-L103 HydrophobicContact CE1-CG 4.38Å; F67-L103 HydrophobicContact CE2-CB 4.08Å; F67-L103 HydrophobicContact CZ-CB 3.62Å; F67-Q104 HydrophobicContact CD2-CG 3.77Å; F67-Q104 HydrophobicContact CE2-CG 4.11Å; F67-F427 HydrophobicContact CB-CZ 4.37Å
68	S	84.9	Confident	83.6	Confident	27 Å²	27	46.5 Å²	46.5	19%	0.189	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	166.3	175.7	66.9	0	0	0	0	110.9	F77 E78	S68-F77 CarbonylContact O-C 3.47Å; S68-F77 WeakPolarHBondContact O-CA 3.36Å; S68-E78 PolarHBondContact N-O 3.28Å; S68-E78 VanDerWaalsContact N-O 3.09Å; S68-E78 PolarHBondContact O-N 2.94Å; S68-E78 PolarHBondContact OG-OE2 2.9Å
69	F	86.6	Confident	83.9	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.022	22%	0.221	C	C	.	.			trans	-152.4	150.2	172.4	70.5	-92.9	0	0	0	110.4	T76 F77 F97 L100 Q424 F427	F69-T76 WeakPolarHBondContact CB-O 3.21Å; F69-F77 HydrophobicContact CB-CB 3.9Å; F69-F97 AromaticContact CE1-CE1 3.92Å; F69-F97 HydrophobicContact CE1-CE1 3.92Å; F69-F97 HydrophobicContact CE2-CZ 4.46Å; F69-F97 AromaticContact CZ-CE1 3.78Å; F69-F97 HydrophobicContact CZ-CE1 3.78Å; F69-F97 AromaticContact CZ-CZ 4Å; F69-F97 HydrophobicContact CZ-CZ 4Å; F69-L100 HydrophobicContact CD1-CD1 3.8Å; F69-L100 HydrophobicContact CE1-CD1 4.37Å; F69-Q424 HydrophobicContact CD2-CG 4.34Å; F69-Q424 HydrophobicContact CE1-CB 4.45Å; F69-Q424 HydrophobicContact CE1-CG 4.32Å; F69-Q424 HydrophobicContact CE2-CB 3.78Å; F69-Q424 HydrophobicContact CE2-CG 3.99Å; F69-Q424 VanDerWaalsContact CZ-CA 3.42Å; F69-Q424 HydrophobicContact CZ-CB 3.72Å; F69-Q424 HydrophobicContact CZ-CG 4Å; F69-Q424 VanDerWaalsContact O-CD 3.3Å; F69-Q424 WeakPolarHBondContact O-CG 3.33Å; F69-Q424 PolarHBondContact O-NE2 3.1Å; F69-F427 AromaticContact CD1-CD1 3.88Å; F69-F427 HydrophobicContact CD1-CD1 3.88Å; F69-F427 HydrophobicContact CD1-CE1 4.22Å; F69-F427 HydrophobicContact CD1-CG 4.3Å; F69-F427 HydrophobicContact CE1-CB 3.74Å; F69-F427 AromaticContact CE1-CD1 3.65Å; F69-F427 HydrophobicContact CE1-CD1 3.65Å; F69-F427 HydrophobicContact CE1-CD2 4.38Å; F69-F427 HydrophobicContact CE1-CE1 4.39Å; F69-F427 AromaticContact CE1-CG 3.66Å; F69-F427 HydrophobicContact CE1-CG 3.66Å; F69-F427 HydrophobicContact CZ-CB 4.39Å
70	D	81.4	Confident	83.8	Confident	49 Å²	49	41.4 Å²	41.4	26%	0.262	21%	0.207	S	C	.	.			trans	-103.2	122	176.3	-177.2	-1.8	0	0	0	110.6	K72 Q73	D70-K72 PolarHBondContact O-N 3.26Å; D70-K72 WeakPolarHBondContact OD1-CB 3.39Å; D70-K72 PolarHBondContact OD1-N 3.38Å; D70-Q73 PolarHBondContact O-N 2.99Å; D70-Q73 VanDerWaalsContact O-O 3.1Å
71	P	75.7	Confident	83.7	Confident	22 Å²	22	41.7 Å²	41.7	14%	0.143	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.8	179.3	26.8	-35.3	0	0	0	114.2	Q73 Y421 Q424	P71-Q73 PolarHBondContact O-N 3.1Å; P71-Y421 HydrophobicContact CG-CD1 3.42Å; P71-Y421 VanDerWaalsContact CG-CD1 3.42Å; P71-Y421 HydrophobicContact CG-CD2 4.25Å; P71-Y421 HydrophobicContact CG-CE1 3.4Å; P71-Y421 VanDerWaalsContact CG-CE1 3.4Å; P71-Y421 HydrophobicContact CG-CE2 4.26Å; P71-Y421 HydrophobicContact CG-CG 3.83Å; P71-Q424 VanDerWaalsContact CD-CD 3.43Å; P71-Q424 HydrophobicContact CG-CB 4.46Å
72	K	76.6	Confident	83.2	Confident	141 Å²	141	44 Å²	44	61%	0.613	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-29.3	174.6	-73.8	175.9	170.7	168.8	0	112.3	D70 L417 Y421	D70-K72 PolarHBondContact O-N 3.26Å; D70-K72 WeakPolarHBondContact OD1-CB 3.39Å; D70-K72 PolarHBondContact OD1-N 3.38Å; K72-L417 HydrophobicContact CG-CD2 4.17Å; K72-Y421 WeakPolarHBondContact CE-OH 3.4Å
73	Q	77.2	Confident	82.8	Confident	71 Å²	71	47.7 Å²	47.7	33%	0.332	26%	0.264	S	S	.	.	S	Bend	trans	-99.7	121.3	-179.2	-63.1	-172.1	16.1	0	0	109.5	D70 P71 S75 T76	D70-Q73 PolarHBondContact O-N 2.99Å; D70-Q73 VanDerWaalsContact O-O 3.1Å; P71-Q73 PolarHBondContact O-N 3.1Å; Q73-S75 PolarHBondContact O-N 3.36Å; Q73-T76 HydrophobicContact CB-CG2 4.31Å; Q73-T76 WeakPolarHBondContact CB-OG1 3.43Å; Q73-T76 PolarHBondContact OE1-OG1 2.88Å
74	Q	74.4	Confident	83	Confident	176 Å²	176	52.1 Å²	52.1	82%	0.822	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	125.6	-179.4	-70	-176.8	-6.5	0	0	110.3	T76	Q74-T76 PolarHBondContact O-N 2.82Å; Q74-T76 VanDerWaalsContact O-N 3.13Å
75	S	79.2	Confident	83.3	Confident	18 Å²	18	53.4 Å²	53.4	13%	0.126	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	12.9	173.6	-51	0	0	0	0	117.1	Q73 A90 E93	Q73-S75 PolarHBondContact O-N 3.36Å; S75-A90 WeakPolarHBondContact CB-O 3.08Å; S75-A90 WeakPolarHBondContact O-CB 3.43Å; S75-A90 PolarHBondContact O-N 3.32Å; S75-E93 PolarHBondContact OG-N 3.48Å
76	T	86.2	Confident	83.3	Confident	10 Å²	10	55 Å²	55	6%	0.061	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	152.4	173.1	61.4	0	0	0	0	112.5	I22 F69 Q73 Q74 L88 E89 R96	I22-T76 HydrophobicContact CD1-CG2 4.33Å; F69-T76 WeakPolarHBondContact CB-O 3.21Å; Q73-T76 HydrophobicContact CB-CG2 4.31Å; Q73-T76 WeakPolarHBondContact CB-OG1 3.43Å; Q73-T76 PolarHBondContact OE1-OG1 2.88Å; Q74-T76 PolarHBondContact O-N 2.82Å; Q74-T76 VanDerWaalsContact O-N 3.13Å; T76-L88 CarbonylContact C-O 3.57Å; T76-L88 WeakPolarHBondContact CA-O 3.39Å; T76-E89 HydrophobicContact CG2-CB 3.98Å; T76-E89 HydrophobicContact CG2-CG 3.91Å; T76-R96 WeakPolarHBondContact O-CD 3.44Å
77	F	89.1	Confident	83.6	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	160.4	171.8	67.1	-83.6	0	0	0	110.4	L19 S68 F69 I79 L88 A90 R96 W99 L100 L103	L19-F77 HydrophobicContact CD1-CE1 4.33Å; L19-F77 HydrophobicContact CD1-CZ 3.84Å; L19-F77 HydrophobicContact CD2-CE1 4.27Å; S68-F77 CarbonylContact O-C 3.47Å; S68-F77 WeakPolarHBondContact O-CA 3.36Å; F69-F77 HydrophobicContact CB-CB 3.9Å; F77-I79 HydrophobicContact CD2-CG1 4.26Å; F77-I79 HydrophobicContact CE2-CD1 4.09Å; F77-I79 HydrophobicContact CE2-CG1 4.06Å; F77-L88 HydrophobicContact CD1-CB 4.31Å; F77-L88 HydrophobicContact CE1-CB 3.87Å; F77-L88 HydrophobicContact CE2-CB 4.09Å; F77-L88 HydrophobicContact CE2-CD1 3.86Å; F77-L88 HydrophobicContact CE2-CG 4.46Å; F77-L88 HydrophobicContact CZ-CB 3.76Å; F77-L88 HydrophobicContact CZ-CD1 3.83Å; F77-L88 HydrophobicContact CZ-CG 4.41Å; F77-L88 PolarHBondContact N-O 3.2Å; F77-L88 PolarHBondContact O-N 3.34Å; F77-A90 HydrophobicContact CE1-CB 4.27Å; F77-R96 HydrophobicContact CB-CG 4.15Å; F77-R96 HydrophobicContact CD1-CG 4Å; F77-R96 HydrophobicContact CG-CG 4.4Å; F77-W99 HydrophobicContact CE1-CB 4.39Å; F77-W99 HydrophobicContact CZ-CB 4.08Å; F77-W99 HydrophobicContact CZ-CG 4.38Å; F77-L100 HydrophobicContact CB-CD1 4.42Å; F77-L100 HydrophobicContact CB-CD2 4.14Å; F77-L100 HydrophobicContact CB-CG 4.47Å; F77-L100 HydrophobicContact CD2-CD2 3.87Å; F77-L100 HydrophobicContact CD2-CG 4.47Å; F77-L100 HydrophobicContact CG-CD2 4.22Å; F77-L100 HydrophobicContact CG-CG 4.49Å; F77-L103 HydrophobicContact CE2-CD1 4.14Å
78	E	89.3	Confident	83.7	Confident	59 Å²	59	51.8 Å²	51.8	28%	0.276	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.8	-175.3	-56.2	179.6	172.5	0	0	110.9	F67 S68 H80 Y86 V87	F67-E78 WeakPolarHBondContact CA-O 3.28Å; S68-E78 PolarHBondContact N-O 3.28Å; S68-E78 VanDerWaalsContact N-O 3.09Å; S68-E78 PolarHBondContact O-N 2.94Å; S68-E78 PolarHBondContact OG-OE2 2.9Å; E78-H80 IonicContact OE2-CE1 2.75Å; E78-H80 IonicContact OE2-NE2 2.77Å; E78-H80 PolarHBondContact OE2-NE2 3.36Å; E78-Y86 CarbonylContact C-O 3.55Å; E78-Y86 VanDerWaalsContact CA-O 3.31Å; E78-Y86 WeakPolarHBondContact CA-O 3.48Å; E78-V87 HydrophobicContact CG-CG1 4.3Å; E78-V87 HydrophobicContact CG-CG2 4.21Å
79	I	90.1	Very high	83.9	Confident	3 Å²	3	53 Å²	53	2%	0.015	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.9	172.5	-48.8	177.7	0	0	0	108.1	I60 A65 F67 F77 Y86 L88 L103	I60-I79 HydrophobicContact CD1-CD1 4.21Å; I60-I79 HydrophobicContact CG2-CG2 4.01Å; A65-I79 HydrophobicContact CB-CG2 4.03Å; F67-I79 HydrophobicContact CD1-CB 4.39Å; F67-I79 HydrophobicContact CD1-CG1 4.07Å; F67-I79 HydrophobicContact CD1-CG2 3.99Å; F67-I79 HydrophobicContact CE1-CG1 4.32Å; F67-I79 HydrophobicContact CE1-CG2 3.76Å; F77-I79 HydrophobicContact CD2-CG1 4.26Å; F77-I79 HydrophobicContact CE2-CD1 4.09Å; F77-I79 HydrophobicContact CE2-CG1 4.06Å; I79-Y86 PolarHBondContact N-O 3.34Å; I79-Y86 PolarHBondContact O-N 2.92Å; I79-L88 HydrophobicContact CD1-CD1 3.72Å; I79-L88 HydrophobicContact CG1-CD1 4.38Å; I79-L103 HydrophobicContact CD1-CD1 3.95Å
80	H	86.8	Confident	83.9	Confident	63 Å²	63	52.9 Å²	52.9	29%	0.292	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	113.3	178.8	-62.2	-102.6	0	0	0	108.4	A65 I66 E78 E84 V85	A65-H80 CarbonylContact C-O 3.58Å; A65-H80 VanDerWaalsContact CA-O 3.25Å; A65-H80 WeakPolarHBondContact CA-O 3.48Å; I66-H80 HydrophobicContact CB-CB 4.28Å; I66-H80 PolarHBondContact N-O 3.42Å; I66-H80 PolarHBondContact O-N 2.91Å; E78-H80 IonicContact OE2-CE1 2.75Å; E78-H80 IonicContact OE2-NE2 2.77Å; E78-H80 PolarHBondContact OE2-NE2 3.36Å; H80-E84 WeakPolarHBondContact CA-O 3.32Å; H80-V85 WeakPolarHBondContact ND1-CG2 3.42Å
81	S	85.2	Confident	84	Confident	7 Å²	7	54.3 Å²	54.3	5%	0.049	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	126.6	-175	162.6	0	0	0	0	110.6	Y61 G83 E84	Y61-S81 PolarHBondContact O-OG 3.45Å; S81-G83 PolarHBondContact O-N 2.98Å; S81-E84 PolarHBondContact N-O 2.97Å; S81-E84 WeakPolarHBondContact O-CB 3.16Å; S81-E84 PolarHBondContact O-N 2.88Å
82	N	78.8	Confident	84.4	Confident	117 Å²	117	58.3 Å²	58.3	63%	0.626	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	35.1	178.6	-62.9	-16.2	0	0	0	114.3	S64 E84	S64-N82 PolarHBondContact OG-OD1 3.39Å; N82-E84 VanDerWaalsContact C-N 3.28Å; N82-E84 PolarHBondContact O-N 3.37Å
83	G	77.7	Confident	84.6	Confident	78 Å²	78	55.4 Å²	55.4	80%	0.804	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-9.8	-178	0	0	0	0	0	115.2	S81	S81-G83 PolarHBondContact O-N 2.98Å
84	E	84.6	Confident	84.9	Confident	119 Å²	119	58.6 Å²	58.6	56%	0.556	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	143.7	175.7	-66.7	-66.7	146.4	0	0	111.4	H80 S81 N82 Y86	H80-E84 WeakPolarHBondContact CA-O 3.32Å; S81-E84 PolarHBondContact N-O 2.97Å; S81-E84 WeakPolarHBondContact O-CB 3.16Å; S81-E84 PolarHBondContact O-N 2.88Å; N82-E84 VanDerWaalsContact C-N 3.28Å; N82-E84 PolarHBondContact O-N 3.37Å; E84-Y86 HydrophobicContact CB-CE2 3.79Å
85	V	86	Confident	85.4	Confident	72 Å²	72	50.6 Å²	50.6	44%	0.436	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	116.2	179.8	-174	0	0	0	0	110.1	H80 V87	H80-V85 WeakPolarHBondContact ND1-CG2 3.42Å; V85-V87 HydrophobicContact CG1-CG2 4.32Å
86	Y	87.7	Confident	85.7	Confident	35 Å²	35	50.1 Å²	50.1	14%	0.137	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	110.2	177.7	-58.9	-91.3	0	0	0	110.1	Y47 I60 E78 I79 E84	Y47-Y86 HydrophobicContact CE1-CE1 4.38Å; I60-Y86 HydrophobicContact CD1-CD1 3.97Å; I60-Y86 HydrophobicContact CD1-CD2 3.83Å; I60-Y86 HydrophobicContact CD1-CE1 4.25Å; I60-Y86 HydrophobicContact CD1-CE2 4.11Å; I60-Y86 HydrophobicContact CD1-CG 3.76Å; I60-Y86 HydrophobicContact CG1-CD1 4.41Å; I60-Y86 HydrophobicContact CG1-CD2 4.13Å; I60-Y86 HydrophobicContact CG1-CE1 4.19Å; I60-Y86 HydrophobicContact CG1-CE2 3.88Å; I60-Y86 HydrophobicContact CG1-CG 4.39Å; I60-Y86 HydrophobicContact CG2-CD2 4.33Å; I60-Y86 HydrophobicContact CG2-CE2 4.15Å; E78-Y86 CarbonylContact C-O 3.55Å; E78-Y86 VanDerWaalsContact CA-O 3.31Å; E78-Y86 WeakPolarHBondContact CA-O 3.48Å; I79-Y86 PolarHBondContact N-O 3.34Å; I79-Y86 PolarHBondContact O-N 2.92Å; E84-Y86 HydrophobicContact CB-CE2 3.79Å
87	V	89.5	Confident	85.6	Confident	13 Å²	13	51.7 Å²	51.7	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117.1	176.2	-168.6	0	0	0	0	109.5	I22 E78 V85	I22-V87 HydrophobicContact CB-CB 4.2Å; I22-V87 HydrophobicContact CB-CG1 4.41Å; I22-V87 HydrophobicContact CD1-CG1 3.82Å; I22-V87 PolarHBondContact N-O 3.43Å; E78-V87 HydrophobicContact CG-CG1 4.3Å; E78-V87 HydrophobicContact CG-CG2 4.21Å; V85-V87 HydrophobicContact CG1-CG2 4.32Å
88	L	90.2	Very high	85.5	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.4	-173.4	-56.8	-179.5	0	0	0	111.5	L19 K20 Q21 F36 T76 F77 I79	L19-L88 HydrophobicContact CD1-CB 4.49Å; L19-L88 HydrophobicContact CD1-CD1 3.94Å; K20-L88 CarbonylContact O-C 3.58Å; K20-L88 WeakPolarHBondContact O-CA 3.21Å; Q21-L88 HydrophobicContact CB-CD2 3.81Å; Q21-L88 HydrophobicContact CG-CD2 3.92Å; F36-L88 HydrophobicContact CD1-CD1 4.43Å; F36-L88 HydrophobicContact CE1-CD1 3.89Å; F36-L88 HydrophobicContact CE1-CD2 4.18Å; F36-L88 HydrophobicContact CE2-CD2 3.96Å; F36-L88 HydrophobicContact CZ-CD1 3.96Å; F36-L88 HydrophobicContact CZ-CD2 3.46Å; F36-L88 VanDerWaalsContact CZ-CD2 3.46Å; F36-L88 HydrophobicContact CZ-CG 4.4Å; T76-L88 CarbonylContact C-O 3.57Å; T76-L88 WeakPolarHBondContact CA-O 3.39Å; F77-L88 HydrophobicContact CD1-CB 4.31Å; F77-L88 HydrophobicContact CE1-CB 3.87Å; F77-L88 HydrophobicContact CE2-CB 4.09Å; F77-L88 HydrophobicContact CE2-CD1 3.86Å; F77-L88 HydrophobicContact CE2-CG 4.46Å; F77-L88 HydrophobicContact CZ-CB 3.76Å; F77-L88 HydrophobicContact CZ-CD1 3.83Å; F77-L88 HydrophobicContact CZ-CG 4.41Å; F77-L88 PolarHBondContact N-O 3.2Å; F77-L88 PolarHBondContact O-N 3.34Å; I79-L88 HydrophobicContact CD1-CD1 3.72Å; I79-L88 HydrophobicContact CG1-CD1 4.38Å
89	E	88.9	Confident	85.5	Confident	53 Å²	53	50.8 Å²	50.8	25%	0.248	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	118.3	175.2	-168.1	-166.6	139	0	0	109.9	K20 T76	K20-E89 HydrophobicContact CB-CB 4.09Å; K20-E89 PolarHBondContact N-O 2.96Å; K20-E89 IonicContact NZ-OE1 3.44Å; K20-E89 PolarHBondContact NZ-OE1 2.73Å; K20-E89 IonicContact NZ-OE2 2.95Å; K20-E89 PolarHBondContact O-N 2.92Å; T76-E89 HydrophobicContact CG2-CB 3.98Å; T76-E89 HydrophobicContact CG2-CG 3.91Å
90	A	87.9	Confident	85.3	Confident	2 Å²	2	50.7 Å²	50.7	2%	0.017	28%	0.281	C	S	.	.			trans	-83.2	158.1	173.3	0	0	0	0	0	111.3	L19 S75 F77 A95 R96	L19-A90 HydrophobicContact CD2-CB 4.07Å; S75-A90 WeakPolarHBondContact CB-O 3.08Å; S75-A90 WeakPolarHBondContact O-CB 3.43Å; S75-A90 PolarHBondContact O-N 3.32Å; F77-A90 HydrophobicContact CE1-CB 4.27Å; A90-A95 HydrophobicContact CB-CB 4.33Å; A90-R96 HydrophobicContact CB-CB 3.92Å
91	P	83.6	Confident	85.2	Confident	80 Å²	80	52.7 Å²	52.7	52%	0.519	29%	0.291	S	S	.	.	S	Bend	trans	-66.3	-39.4	179.7	23.6	-32.4	0	0	0	113.3	A95	P91-A95 HydrophobicContact CG-CB 3.81Å
92	D	84.2	Confident	85.3	Confident	106 Å²	106	53.3 Å²	53.3	57%	0.567	30%	0.296	S	S	*	.	S	Bend	trans	-138.6	160.1	-176.4	-62.7	-49.6	0	0	0	110.8	Q94 A95 R96	D92-Q94 PolarHBondContact O-N 3.01Å; D92-A95 HydrophobicContact CB-CB 4.44Å; D92-A95 WeakPolarHBondContact O-CB 3.34Å; D92-A95 PolarHBondContact O-N 3.04Å; D92-R96 PolarHBondContact O-N 3.45Å
93	E	79.8	Confident	85.7	Confident	80 Å²	80	47.8 Å²	47.8	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-58.7	-38.8	177.8	-150.9	-166.2	161.9	0	0	111.8	S75 A95 R96 F97 R423	S75-E93 PolarHBondContact OG-N 3.48Å; E93-A95 VanDerWaalsContact C-N 3.35Å; E93-A95 PolarHBondContact O-N 3.29Å; E93-R96 WeakPolarHBondContact O-CB 3.36Å; E93-R96 PolarHBondContact O-N 3.04Å; E93-R96 IonicContact OE1-NH2 3.45Å; E93-R96 PolarHBondContact OE1-NH2 3.23Å; E93-F97 HydrophobicContact CG-CD2 4.4Å; E93-F97 HydrophobicContact CG-CE2 3.82Å; E93-F97 WeakPolarHBondContact O-CD2 3.1Å; E93-F97 PolarHBondContact O-N 2.99Å; E93-F97 WeakPolarHBondContact OE1-CE2 3.34Å; E93-R423 IonicContact OE1-CZ 3.98Å; E93-R423 IonicContact OE1-NH1 2.98Å; E93-R423 PolarHBondContact OE1-NH1 2.91Å; E93-R423 IonicContact OE2-NH1 3.88Å; E93-R423 PolarHBondContact OE2-NH1 3.21Å
94	Q	84.5	Confident	86.1	Confident	138 Å²	138	44.3 Å²	44.3	65%	0.645	23%	0.229	S	C	*	.	H	α-helix	trans	-64.3	-40	176.1	-169.9	63	35.8	0	0	111.7	D92 F97 S98	D92-Q94 PolarHBondContact O-N 3.01Å; Q94-F97 PolarHBondContact O-N 3.32Å; Q94-S98 PolarHBondContact O-N 3.14Å; Q94-S98 PolarHBondContact O-OG 3.5Å
95	A	84.9	Confident	86	Confident	8 Å²	8	41.9 Å²	41.9	7%	0.066	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-38.9	178.5	0	0	0	0	0	111.4	M6 A90 P91 D92 E93 F97 S98 W99	M6-A95 HydrophobicContact CE-CB 4.35Å; M6-A95 HydrophobicContact SD-CB 4.5Å; A90-A95 HydrophobicContact CB-CB 4.33Å; P91-A95 HydrophobicContact CG-CB 3.81Å; D92-A95 HydrophobicContact CB-CB 4.44Å; D92-A95 WeakPolarHBondContact O-CB 3.34Å; D92-A95 PolarHBondContact O-N 3.04Å; E93-A95 VanDerWaalsContact C-N 3.35Å; E93-A95 PolarHBondContact O-N 3.29Å; A95-F97 PolarHBondContact O-N 3.41Å; A95-S98 PolarHBondContact O-N 3.21Å; A95-W99 VanDerWaalsContact O-CD1 3.29Å; A95-W99 PolarHBondContact O-N 3.02Å
96	R	85.4	Confident	86	Confident	7 Å²	7	38.8 Å²	38.8	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-55	-50.1	172.3	174	-178.9	65.1	-176.8	2.7	111.3	T76 F77 A90 D92 E93 W99 L100	T76-R96 WeakPolarHBondContact O-CD 3.44Å; F77-R96 HydrophobicContact CB-CG 4.15Å; F77-R96 HydrophobicContact CD1-CG 4Å; F77-R96 HydrophobicContact CG-CG 4.4Å; A90-R96 HydrophobicContact CB-CB 3.92Å; D92-R96 PolarHBondContact O-N 3.45Å; E93-R96 WeakPolarHBondContact O-CB 3.36Å; E93-R96 PolarHBondContact O-N 3.04Å; E93-R96 IonicContact OE1-NH2 3.45Å; E93-R96 PolarHBondContact OE1-NH2 3.23Å; R96-W99 PolarHBondContact O-N 3.48Å; R96-L100 HydrophobicContact CG-CD1 3.97Å; R96-L100 WeakPolarHBondContact O-CG 3.43Å; R96-L100 PolarHBondContact O-N 3.08Å
97	F	84	Confident	86	Confident	43 Å²	43	37.2 Å²	37.2	19%	0.189	20%	0.195	C	C	.	.	H	α-helix	trans	-66	-39.8	-179.7	-71.8	-63.9	0	0	0	112.8	F69 E93 Q94 A95 W99 L100 Q101 R423	F69-F97 AromaticContact CE1-CE1 3.92Å; F69-F97 HydrophobicContact CE1-CE1 3.92Å; F69-F97 HydrophobicContact CE2-CZ 4.46Å; F69-F97 AromaticContact CZ-CE1 3.78Å; F69-F97 HydrophobicContact CZ-CE1 3.78Å; F69-F97 AromaticContact CZ-CZ 4Å; F69-F97 HydrophobicContact CZ-CZ 4Å; E93-F97 HydrophobicContact CG-CD2 4.4Å; E93-F97 HydrophobicContact CG-CE2 3.82Å; E93-F97 WeakPolarHBondContact O-CD2 3.1Å; E93-F97 PolarHBondContact O-N 2.99Å; E93-F97 WeakPolarHBondContact OE1-CE2 3.34Å; Q94-F97 PolarHBondContact O-N 3.32Å; A95-F97 PolarHBondContact O-N 3.41Å; F97-W99 VanDerWaalsContact C-N 3.34Å; F97-W99 PolarHBondContact O-N 3.36Å; F97-L100 PolarHBondContact O-N 3.47Å; F97-Q101 WeakPolarHBondContact O-CB 3.49Å; F97-Q101 PolarHBondContact O-N 2.84Å; F97-R423 HydrophobicContact CE1-CG 4.43Å; F97-R423 HydrophobicContact CZ-CG 3.98Å
98	S	86.5	Confident	85.5	Confident	33 Å²	33	40.6 Å²	40.6	23%	0.231	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-41.7	174.8	-63.7	0	0	0	0	112.2	Q94 A95 A102	Q94-S98 PolarHBondContact O-N 3.14Å; Q94-S98 PolarHBondContact O-OG 3.5Å; A95-S98 PolarHBondContact O-N 3.21Å; S98-A102 WeakPolarHBondContact O-CB 3.14Å; S98-A102 PolarHBondContact O-N 2.82Å
99	W	88.8	Confident	85.1	Confident	9 Å²	9	44.7 Å²	44.7	3%	0.034	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-50.3	174.4	-90.7	101.5	0	0	0	112.1	F15 L19 F36 F77 A95 R96 F97 Q101 A102 L103	F15-W99 HydrophobicContact CD1-CD2 4.11Å; F15-W99 AromaticContact CD1-CE3 3.88Å; F15-W99 HydrophobicContact CD1-CE3 3.88Å; F15-W99 AromaticContact CD1-CH2 3.94Å; F15-W99 HydrophobicContact CD1-CH2 3.94Å; F15-W99 HydrophobicContact CD1-CZ2 4.16Å; F15-W99 AromaticContact CD1-CZ3 3.79Å; F15-W99 HydrophobicContact CD1-CZ3 3.79Å; F15-W99 HydrophobicContact CE1-CB 4.43Å; F15-W99 AromaticContact CE1-CD2 3.45Å; F15-W99 HydrophobicContact CE1-CD2 3.45Å; F15-W99 VanDerWaalsContact CE1-CD2 3.45Å; F15-W99 AromaticContact CE1-CE2 3.64Å; F15-W99 AromaticContact CE1-CE3 3.65Å; F15-W99 HydrophobicContact CE1-CE3 3.65Å; F15-W99 AromaticContact CE1-CG 3.81Å; F15-W99 HydrophobicContact CE1-CG 3.81Å; F15-W99 HydrophobicContact CE1-CH2 4.19Å; F15-W99 HydrophobicContact CE1-CZ2 4.03Å; F15-W99 HydrophobicContact CE1-CZ3 4.01Å; F15-W99 HydrophobicContact CZ-CD2 4.47Å; F15-W99 HydrophobicContact CZ-CG 4.47Å; L19-W99 HydrophobicContact CD1-CD2 3.99Å; L19-W99 HydrophobicContact CD1-CE3 4.39Å; L19-W99 HydrophobicContact CD1-CG 4.46Å; L19-W99 HydrophobicContact CD1-CZ2 4.15Å; L19-W99 HydrophobicContact CG-CZ2 4.41Å; F36-W99 HydrophobicContact CB-CH2 3.68Å; F36-W99 HydrophobicContact CB-CZ2 4.23Å; F36-W99 HydrophobicContact CB-CZ3 4.25Å; F77-W99 HydrophobicContact CE1-CB 4.39Å; F77-W99 HydrophobicContact CZ-CB 4.08Å; F77-W99 HydrophobicContact CZ-CG 4.38Å; A95-W99 VanDerWaalsContact O-CD1 3.29Å; A95-W99 PolarHBondContact O-N 3.02Å; R96-W99 PolarHBondContact O-N 3.48Å; F97-W99 VanDerWaalsContact C-N 3.34Å; F97-W99 PolarHBondContact O-N 3.36Å; W99-Q101 VanDerWaalsContact C-N 3.29Å; W99-Q101 PolarHBondContact O-N 3.4Å; W99-A102 PolarHBondContact O-N 3.04Å; W99-L103 HydrophobicContact CE3-CD1 4.38Å; W99-L103 HydrophobicContact CE3-CG 4.37Å; W99-L103 WeakPolarHBondContact O-CB 3.47Å; W99-L103 WeakPolarHBondContact O-CG 3.43Å; W99-L103 PolarHBondContact O-N 2.94Å
100	L	86.5	Confident	84.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-43.3	178.9	-71.9	170.3	0	0	0	111.6	F67 F69 F77 R96 F97 L103 Q104 F427	F67-L100 HydrophobicContact CB-CD2 3.76Å; F67-L100 HydrophobicContact CG-CD2 4.45Å; F69-L100 HydrophobicContact CD1-CD1 3.8Å; F69-L100 HydrophobicContact CE1-CD1 4.37Å; F77-L100 HydrophobicContact CB-CD1 4.42Å; F77-L100 HydrophobicContact CB-CD2 4.14Å; F77-L100 HydrophobicContact CB-CG 4.47Å; F77-L100 HydrophobicContact CD2-CD2 3.87Å; F77-L100 HydrophobicContact CD2-CG 4.47Å; F77-L100 HydrophobicContact CG-CD2 4.22Å; F77-L100 HydrophobicContact CG-CG 4.49Å; R96-L100 HydrophobicContact CG-CD1 3.97Å; R96-L100 WeakPolarHBondContact O-CG 3.43Å; R96-L100 PolarHBondContact O-N 3.08Å; F97-L100 PolarHBondContact O-N 3.47Å; L100-L103 PolarHBondContact O-N 3.42Å; L100-Q104 WeakPolarHBondContact O-CB 2.95Å; L100-Q104 VanDerWaalsContact O-CG 3.23Å; L100-Q104 WeakPolarHBondContact O-CG 3.34Å; L100-Q104 PolarHBondContact O-N 3.07Å; L100-F427 HydrophobicContact CB-CE2 3.85Å; L100-F427 HydrophobicContact CB-CZ 3.96Å; L100-F427 HydrophobicContact CD1-CE1 4.39Å; L100-F427 HydrophobicContact CD1-CE2 4.04Å; L100-F427 HydrophobicContact CD1-CZ 3.91Å; L100-F427 HydrophobicContact CD2-CZ 3.99Å; L100-F427 HydrophobicContact CG-CE2 4.42Å; L100-F427 HydrophobicContact CG-CZ 4.18Å
101	Q	85.4	Confident	84.2	Confident	106 Å²	106	42.9 Å²	42.9	50%	0.495	22%	0.217	S	C	.	.	H	α-helix	trans	-66.6	-42.2	178	-174.9	176.2	0.4	0	0	112.5	F97 W99 Q104 N105	F97-Q101 WeakPolarHBondContact O-CB 3.49Å; F97-Q101 PolarHBondContact O-N 2.84Å; W99-Q101 VanDerWaalsContact C-N 3.29Å; W99-Q101 PolarHBondContact O-N 3.4Å; Q101-Q104 PolarHBondContact O-N 2.89Å; Q101-N105 WeakPolarHBondContact O-CB 3.26Å; Q101-N105 VanDerWaalsContact O-CG 3.28Å; Q101-N105 PolarHBondContact O-N 3.26Å
102	A	86	Confident	83.9	Confident	19 Å²	19	43.6 Å²	43.6	16%	0.157	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-45.6	176.8	0	0	0	0	0	111.3	F15 L38 S98 W99 N105 Q106	F15-A102 HydrophobicContact CD1-CB 3.75Å; F15-A102 HydrophobicContact CD2-CB 4.32Å; F15-A102 HydrophobicContact CE1-CB 3.81Å; F15-A102 HydrophobicContact CE2-CB 4.38Å; F15-A102 HydrophobicContact CG-CB 4Å; F15-A102 HydrophobicContact CZ-CB 4.13Å; L38-A102 HydrophobicContact CD2-CB 3.93Å; S98-A102 WeakPolarHBondContact O-CB 3.14Å; S98-A102 PolarHBondContact O-N 2.82Å; W99-A102 PolarHBondContact O-N 3.04Å; A102-N105 PolarHBondContact O-N 3.4Å; A102-Q106 WeakPolarHBondContact O-CB 3.42Å; A102-Q106 PolarHBondContact O-N 3.49Å
103	L	87.4	Confident	83.4	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-42.8	177.7	-68.4	168.6	0	0	0	112.3	L38 V45 L62 F67 F77 I79 W99 L100 R107	L38-L103 HydrophobicContact CD1-CD2 4.05Å; V45-L103 HydrophobicContact CG2-CD2 3.61Å; L62-L103 HydrophobicContact CD2-CD2 3.85Å; F67-L103 HydrophobicContact CD1-CB 4.39Å; F67-L103 HydrophobicContact CD1-CD1 4.3Å; F67-L103 HydrophobicContact CE1-CB 3.78Å; F67-L103 HydrophobicContact CE1-CD1 4.04Å; F67-L103 HydrophobicContact CE1-CG 4.38Å; F67-L103 HydrophobicContact CE2-CB 4.08Å; F67-L103 HydrophobicContact CZ-CB 3.62Å; F77-L103 HydrophobicContact CE2-CD1 4.14Å; I79-L103 HydrophobicContact CD1-CD1 3.95Å; W99-L103 HydrophobicContact CE3-CD1 4.38Å; W99-L103 HydrophobicContact CE3-CG 4.37Å; W99-L103 WeakPolarHBondContact O-CB 3.47Å; W99-L103 WeakPolarHBondContact O-CG 3.43Å; W99-L103 PolarHBondContact O-N 2.94Å; L100-L103 PolarHBondContact O-N 3.42Å; L103-R107 WeakPolarHBondContact O-CB 3.13Å; L103-R107 PolarHBondContact O-N 3.43Å
104	Q	85.9	Confident	82.9	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.019	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-44.6	175.1	-77.8	172.9	-31.5	0	0	112.5	F67 L100 Q101 R108 F427 E431	F67-Q104 HydrophobicContact CD2-CG 3.77Å; F67-Q104 HydrophobicContact CE2-CG 4.11Å; L100-Q104 WeakPolarHBondContact O-CB 2.95Å; L100-Q104 VanDerWaalsContact O-CG 3.23Å; L100-Q104 WeakPolarHBondContact O-CG 3.34Å; L100-Q104 PolarHBondContact O-N 3.07Å; Q101-Q104 PolarHBondContact O-N 2.89Å; Q104-R108 PolarHBondContact O-N 3.44Å; Q104-R108 VanDerWaalsContact O-N 3.16Å; Q104-F427 VanDerWaalsContact NE2-CE2 3.26Å; Q104-E431 PolarHBondContact NE2-OE2 3.15Å
105	N	83.9	Confident	82	Confident	69 Å²	69	34.8 Å²	34.8	37%	0.369	17%	0.172	S	C	.	.	H	α-helix	trans	-65.9	-44.8	178.9	-75.8	-11.2	0	0	0	111.4	Q101 A102 R108 Q109	Q101-N105 WeakPolarHBondContact O-CB 3.26Å; Q101-N105 VanDerWaalsContact O-CG 3.28Å; Q101-N105 PolarHBondContact O-N 3.26Å; A102-N105 PolarHBondContact O-N 3.4Å; N105-R108 WeakPolarHBondContact O-CB 3.47Å; N105-R108 PolarHBondContact O-N 3.4Å; N105-Q109 PolarHBondContact O-N 3.4Å
106	Q	84.9	Confident	81.1	Confident	7 Å²	7	41.2 Å²	41.2	3%	0.033	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-45	178	-172.9	66.5	17.7	0	0	111.7	L38 E39 D41 A42 L62 A102 R108 Q109 C110	L38-Q106 HydrophobicContact CD1-CB 4.09Å; L38-Q106 HydrophobicContact CD1-CG 3.81Å; L38-Q106 HydrophobicContact CD2-CB 4.03Å; L38-Q106 HydrophobicContact CD2-CG 4.43Å; L38-Q106 HydrophobicContact CG-CB 4.33Å; L38-Q106 HydrophobicContact CG-CG 4.18Å; E39-Q106 PolarHBondContact O-NE2 3.3Å; D41-Q106 VanDerWaalsContact CA-NE2 3.3Å; A42-Q106 VanDerWaalsContact N-NE2 3.1Å; A42-Q106 PolarHBondContact O-NE2 3.07Å; A42-Q106 VanDerWaalsContact O-NE2 3.16Å; L62-Q106 HydrophobicContact CD1-CB 4.26Å; L62-Q106 HydrophobicContact CD1-CG 3.61Å; A102-Q106 WeakPolarHBondContact O-CB 3.42Å; A102-Q106 PolarHBondContact O-N 3.49Å; Q106-R108 PolarHBondContact O-N 2.88Å; Q106-Q109 PolarHBondContact O-N 3.22Å; Q106-C110 WeakPolarHBondContact O-CB 3.34Å; Q106-C110 PolarHBondContact O-N 2.88Å; Q106-C110 PolarHBondContact O-SG 3.48Å; Q106-C110 VanDerWaalsContact O-SG 3.34Å
107	R	87.3	Confident	79.9	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-54.3	-44.4	174.7	177.7	-177.8	67.7	-168.2	-3.9	111.2	L62 A65 L103 I111 E431	L62-R107 WeakPolarHBondContact O-CD 3.42Å; L62-R107 WeakPolarHBondContact O-CG 3.42Å; A65-R107 WeakPolarHBondContact O-CD 3.45Å; A65-R107 PolarHBondContact O-NH1 3.01Å; L103-R107 WeakPolarHBondContact O-CB 3.13Å; L103-R107 PolarHBondContact O-N 3.43Å; R107-I111 HydrophobicContact CG-CD1 3.93Å; R107-I111 VanDerWaalsContact O-CG1 3.29Å; R107-I111 WeakPolarHBondContact O-CG1 3.39Å; R107-I111 PolarHBondContact O-N 3.38Å; R107-I111 VanDerWaalsContact O-N 3.1Å; R107-E431 IonicContact CZ-OE1 3.65Å; R107-E431 VanDerWaalsContact CZ-OE1 3.25Å; R107-E431 IonicContact CZ-OE2 3.88Å; R107-E431 IonicContact NH1-OE1 3.97Å; R107-E431 PolarHBondContact NH1-OE1 3.06Å; R107-E431 VanDerWaalsContact NH2-CD 3.26Å; R107-E431 IonicContact NH2-OE1 3.47Å; R107-E431 PolarHBondContact NH2-OE1 3.01Å; R107-E431 IonicContact NH2-OE2 3.67Å; R107-E431 PolarHBondContact NH2-OE2 3.36Å
108	R	79.7	Confident	78.3	Confident	83 Å²	83	50.8 Å²	50.8	31%	0.313	24%	0.243	S	C	.	.	H	α-helix	trans	-63.6	-48	178.8	-165.2	-172.6	-40.2	-136.2	-2.3	111.6	Q104 N105 Q106 I111 E112 E434	Q104-R108 PolarHBondContact O-N 3.44Å; Q104-R108 VanDerWaalsContact O-N 3.16Å; N105-R108 WeakPolarHBondContact O-CB 3.47Å; N105-R108 PolarHBondContact O-N 3.4Å; Q106-R108 PolarHBondContact O-N 2.88Å; R108-I111 PolarHBondContact O-N 3.21Å; R108-E112 WeakPolarHBondContact O-CB 3.5Å; R108-E112 WeakPolarHBondContact O-CG 3.23Å; R108-E112 PolarHBondContact O-N 2.89Å; R108-E434 IonicContact CZ-OE1 3.52Å; R108-E434 IonicContact CZ-OE2 3.47Å; R108-E434 IonicContact NH1-OE1 3.98Å; R108-E434 IonicContact NH2-OE1 2.85Å; R108-E434 PolarHBondContact NH2-OE1 3.28Å; R108-E434 IonicContact NH2-OE2 3.59Å; R108-E434 PolarHBondContact NH2-OE2 3.39Å
109	Q	82	Confident	76.8	Confident	88 Å²	88	52.5 Å²	52.5	41%	0.411	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-46.5	177.2	-74.3	178.8	-9.3	0	0	111.7	N105 Q106 I111 E112 T113	N105-Q109 PolarHBondContact O-N 3.4Å; Q106-Q109 PolarHBondContact O-N 3.22Å; Q109-I111 VanDerWaalsContact C-N 3.29Å; Q109-I111 PolarHBondContact O-N 2.96Å; Q109-E112 PolarHBondContact O-N 3.39Å; Q109-E112 VanDerWaalsContact O-N 3.15Å; Q109-T113 WeakPolarHBondContact O-CB 3.21Å; Q109-T113 PolarHBondContact O-N 3.48Å; Q109-T113 PolarHBondContact O-OG1 2.98Å
110	C	81.7	Confident	74.8	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-57.2	-42.3	176.8	-72.7	0	0	0	0	112.7	A42 H43 P63 Q106 Q114	A42-C110 VanDerWaalsContact C-SG 3.58Å; A42-C110 PolarHBondContact O-SG 2.94Å; H43-C110 WeakPolarHBondContact ND1-CB 3.29Å; H43-C110 PolarHBondContact ND1-SG 3.02Å; P63-C110 HydrophobicContact CG-CB 4.32Å; Q106-C110 WeakPolarHBondContact O-CB 3.34Å; Q106-C110 PolarHBondContact O-N 2.88Å; Q106-C110 PolarHBondContact O-SG 3.48Å; Q106-C110 VanDerWaalsContact O-SG 3.34Å; C110-Q114 WeakPolarHBondContact O-CB 3.19Å; C110-Q114 VanDerWaalsContact O-CG 3.27Å; C110-Q114 WeakPolarHBondContact O-CG 3.44Å; C110-Q114 PolarHBondContact O-N 3.34Å
111	I	76.4	Confident	72.8	Confident	15 Å²	15	64.4 Å²	64.4	8%	0.077	32%	0.32	C	S	.	.	H	α-helix	trans	-70	-41.3	178.1	-65.8	167.6	0	0	0	110.4	P63 R107 R108 Q109 Q114 M115 L438	P63-I111 HydrophobicContact CB-CG1 4.18Å; R107-I111 HydrophobicContact CG-CD1 3.93Å; R107-I111 VanDerWaalsContact O-CG1 3.29Å; R107-I111 WeakPolarHBondContact O-CG1 3.39Å; R107-I111 PolarHBondContact O-N 3.38Å; R107-I111 VanDerWaalsContact O-N 3.1Å; R108-I111 PolarHBondContact O-N 3.21Å; Q109-I111 VanDerWaalsContact C-N 3.29Å; Q109-I111 PolarHBondContact O-N 2.96Å; I111-Q114 PolarHBondContact O-N 3.31Å; I111-M115 HydrophobicContact CG2-CE 3.58Å; I111-M115 HydrophobicContact CG2-SD 4.26Å; I111-M115 WeakPolarHBondContact O-CB 3.4Å; I111-M115 WeakPolarHBondContact O-CG 3.06Å; I111-M115 PolarHBondContact O-N 3.35Å; I111-L438 HydrophobicContact CB-CD2 4.25Å; I111-L438 HydrophobicContact CD1-CD1 3.75Å; I111-L438 HydrophobicContact CD1-CD2 3.81Å; I111-L438 HydrophobicContact CD1-CG 4.3Å; I111-L438 HydrophobicContact CG2-CD2 3.91Å
112	E	76	Confident	70.7	Confident	95 Å²	95	64 Å²	64	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-64.7	-39.3	176.1	-75.7	176.6	-169.5	0	0	112.7	R108 Q109 M115 K116	R108-E112 WeakPolarHBondContact O-CB 3.5Å; R108-E112 WeakPolarHBondContact O-CG 3.23Å; R108-E112 PolarHBondContact O-N 2.89Å; Q109-E112 PolarHBondContact O-N 3.39Å; Q109-E112 VanDerWaalsContact O-N 3.15Å; E112-M115 WeakPolarHBondContact O-CB 3.4Å; E112-M115 PolarHBondContact O-N 3.48Å; E112-K116 PolarHBondContact O-N 2.93Å
113	T	74.4	Confident	68.8	Low	46 Å²	46	67.7 Å²	67.7	28%	0.282	36%	0.357	S	S	.	.	H	α-helix	trans	-66.7	-47.1	175.7	-57.6	0	0	0	0	110.3	Q109 M115 K116 E117	Q109-T113 WeakPolarHBondContact O-CB 3.21Å; Q109-T113 PolarHBondContact O-N 3.48Å; Q109-T113 PolarHBondContact O-OG1 2.98Å; T113-M115 PolarHBondContact O-N 3.36Å; T113-K116 PolarHBondContact O-N 2.77Å; T113-K116 VanDerWaalsContact O-N 3.1Å; T113-E117 PolarHBondContact O-N 3.24Å
114	Q	69.8	Low	66.7	Low	48 Å²	48	75.2 Å²	75.2	22%	0.224	40%	0.397	C	S	.	.	H	α-helix	trans	-55.1	-40.5	170.3	-76.7	174.6	1.6	0	0	110.9	H43 C110 I111 E117 F118	H43-Q114 PolarHBondContact CE1-NE2 3.45Å; C110-Q114 WeakPolarHBondContact O-CB 3.19Å; C110-Q114 VanDerWaalsContact O-CG 3.27Å; C110-Q114 WeakPolarHBondContact O-CG 3.44Å; C110-Q114 PolarHBondContact O-N 3.34Å; I111-Q114 PolarHBondContact O-N 3.31Å; Q114-E117 PolarHBondContact O-N 2.94Å; Q114-F118 WeakPolarHBondContact O-CD2 3.47Å; Q114-F118 PolarHBondContact O-N 3.42Å
115	M	65.1	Low	64.6	Low	46 Å²	46	78.9 Å²	78.9	23%	0.227	42%	0.423	C	S	.	.	H	α-helix	trans	-64.1	-41.1	176.4	-75.7	175.1	179.8	0	0	113.5	I111 E112 T113 F118 A119 T441	I111-M115 HydrophobicContact CG2-CE 3.58Å; I111-M115 HydrophobicContact CG2-SD 4.26Å; I111-M115 WeakPolarHBondContact O-CB 3.4Å; I111-M115 WeakPolarHBondContact O-CG 3.06Å; I111-M115 PolarHBondContact O-N 3.35Å; E112-M115 WeakPolarHBondContact O-CB 3.4Å; E112-M115 PolarHBondContact O-N 3.48Å; T113-M115 PolarHBondContact O-N 3.36Å; M115-F118 PolarHBondContact O-N 3.04Å; M115-A119 VanDerWaalsContact O-CB 3.27Å; M115-A119 WeakPolarHBondContact O-CB 3.22Å; M115-A119 PolarHBondContact O-N 3.13Å; M115-T441 HydrophobicContact CE-CG2 3.19Å; M115-T441 HydrophobicContact SD-CG2 3.69Å
116	K	65.8	Low	62.7	Low	142 Å²	142	79.2 Å²	79.2	62%	0.617	42%	0.423	S	S	*	.	H	α-helix	trans	-64.3	-43.4	177.9	-76.1	178.4	-178.3	171.4	0	111.6	E112 T113 F118 A119 D120	E112-K116 PolarHBondContact O-N 2.93Å; T113-K116 PolarHBondContact O-N 2.77Å; T113-K116 VanDerWaalsContact O-N 3.1Å; K116-F118 PolarHBondContact O-N 2.97Å; K116-A119 PolarHBondContact O-N 2.76Å; K116-A119 VanDerWaalsContact O-N 3.09Å; K116-D120 PolarHBondContact O-N 3.31Å
117	E	60	Low	60.7	Low	138 Å²	138	88.1 Å²	88.1	65%	0.645	46%	0.462	S	S	*	.	H	α-helix	trans	-57.7	-31.1	176.4	-71	179	171.7	0	0	112.7	T113 Q114	T113-E117 PolarHBondContact O-N 3.24Å; Q114-E117 PolarHBondContact O-N 2.94Å
118	F	51.5	Low	58.5	Low	114 Å²	114	91 Å²	91	50%	0.5	48%	0.477	S	S	.	.	H	α-helix	trans	-91	-22.2	175.7	-74.1	-69.6	0	0	0	114.8	Q114 M115 K116	Q114-F118 WeakPolarHBondContact O-CD2 3.47Å; Q114-F118 PolarHBondContact O-N 3.42Å; M115-F118 PolarHBondContact O-N 3.04Å; K116-F118 PolarHBondContact O-N 2.97Å
119	A	53.5	Low	56.7	Low	69 Å²	69	90.3 Å²	90.3	57%	0.57	48%	0.484	S	S	*	.	H	α-helix	trans	-82.4	-24	-175.4	0	0	0	0	0	113.4	M115 K116 E121	M115-A119 VanDerWaalsContact O-CB 3.27Å; M115-A119 WeakPolarHBondContact O-CB 3.22Å; M115-A119 PolarHBondContact O-N 3.13Å; K116-A119 PolarHBondContact O-N 2.76Å; K116-A119 VanDerWaalsContact O-N 3.09Å; A119-E121 PolarHBondContact O-N 3.29Å
120	D	47.2	Very low	54.9	Low	142 Å²	142	91.8 Å²	91.8	76%	0.759	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	3.3	178.7	-77.3	-23.6	0	0	0	114	K116 P122	K116-D120 PolarHBondContact O-N 3.31Å; D120-P122 VanDerWaalsContact O-CD 3.27Å; D120-P122 WeakPolarHBondContact O-CD 3.42Å
121	E	44	Very low	53	Low	116 Å²	116	95.1 Å²	95.1	54%	0.542	51%	0.512	S	S	.	.	S	Bend	trans	-73.4	109.9	165.1	-77.8	-112.2	150.6	0	0	110.8	A119 A123	A119-E121 PolarHBondContact O-N 3.29Å; E121-A123 PolarHBondContact O-N 3.48Å
122	P	43	Very low	51.4	Low	99 Å²	99	98 Å²	98	64%	0.643	53%	0.533	S	S	*	.			trans	-62.5	125.5	-171.8	24.2	-32.6	0	0	0	111.9	D120 D124	D120-P122 VanDerWaalsContact O-CD 3.27Å; D120-P122 WeakPolarHBondContact O-CD 3.42Å; P122-D124 PolarHBondContact O-N 3.49Å
123	A	45.3	Very low	49.8	Very low	96 Å²	96	101.3 Å²	101.3	79%	0.793	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.4	-179.4	0	0	0	0	0	114.7	E121	E121-A123 PolarHBondContact O-N 3.48Å
124	D	42.4	Very low	48.2	Very low	159 Å²	159	106 Å²	106	85%	0.85	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	3.1	-167.1	-131.6	7.2	0	0	0	114.5	P122	P122-D124 PolarHBondContact O-N 3.49Å
125	S	42.7	Very low	46.6	Very low	82 Å²	82	110.2 Å²	110.2	57%	0.573	59%	0.589	S	S	*	*	S	Bend	trans	-95.6	94.4	174	60	0	0	0	0	110.7
126	M	44.8	Very low	45.2	Very low	75 Å²	75	113.4 Å²	113.4	37%	0.369	61%	0.613	S	S	.	*			trans	146.1	82.8	151.2	-82.1	169	-165.7	0	0	110.5	M456 Q459 T515	M126-M456 HydrophobicContact CE-SD 4.38Å; M126-M456 HydrophobicContact SD-CE 4.46Å; M126-M456 HydrophobicContact SD-SD 3.61Å; M126-M456 VanDerWaalsContact SD-SD 3.61Å; M126-Q459 PolarHBondContact SD-OE1 3.03Å; M126-T515 HydrophobicContact CE-CG2 4.36Å
127	K	41.3	Very low	43.6	Very low	194 Å²	194	110.1 Å²	110.1	84%	0.843	62%	0.619	S	S	*	*			trans	-117.3	124.1	155.5	-80.5	-175.7	179.4	173.9	0	108.4
128	L	42.3	Very low	42.1	Very low	63 Å²	63	114.5 Å²	114.5	33%	0.33	63%	0.631	S	S	.	*			trans	-69.3	127.3	174.8	-151.3	81.1	0	0	0	109.1	E511	L128-E511 HydrophobicContact CD1-CG 4.26Å
129	P	42.3	Very low	40.9	Very low	69 Å²	69	114.1 Å²	114.1	45%	0.448	64%	0.643	S	S	.	*			trans	-62.8	139.7	171.6	-20.5	32.2	0	0	0	111.3	L131	P129-L131 PolarHBondContact O-N 3.49Å
130	D	44.1	Very low	39.5	Very low	119 Å²	119	117.3 Å²	117.3	64%	0.636	66%	0.655	S	S	*	*			trans	-73.2	111.3	174.4	-172.8	-0.2	0	0	0	109.6	S132	D130-S132 VanDerWaalsContact C-N 3.31Å; D130-S132 VanDerWaalsContact OD1-CB 3.27Å; D130-S132 WeakPolarHBondContact OD1-CB 3.4Å; D130-S132 PolarHBondContact OD1-N 2.88Å; D130-S132 PolarHBondContact OD1-OG 3.26Å; D130-S132 PolarHBondContact OD2-OG 3.01Å; D130-S132 VanDerWaalsContact OD2-OG 3.04Å
131	L	40.5	Very low	38.3	Very low	71 Å²	71	116 Å²	116	37%	0.372	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-90.4	8.1	180	-72.2	171.4	0	0	0	112.9	P129 E133 F134	P129-L131 PolarHBondContact O-N 3.49Å; L131-E133 PolarHBondContact O-N 2.92Å; L131-E133 VanDerWaalsContact O-N 3.11Å; L131-F134 HydrophobicContact CB-CD2 4.39Å; L131-F134 HydrophobicContact CD2-CD2 3.47Å; L131-F134 VanDerWaalsContact CD2-CD2 3.47Å; L131-F134 HydrophobicContact CD2-CE2 3.85Å; L131-F134 HydrophobicContact CD2-CG 4.43Å; L131-F134 PolarHBondContact O-N 3.42Å
132	S	44.3	Very low	37.4	Very low	74 Å²	74	116.1 Å²	116.1	52%	0.517	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-58.6	-20.9	174.6	58.7	0	0	0	0	113	D130 F134	D130-S132 VanDerWaalsContact C-N 3.31Å; D130-S132 VanDerWaalsContact OD1-CB 3.27Å; D130-S132 WeakPolarHBondContact OD1-CB 3.4Å; D130-S132 PolarHBondContact OD1-N 2.88Å; D130-S132 PolarHBondContact OD1-OG 3.26Å; D130-S132 PolarHBondContact OD2-OG 3.01Å; D130-S132 VanDerWaalsContact OD2-OG 3.04Å; S132-F134 PolarHBondContact O-N 3.49Å
133	E	40.6	Very low	36.5	Very low	165 Å²	165	119.8 Å²	119.8	77%	0.771	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-67.8	-16.3	172.3	-66.2	-171.6	169.1	0	0	114.5	L131	L131-E133 PolarHBondContact O-N 2.92Å; L131-E133 VanDerWaalsContact O-N 3.11Å
134	F	42.2	Very low	35.6	Very low	144 Å²	144	123.3 Å²	123.3	63%	0.632	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-113.2	-0.2	-171.8	-56.4	-77.4	0	0	0	114.4	L131 S132	L131-F134 HydrophobicContact CB-CD2 4.39Å; L131-F134 HydrophobicContact CD2-CD2 3.47Å; L131-F134 VanDerWaalsContact CD2-CD2 3.47Å; L131-F134 HydrophobicContact CD2-CE2 3.85Å; L131-F134 HydrophobicContact CD2-CG 4.43Å; L131-F134 PolarHBondContact O-N 3.42Å; S132-F134 PolarHBondContact O-N 3.49Å
135	L	34.9	Very low	34.8	Very low	138 Å²	138	121.1 Å²	121.1	72%	0.723	67%	0.673	S	S	*	*	S	Bend	trans	-84.2	126.6	169.7	-70.1	175.5	0	0	0	109.4	G137	L135-G137 PolarHBondContact O-N 3.24Å; L135-G137 VanDerWaalsContact O-N 3.16Å
136	P	35.4	Very low	33.9	Very low	113 Å²	113	124.2 Å²	124.2	73%	0.734	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-57.8	122.8	-179.7	-20.1	29.9	0	0	0	110.5	Y138	P136-Y138 PolarHBondContact O-N 2.92Å
137	G	32.7	Very low	33.2	Very low	72 Å²	72	126.8 Å²	126.8	74%	0.742	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-53.5	123.2	175.3	0	0	0	0	0	110.5	L135 S139	L135-G137 PolarHBondContact O-N 3.24Å; L135-G137 VanDerWaalsContact O-N 3.16Å; G137-S139 VanDerWaalsContact C-N 3.32Å; G137-S139 PolarHBondContact O-N 3.5Å
138	Y	29.3	Very low	32.3	Very low	231 Å²	231	122.6 Å²	122.6	91%	0.906	71%	0.71	S	S	*	*			trans	-61.5	92.8	174.4	-77.7	-93.2	0	0	0	109.2	P136 T140	P136-Y138 PolarHBondContact O-N 2.92Å; Y138-T140 PolarHBondContact O-N 2.75Å; Y138-T140 VanDerWaalsContact O-N 3.11Å
139	S	25.8	Very low	31.4	Very low	106 Å²	106	123 Å²	123	74%	0.741	73%	0.729	S	S	*	*			trans	-68	107.8	172.7	178.6	0	0	0	0	108.8	G137 C141	G137-S139 VanDerWaalsContact C-N 3.32Å; G137-S139 PolarHBondContact O-N 3.5Å; S139-C141 PolarHBondContact O-N 2.72Å
140	T	24.1	Very low	30.8	Very low	135 Å²	135	126.7 Å²	126.7	83%	0.828	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-60.1	117.4	171.6	48.2	0	0	0	0	110.5	Y138	Y138-T140 PolarHBondContact O-N 2.75Å; Y138-T140 VanDerWaalsContact O-N 3.11Å
141	C	22.4	Very low	29.7	Very low	116 Å²	116	125.5 Å²	125.5	78%	0.784	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-96.9	142	163	-72.6	0	0	0	0	109.6	S139	S139-C141 PolarHBondContact O-N 2.72Å
142	P	25.4	Very low	28.9	Very low	117 Å²	117	127 Å²	127	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-90.8	144.3	-164.1	26.2	-14.5	0	0	0	113.8
143	E	24	Very low	28.2	Very low	176 Å²	176	128.1 Å²	128.1	82%	0.822	79%	0.794	S	S	*	*			trans	37.6	103.5	142.1	-61.6	-179.3	171.3	0	0	118.3
144	N	26.8	Very low	27.5	Very low	170 Å²	170	129.5 Å²	129.5	91%	0.909	80%	0.8	S	S	*	*			trans	-118.7	111.9	143.3	-87.8	-25.4	0	0	0	108.3
145	T	24.4	Very low	27	Very low	114 Å²	114	128.5 Å²	128.5	70%	0.699	81%	0.811	S	S	*	*			trans	-60.6	130.9	164.2	46	0	0	0	0	109.9
146	D	25	Very low	26.8	Very low	147 Å²	147	131 Å²	131	79%	0.786	82%	0.819	S	S	*	*				166.9	142.8	120.2	-83.1	-21.3	0	0	0	114.1
147	S	28.4	Very low	26.4	Very low	128 Å²	128	131.3 Å²	131.3	90%	0.895	82%	0.824	S	S	*	*			trans	88.8	129.6	156	76.8	0	0	0	0	119.5
148	A	23.7	Very low	26.4	Very low	106 Å²	106	135.7 Å²	135.7	88%	0.876	83%	0.829	S	S	*	*			trans	-109.1	163	-167	0	0	0	0	0	112.1
149	G	23.6	Very low	26.4	Very low	71 Å²	71	130.2 Å²	130.2	73%	0.732	83%	0.825	S	S	*	*			trans	107.9	122.8	173.1	0	0	0	0	0	111
150	T	28.2	Very low	27	Very low	147 Å²	147	130 Å²	130	90%	0.902	82%	0.819	S	S	*	*			cis	-164.8	143.6	46.9	-33.6	0	0	0	0	108.7
151	A	21.9	Very low	27.7	Very low	95 Å²	95	131.6 Å²	131.6	79%	0.785	82%	0.815	S	S	*	*			trans	-80	143.8	174.3	0	0	0	0	0	112
152	A	24	Very low	28.5	Very low	101 Å²	101	134.5 Å²	134.5	84%	0.835	81%	0.811	S	S	*	*			trans	158.2	150.4	133.5	0	0	0	0	0	113.4
153	A	28.6	Very low	29.2	Very low	98 Å²	98	134.1 Å²	134.1	81%	0.81	80%	0.801	S	S	*	*			trans	90.8	100	162.7	0	0	0	0	0	118.2
154	H	26.3	Very low	30.1	Very low	195 Å²	195	129 Å²	129	90%	0.903	78%	0.779	S	S	*	*			trans	-70.4	140.6	168	-65.2	-89.3	0	0	0	112.1
155	S	31.7	Very low	31	Very low	122 Å²	122	131.1 Å²	131.1	85%	0.853	78%	0.784	S	S	*	*			trans	-158.4	148.2	151.9	-139.8	0	0	0	0	110.2
156	E	30.4	Very low	32.2	Very low	190 Å²	190	129.2 Å²	129.2	89%	0.888	78%	0.775	S	S	*	*			trans	-64.6	149.1	-153.1	-66.4	155.7	152.2	0	0	117.6
157	S	28.6	Very low	32.9	Very low	121 Å²	121	124.7 Å²	124.7	85%	0.846	76%	0.763	S	S	*	*			trans	-103	104.3	-174.4	54.2	0	0	0	0	112
158	L	31.1	Very low	33.5	Very low	163 Å²	163	124.8 Å²	124.8	85%	0.853	75%	0.749	S	S	*	*			trans	-106.4	113.9	161.5	-89.8	148.8	0	0	0	107.7	V160	L158-V160 VanDerWaalsContact C-N 3.29Å; L158-V160 PolarHBondContact O-N 3.46Å
159	S	30.3	Very low	34.2	Very low	117 Å²	117	124.2 Å²	124.2	82%	0.818	73%	0.731	S	S	*	*			trans	-74.7	79.7	179.4	61.4	0	0	0	0	110.2
160	V	37.2	Very low	35.1	Very low	102 Å²	102	128 Å²	128	62%	0.618	73%	0.727	S	S	*	*			trans	-118.3	126.5	165.9	-178.6	0	0	0	0	106.6	L158 Y162	L158-V160 VanDerWaalsContact C-N 3.29Å; L158-V160 PolarHBondContact O-N 3.46Å; V160-Y162 PolarHBondContact O-N 3.02Å
161	F	38.8	Very low	36.2	Very low	167 Å²	167	130.4 Å²	130.4	73%	0.732	73%	0.725	S	S	*	*			trans	-49.2	97.6	178.5	-68.5	-90.8	0	0	0	110.8
162	Y	40.4	Very low	37.2	Very low	178 Å²	178	131.2 Å²	131.2	70%	0.698	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-103.6	120.5	176.1	-121.4	-86.9	0	0	0	109.9	V160	V160-Y162 PolarHBondContact O-N 3.02Å
163	I	39.7	Very low	38.2	Very low	108 Å²	108	128.2 Å²	128.2	55%	0.554	69%	0.689	S	S	*	*	B	Isolated β-bridge	trans	-92.5	123.9	165.6	-56.6	173.1	0	0	0	104.9
164	N	42	Very low	38.5	Very low	70 Å²	70	130.3 Å²	130.3	37%	0.374	69%	0.686	S	S	.	*	P	Polyproline II helix	trans	-71.5	167.5	173.2	56.8	11.5	0	0	0	110.5	S166 G167 Q168	N164-S166 PolarHBondContact ND2-OG 3.5Å; N164-S166 PolarHBondContact O-N 3.33Å; N164-S166 PolarHBondContact OD1-OG 3.3Å; N164-S166 VanDerWaalsContact OD1-OG 3.11Å; N164-G167 PolarHBondContact O-N 2.96Å; N164-G167 PolarHBondContact OD1-N 2.96Å; N164-Q168 WeakPolarHBondContact OD1-CA 3.41Å; N164-Q168 PolarHBondContact OD1-N 2.89Å; N164-Q168 PolarHBondContact OD1-O 3.38Å
165	E	45.8	Very low	38.9	Very low	213 Å²	213	128 Å²	128	100%	0.995	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-16.6	-177.7	-62.3	-168.3	166.6	0	0	114
166	S	49.7	Very low	39	Very low	75 Å²	75	127.1 Å²	127.1	52%	0.524	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	7	174.9	59.5	0	0	0	0	114.7	N164 Q168	N164-S166 PolarHBondContact ND2-OG 3.5Å; N164-S166 PolarHBondContact O-N 3.33Å; N164-S166 PolarHBondContact OD1-OG 3.3Å; N164-S166 VanDerWaalsContact OD1-OG 3.11Å; S166-Q168 VanDerWaalsContact C-N 3.28Å; S166-Q168 PolarHBondContact O-N 3.38Å
167	G	40.6	Very low	39.1	Very low	51 Å²	51	123.8 Å²	123.8	53%	0.526	66%	0.663	S	S	.	*	S	Bend	trans	76	10	175.5	0	0	0	0	0	114.7	N164	N164-G167 PolarHBondContact O-N 2.96Å; N164-G167 PolarHBondContact OD1-N 2.96Å
168	Q	40.5	Very low	39.4	Very low	130 Å²	130	124.6 Å²	124.6	61%	0.607	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-94.6	132.4	-179.4	-65.6	-175.2	-4.2	0	0	111.3	N164 S166 K170	N164-Q168 WeakPolarHBondContact OD1-CA 3.41Å; N164-Q168 PolarHBondContact OD1-N 2.89Å; N164-Q168 PolarHBondContact OD1-O 3.38Å; S166-Q168 VanDerWaalsContact C-N 3.28Å; S166-Q168 PolarHBondContact O-N 3.38Å; Q168-K170 PolarHBondContact O-N 3.45Å
169	L	39.4	Very low	39.3	Very low	95 Å²	95	120.1 Å²	120.1	50%	0.497	66%	0.657	S	S	.	*	B	Isolated β-bridge	trans	-66.7	125.4	171.3	-145.6	97.5	0	0	0	108.7	K171 L174	L169-K171 PolarHBondContact O-N 2.92Å; L169-L174 HydrophobicContact CD2-CD1 4.39Å; L169-L174 HydrophobicContact CD2-CG 4.22Å
170	K	41.6	Very low	39.1	Very low	151 Å²	151	118.1 Å²	118.1	66%	0.657	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-60.6	132.7	173.3	-137.8	-176.4	-175.3	-176.2	0	108.4	Q168 N172 S173	Q168-K170 PolarHBondContact O-N 3.45Å; K170-N172 PolarHBondContact O-N 3.4Å; K170-S173 VanDerWaalsContact O-CB 3.3Å; K170-S173 WeakPolarHBondContact O-CB 3.25Å; K170-S173 PolarHBondContact O-N 2.86Å; K170-S173 PolarHBondContact O-OG 3.4Å; K170-S173 VanDerWaalsContact O-OG 3.09Å
171	K	51.6	Low	38.5	Very low	197 Å²	197	117 Å²	117	86%	0.857	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-54.8	-25.3	-172.6	-71.8	-175.9	176.8	-178.8	0	114.2	L169	L169-K171 PolarHBondContact O-N 2.92Å
172	N	42.5	Very low	38.1	Very low	112 Å²	112	118.3 Å²	118.3	60%	0.599	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-89.6	-3.3	-177.3	-53.7	30.8	0	0	0	112.9	K170 L174 E175	K170-N172 PolarHBondContact O-N 3.4Å; N172-L174 PolarHBondContact O-N 3.39Å; N172-L174 VanDerWaalsContact O-N 3.11Å; N172-E175 PolarHBondContact O-N 3.18Å; N172-E175 VanDerWaalsContact O-N 3.16Å
173	S	45.3	Very low	37.2	Very low	38 Å²	38	121.2 Å²	121.2	27%	0.266	68%	0.679	S	S	.	*	G	3₁₀ helix	trans	-65.5	-13	-178.5	-63.4	0	0	0	0	113.7	K170	K170-S173 VanDerWaalsContact O-CB 3.3Å; K170-S173 WeakPolarHBondContact O-CB 3.25Å; K170-S173 PolarHBondContact O-N 2.86Å; K170-S173 PolarHBondContact O-OG 3.4Å; K170-S173 VanDerWaalsContact O-OG 3.09Å
174	L	36.1	Very low	36.5	Very low	141 Å²	141	125.5 Å²	125.5	74%	0.738	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-108.5	-1.9	178.1	-65.8	173.8	0	0	0	113.5	L169 N172 C176	L169-L174 HydrophobicContact CD2-CD1 4.39Å; L169-L174 HydrophobicContact CD2-CG 4.22Å; N172-L174 PolarHBondContact O-N 3.39Å; N172-L174 VanDerWaalsContact O-N 3.11Å; L174-C176 PolarHBondContact O-N 3.11Å
175	E	33.2	Very low	35.7	Very low	146 Å²	146	127.3 Å²	127.3	68%	0.682	71%	0.709	S	S	*	*			trans	-85.8	103.8	175.6	-74.6	-179.6	170.1	0	0	109	N172	N172-E175 PolarHBondContact O-N 3.18Å; N172-E175 VanDerWaalsContact O-N 3.16Å
176	C	33.6	Very low	34.7	Very low	105 Å²	105	124.8 Å²	124.8	71%	0.709	70%	0.701	S	S	*	*			trans	-53.9	138.1	163	-74.3	0	0	0	0	108.3	L174 T178	L174-C176 PolarHBondContact O-N 3.11Å; C176-T178 PolarHBondContact O-N 3.15Å
177	P	33.3	Very low	33.7	Very low	120 Å²	120	130.3 Å²	130.3	78%	0.779	72%	0.715	S	S	*	*			trans	-60.6	102.2	178.3	23.3	-29.9	0	0	0	108.5	G179	P177-G179 PolarHBondContact O-N 2.84Å
178	T	34.4	Very low	32.9	Very low	138 Å²	138	136.9 Å²	136.9	85%	0.847	73%	0.73	S	S	*	*			trans	-71	85	167.7	52.1	0	0	0	0	106.2	C176 G180	C176-T178 PolarHBondContact O-N 3.15Å; T178-G180 PolarHBondContact O-N 3.32Å
179	G	29.8	Very low	32.3	Very low	69 Å²	69	140 Å²	140	71%	0.711	74%	0.744	S	S	*	*			trans	-52.2	110.9	169.4	0	0	0	0	0	108.5	P177 G181	P177-G179 PolarHBondContact O-N 2.84Å; G179-G181 PolarHBondContact O-N 2.88Å
180	G	26.4	Very low	31.8	Very low	75 Å²	75	142.4 Å²	142.4	77%	0.773	76%	0.758	S	S	*	*			trans	-49.3	135.9	173.6	0	0	0	0	0	110.3	T178 K182	T178-G180 PolarHBondContact O-N 3.32Å; G180-K182 PolarHBondContact O-N 3.09Å
181	G	24.9	Very low	30.9	Very low	78 Å²	78	143 Å²	143	80%	0.804	77%	0.768	S	S	*	*			trans	-58.2	126.3	-162.6	0	0	0	0	0	114.3	G179	G179-G181 PolarHBondContact O-N 2.88Å
182	K	30	Very low	29.7	Very low	195 Å²	195	139.6 Å²	139.6	85%	0.848	77%	0.767	S	S	*	*			trans	-118.7	95	141.2	-77.4	-173.2	177.4	178.4	0	107.6	G180 F184	G180-K182 PolarHBondContact O-N 3.09Å; K182-F184 PolarHBondContact O-N 2.66Å
183	R	22.1	Very low	28.9	Very low	239 Å²	239	139.1 Å²	139.1	90%	0.902	77%	0.773	S	S	*	*			trans	-51.3	121.3	166.7	-81.2	175.6	170.1	168.9	-3	109.3
184	F	23.7	Very low	28.1	Very low	198 Å²	198	144.2 Å²	144.2	87%	0.868	80%	0.802	S	S	*	*			trans	-113.3	120.1	145.5	-80.5	-78.8	0	0	0	107.6	K182	K182-F184 PolarHBondContact O-N 2.66Å
185	P	25.2	Very low	27.8	Very low	107 Å²	107	143.5 Å²	143.5	70%	0.695	80%	0.804	S	S	*	*			trans	-92.3	136	-177.3	34.6	-29.4	0	0	0	110.7
186	I	26.1	Very low	27.4	Very low	161 Å²	161	141.3 Å²	141.3	83%	0.826	81%	0.811	S	S	*	*			trans	167.1	120.5	167.8	-94.9	151.7	0	0	0	103.9
187	F	28	Very low	27.1	Very low	190 Å²	190	140.5 Å²	140.5	83%	0.833	81%	0.811	S	S	*	*			cis	-140.2	140.6	11	-111.3	-116	0	0	0	108.4
188	K	22.9	Very low	26.8	Very low	189 Å²	189	140.7 Å²	140.7	82%	0.822	81%	0.813	S	S	*	*			trans	-78	136.5	161.3	-71.2	176.7	172.5	-178.1	0	108
189	Q	28.2	Very low	26.6	Very low	195 Å²	195	140.7 Å²	140.7	91%	0.911	81%	0.813	S	S	*	*			trans	-129.1	121.8	158.4	-133.3	177.3	-2	0	0	107.9
190	D	28.9	Very low	26.4	Very low	146 Å²	146	146.7 Å²	146.7	78%	0.781	82%	0.819	S	S	*	*			trans	-71.6	141.6	-165.2	-69.7	-51.6	0	0	0	113.1	C192	D190-C192 PolarHBondContact O-N 3.23Å
191	N	23.3	Very low	26.4	Very low	165 Å²	165	151.1 Å²	151.1	88%	0.882	83%	0.825	S	S	*	*			trans	-51.3	121.8	163.6	-75.6	-30.5	0	0	0	110.8
192	C	26.2	Very low	26.5	Very low	124 Å²	124	152.8 Å²	152.8	84%	0.838	82%	0.821	S	S	*	*			trans	-119.1	99.8	158.5	-133.7	0	0	0	0	108.6	D190 V194	D190-C192 PolarHBondContact O-N 3.23Å; C192-V194 PolarHBondContact O-N 3.01Å
193	S	26	Very low	26.7	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	82%	0.818	S	S	*	*			trans	-66.5	116.7	173.9	49.3	0	0	0	0	110.5	T195	S193-T195 PolarHBondContact O-N 3.3Å
194	V	27.7	Very low	26.9	Very low	145 Å²	145	141.9 Å²	141.9	88%	0.879	82%	0.816	S	S	*	*			trans	-92.1	96.3	169.5	179.9	0	0	0	0	107.8	C192	C192-V194 PolarHBondContact O-N 3.01Å
195	T	30.4	Very low	26.9	Very low	125 Å²	125	140.2 Å²	140.2	77%	0.767	81%	0.811	S	S	*	*			trans	-80.3	135.7	169.9	45.2	0	0	0	0	110.9	S193	S193-T195 PolarHBondContact O-N 3.3Å
196	A	24.6	Very low	26.8	Very low	100 Å²	100	143.5 Å²	143.5	83%	0.826	82%	0.817	S	S	*	*			trans	-59.9	142.5	175.5	0	0	0	0	0	114.1
197	A	27.4	Very low	26.8	Very low	88 Å²	88	140.9 Å²	140.9	73%	0.727	81%	0.813	S	S	*	*			trans	-175.8	120.8	134.6	0	0	0	0	0	110.2
198	P	26.4	Very low	26.6	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	81%	0.814	S	S	*	*			trans	-93.2	124.4	170.6	33.5	-25.2	0	0	0	109.2
199	T	30.8	Very low	27	Very low	139 Å²	139	137.9 Å²	137.9	85%	0.853	81%	0.814	S	S	*	*			trans	-141.5	122.1	165.3	-36.5	0	0	0	0	110.7
200	K	24.9	Very low	26.8	Very low	194 Å²	194	133.5 Å²	133.5	84%	0.843	81%	0.811	S	S	*	*			trans	-51.9	138.3	176.9	-65.3	166.5	170.3	176.9	0	112.2
201	L	25.9	Very low	26.7	Very low	169 Å²	169	131 Å²	131	89%	0.885	81%	0.81	S	S	*	*				-177.8	133.6	123.2	-99.9	141.1	0	0	0	111.1
202	P	28	Very low	26.8	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	81%	0.811	S	S	*	*			trans	-98	-174.8	-177.1	44.8	-38.8	0	0	0	111.4
203	P	34.2	Very low	26.7	Very low	120 Å²	120	127.4 Å²	127.4	78%	0.779	80%	0.803	S	S	*	*	P	Polyproline II helix		-101.9	137.9	-104.9	22.7	-1	0	0	0	113
204	G	26.7	Very low	26.9	Very low	84 Å²	84	132 Å²	132	87%	0.866	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-88.3	129.2	172.1	0	0	0	0	0	111.5
205	E	22.6	Very low	26.9	Very low	164 Å²	164	129.7 Å²	129.7	77%	0.766	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73.1	160.6	176.1	-56.9	167.6	139.5	0	0	112.5
206	H	24	Very low	26.7	Very low	175 Å²	175	131.7 Å²	131.7	81%	0.81	81%	0.807	S	S	*	*			trans	66.6	112.2	153.6	-57.8	-56.9	0	0	0	120.2
207	S	26.4	Very low	26.7	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	81%	0.806	S	S	*	*			trans	172	106	131.5	-164.8	0	0	0	0	107.4
208	E	23	Very low	26.5	Very low	182 Å²	182	135.9 Å²	135.9	85%	0.85	81%	0.813	S	S	*	*				45.9	95.4	87.9	-72.6	-167.6	169.9	0	0	114.7
209	T	30.7	Very low	26.4	Very low	134 Å²	134	139.4 Å²	139.4	82%	0.822	82%	0.815	S	S	*	*			trans	-158.5	105.2	146.4	50.7	0	0	0	0	106
210	A	24	Very low	26.2	Very low	103 Å²	103	141 Å²	141	85%	0.851	82%	0.817	S	S	*	*				61.6	87.1	64.5	0	0	0	0	0	114
211	A	28.7	Very low	26.2	Very low	93 Å²	93	134 Å²	134	77%	0.769	80%	0.8	S	S	*	*			trans	-168.1	98.6	151.8	0	0	0	0	0	109
212	V	24.8	Very low	26.2	Very low	148 Å²	148	130.5 Å²	130.5	90%	0.897	79%	0.79	S	S	*	*				80.7	102.4	89.9	175.9	0	0	0	0	113.1
213	G	24.2	Very low	26.2	Very low	66 Å²	66	132.6 Å²	132.6	68%	0.68	79%	0.794	S	S	*	*				82.2	101.6	121.7	0	0	0	0	0	119.4
214	K	30.6	Very low	25.9	Very low	199 Å²	199	132.5 Å²	132.5	87%	0.865	79%	0.792	S	S	*	*			trans	160	88.6	135.3	-89.3	168.9	-178.3	-176.9	0	108.4
215	S	26.2	Very low	26	Very low	97 Å²	97	133.7 Å²	133.7	68%	0.678	79%	0.786	S	S	*	*				59.1	97.8	94.3	72.8	0	0	0	0	114.3
216	D	26	Very low	26.4	Very low	168 Å²	168	137.1 Å²	137.1	90%	0.898	79%	0.792	S	S	*	*			trans	54.3	82.8	131.3	-56.5	-33.8	0	0	0	118.8
217	G	25.6	Very low	26.8	Very low	79 Å²	79	140.6 Å²	140.6	81%	0.814	80%	0.798	S	S	*	*			trans	-126.3	79.9	155.2	0	0	0	0	0	109.8
218	F	22.3	Very low	27	Very low	197 Å²	197	139 Å²	139	86%	0.864	80%	0.799	S	S	*	*			trans	38	98.3	161.1	-106	-104.8	0	0	0	118.3	I220	F218-I220 PolarHBondContact O-N 2.73Å; F218-I220 VanDerWaalsContact O-N 3.16Å
219	K	25	Very low	27.4	Very low	197 Å²	197	136.3 Å²	136.3	86%	0.857	80%	0.798	S	S	*	*			trans	-54.2	114.1	153.3	-82	175.3	174	173.1	0	109.6	G221	K219-G221 PolarHBondContact O-N 2.71Å
220	I	26.4	Very low	27.9	Very low	172 Å²	172	139 Å²	139	88%	0.882	80%	0.798	S	S	*	*			trans	-77.8	91.3	143.4	-63.1	177	0	0	0	105.1	F218	F218-I220 PolarHBondContact O-N 2.73Å; F218-I220 VanDerWaalsContact O-N 3.16Å
221	G	25.8	Very low	28.6	Very low	48 Å²	48	140.8 Å²	140.8	50%	0.495	79%	0.794	S	S	.	*			trans	-63.4	139.1	170.3	0	0	0	0	0	110.6	K219 L223	K219-G221 PolarHBondContact O-N 2.71Å; G221-L223 PolarHBondContact O-N 3.15Å; G221-L223 VanDerWaalsContact O-N 3.11Å
222	S	25.7	Very low	29.1	Very low	96 Å²	96	141.4 Å²	141.4	67%	0.671	79%	0.791	S	S	*	*			trans	-19.5	105.1	155.3	164.3	0	0	0	0	113.8	T224	S222-T224 VanDerWaalsContact C-N 3.34Å; S222-T224 PolarHBondContact OG-N 3.36Å; S222-T224 PolarHBondContact OG-OG1 2.96Å; S222-T224 VanDerWaalsContact OG-OG1 3.06Å
223	L	27	Very low	30.1	Very low	156 Å²	156	138.7 Å²	138.7	82%	0.817	78%	0.779	S	S	*	*			trans	-96.8	69.5	151.1	-85.9	160.7	0	0	0	107.9	G221	G221-L223 PolarHBondContact O-N 3.15Å; G221-L223 VanDerWaalsContact O-N 3.11Å
224	T	28.5	Very low	31.1	Very low	119 Å²	119	143.2 Å²	143.2	73%	0.73	78%	0.783	S	S	*	*			trans	-68.6	128	145	43.9	0	0	0	0	106.8	S222	S222-T224 VanDerWaalsContact C-N 3.34Å; S222-T224 PolarHBondContact OG-N 3.36Å; S222-T224 PolarHBondContact OG-OG1 2.96Å; S222-T224 VanDerWaalsContact OG-OG1 3.06Å
225	S	28.9	Very low	31.9	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	77%	0.77	S	S	*	*			trans	78.8	89.6	178.7	-161.8	0	0	0	0	117.4
226	R	30.6	Very low	32.9	Very low	236 Å²	236	143.1 Å²	143.1	89%	0.891	77%	0.773	S	S	*	*				-152.5	126.6	126.6	-116.9	175.4	-174.5	-174.9	1.5	111.6
227	R	32.4	Very low	33.9	Very low	249 Å²	249	141.5 Å²	141.5	94%	0.94	76%	0.763	S	S	*	*			trans	-46.2	132.3	166.9	-74.8	173.2	174.6	171.9	-2.6	110.9
228	G	30.4	Very low	35.1	Very low	72 Å²	72	141.6 Å²	141.6	74%	0.742	75%	0.751	S	S	*	*			trans	58.1	96.3	142.8	0	0	0	0	0	117.8
229	C	32.1	Very low	36.4	Very low	125 Å²	125	136.6 Å²	136.6	85%	0.845	73%	0.733	S	S	*	*			trans	-114.3	86.3	140	-158.6	0	0	0	0	107.5
230	K	39.9	Very low	37.5	Very low	190 Å²	190	132 Å²	132	83%	0.826	72%	0.717	S	S	*	*			trans	-81.6	111.5	159.9	-69.6	-179	178.4	-177.4	0	104.6
231	N	40.1	Very low	38.8	Very low	141 Å²	141	127.7 Å²	127.7	75%	0.754	70%	0.699	S	S	*	*			trans	124.3	102.7	165.8	-62.5	-10	0	0	0	111.7
232	C	39.6	Very low	40.2	Very low	106 Å²	106	127.4 Å²	127.4	72%	0.716	69%	0.692	S	S	*	*				172.1	111.3	126	-94	0	0	0	0	109.7	E234	C232-E234 PolarHBondContact O-N 2.81Å
233	S	45.8	Very low	41.5	Very low	92 Å²	92	127 Å²	127	64%	0.643	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	25.6	-22.7	143.9	40.7	0	0	0	0	124.3	V235 R236	S233-V235 VanDerWaalsContact C-N 3.35Å; S233-V235 PolarHBondContact O-N 3.49Å; S233-R236 PolarHBondContact O-N 2.82Å
234	E	43.6	Very low	42.8	Very low	161 Å²	161	125.6 Å²	125.6	75%	0.752	67%	0.672	S	S	*	*	H	α-helix	trans	-71	-29.2	-174.8	-74.8	-176.1	160.7	0	0	113.2	C232 R236 L237	C232-E234 PolarHBondContact O-N 2.81Å; E234-R236 PolarHBondContact O-N 3.35Å; E234-L237 PolarHBondContact O-N 3.02Å
235	V	48.1	Very low	44.4	Very low	100 Å²	100	124.8 Å²	124.8	61%	0.606	66%	0.662	S	S	*	*	H	α-helix	trans	-62.1	-26.3	175.3	-177.3	0	0	0	0	111.8	S233 N239	S233-V235 VanDerWaalsContact C-N 3.35Å; S233-V235 PolarHBondContact O-N 3.49Å; V235-N239 WeakPolarHBondContact O-CB 3.46Å; V235-N239 VanDerWaalsContact O-CG 3.27Å; V235-N239 PolarHBondContact O-N 3Å; V235-N239 VanDerWaalsContact O-N 3.08Å; V235-N239 PolarHBondContact O-ND2 2.92Å
236	R	46.6	Very low	45.8	Very low	193 Å²	193	126.4 Å²	126.4	73%	0.728	66%	0.656	S	S	*	*	H	α-helix	trans	-69.4	-36.6	-179.7	-69.1	-171.4	-170.7	174.5	3	112.5	S233 E234 N239 L240	S233-R236 PolarHBondContact O-N 2.82Å; E234-R236 PolarHBondContact O-N 3.35Å; R236-N239 PolarHBondContact O-N 2.92Å; R236-L240 PolarHBondContact O-N 3.24Å
237	L	46.8	Very low	47.3	Very low	134 Å²	134	119 Å²	119	70%	0.702	64%	0.637	S	S	*	*	H	α-helix	trans	-69.8	-43.7	180	-128.6	94.8	0	0	0	111	E234 N239 L240 T241	E234-L237 PolarHBondContact O-N 3.02Å; L237-N239 VanDerWaalsContact C-N 3.28Å; L237-N239 PolarHBondContact O-N 2.81Å; L237-L240 PolarHBondContact O-N 2.88Å; L237-T241 PolarHBondContact O-N 2.86Å; L237-T241 VanDerWaalsContact O-N 3.1Å; L237-T241 PolarHBondContact O-OG1 2.91Å; L237-T241 VanDerWaalsContact O-OG1 3.1Å
238	C	51.4	Low	48.8	Very low	82 Å²	82	110.5 Å²	110.5	55%	0.554	62%	0.615	S	S	*	*	H	α-helix	trans	-61.7	-37.7	176.3	-59.1	0	0	0	0	111.9	T241 A242	C238-T241 WeakPolarHBondContact CA-OG1 3.35Å; C238-T241 PolarHBondContact O-OG1 3.02Å; C238-A242 VanDerWaalsContact O-CB 3.29Å; C238-A242 WeakPolarHBondContact O-CB 3.43Å; C238-A242 PolarHBondContact O-N 2.89Å
239	N	49.2	Very low	50.6	Low	91 Å²	91	112 Å²	112	49%	0.487	61%	0.606	S	S	.	*	H	α-helix	trans	-68.4	-39.3	176.9	-78.4	-12.5	0	0	0	112.8	V235 R236 L237 A242 Q243	V235-N239 WeakPolarHBondContact O-CB 3.46Å; V235-N239 VanDerWaalsContact O-CG 3.27Å; V235-N239 PolarHBondContact O-N 3Å; V235-N239 VanDerWaalsContact O-N 3.08Å; V235-N239 PolarHBondContact O-ND2 2.92Å; R236-N239 PolarHBondContact O-N 2.92Å; L237-N239 VanDerWaalsContact C-N 3.28Å; L237-N239 PolarHBondContact O-N 2.81Å; N239-A242 PolarHBondContact O-N 2.96Å; N239-Q243 WeakPolarHBondContact O-CB 3.45Å; N239-Q243 WeakPolarHBondContact O-CG 3.22Å; N239-Q243 PolarHBondContact O-N 2.96Å
240	L	48.4	Very low	52	Low	101 Å²	101	110.9 Å²	110.9	53%	0.529	59%	0.587	S	S	.	*	H	α-helix	trans	-64.2	-44.9	176	-91.3	152.4	0	0	0	112	R236 L237 A242 Q243 L244	R236-L240 PolarHBondContact O-N 3.24Å; L237-L240 PolarHBondContact O-N 2.88Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.16Å; L240-Q243 PolarHBondContact O-N 2.99Å; L240-L244 PolarHBondContact O-N 3.21Å
241	T	53.9	Low	53.4	Low	82 Å²	82	108.4 Å²	108.4	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-63.9	-39.9	174.8	43.7	0	0	0	0	112.1	L237 C238 Q243 L244 I245	L237-T241 PolarHBondContact O-N 2.86Å; L237-T241 VanDerWaalsContact O-N 3.1Å; L237-T241 PolarHBondContact O-OG1 2.91Å; L237-T241 VanDerWaalsContact O-OG1 3.1Å; C238-T241 WeakPolarHBondContact CA-OG1 3.35Å; C238-T241 PolarHBondContact O-OG1 3.02Å; T241-Q243 VanDerWaalsContact C-N 3.35Å; T241-L244 PolarHBondContact O-N 3.42Å; T241-I245 WeakPolarHBondContact O-CD1 3.48Å; T241-I245 VanDerWaalsContact O-CG1 3.28Å; T241-I245 WeakPolarHBondContact O-CG1 3.38Å; T241-I245 PolarHBondContact O-N 2.94Å; T241-I245 VanDerWaalsContact O-N 3.07Å
242	A	54.5	Low	55.1	Low	41 Å²	41	107.7 Å²	107.7	34%	0.339	57%	0.572	S	S	.	*	H	α-helix	trans	-67.3	-34.9	175.7	0	0	0	0	0	112.3	C238 N239 L240 K246	C238-A242 VanDerWaalsContact O-CB 3.29Å; C238-A242 WeakPolarHBondContact O-CB 3.43Å; C238-A242 PolarHBondContact O-N 2.89Å; N239-A242 PolarHBondContact O-N 2.96Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.16Å; A242-K246 WeakPolarHBondContact O-CG 3.33Å; A242-K246 PolarHBondContact O-N 3.36Å
243	Q	53.3	Low	56.7	Low	87 Å²	87	108.5 Å²	108.5	41%	0.407	56%	0.563	S	S	.	*	H	α-helix	trans	-66.3	-44.6	173.4	-85.9	176	-34.3	0	0	111.6	N239 L240 T241 I245 K246 V247 E422	N239-Q243 WeakPolarHBondContact O-CB 3.45Å; N239-Q243 WeakPolarHBondContact O-CG 3.22Å; N239-Q243 PolarHBondContact O-N 2.96Å; L240-Q243 PolarHBondContact O-N 2.99Å; T241-Q243 VanDerWaalsContact C-N 3.35Å; Q243-I245 VanDerWaalsContact C-N 3.34Å; Q243-I245 PolarHBondContact O-N 3.43Å; Q243-K246 WeakPolarHBondContact O-CB 3.36Å; Q243-K246 PolarHBondContact O-N 2.97Å; Q243-K246 VanDerWaalsContact O-N 3.15Å; Q243-V247 WeakPolarHBondContact O-CG2 3.48Å; Q243-V247 PolarHBondContact O-N 3.4Å; Q243-E422 PolarHBondContact NE2-OE1 3Å
244	L	54.6	Low	57.9	Low	128 Å²	128	109.3 Å²	109.3	67%	0.67	56%	0.56	S	S	*	*	H	α-helix	trans	-61.7	-42	177	-116	112.9	0	0	0	112.1	L240 T241 K246 V247 S248	L240-L244 PolarHBondContact O-N 3.21Å; T241-L244 PolarHBondContact O-N 3.42Å; L244-K246 VanDerWaalsContact C-N 3.32Å; L244-K246 PolarHBondContact O-N 3.44Å; L244-V247 PolarHBondContact O-N 2.98Å; L244-S248 PolarHBondContact O-N 3.48Å
245	I	63.3	Low	59.6	Low	102 Å²	102	105.3 Å²	105.3	52%	0.523	55%	0.546	S	S	.	.	H	α-helix	trans	-60.8	-43.6	174.5	-67.5	164.9	0	0	0	110.2	T241 Q243 S248 L249	T241-I245 WeakPolarHBondContact O-CD1 3.48Å; T241-I245 VanDerWaalsContact O-CG1 3.28Å; T241-I245 WeakPolarHBondContact O-CG1 3.38Å; T241-I245 PolarHBondContact O-N 2.94Å; T241-I245 VanDerWaalsContact O-N 3.07Å; Q243-I245 VanDerWaalsContact C-N 3.34Å; Q243-I245 PolarHBondContact O-N 3.43Å; I245-S248 PolarHBondContact O-N 2.97Å; I245-S248 PolarHBondContact O-OG 3.21Å; I245-L249 HydrophobicContact CG2-CD1 4.01Å; I245-L249 PolarHBondContact O-N 3.29Å
246	K	57.6	Low	61.3	Low	142 Å²	142	103.9 Å²	103.9	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-62.1	-43.8	175.9	-78.9	176.7	179.3	-179.9	0	112.8	A242 Q243 L244 S248 L249 F250	A242-K246 WeakPolarHBondContact O-CG 3.33Å; A242-K246 PolarHBondContact O-N 3.36Å; Q243-K246 WeakPolarHBondContact O-CB 3.36Å; Q243-K246 PolarHBondContact O-N 2.97Å; Q243-K246 VanDerWaalsContact O-N 3.15Å; L244-K246 VanDerWaalsContact C-N 3.32Å; L244-K246 PolarHBondContact O-N 3.44Å; K246-S248 VanDerWaalsContact C-N 3.33Å; K246-S248 PolarHBondContact O-N 3.15Å; K246-L249 WeakPolarHBondContact O-CB 3.43Å; K246-L249 PolarHBondContact O-N 3.05Å; K246-F250 WeakPolarHBondContact O-CD2 2.92Å; K246-F250 PolarHBondContact O-N 3.42Å
247	V	61.3	Low	62.9	Low	80 Å²	80	97.5 Å²	97.5	49%	0.485	52%	0.523	S	S	.	.	H	α-helix	trans	-62.7	-41.9	177.3	173.6	0	0	0	0	110.6	Q243 L244 L249 F250 F251	Q243-V247 WeakPolarHBondContact O-CG2 3.48Å; Q243-V247 PolarHBondContact O-N 3.4Å; L244-V247 PolarHBondContact O-N 2.98Å; V247-L249 VanDerWaalsContact C-N 3.34Å; V247-L249 PolarHBondContact O-N 3.15Å; V247-F250 WeakPolarHBondContact O-CB 3.37Å; V247-F250 PolarHBondContact O-N 3.02Å; V247-F250 VanDerWaalsContact O-N 3.15Å; V247-F251 HydrophobicContact CG1-CD2 3.9Å; V247-F251 HydrophobicContact CG1-CE2 3.98Å; V247-F251 WeakPolarHBondContact O-CD2 3.49Å; V247-F251 PolarHBondContact O-N 3.48Å
248	S	64.1	Low	64.6	Low	70 Å²	70	95 Å²	95	49%	0.49	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-39.8	176.5	76.6	0	0	0	0	112.6	L244 I245 K246 F250 F251 L252	L244-S248 PolarHBondContact O-N 3.48Å; I245-S248 PolarHBondContact O-N 2.97Å; I245-S248 PolarHBondContact O-OG 3.21Å; K246-S248 VanDerWaalsContact C-N 3.33Å; K246-S248 PolarHBondContact O-N 3.15Å; S248-F250 VanDerWaalsContact C-N 3.33Å; S248-F250 PolarHBondContact O-N 3.04Å; S248-F251 PolarHBondContact O-N 3.37Å; S248-L252 PolarHBondContact O-N 2.88Å
249	L	69.4	Low	66.4	Low	104 Å²	104	95 Å²	95	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-64	-37	173.6	-95.6	147.3	0	0	0	112	I245 K246 V247 L252 K253	I245-L249 HydrophobicContact CG2-CD1 4.01Å; I245-L249 PolarHBondContact O-N 3.29Å; K246-L249 WeakPolarHBondContact O-CB 3.43Å; K246-L249 PolarHBondContact O-N 3.05Å; V247-L249 VanDerWaalsContact C-N 3.34Å; V247-L249 PolarHBondContact O-N 3.15Å; L249-L252 PolarHBondContact O-N 2.84Å; L249-K253 WeakPolarHBondContact O-CB 3.47Å; L249-K253 PolarHBondContact O-N 3.44Å
250	F	60.9	Low	68.2	Low	102 Å²	102	94 Å²	94	45%	0.447	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-48.1	175	-102.6	-74.9	0	0	0	112.7	K246 V247 S248 L252 K253 L254 N429	K246-F250 WeakPolarHBondContact O-CD2 2.92Å; K246-F250 PolarHBondContact O-N 3.42Å; V247-F250 WeakPolarHBondContact O-CB 3.37Å; V247-F250 PolarHBondContact O-N 3.02Å; V247-F250 VanDerWaalsContact O-N 3.15Å; S248-F250 VanDerWaalsContact C-N 3.33Å; S248-F250 PolarHBondContact O-N 3.04Å; F250-L252 VanDerWaalsContact C-N 3.29Å; F250-L252 PolarHBondContact O-N 2.96Å; F250-K253 PolarHBondContact O-N 3.23Å; F250-L254 WeakPolarHBondContact O-CB 3Å; F250-L254 PolarHBondContact O-N 2.84Å; F250-N429 WeakPolarHBondContact CE1-OD1 3.38Å; F250-N429 WeakPolarHBondContact CE2-ND2 3.36Å; F250-N429 HydrophobicContact CZ-CB 4.19Å; F250-N429 WeakPolarHBondContact CZ-ND2 3.47Å; F250-N429 WeakPolarHBondContact CZ-OD1 3.29Å
251	F	68.9	Low	69.8	Low	137 Å²	137	94.3 Å²	94.3	60%	0.601	51%	0.509	S	S	*	.	H	α-helix	trans	-60	-42.1	175.7	-92	-82.2	0	0	0	111.3	V247 S248 K253 L254 V255	V247-F251 HydrophobicContact CG1-CD2 3.9Å; V247-F251 HydrophobicContact CG1-CE2 3.98Å; V247-F251 WeakPolarHBondContact O-CD2 3.49Å; V247-F251 PolarHBondContact O-N 3.48Å; S248-F251 PolarHBondContact O-N 3.37Å; F251-K253 VanDerWaalsContact C-N 3.29Å; F251-K253 PolarHBondContact O-N 2.95Å; F251-L254 PolarHBondContact O-N 3.22Å; F251-V255 WeakPolarHBondContact O-CB 3.4Å; F251-V255 WeakPolarHBondContact O-CG2 3.44Å; F251-V255 PolarHBondContact O-N 3.03Å
252	L	75.2	Confident	71.4	Confident	127 Å²	127	96.9 Å²	96.9	67%	0.665	51%	0.514	S	S	*	.	H	α-helix	trans	-62	-39.3	177.9	-156.7	75.8	0	0	0	112	S248 L249 F250 S256	S248-L252 PolarHBondContact O-N 2.88Å; L249-L252 PolarHBondContact O-N 2.84Å; F250-L252 VanDerWaalsContact C-N 3.29Å; F250-L252 PolarHBondContact O-N 2.96Å; L252-S256 PolarHBondContact O-N 2.69Å
253	K	73.7	Confident	73	Confident	122 Å²	122	100.8 Å²	100.8	53%	0.53	53%	0.525	S	S	.	.	H	α-helix	trans	-73.7	-41.5	179.9	-155.5	168.6	-172.5	-179.1	0	112.4	L249 F250 F251 V255 S256 V257	L249-K253 WeakPolarHBondContact O-CB 3.47Å; L249-K253 PolarHBondContact O-N 3.44Å; F250-K253 PolarHBondContact O-N 3.23Å; F251-K253 VanDerWaalsContact C-N 3.29Å; F251-K253 PolarHBondContact O-N 2.95Å; K253-V255 VanDerWaalsContact C-N 3.32Å; K253-V255 PolarHBondContact O-N 2.9Å; K253-S256 PolarHBondContact O-N 3.09Å; K253-S256 VanDerWaalsContact O-N 3.17Å; K253-S256 PolarHBondContact O-OG 3.42Å; K253-V257 WeakPolarHBondContact O-CG2 3.49Å; K253-V257 PolarHBondContact O-N 2.77Å
254	L	71.4	Confident	74.7	Confident	110 Å²	110	103.6 Å²	103.6	58%	0.576	53%	0.532	S	S	*	.	H	α-helix	trans	-60.5	-44.6	174.1	-170.8	76	0	0	0	110.8	F250 F251 S256 V257 V258	F250-L254 WeakPolarHBondContact O-CB 3Å; F250-L254 PolarHBondContact O-N 2.84Å; F251-L254 PolarHBondContact O-N 3.22Å; L254-S256 VanDerWaalsContact C-N 3.29Å; L254-S256 PolarHBondContact O-N 3.48Å; L254-V257 PolarHBondContact O-N 3.2Å; L254-V258 WeakPolarHBondContact O-CB 3.46Å; L254-V258 VanDerWaalsContact O-CG2 3.31Å; L254-V258 WeakPolarHBondContact O-CG2 3.42Å; L254-V258 PolarHBondContact O-N 2.88Å
255	V	79.2	Confident	76.2	Confident	76 Å²	76	101.7 Å²	101.7	46%	0.461	53%	0.528	S	S	.	.	H	α-helix	trans	-60.8	-39.7	175.4	170.3	0	0	0	0	110.9	F251 K253 N259	F251-V255 WeakPolarHBondContact O-CB 3.4Å; F251-V255 WeakPolarHBondContact O-CG2 3.44Å; F251-V255 PolarHBondContact O-N 3.03Å; K253-V255 VanDerWaalsContact C-N 3.32Å; K253-V255 PolarHBondContact O-N 2.9Å; V255-N259 WeakPolarHBondContact O-CB 3.41Å; V255-N259 PolarHBondContact O-N 3.16Å; V255-N259 PolarHBondContact O-ND2 2.97Å
256	S	83.3	Confident	77.5	Confident	70 Å²	70	101.4 Å²	101.4	49%	0.49	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-41.4	176.8	115.8	0	0	0	0	112.7	L252 K253 L254 N259 S260	L252-S256 PolarHBondContact O-N 2.69Å; K253-S256 PolarHBondContact O-N 3.09Å; K253-S256 VanDerWaalsContact O-N 3.17Å; K253-S256 PolarHBondContact O-OG 3.42Å; L254-S256 VanDerWaalsContact C-N 3.29Å; L254-S256 PolarHBondContact O-N 3.48Å; S256-N259 PolarHBondContact O-N 2.88Å; S256-S260 WeakPolarHBondContact O-CB 3.36Å; S256-S260 PolarHBondContact O-N 2.83Å
257	V	80.1	Confident	79	Confident	59 Å²	59	98.3 Å²	98.3	36%	0.358	52%	0.517	S	S	.	.	H	α-helix	trans	-67.4	-44.3	178.5	172.2	0	0	0	0	110.9	K253 L254 N259 S260 L261	K253-V257 WeakPolarHBondContact O-CG2 3.49Å; K253-V257 PolarHBondContact O-N 2.77Å; L254-V257 PolarHBondContact O-N 3.2Å; V257-N259 VanDerWaalsContact C-N 3.3Å; V257-N259 PolarHBondContact O-N 3.27Å; V257-S260 PolarHBondContact O-N 2.84Å; V257-L261 HydrophobicContact CG1-CD1 4.05Å; V257-L261 PolarHBondContact O-N 2.97Å
258	V	84	Confident	80.2	Confident	82 Å²	82	99.3 Å²	99.3	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-62.1	-40.2	176.2	171.6	0	0	0	0	110.9	L254 K262	L254-V258 WeakPolarHBondContact O-CB 3.46Å; L254-V258 VanDerWaalsContact O-CG2 3.31Å; L254-V258 WeakPolarHBondContact O-CG2 3.42Å; L254-V258 PolarHBondContact O-N 2.88Å; V258-K262 VanDerWaalsContact O-CB 3.27Å; V258-K262 WeakPolarHBondContact O-CB 3.46Å; V258-K262 PolarHBondContact O-N 2.94Å
259	N	88.5	Confident	81.4	Confident	81 Å²	81	101.8 Å²	101.8	43%	0.433	52%	0.523	S	S	.	.	H	α-helix	trans	-66	-42.7	175.5	-74.2	-19.2	0	0	0	112	V255 S256 V257 K262 E263	V255-N259 WeakPolarHBondContact O-CB 3.41Å; V255-N259 PolarHBondContact O-N 3.16Å; V255-N259 PolarHBondContact O-ND2 2.97Å; S256-N259 PolarHBondContact O-N 2.88Å; V257-N259 VanDerWaalsContact C-N 3.3Å; V257-N259 PolarHBondContact O-N 3.27Å; N259-K262 WeakPolarHBondContact O-CB 3.49Å; N259-K262 PolarHBondContact O-N 3.29Å; N259-E263 WeakPolarHBondContact O-CG 3.31Å; N259-E263 PolarHBondContact O-N 3.22Å
260	S	86.2	Confident	82.3	Confident	71 Å²	71	101.6 Å²	101.6	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-63.4	-42.2	177	174.4	0	0	0	0	112.5	S256 V257 K262 E263 R264	S256-S260 WeakPolarHBondContact O-CB 3.36Å; S256-S260 PolarHBondContact O-N 2.83Å; V257-S260 PolarHBondContact O-N 2.84Å; S260-K262 VanDerWaalsContact C-N 3.33Å; S260-K262 PolarHBondContact O-N 2.8Å; S260-E263 PolarHBondContact O-N 3.16Å; S260-R264 WeakPolarHBondContact O-CB 3.37Å; S260-R264 PolarHBondContact O-N 3.34Å
261	L	82.7	Confident	83.6	Confident	107 Å²	107	102.3 Å²	102.3	56%	0.56	53%	0.527	S	S	*	.	H	α-helix	trans	-63.3	-40.3	173.5	-92.5	154.8	0	0	0	111.7	V257 R264 C265	V257-L261 HydrophobicContact CG1-CD1 4.05Å; V257-L261 PolarHBondContact O-N 2.97Å; L261-R264 PolarHBondContact O-N 3.11Å; L261-C265 PolarHBondContact O-N 2.77Å; L261-C265 PolarHBondContact O-SG 3.13Å; L261-C265 VanDerWaalsContact O-SG 3.41Å
262	K	88	Confident	84.5	Confident	137 Å²	137	99.6 Å²	99.6	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-65.2	-42	177.5	-171.9	178.1	178.2	-177.5	0	111.8	V258 N259 S260 C265 L266	V258-K262 VanDerWaalsContact O-CB 3.27Å; V258-K262 WeakPolarHBondContact O-CB 3.46Å; V258-K262 PolarHBondContact O-N 2.94Å; N259-K262 WeakPolarHBondContact O-CB 3.49Å; N259-K262 PolarHBondContact O-N 3.29Å; S260-K262 VanDerWaalsContact C-N 3.33Å; S260-K262 PolarHBondContact O-N 2.8Å; K262-C265 PolarHBondContact O-N 2.88Å; K262-L266 WeakPolarHBondContact O-CG 3.39Å; K262-L266 PolarHBondContact O-N 3.24Å; K262-L266 VanDerWaalsContact O-N 3.13Å
263	E	88.6	Confident	85.2	Confident	122 Å²	122	95.4 Å²	95.4	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-60.1	-47.8	172.1	-75.7	174.2	-179.8	0	0	110.6	N259 S260 C265 L266 D267	N259-E263 WeakPolarHBondContact O-CG 3.31Å; N259-E263 PolarHBondContact O-N 3.22Å; S260-E263 PolarHBondContact O-N 3.16Å; E263-C265 VanDerWaalsContact C-N 3.32Å; E263-C265 PolarHBondContact O-N 3.3Å; E263-L266 WeakPolarHBondContact O-CA 3.48Å; E263-L266 WeakPolarHBondContact O-CB 3.44Å; E263-L266 PolarHBondContact O-N 2.9Å; E263-D267 PolarHBondContact O-N 3.36Å
264	R	87.9	Confident	85.9	Confident	147 Å²	147	92.2 Å²	92.2	56%	0.555	50%	0.499	S	S	*	.	H	α-helix	trans	-62.7	-37.5	179.6	-168.5	60	174.3	174	3.6	113.3	S260 L261 L266 L268	S260-R264 WeakPolarHBondContact O-CB 3.37Å; S260-R264 PolarHBondContact O-N 3.34Å; L261-R264 PolarHBondContact O-N 3.11Å; R264-L266 VanDerWaalsContact C-N 3.3Å; R264-L268 WeakPolarHBondContact O-CB 3.43Å; R264-L268 PolarHBondContact O-N 2.84Å
265	C	86.4	Confident	86.5	Confident	88 Å²	88	89.4 Å²	89.4	60%	0.595	49%	0.488	S	S	*	.	H	α-helix	trans	-65.8	-33.3	174.2	-76.3	0	0	0	0	112.6	L261 K262 E263 H269	L261-C265 PolarHBondContact O-N 2.77Å; L261-C265 PolarHBondContact O-SG 3.13Å; L261-C265 VanDerWaalsContact O-SG 3.41Å; K262-C265 PolarHBondContact O-N 2.88Å; E263-C265 VanDerWaalsContact C-N 3.32Å; E263-C265 PolarHBondContact O-N 3.3Å; C265-H269 WeakPolarHBondContact O-CB 3.26Å; C265-H269 PolarHBondContact O-N 2.98Å
266	L	89.7	Confident	87	Confident	95 Å²	95	93.3 Å²	93.3	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-71.2	-46.9	174.9	-71.9	164.8	0	0	0	110.8	K262 E263 R264 L268 H269 D270	K262-L266 WeakPolarHBondContact O-CG 3.39Å; K262-L266 PolarHBondContact O-N 3.24Å; K262-L266 VanDerWaalsContact O-N 3.13Å; E263-L266 WeakPolarHBondContact O-CA 3.48Å; E263-L266 WeakPolarHBondContact O-CB 3.44Å; E263-L266 PolarHBondContact O-N 2.9Å; R264-L266 VanDerWaalsContact C-N 3.3Å; L266-L268 VanDerWaalsContact C-N 3.32Å; L266-L268 PolarHBondContact O-N 3.5Å; L266-H269 WeakPolarHBondContact O-CB 3.4Å; L266-H269 PolarHBondContact O-N 3.47Å; L266-H269 VanDerWaalsContact O-N 3.08Å; L266-D270 PolarHBondContact O-N 2.92Å
267	D	89.2	Confident	87.3	Confident	77 Å²	77	96 Å²	96	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-55.7	-47.5	176.7	-64.4	-22.5	0	0	0	111.6	E263 H269 D270 E271	E263-D267 PolarHBondContact O-N 3.36Å; D267-H269 VanDerWaalsContact C-N 3.27Å; D267-H269 PolarHBondContact O-N 3.2Å; D267-D270 PolarHBondContact O-N 3.26Å; D267-E271 WeakPolarHBondContact O-CG 3.21Å; D267-E271 PolarHBondContact O-N 3.46Å
268	L	86.6	Confident	87.8	Confident	102 Å²	102	98.2 Å²	98.2	53%	0.534	51%	0.509	S	S	.	.	H	α-helix	trans	-66.2	-31.8	-179.4	-154.7	81.5	0	0	0	112	R264 L266 L272	R264-L268 WeakPolarHBondContact O-CB 3.43Å; R264-L268 PolarHBondContact O-N 2.84Å; L266-L268 VanDerWaalsContact C-N 3.32Å; L266-L268 PolarHBondContact O-N 3.5Å; L268-L272 WeakPolarHBondContact O-CB 3.5Å; L268-L272 PolarHBondContact O-N 3.4Å; L268-L272 VanDerWaalsContact O-N 3.08Å
269	H	89.7	Confident	87.9	Confident	121 Å²	121	98.7 Å²	98.7	56%	0.56	51%	0.508	S	S	*	.	H	α-helix	trans	-68.5	-41.6	174.8	-173.6	71.6	0	0	0	111.4	C265 L266 D267 L272 A273	C265-H269 WeakPolarHBondContact O-CB 3.26Å; C265-H269 PolarHBondContact O-N 2.98Å; L266-H269 WeakPolarHBondContact O-CB 3.4Å; L266-H269 PolarHBondContact O-N 3.47Å; L266-H269 VanDerWaalsContact O-N 3.08Å; D267-H269 VanDerWaalsContact C-N 3.27Å; D267-H269 PolarHBondContact O-N 3.2Å; H269-L272 PolarHBondContact O-N 3.25Å; H269-A273 PolarHBondContact O-N 2.95Å
270	D	88.2	Confident	87.9	Confident	100 Å²	100	101 Å²	101	54%	0.535	52%	0.516	S	S	.	.	H	α-helix	trans	-68	-40.6	177.8	-69.1	-15.9	0	0	0	111.6	L266 D267 L272 A273 A274	L266-D270 PolarHBondContact O-N 2.92Å; D267-D270 PolarHBondContact O-N 3.26Å; D270-L272 VanDerWaalsContact C-N 3.35Å; D270-L272 PolarHBondContact O-N 3.04Å; D270-A273 PolarHBondContact O-N 3.43Å; D270-A274 WeakPolarHBondContact O-CB 3.41Å; D270-A274 PolarHBondContact O-N 3.46Å
271	E	89	Confident	87.9	Confident	117 Å²	117	102.2 Å²	102.2	55%	0.547	52%	0.52	S	S	.	.	H	α-helix	trans	-62	-41.1	172.7	-74.6	-176.2	177.7	0	0	112.1	D267 A273 A274 S275	D267-E271 WeakPolarHBondContact O-CG 3.21Å; D267-E271 PolarHBondContact O-N 3.46Å; E271-A273 VanDerWaalsContact C-N 3.34Å; E271-A274 PolarHBondContact O-N 3.17Å; E271-S275 WeakPolarHBondContact O-CB 3.29Å; E271-S275 PolarHBondContact O-N 2.95Å; E271-S275 PolarHBondContact O-OG 3.42Å
272	L	87.4	Confident	88.2	Confident	81 Å²	81	101.8 Å²	101.8	42%	0.424	52%	0.518	S	S	.	.	H	α-helix	trans	-65.8	-37.5	175.9	-164.8	94	0	0	0	111.6	L268 H269 D270 S275 R276	L268-L272 WeakPolarHBondContact O-CB 3.5Å; L268-L272 PolarHBondContact O-N 3.4Å; L268-L272 VanDerWaalsContact O-N 3.08Å; H269-L272 PolarHBondContact O-N 3.25Å; D270-L272 VanDerWaalsContact C-N 3.35Å; D270-L272 PolarHBondContact O-N 3.04Å; L272-S275 WeakPolarHBondContact CA-OG 3.25Å; L272-S275 PolarHBondContact O-OG 3.5Å; L272-R276 VanDerWaalsContact O-CG 3.28Å; L272-R276 WeakPolarHBondContact O-CG 3.37Å; L272-R276 PolarHBondContact O-N 2.72Å
273	A	89.4	Confident	88.3	Confident	39 Å²	39	101 Å²	101	32%	0.322	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-49.2	174.6	0	0	0	0	0	111.2	H269 D270 E271 S275 R276 E277	H269-A273 PolarHBondContact O-N 2.95Å; D270-A273 PolarHBondContact O-N 3.43Å; E271-A273 VanDerWaalsContact C-N 3.34Å; A273-S275 VanDerWaalsContact C-N 3.35Å; A273-S275 PolarHBondContact O-N 3.38Å; A273-R276 WeakPolarHBondContact O-CB 3.42Å; A273-R276 PolarHBondContact O-N 2.99Å; A273-E277 PolarHBondContact O-N 3.43Å
274	A	89.1	Confident	88.2	Confident	55 Å²	55	101.4 Å²	101.4	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-40.8	179.1	0	0	0	0	0	112.6	D270 E271 E277 L278	D270-A274 WeakPolarHBondContact O-CB 3.41Å; D270-A274 PolarHBondContact O-N 3.46Å; E271-A274 PolarHBondContact O-N 3.17Å; A274-E277 PolarHBondContact O-N 3.48Å; A274-L278 WeakPolarHBondContact O-CB 3.32Å; A274-L278 PolarHBondContact O-N 3.47Å
275	S	83.4	Confident	88.1	Confident	51 Å²	51	97.7 Å²	97.7	36%	0.357	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-36.8	176.7	56	0	0	0	0	112.7	E271 L272 A273 L278 I279	E271-S275 WeakPolarHBondContact O-CB 3.29Å; E271-S275 PolarHBondContact O-N 2.95Å; E271-S275 PolarHBondContact O-OG 3.42Å; L272-S275 WeakPolarHBondContact CA-OG 3.25Å; L272-S275 PolarHBondContact O-OG 3.5Å; A273-S275 VanDerWaalsContact C-N 3.35Å; A273-S275 PolarHBondContact O-N 3.38Å; S275-L278 PolarHBondContact O-N 3.34Å; S275-I279 VanDerWaalsContact O-CG1 3.27Å; S275-I279 WeakPolarHBondContact O-CG1 3.4Å; S275-I279 PolarHBondContact O-N 2.88Å
276	R	90.5	Very high	88.1	Confident	157 Å²	157	98.3 Å²	98.3	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-65.6	-41.9	173.9	-75.7	172.1	174.6	176.6	-1.1	112.3	L272 A273 I279 Q280	L272-R276 VanDerWaalsContact O-CG 3.28Å; L272-R276 WeakPolarHBondContact O-CG 3.37Å; L272-R276 PolarHBondContact O-N 2.72Å; A273-R276 WeakPolarHBondContact O-CB 3.42Å; A273-R276 PolarHBondContact O-N 2.99Å; R276-I279 PolarHBondContact O-N 3.49Å; R276-Q280 WeakPolarHBondContact O-CG 3.17Å; R276-Q280 PolarHBondContact O-N 3.45Å
277	E	89.4	Confident	88	Confident	127 Å²	127	97.5 Å²	97.5	59%	0.593	51%	0.509	S	S	*	.	H	α-helix	trans	-62.8	-44.3	175.2	-70.9	179.2	-177.2	0	0	111.5	A273 A274 I279 Q280 V281	A273-E277 PolarHBondContact O-N 3.43Å; A274-E277 PolarHBondContact O-N 3.48Å; E277-I279 VanDerWaalsContact C-N 3.33Å; E277-I279 PolarHBondContact O-N 3.15Å; E277-Q280 PolarHBondContact O-N 3.44Å; E277-V281 WeakPolarHBondContact O-CG2 3.39Å; E277-V281 PolarHBondContact O-N 3.29Å
278	L	89.9	Confident	87.7	Confident	106 Å²	106	96.5 Å²	96.5	56%	0.555	51%	0.506	S	S	*	.	H	α-helix	trans	-59	-44.2	176.4	-180	64.4	0	0	0	111.9	A274 S275 Q280 V281 L282	A274-L278 WeakPolarHBondContact O-CB 3.32Å; A274-L278 PolarHBondContact O-N 3.47Å; S275-L278 PolarHBondContact O-N 3.34Å; L278-Q280 VanDerWaalsContact C-N 3.34Å; L278-Q280 PolarHBondContact O-N 2.84Å; L278-V281 PolarHBondContact O-N 2.97Å; L278-L282 HydrophobicContact CD1-CD1 4.38Å; L278-L282 HydrophobicContact CD1-CG 4.44Å; L278-L282 HydrophobicContact CG-CD1 4.13Å; L278-L282 WeakPolarHBondContact O-CG 3.43Å; L278-L282 PolarHBondContact O-N 3.11Å
279	I	86.3	Confident	87.5	Confident	92 Å²	92	96 Å²	96	47%	0.472	50%	0.504	S	S	.	.	H	α-helix	trans	-61.3	-44.1	177.1	-69.9	165.5	0	0	0	110.6	S275 R276 E277 V281 L282 Q283	S275-I279 VanDerWaalsContact O-CG1 3.27Å; S275-I279 WeakPolarHBondContact O-CG1 3.4Å; S275-I279 PolarHBondContact O-N 2.88Å; R276-I279 PolarHBondContact O-N 3.49Å; E277-I279 VanDerWaalsContact C-N 3.33Å; E277-I279 PolarHBondContact O-N 3.15Å; I279-V281 PolarHBondContact O-N 2.75Å; I279-L282 PolarHBondContact O-N 2.86Å; I279-Q283 HydrophobicContact CG2-CG 4.38Å; I279-Q283 WeakPolarHBondContact O-CB 3.33Å; I279-Q283 WeakPolarHBondContact O-CG 3.36Å; I279-Q283 PolarHBondContact O-N 2.91Å
280	Q	88.5	Confident	87.2	Confident	130 Å²	130	97.2 Å²	97.2	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-62.2	-42.5	177.5	-75.2	-179.6	-3.2	0	0	112.1	R276 E277 L278 Q283 H284	R276-Q280 WeakPolarHBondContact O-CG 3.17Å; R276-Q280 PolarHBondContact O-N 3.45Å; E277-Q280 PolarHBondContact O-N 3.44Å; L278-Q280 VanDerWaalsContact C-N 3.34Å; L278-Q280 PolarHBondContact O-N 2.84Å; Q280-Q283 PolarHBondContact O-N 2.95Å; Q280-H284 WeakPolarHBondContact O-CB 3.35Å; Q280-H284 PolarHBondContact O-N 3.04Å
281	V	87.1	Confident	87	Confident	96 Å²	96	97.4 Å²	97.4	58%	0.582	51%	0.509	S	S	*	.	H	α-helix	trans	-62.8	-43.7	176.7	172.4	0	0	0	0	111.1	E277 L278 I279 H284 S285	E277-V281 WeakPolarHBondContact O-CG2 3.39Å; E277-V281 PolarHBondContact O-N 3.29Å; L278-V281 PolarHBondContact O-N 2.97Å; I279-V281 PolarHBondContact O-N 2.75Å; V281-H284 PolarHBondContact O-N 2.96Å; V281-S285 WeakPolarHBondContact O-CB 3.41Å; V281-S285 PolarHBondContact O-N 2.82Å
282	L	87.5	Confident	86.6	Confident	98 Å²	98	97.3 Å²	97.3	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-64.7	-43.7	177.6	-72.4	171.8	0	0	0	112	L278 I279 H284 S285 I286	L278-L282 HydrophobicContact CD1-CD1 4.38Å; L278-L282 HydrophobicContact CD1-CG 4.44Å; L278-L282 HydrophobicContact CG-CD1 4.13Å; L278-L282 WeakPolarHBondContact O-CG 3.43Å; L278-L282 PolarHBondContact O-N 3.11Å; I279-L282 PolarHBondContact O-N 2.86Å; L282-H284 VanDerWaalsContact C-N 3.34Å; L282-H284 PolarHBondContact O-N 3.06Å; L282-S285 PolarHBondContact O-N 3.15Å; L282-I286 WeakPolarHBondContact O-CG1 3.43Å; L282-I286 PolarHBondContact O-N 2.82Å
283	Q	89.5	Confident	86.3	Confident	120 Å²	120	96 Å²	96	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-59.6	-45.9	175.3	-76.2	176.8	-16.9	0	0	111.3	I279 Q280 S285 I286 V287	I279-Q283 HydrophobicContact CG2-CG 4.38Å; I279-Q283 WeakPolarHBondContact O-CB 3.33Å; I279-Q283 WeakPolarHBondContact O-CG 3.36Å; I279-Q283 PolarHBondContact O-N 2.91Å; Q280-Q283 PolarHBondContact O-N 2.95Å; Q283-S285 PolarHBondContact O-N 3.46Å; Q283-I286 PolarHBondContact O-N 3.3Å; Q283-V287 WeakPolarHBondContact O-CG2 3.35Å; Q283-V287 PolarHBondContact O-N 3.1Å; Q283-V287 VanDerWaalsContact O-N 3.15Å
284	H	86.6	Confident	85.9	Confident	131 Å²	131	95.8 Å²	95.8	61%	0.606	50%	0.504	S	S	*	.	H	α-helix	trans	-62.4	-43.8	177	-169.8	68.8	0	0	0	111.7	Q280 V281 L282 I286 V287 V288	Q280-H284 WeakPolarHBondContact O-CB 3.35Å; Q280-H284 PolarHBondContact O-N 3.04Å; V281-H284 PolarHBondContact O-N 2.96Å; L282-H284 VanDerWaalsContact C-N 3.34Å; L282-H284 PolarHBondContact O-N 3.06Å; H284-I286 VanDerWaalsContact C-N 3.28Å; H284-I286 PolarHBondContact O-N 3.2Å; H284-V287 PolarHBondContact O-N 3.22Å; H284-V288 WeakPolarHBondContact O-CG2 3.45Å; H284-V288 PolarHBondContact O-N 2.92Å
285	S	86.9	Confident	85.3	Confident	69 Å²	69	94.5 Å²	94.5	48%	0.483	49%	0.493	S	S	.	.	H	α-helix	trans	-60.3	-36.2	176.6	-175.6	0	0	0	0	112.8	V281 L282 Q283 N289	V281-S285 WeakPolarHBondContact O-CB 3.41Å; V281-S285 PolarHBondContact O-N 2.82Å; L282-S285 PolarHBondContact O-N 3.15Å; Q283-S285 PolarHBondContact O-N 3.46Å; S285-N289 WeakPolarHBondContact O-CB 3.46Å; S285-N289 PolarHBondContact O-N 2.85Å
286	I	86.6	Confident	84.9	Confident	100 Å²	100	97.1 Å²	97.1	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-67.9	-42.4	177.3	-70.3	166.2	0	0	0	110.8	L282 Q283 H284 N289 K290	L282-I286 WeakPolarHBondContact O-CG1 3.43Å; L282-I286 PolarHBondContact O-N 2.82Å; Q283-I286 PolarHBondContact O-N 3.3Å; H284-I286 VanDerWaalsContact C-N 3.28Å; H284-I286 PolarHBondContact O-N 3.2Å; I286-N289 PolarHBondContact O-N 3.16Å; I286-K290 WeakPolarHBondContact O-CG 3.25Å; I286-K290 PolarHBondContact O-N 2.98Å
287	V	86.9	Confident	84.3	Confident	78 Å²	78	95.6 Å²	95.6	47%	0.473	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-48.5	176.8	175.7	0	0	0	0	110.2	Q283 H284 N289 K290 D291	Q283-V287 WeakPolarHBondContact O-CG2 3.35Å; Q283-V287 PolarHBondContact O-N 3.1Å; Q283-V287 VanDerWaalsContact O-N 3.15Å; H284-V287 PolarHBondContact O-N 3.22Å; V287-N289 VanDerWaalsContact C-N 3.29Å; V287-N289 PolarHBondContact O-N 3.1Å; V287-K290 WeakPolarHBondContact O-CB 3.46Å; V287-K290 PolarHBondContact O-N 2.77Å; V287-K290 VanDerWaalsContact O-N 3.13Å; V287-D291 PolarHBondContact O-N 3.17Å
288	V	82.9	Confident	83.7	Confident	56 Å²	56	97.1 Å²	97.1	34%	0.339	50%	0.503	S	S	.	.	H	α-helix	trans	-58.1	-41.9	177.3	173.5	0	0	0	0	111.6	H284 D291 Q292	H284-V288 WeakPolarHBondContact O-CG2 3.45Å; H284-V288 PolarHBondContact O-N 2.92Å; V288-D291 PolarHBondContact O-N 2.97Å; V288-Q292 WeakPolarHBondContact O-CB 3.41Å; V288-Q292 WeakPolarHBondContact O-CG 3.32Å; V288-Q292 PolarHBondContact O-N 3.35Å
289	N	82.7	Confident	82.8	Confident	93 Å²	93	94.4 Å²	94.4	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-67.5	-36.5	179.3	-160.2	-60.8	0	0	0	112.3	S285 I286 V287 S293	S285-N289 WeakPolarHBondContact O-CB 3.46Å; S285-N289 PolarHBondContact O-N 2.85Å; I286-N289 PolarHBondContact O-N 3.16Å; V287-N289 VanDerWaalsContact C-N 3.29Å; V287-N289 PolarHBondContact O-N 3.1Å; N289-S293 WeakPolarHBondContact O-CB 3.35Å; N289-S293 PolarHBondContact O-N 3.06Å; N289-S293 PolarHBondContact O-OG 2.98Å
290	K	84.2	Confident	82.2	Confident	145 Å²	145	95.4 Å²	95.4	63%	0.63	49%	0.493	S	S	*	.	H	α-helix	trans	-64.3	-44.9	173	-77.9	-179	176.4	177.8	0	111.7	I286 V287 S293 A294	I286-K290 WeakPolarHBondContact O-CG 3.25Å; I286-K290 PolarHBondContact O-N 2.98Å; V287-K290 WeakPolarHBondContact O-CB 3.46Å; V287-K290 PolarHBondContact O-N 2.77Å; V287-K290 VanDerWaalsContact O-N 3.13Å; K290-S293 PolarHBondContact O-N 3.5Å; K290-A294 WeakPolarHBondContact O-CB 3.2Å; K290-A294 PolarHBondContact O-N 2.94Å
291	D	83.2	Confident	81.5	Confident	105 Å²	105	95.2 Å²	95.2	56%	0.561	50%	0.497	S	S	*	.	H	α-helix	trans	-64.7	-41.2	178.9	-70	-20.3	0	0	0	111.6	V287 V288 A294 A295	V287-D291 PolarHBondContact O-N 3.17Å; V288-D291 PolarHBondContact O-N 2.97Å; D291-A294 PolarHBondContact O-N 2.89Å; D291-A295 WeakPolarHBondContact O-CB 3.29Å; D291-A295 PolarHBondContact O-N 3.48Å
292	Q	79.6	Confident	80.6	Confident	114 Å²	114	91.5 Å²	91.5	53%	0.533	48%	0.476	S	S	.	.	H	α-helix	trans	-61.1	-45.2	172.6	-74.8	177.9	-5.4	0	0	112	V288 A294 A295 L296	V288-Q292 WeakPolarHBondContact O-CB 3.41Å; V288-Q292 WeakPolarHBondContact O-CG 3.32Å; V288-Q292 PolarHBondContact O-N 3.35Å; Q292-A294 VanDerWaalsContact C-N 3.33Å; Q292-A294 PolarHBondContact O-N 3.11Å; Q292-A295 PolarHBondContact O-N 3.38Å; Q292-L296 WeakPolarHBondContact O-CG 3.43Å; Q292-L296 PolarHBondContact O-N 3.25Å
293	S	81.8	Confident	79.4	Confident	55 Å²	55	90.2 Å²	90.2	39%	0.385	47%	0.472	S	S	.	.	H	α-helix	trans	-61.7	-41.3	177.3	-65	0	0	0	0	111.8	N289 K290 L296 Q297	N289-S293 WeakPolarHBondContact O-CB 3.35Å; N289-S293 PolarHBondContact O-N 3.06Å; N289-S293 PolarHBondContact O-OG 2.98Å; K290-S293 PolarHBondContact O-N 3.5Å; S293-L296 PolarHBondContact O-N 3.5Å; S293-Q297 PolarHBondContact O-N 3.15Å
294	A	80.7	Confident	78.3	Confident	33 Å²	33	93.4 Å²	93.4	27%	0.273	49%	0.487	S	S	.	.	H	α-helix	trans	-66	-40.4	175.7	0	0	0	0	0	112	K290 D291 Q292 Q297 R298	K290-A294 WeakPolarHBondContact O-CB 3.2Å; K290-A294 PolarHBondContact O-N 2.94Å; D291-A294 PolarHBondContact O-N 2.89Å; Q292-A294 VanDerWaalsContact C-N 3.33Å; Q292-A294 PolarHBondContact O-N 3.11Å; A294-Q297 PolarHBondContact O-N 2.61Å; A294-R298 WeakPolarHBondContact O-CG 3.42Å; A294-R298 PolarHBondContact O-N 2.87Å
295	A	76.5	Confident	77.8	Confident	28 Å²	28	89 Å²	89	23%	0.231	47%	0.471	C	S	.	.	H	α-helix	trans	-63.5	-43.4	175.2	0	0	0	0	0	111.9	D291 Q292 Q297 R298 L299 F312	D291-A295 WeakPolarHBondContact O-CB 3.29Å; D291-A295 PolarHBondContact O-N 3.48Å; Q292-A295 PolarHBondContact O-N 3.38Å; A295-Q297 VanDerWaalsContact C-N 3.34Å; A295-Q297 PolarHBondContact O-N 3.24Å; A295-R298 WeakPolarHBondContact O-CB 3.27Å; A295-R298 PolarHBondContact O-N 3.45Å; A295-L299 PolarHBondContact O-N 2.75Å; A295-L299 VanDerWaalsContact O-N 3.1Å; A295-F312 HydrophobicContact CB-CE2 4.24Å; A295-F312 HydrophobicContact CB-CZ 4.28Å; A295-F312 WeakPolarHBondContact O-CE2 3.46Å
296	L	74.7	Confident	77.4	Confident	107 Å²	107	93.1 Å²	93.1	56%	0.56	48%	0.483	S	S	*	.	H	α-helix	trans	-62	-40.1	175	-71.8	172	0	0	0	111.9	Q292 S293 R298 L299 I300	Q292-L296 WeakPolarHBondContact O-CG 3.43Å; Q292-L296 PolarHBondContact O-N 3.25Å; S293-L296 PolarHBondContact O-N 3.5Å; L296-R298 PolarHBondContact O-N 3.06Å; L296-L299 WeakPolarHBondContact O-CB 3.25Å; L296-L299 PolarHBondContact O-N 3.15Å; L296-I300 WeakPolarHBondContact O-CG1 3.38Å; L296-I300 PolarHBondContact O-N 3.44Å
297	Q	79.3	Confident	77	Confident	124 Å²	124	92.7 Å²	92.7	58%	0.579	49%	0.488	S	S	*	.	H	α-helix	trans	-63.3	-38.9	174.1	-82.9	173.2	-21.8	0	0	112.6	S293 A294 A295 L299 I300 N301	S293-Q297 PolarHBondContact O-N 3.15Å; A294-Q297 PolarHBondContact O-N 2.61Å; A295-Q297 VanDerWaalsContact C-N 3.34Å; A295-Q297 PolarHBondContact O-N 3.24Å; Q297-L299 VanDerWaalsContact C-N 3.29Å; Q297-L299 PolarHBondContact O-N 3.28Å; Q297-I300 PolarHBondContact O-N 2.98Å; Q297-N301 PolarHBondContact O-N 3.38Å; Q297-N301 PolarHBondContact O-ND2 3.29Å
298	R	76.2	Confident	76.4	Confident	160 Å²	160	93.7 Å²	93.7	60%	0.604	49%	0.488	S	S	*	.	H	α-helix	trans	-61.7	-38.7	173.3	-68	179.7	-154.4	161.4	6.8	111.7	A294 A295 L296 N301 A302	A294-R298 WeakPolarHBondContact O-CG 3.42Å; A294-R298 PolarHBondContact O-N 2.87Å; A295-R298 WeakPolarHBondContact O-CB 3.27Å; A295-R298 PolarHBondContact O-N 3.45Å; L296-R298 PolarHBondContact O-N 3.06Å; R298-N301 PolarHBondContact O-N 2.98Å; R298-A302 VanDerWaalsContact O-CB 3.3Å; R298-A302 WeakPolarHBondContact O-CB 3.47Å; R298-A302 PolarHBondContact O-N 2.84Å
299	L	71.5	Confident	76.1	Confident	49 Å²	49	96 Å²	96	26%	0.257	49%	0.49	S	S	.	.	H	α-helix	trans	-66.6	-43.7	178.4	-159.8	163.5	0	0	0	111.7	A295 L296 Q297 N301 A302 F312	A295-L299 PolarHBondContact O-N 2.75Å; A295-L299 VanDerWaalsContact O-N 3.1Å; L296-L299 WeakPolarHBondContact O-CB 3.25Å; L296-L299 PolarHBondContact O-N 3.15Å; Q297-L299 VanDerWaalsContact C-N 3.29Å; Q297-L299 PolarHBondContact O-N 3.28Å; L299-N301 PolarHBondContact O-N 3.45Å; L299-A302 PolarHBondContact O-N 3.15Å; L299-F312 HydrophobicContact CB-CE2 4.45Å; L299-F312 HydrophobicContact CB-CZ 4.34Å; L299-F312 HydrophobicContact CD1-CD1 3.74Å; L299-F312 HydrophobicContact CD1-CE1 3.42Å; L299-F312 VanDerWaalsContact CD1-CE1 3.42Å; L299-F312 HydrophobicContact CD1-CZ 3.95Å; L299-F312 HydrophobicContact CG-CD1 4.26Å; L299-F312 HydrophobicContact CG-CE1 4.26Å
300	I	73.2	Confident	76	Confident	112 Å²	112	96.7 Å²	96.7	57%	0.574	49%	0.494	S	S	*	.	H	α-helix	trans	-58.8	-38.7	174.2	-67.3	166.2	0	0	0	110.7	L296 Q297 T303	L296-I300 WeakPolarHBondContact O-CG1 3.38Å; L296-I300 PolarHBondContact O-N 3.44Å; Q297-I300 PolarHBondContact O-N 2.98Å; I300-T303 VanDerWaalsContact O-CG2 3.29Å; I300-T303 WeakPolarHBondContact O-CG2 3.23Å; I300-T303 PolarHBondContact O-OG1 3.34Å; I300-T303 VanDerWaalsContact O-OG1 3.1Å
301	N	74.4	Confident	75.8	Confident	127 Å²	127	96.1 Å²	96.1	68%	0.679	49%	0.493	S	S	*	.	H	α-helix	trans	-78.8	-27.1	-179.7	-64.1	-16.3	0	0	0	113.3	Q297 R298 L299 T303	Q297-N301 PolarHBondContact O-N 3.38Å; Q297-N301 PolarHBondContact O-ND2 3.29Å; R298-N301 PolarHBondContact O-N 2.98Å; L299-N301 PolarHBondContact O-N 3.45Å; N301-T303 PolarHBondContact O-N 3.27Å
302	A	67.6	Low	75.6	Confident	17 Å²	17	92.9 Å²	92.9	14%	0.14	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	14.1	-179.9	0	0	0	0	0	113.7	R298 L299 E304 Q308	R298-A302 VanDerWaalsContact O-CB 3.3Å; R298-A302 WeakPolarHBondContact O-CB 3.47Å; R298-A302 PolarHBondContact O-N 2.84Å; L299-A302 PolarHBondContact O-N 3.15Å; A302-E304 PolarHBondContact O-N 3.02Å; A302-E304 VanDerWaalsContact O-N 3.11Å; A302-Q308 HydrophobicContact CB-CB 4.15Å
303	T	62.3	Low	75.7	Confident	72 Å²	72	93.8 Å²	93.8	44%	0.442	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.7	-172.7	42.8	0	0	0	0	115.1	I300 N301 R309	I300-T303 VanDerWaalsContact O-CG2 3.29Å; I300-T303 WeakPolarHBondContact O-CG2 3.23Å; I300-T303 PolarHBondContact O-OG1 3.34Å; I300-T303 VanDerWaalsContact O-OG1 3.1Å; N301-T303 PolarHBondContact O-N 3.27Å; T303-R309 PolarHBondContact O-NH2 3.13Å
304	E	67	Low	75.9	Confident	187 Å²	187	96.4 Å²	96.4	87%	0.874	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-22.4	-172.5	-64.2	-175	176.9	0	0	114.7	A302	A302-E304 PolarHBondContact O-N 3.02Å; A302-E304 VanDerWaalsContact O-N 3.11Å
305	S	75.3	Confident	75.9	Confident	38 Å²	38	99.4 Å²	99.4	27%	0.266	49%	0.491	S	S	.	.			trans	-129.6	129.6	-179.7	74	0	0	0	0	113.2	S307 Q308 R309	S305-S307 PolarHBondContact O-N 3.04Å; S305-Q308 PolarHBondContact O-N 3.34Å; S305-Q308 VanDerWaalsContact OG-CB 3.28Å; S305-Q308 WeakPolarHBondContact OG-CB 3.5Å; S305-Q308 WeakPolarHBondContact OG-CG 3.47Å; S305-Q308 PolarHBondContact OG-N 3.49Å; S305-Q308 PolarHBondContact OG-OE1 2.82Å; S305-Q308 VanDerWaalsContact OG-OE1 3.09Å; S305-R309 PolarHBondContact O-N 3.05Å
306	E	78.5	Confident	76.1	Confident	156 Å²	156	100.1 Å²	100.1	73%	0.729	49%	0.493	S	S	*	.	H	α-helix	trans	-59.8	-36.5	178.3	-169.1	172.8	-173.9	0	0	111.9	Q308 R309 L310	E306-Q308 PolarHBondContact O-N 3.39Å; E306-R309 PolarHBondContact O-N 3.06Å; E306-L310 HydrophobicContact CG-CD1 4.43Å; E306-L310 PolarHBondContact O-N 2.96Å
307	S	79.7	Confident	76.6	Confident	90 Å²	90	99.4 Å²	99.4	63%	0.629	49%	0.487	S	S	*	.	H	α-helix	trans	-61	-40.9	176.2	-53.4	0	0	0	0	113.3	S305 L310 Q311	S305-S307 PolarHBondContact O-N 3.04Å; S307-L310 PolarHBondContact O-N 3.46Å; S307-Q311 WeakPolarHBondContact O-CB 3.46Å; S307-Q311 PolarHBondContact O-N 3.36Å
308	Q	73.7	Confident	77	Confident	99 Å²	99	99.4 Å²	99.4	46%	0.463	49%	0.488	S	S	.	.	H	α-helix	trans	-68.5	-36.4	177.8	-75	169	-4.6	0	0	111.8	A302 S305 E306 Q311 F312	A302-Q308 HydrophobicContact CB-CB 4.15Å; S305-Q308 PolarHBondContact O-N 3.34Å; S305-Q308 VanDerWaalsContact OG-CB 3.28Å; S305-Q308 WeakPolarHBondContact OG-CB 3.5Å; S305-Q308 WeakPolarHBondContact OG-CG 3.47Å; S305-Q308 PolarHBondContact OG-N 3.49Å; S305-Q308 PolarHBondContact OG-OE1 2.82Å; S305-Q308 VanDerWaalsContact OG-OE1 3.09Å; E306-Q308 PolarHBondContact O-N 3.39Å; Q308-Q311 PolarHBondContact O-N 3.28Å; Q308-F312 PolarHBondContact O-N 3.42Å
309	R	76.4	Confident	77.4	Confident	104 Å²	104	96.6 Å²	96.6	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-44.3	174.7	-63.6	-178.3	-170	-179.5	0.3	111.6	T303 S305 E306 Q311 F312 Y313	T303-R309 PolarHBondContact O-NH2 3.13Å; S305-R309 PolarHBondContact O-N 3.05Å; E306-R309 PolarHBondContact O-N 3.06Å; R309-Q311 VanDerWaalsContact C-N 3.32Å; R309-Q311 PolarHBondContact O-N 2.91Å; R309-F312 PolarHBondContact O-N 3.41Å; R309-Y313 HydrophobicContact CB-CE2 4.43Å; R309-Y313 WeakPolarHBondContact O-CD2 3.46Å; R309-Y313 PolarHBondContact O-N 2.94Å
310	L	80.4	Confident	77.8	Confident	108 Å²	108	101.1 Å²	101.1	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-60.6	-41.2	175.4	-78.7	166.2	0	0	0	111.8	E306 S307 Y313 L314	E306-L310 HydrophobicContact CG-CD1 4.43Å; E306-L310 PolarHBondContact O-N 2.96Å; S307-L310 PolarHBondContact O-N 3.46Å; L310-Y313 PolarHBondContact O-N 3.29Å; L310-L314 WeakPolarHBondContact O-CB 3.46Å; L310-L314 PolarHBondContact O-N 2.94Å
311	Q	80.8	Confident	78.4	Confident	134 Å²	134	99 Å²	99	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-64.3	-40.1	176.7	-166.2	172.1	4.3	0	0	112	S307 Q308 R309 L314 E315	S307-Q311 WeakPolarHBondContact O-CB 3.46Å; S307-Q311 PolarHBondContact O-N 3.36Å; Q308-Q311 PolarHBondContact O-N 3.28Å; R309-Q311 VanDerWaalsContact C-N 3.32Å; R309-Q311 PolarHBondContact O-N 2.91Å; Q311-L314 PolarHBondContact O-N 3.44Å; Q311-E315 WeakPolarHBondContact O-CB 3.34Å; Q311-E315 PolarHBondContact O-N 3Å
312	F	79	Confident	79.1	Confident	36 Å²	36	98.6 Å²	98.6	16%	0.158	49%	0.485	C	S	.	.	H	α-helix	trans	-62.8	-45.4	173.4	179.7	-84.6	0	0	0	112.4	A295 L299 Q308 R309 L314 E315 T316	A295-F312 HydrophobicContact CB-CE2 4.24Å; A295-F312 HydrophobicContact CB-CZ 4.28Å; A295-F312 WeakPolarHBondContact O-CE2 3.46Å; L299-F312 HydrophobicContact CB-CE2 4.45Å; L299-F312 HydrophobicContact CB-CZ 4.34Å; L299-F312 HydrophobicContact CD1-CD1 3.74Å; L299-F312 HydrophobicContact CD1-CE1 3.42Å; L299-F312 VanDerWaalsContact CD1-CE1 3.42Å; L299-F312 HydrophobicContact CD1-CZ 3.95Å; L299-F312 HydrophobicContact CG-CD1 4.26Å; L299-F312 HydrophobicContact CG-CE1 4.26Å; Q308-F312 PolarHBondContact O-N 3.42Å; R309-F312 PolarHBondContact O-N 3.41Å; F312-L314 VanDerWaalsContact C-N 3.32Å; F312-L314 PolarHBondContact O-N 2.91Å; F312-E315 PolarHBondContact O-N 3.42Å; F312-T316 HydrophobicContact CD1-CG2 4.08Å; F312-T316 HydrophobicContact CE1-CG2 3.53Å; F312-T316 HydrophobicContact CE2-CG2 4.27Å; F312-T316 HydrophobicContact CZ-CG2 3.67Å; F312-T316 WeakPolarHBondContact O-CB 3.43Å; F312-T316 WeakPolarHBondContact O-CG2 3.42Å; F312-T316 PolarHBondContact O-N 3.26Å; F312-T316 PolarHBondContact O-OG1 3.05Å
313	Y	80.9	Confident	79.9	Confident	133 Å²	133	102.5 Å²	102.5	52%	0.522	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-39.5	176.5	-72.7	-56.8	0	0	0	112.1	R309 L310 T316 E317	R309-Y313 HydrophobicContact CB-CE2 4.43Å; R309-Y313 WeakPolarHBondContact O-CD2 3.46Å; R309-Y313 PolarHBondContact O-N 2.94Å; L310-Y313 PolarHBondContact O-N 3.29Å; Y313-T316 WeakPolarHBondContact CA-OG1 3.4Å; Y313-T316 PolarHBondContact O-OG1 2.96Å; Y313-E317 WeakPolarHBondContact O-CB 3.46Å; Y313-E317 PolarHBondContact O-N 3.27Å
314	L	84.9	Confident	81.2	Confident	111 Å²	111	105.3 Å²	105.3	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-64.7	-45.7	175.9	-177.3	64.9	0	0	0	111.7	L310 Q311 F312 E317 M318	L310-L314 WeakPolarHBondContact O-CB 3.46Å; L310-L314 PolarHBondContact O-N 2.94Å; Q311-L314 PolarHBondContact O-N 3.44Å; F312-L314 VanDerWaalsContact C-N 3.32Å; F312-L314 PolarHBondContact O-N 2.91Å; L314-E317 PolarHBondContact O-N 3.15Å; L314-M318 HydrophobicContact CG-SD 4.46Å; L314-M318 WeakPolarHBondContact O-CB 3.4Å; L314-M318 VanDerWaalsContact O-CG 3.32Å; L314-M318 WeakPolarHBondContact O-CG 3.41Å; L314-M318 PolarHBondContact O-N 3.49Å
315	E	82.5	Confident	82.3	Confident	95 Å²	95	100 Å²	100	44%	0.444	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-42.3	178.7	-172	176	-174	0	0	111.8	Q311 F312 M318 Q319	Q311-E315 WeakPolarHBondContact O-CB 3.34Å; Q311-E315 PolarHBondContact O-N 3Å; F312-E315 PolarHBondContact O-N 3.42Å; E315-M318 PolarHBondContact O-N 2.83Å; E315-Q319 WeakPolarHBondContact O-CG 3.42Å; E315-Q319 PolarHBondContact O-N 3.07Å
316	T	80.1	Confident	83	Confident	44 Å²	44	101.9 Å²	101.9	27%	0.27	50%	0.499	S	S	.	.	H	α-helix	trans	-66.4	-40	177	46.3	0	0	0	0	112.7	F312 Y313 Q319 R320	F312-T316 HydrophobicContact CD1-CG2 4.08Å; F312-T316 HydrophobicContact CE1-CG2 3.53Å; F312-T316 HydrophobicContact CE2-CG2 4.27Å; F312-T316 HydrophobicContact CZ-CG2 3.67Å; F312-T316 WeakPolarHBondContact O-CB 3.43Å; F312-T316 WeakPolarHBondContact O-CG2 3.42Å; F312-T316 PolarHBondContact O-N 3.26Å; F312-T316 PolarHBondContact O-OG1 3.05Å; Y313-T316 WeakPolarHBondContact CA-OG1 3.4Å; Y313-T316 PolarHBondContact O-OG1 2.96Å; T316-Q319 PolarHBondContact O-N 2.92Å; T316-R320 WeakPolarHBondContact O-CB 3.31Å; T316-R320 PolarHBondContact O-N 3.06Å
317	E	85	Confident	83.5	Confident	92 Å²	92	98.7 Å²	98.7	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-68.8	-35.1	173.6	-79.7	-62	139.6	0	0	112.6	Y313 L314 R320 S321	Y313-E317 WeakPolarHBondContact O-CB 3.46Å; Y313-E317 PolarHBondContact O-N 3.27Å; L314-E317 PolarHBondContact O-N 3.15Å; E317-R320 PolarHBondContact O-N 2.91Å; E317-R320 IonicContact OE1-CZ 3.75Å; E317-R320 IonicContact OE1-NH1 3.75Å; E317-R320 PolarHBondContact OE1-NH1 3.31Å; E317-S321 WeakPolarHBondContact O-CB 3.5Å; E317-S321 PolarHBondContact O-N 2.93Å; E317-S321 PolarHBondContact O-OG 3.3Å
318	M	87.1	Confident	84.1	Confident	124 Å²	124	97.2 Å²	97.2	61%	0.611	48%	0.481	S	S	*	.	H	α-helix	trans	-62.9	-47.8	171.7	-79.2	-176.6	59.3	0	0	111.9	L314 E315 R320 S321 Q322	L314-M318 HydrophobicContact CG-SD 4.46Å; L314-M318 WeakPolarHBondContact O-CB 3.4Å; L314-M318 VanDerWaalsContact O-CG 3.32Å; L314-M318 WeakPolarHBondContact O-CG 3.41Å; L314-M318 PolarHBondContact O-N 3.49Å; E315-M318 PolarHBondContact O-N 2.83Å; M318-R320 VanDerWaalsContact C-N 3.35Å; M318-R320 PolarHBondContact O-N 3.43Å; M318-S321 PolarHBondContact O-N 3.26Å; M318-Q322 PolarHBondContact O-N 3.09Å
319	Q	84.3	Confident	84.9	Confident	100 Å²	100	96.7 Å²	96.7	47%	0.467	48%	0.481	S	S	.	.	H	α-helix	trans	-61.5	-42.8	176.6	-74.2	176	0.1	0	0	111.6	E315 T316 S321 Q322 L323	E315-Q319 WeakPolarHBondContact O-CG 3.42Å; E315-Q319 PolarHBondContact O-N 3.07Å; T316-Q319 PolarHBondContact O-N 2.92Å; Q319-S321 VanDerWaalsContact C-N 3.34Å; Q319-S321 PolarHBondContact O-N 2.7Å; Q319-Q322 PolarHBondContact O-N 3.18Å; Q319-L323 WeakPolarHBondContact O-CB 3.33Å; Q319-L323 WeakPolarHBondContact O-CG 3.29Å; Q319-L323 PolarHBondContact O-N 3.49Å
320	R	81.3	Confident	85.6	Confident	145 Å²	145	98.7 Å²	98.7	55%	0.547	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-42.8	175.8	-177.8	-179.4	-83.8	174.7	-10.4	111.5	T316 E317 M318 L323 Q324	T316-R320 WeakPolarHBondContact O-CB 3.31Å; T316-R320 PolarHBondContact O-N 3.06Å; E317-R320 PolarHBondContact O-N 2.91Å; E317-R320 IonicContact OE1-CZ 3.75Å; E317-R320 IonicContact OE1-NH1 3.75Å; E317-R320 PolarHBondContact OE1-NH1 3.31Å; M318-R320 VanDerWaalsContact C-N 3.35Å; M318-R320 PolarHBondContact O-N 3.43Å; R320-L323 PolarHBondContact O-N 2.98Å; R320-Q324 WeakPolarHBondContact O-CB 3.46Å; R320-Q324 WeakPolarHBondContact O-CG 3.46Å; R320-Q324 PolarHBondContact O-N 3.09Å
321	S	85.6	Confident	86.2	Confident	67 Å²	67	100 Å²	100	47%	0.469	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-41.4	177.2	-60.6	0	0	0	0	112	E317 M318 Q319 Q324 S325	E317-S321 WeakPolarHBondContact O-CB 3.5Å; E317-S321 PolarHBondContact O-N 2.93Å; E317-S321 PolarHBondContact O-OG 3.3Å; M318-S321 PolarHBondContact O-N 3.26Å; Q319-S321 VanDerWaalsContact C-N 3.34Å; Q319-S321 PolarHBondContact O-N 2.7Å; S321-Q324 PolarHBondContact O-N 3.04Å; S321-S325 PolarHBondContact O-N 2.7Å
322	Q	88.9	Confident	86.7	Confident	118 Å²	118	96.4 Å²	96.4	55%	0.551	48%	0.481	S	S	*	.	H	α-helix	trans	-63.6	-48.6	175.2	-176.1	179.2	-17.7	0	0	111.5	M318 Q319 Q324 S325 E326	M318-Q322 PolarHBondContact O-N 3.09Å; Q319-Q322 PolarHBondContact O-N 3.18Å; Q322-Q324 VanDerWaalsContact C-N 3.27Å; Q322-Q324 PolarHBondContact O-N 3.35Å; Q322-S325 WeakPolarHBondContact O-CB 3.42Å; Q322-S325 PolarHBondContact O-N 3.17Å; Q322-E326 PolarHBondContact NE2-OE1 3.37Å; Q322-E326 PolarHBondContact O-N 3.26Å
323	L	83.7	Confident	87.4	Confident	100 Å²	100	101.8 Å²	101.8	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-32.1	177.3	-74.2	172	0	0	0	112.7	Q319 R320 N327	Q319-L323 WeakPolarHBondContact O-CB 3.33Å; Q319-L323 WeakPolarHBondContact O-CG 3.29Å; Q319-L323 PolarHBondContact O-N 3.49Å; R320-L323 PolarHBondContact O-N 2.98Å; L323-N327 VanDerWaalsContact O-CB 3.3Å; L323-N327 WeakPolarHBondContact O-CB 3.45Å; L323-N327 PolarHBondContact O-N 3.05Å; L323-N327 PolarHBondContact O-ND2 3.34Å; L323-N327 VanDerWaalsContact O-ND2 3.08Å
324	Q	89.2	Confident	87.8	Confident	130 Å²	130	100.4 Å²	100.4	61%	0.607	50%	0.501	S	S	*	.	H	α-helix	trans	-67.5	-40.9	172	-81.2	-178.8	-11.4	0	0	111.8	R320 S321 Q322 N327 A328	R320-Q324 WeakPolarHBondContact O-CB 3.46Å; R320-Q324 WeakPolarHBondContact O-CG 3.46Å; R320-Q324 PolarHBondContact O-N 3.09Å; S321-Q324 PolarHBondContact O-N 3.04Å; Q322-Q324 VanDerWaalsContact C-N 3.27Å; Q322-Q324 PolarHBondContact O-N 3.35Å; Q324-N327 PolarHBondContact O-N 3.06Å; Q324-A328 PolarHBondContact O-N 3.27Å
325	S	90.3	Very high	88.2	Confident	77 Å²	77	101.8 Å²	101.8	54%	0.538	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-46.2	174.7	-169.5	0	0	0	0	111.7	S321 Q322 N327 A328 D329	S321-S325 PolarHBondContact O-N 2.7Å; Q322-S325 WeakPolarHBondContact O-CB 3.42Å; Q322-S325 PolarHBondContact O-N 3.17Å; S325-N327 PolarHBondContact O-N 3.28Å; S325-A328 WeakPolarHBondContact O-CB 3.27Å; S325-A328 PolarHBondContact O-N 2.92Å; S325-D329 PolarHBondContact O-N 2.98Å
326	E	90.7	Very high	88.7	Confident	76 Å²	76	102.2 Å²	102.2	36%	0.355	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-42.5	176.9	-71.2	175.2	-167	0	0	111.4	Q322 A328 D329 Y330	Q322-E326 PolarHBondContact NE2-OE1 3.37Å; Q322-E326 PolarHBondContact O-N 3.26Å; E326-A328 VanDerWaalsContact C-N 3.3Å; E326-A328 PolarHBondContact O-N 3.26Å; E326-D329 WeakPolarHBondContact O-CB 3.35Å; E326-D329 PolarHBondContact O-N 2.99Å; E326-D329 VanDerWaalsContact O-N 3.17Å; E326-Y330 HydrophobicContact CB-CD2 4.46Å; E326-Y330 HydrophobicContact CB-CE2 4.25Å; E326-Y330 WeakPolarHBondContact O-CD2 3.49Å; E326-Y330 PolarHBondContact O-N 3.45Å
327	N	88.2	Confident	89.3	Confident	89 Å²	89	102.4 Å²	102.4	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-60.5	-38.2	173.8	-98	-66.4	0	0	0	112.9	L323 Q324 S325 D329 K331	L323-N327 VanDerWaalsContact O-CB 3.3Å; L323-N327 WeakPolarHBondContact O-CB 3.45Å; L323-N327 PolarHBondContact O-N 3.05Å; L323-N327 PolarHBondContact O-ND2 3.34Å; L323-N327 VanDerWaalsContact O-ND2 3.08Å; Q324-N327 PolarHBondContact O-N 3.06Å; S325-N327 PolarHBondContact O-N 3.28Å; N327-D329 VanDerWaalsContact C-N 3.34Å; N327-K331 WeakPolarHBondContact O-CB 3.27Å; N327-K331 VanDerWaalsContact O-CG 3.23Å; N327-K331 WeakPolarHBondContact O-CG 3.09Å; N327-K331 PolarHBondContact O-N 3.42Å
328	A	92.1	Very high	89.6	Confident	60 Å²	60	102.5 Å²	102.5	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-64.9	-41.1	175.5	0	0	0	0	0	111.2	Q324 S325 E326 K331 S332	Q324-A328 PolarHBondContact O-N 3.27Å; S325-A328 WeakPolarHBondContact O-CB 3.27Å; S325-A328 PolarHBondContact O-N 2.92Å; E326-A328 VanDerWaalsContact C-N 3.3Å; E326-A328 PolarHBondContact O-N 3.26Å; A328-K331 PolarHBondContact O-N 2.81Å; A328-S332 PolarHBondContact O-N 2.87Å
329	D	92.2	Very high	89.9	Confident	88 Å²	88	102.1 Å²	102.1	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-48.3	176.4	-125.3	44.5	0	0	0	111.8	S325 E326 N327 K331 S332 R333	S325-D329 PolarHBondContact O-N 2.98Å; E326-D329 WeakPolarHBondContact O-CB 3.35Å; E326-D329 PolarHBondContact O-N 2.99Å; E326-D329 VanDerWaalsContact O-N 3.17Å; N327-D329 VanDerWaalsContact C-N 3.34Å; D329-K331 VanDerWaalsContact C-N 3.34Å; D329-K331 PolarHBondContact O-N 3.39Å; D329-S332 WeakPolarHBondContact O-CB 3.41Å; D329-S332 PolarHBondContact O-N 3.42Å; D329-S332 VanDerWaalsContact O-N 3.15Å; D329-R333 WeakPolarHBondContact O-CG 3.27Å; D329-R333 PolarHBondContact O-N 2.99Å; D329-R333 IonicContact OD2-NH2 3.14Å; D329-R333 PolarHBondContact OD2-NH2 2.93Å
330	Y	90.3	Very high	90.3	Very high	146 Å²	146	103.1 Å²	103.1	57%	0.573	51%	0.51	S	S	*	.	H	α-helix	trans	-61.1	-41.2	176	-74.5	-59.6	0	0	0	112.1	E326 S332 R333 L334	E326-Y330 HydrophobicContact CB-CD2 4.46Å; E326-Y330 HydrophobicContact CB-CE2 4.25Å; E326-Y330 WeakPolarHBondContact O-CD2 3.49Å; E326-Y330 PolarHBondContact O-N 3.45Å; Y330-S332 VanDerWaalsContact C-N 3.31Å; Y330-S332 PolarHBondContact O-N 3.01Å; Y330-R333 PolarHBondContact O-N 3.41Å; Y330-L334 WeakPolarHBondContact O-CB 3.26Å; Y330-L334 PolarHBondContact O-N 3.46Å
331	K	92.1	Very high	90.7	Very high	134 Å²	134	101.2 Å²	101.2	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-36.6	174.8	-76.7	175.1	-178	-179.2	0	112.4	N327 A328 D329 K335	N327-K331 WeakPolarHBondContact O-CB 3.27Å; N327-K331 VanDerWaalsContact O-CG 3.23Å; N327-K331 WeakPolarHBondContact O-CG 3.09Å; N327-K331 PolarHBondContact O-N 3.42Å; A328-K331 PolarHBondContact O-N 2.81Å; D329-K331 VanDerWaalsContact C-N 3.34Å; D329-K331 PolarHBondContact O-N 3.39Å; K331-K335 WeakPolarHBondContact O-CG 3.3Å; K331-K335 PolarHBondContact O-N 3.33Å
332	S	92.3	Very high	91.1	Very high	60 Å²	60	103.8 Å²	103.8	42%	0.42	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-46.7	175.1	-164.7	0	0	0	0	111.3	A328 D329 Y330 L334 K335 E336	A328-S332 PolarHBondContact O-N 2.87Å; D329-S332 WeakPolarHBondContact O-CB 3.41Å; D329-S332 PolarHBondContact O-N 3.42Å; D329-S332 VanDerWaalsContact O-N 3.15Å; Y330-S332 VanDerWaalsContact C-N 3.31Å; Y330-S332 PolarHBondContact O-N 3.01Å; S332-L334 VanDerWaalsContact C-N 3.33Å; S332-L334 PolarHBondContact O-N 3.24Å; S332-K335 PolarHBondContact O-N 3.35Å; S332-E336 PolarHBondContact O-N 3.29Å
333	R	92.8	Very high	91.3	Very high	149 Å²	149	103.5 Å²	103.5	56%	0.562	51%	0.512	S	S	*	.	H	α-helix	trans	-63.4	-37.6	177.6	-67.8	179.5	-170.1	-173.6	7.3	112.8	D329 Y330 E336 A337	D329-R333 WeakPolarHBondContact O-CG 3.27Å; D329-R333 PolarHBondContact O-N 2.99Å; D329-R333 IonicContact OD2-NH2 3.14Å; D329-R333 PolarHBondContact OD2-NH2 2.93Å; Y330-R333 PolarHBondContact O-N 3.41Å; R333-E336 PolarHBondContact O-N 2.92Å; R333-A337 WeakPolarHBondContact O-CB 3.48Å; R333-A337 PolarHBondContact O-N 2.86Å
334	L	90.6	Very high	91.8	Very high	104 Å²	104	102.8 Å²	102.8	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-48.1	175.2	-168.1	84.4	0	0	0	110.5	Y330 S332 E336 A337 E338	Y330-L334 WeakPolarHBondContact O-CB 3.26Å; Y330-L334 PolarHBondContact O-N 3.46Å; S332-L334 VanDerWaalsContact C-N 3.33Å; S332-L334 PolarHBondContact O-N 3.24Å; L334-E336 PolarHBondContact O-N 3.26Å; L334-A337 WeakPolarHBondContact O-CB 3.31Å; L334-A337 PolarHBondContact O-N 3.21Å; L334-A337 VanDerWaalsContact O-N 3.14Å; L334-E338 WeakPolarHBondContact O-CG 3.47Å; L334-E338 PolarHBondContact O-N 3.5Å
335	K	93.2	Very high	91.9	Very high	139 Å²	139	102.3 Å²	102.3	60%	0.604	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-44.2	176.5	-73.6	-179.6	179.3	-175.4	0	112.4	K331 S332 A337 E338 E339	K331-K335 WeakPolarHBondContact O-CG 3.3Å; K331-K335 PolarHBondContact O-N 3.33Å; S332-K335 PolarHBondContact O-N 3.35Å; K335-A337 VanDerWaalsContact C-N 3.29Å; K335-A337 PolarHBondContact O-N 2.96Å; K335-E338 PolarHBondContact O-N 3.44Å; K335-E339 WeakPolarHBondContact O-CB 3.32Å; K335-E339 PolarHBondContact O-N 2.93Å
336	E	93.5	Very high	92.1	Very high	105 Å²	105	105.2 Å²	105.2	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-37.4	175.6	-73.7	179.8	-162.7	0	0	112.7	S332 R333 L334 K340	S332-E336 PolarHBondContact O-N 3.29Å; R333-E336 PolarHBondContact O-N 2.92Å; L334-E336 PolarHBondContact O-N 3.26Å; E336-K340 VanDerWaalsContact O-CG 3.27Å; E336-K340 WeakPolarHBondContact O-CG 3.43Å; E336-K340 PolarHBondContact O-N 3.13Å; E336-K340 VanDerWaalsContact O-N 3.12Å
337	A	91	Very high	92.2	Very high	47 Å²	47	109.2 Å²	109.2	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-69.6	-42.5	176.4	0	0	0	0	0	111.7	R333 L334 K335 E339 K340 L341	R333-A337 WeakPolarHBondContact O-CB 3.48Å; R333-A337 PolarHBondContact O-N 2.86Å; L334-A337 WeakPolarHBondContact O-CB 3.31Å; L334-A337 PolarHBondContact O-N 3.21Å; L334-A337 VanDerWaalsContact O-N 3.14Å; K335-A337 VanDerWaalsContact C-N 3.29Å; K335-A337 PolarHBondContact O-N 2.96Å; A337-E339 VanDerWaalsContact C-N 3.33Å; A337-E339 PolarHBondContact O-N 3.02Å; A337-K340 PolarHBondContact O-N 3.24Å; A337-L341 PolarHBondContact O-N 3.32Å
338	E	92.3	Very high	92.3	Very high	94 Å²	94	109.7 Å²	109.7	44%	0.439	52%	0.524	S	S	.	.	H	α-helix	trans	-60.5	-40.6	174.1	-72.6	173.7	176.1	0	0	111.8	L334 K335 L341 K342	L334-E338 WeakPolarHBondContact O-CG 3.47Å; L334-E338 PolarHBondContact O-N 3.5Å; K335-E338 PolarHBondContact O-N 3.44Å; E338-L341 PolarHBondContact O-N 3.17Å; E338-K342 WeakPolarHBondContact O-CG 3.47Å; E338-K342 PolarHBondContact O-N 2.9Å
339	E	93.9	Very high	92.3	Very high	117 Å²	117	111.3 Å²	111.3	55%	0.547	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-42.5	175.2	-152.9	94.1	-149.4	0	0	111.5	K335 A337 K342 Q343	K335-E339 WeakPolarHBondContact O-CB 3.32Å; K335-E339 PolarHBondContact O-N 2.93Å; A337-E339 VanDerWaalsContact C-N 3.33Å; A337-E339 PolarHBondContact O-N 3.02Å; E339-K342 PolarHBondContact O-N 2.87Å; E339-Q343 WeakPolarHBondContact O-CG 3.27Å; E339-Q343 PolarHBondContact O-N 2.88Å
340	K	92.9	Very high	92.3	Very high	121 Å²	121	113.9 Å²	113.9	53%	0.526	53%	0.534	S	S	.	.	H	α-helix	trans	-65.2	-38.8	176.3	-73.5	167.5	-172.8	165.4	0	112.1	E336 A337 Q343 L344	E336-K340 VanDerWaalsContact O-CG 3.27Å; E336-K340 WeakPolarHBondContact O-CG 3.43Å; E336-K340 PolarHBondContact O-N 3.13Å; E336-K340 VanDerWaalsContact O-N 3.12Å; A337-K340 PolarHBondContact O-N 3.24Å; K340-Q343 PolarHBondContact O-N 3.14Å; K340-L344 WeakPolarHBondContact O-CG 3.32Å; K340-L344 PolarHBondContact O-N 3.22Å
341	L	89.5	Confident	92.4	Very high	105 Å²	105	113.3 Å²	113.3	55%	0.55	54%	0.535	S	S	.	.	H	α-helix	trans	-62.4	-47.3	175.7	-77.6	174.3	0	0	0	111	A337 E338 Q343 L344 E345	A337-L341 PolarHBondContact O-N 3.32Å; E338-L341 PolarHBondContact O-N 3.17Å; L341-Q343 VanDerWaalsContact C-N 3.33Å; L341-Q343 PolarHBondContact O-N 3.18Å; L341-L344 PolarHBondContact O-N 3.29Å; L341-L344 VanDerWaalsContact O-N 3.08Å; L341-E345 WeakPolarHBondContact O-CG 3.47Å; L341-E345 PolarHBondContact O-N 2.85Å
342	K	93	Very high	92.3	Very high	121 Å²	121	110.9 Å²	110.9	53%	0.526	53%	0.528	S	S	.	.	H	α-helix	trans	-57.4	-44.5	175	-72	175.6	-177.9	172.1	0	112.4	E338 E339 L344 E345 E346	E338-K342 WeakPolarHBondContact O-CG 3.47Å; E338-K342 PolarHBondContact O-N 2.9Å; E339-K342 PolarHBondContact O-N 2.87Å; K342-L344 VanDerWaalsContact C-N 3.31Å; K342-L344 PolarHBondContact O-N 3.16Å; K342-E345 PolarHBondContact O-N 3.36Å; K342-E346 WeakPolarHBondContact O-CG 3.46Å; K342-E346 PolarHBondContact O-N 3.04Å
343	Q	93.8	Very high	92.3	Very high	112 Å²	112	111.4 Å²	111.4	52%	0.523	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-36.4	176.4	-71.9	174.7	13.7	0	0	112.9	E339 K340 L341 R347	E339-Q343 WeakPolarHBondContact O-CG 3.27Å; E339-Q343 PolarHBondContact O-N 2.88Å; K340-Q343 PolarHBondContact O-N 3.14Å; L341-Q343 VanDerWaalsContact C-N 3.33Å; L341-Q343 PolarHBondContact O-N 3.18Å; Q343-R347 VanDerWaalsContact O-CG 3.27Å; Q343-R347 WeakPolarHBondContact O-CG 3.35Å; Q343-R347 PolarHBondContact O-N 3.15Å; Q343-R347 VanDerWaalsContact O-N 3.16Å
344	L	93.5	Very high	92.3	Very high	85 Å²	85	107.7 Å²	107.7	45%	0.445	52%	0.52	S	S	.	.	H	α-helix	trans	-71.6	-40.5	176.8	-74	172	0	0	0	111.8	K340 L341 K342 R347 I348	K340-L344 WeakPolarHBondContact O-CG 3.32Å; K340-L344 PolarHBondContact O-N 3.22Å; L341-L344 PolarHBondContact O-N 3.29Å; L341-L344 VanDerWaalsContact O-N 3.08Å; K342-L344 VanDerWaalsContact C-N 3.31Å; K342-L344 PolarHBondContact O-N 3.16Å; L344-R347 WeakPolarHBondContact O-CB 3.47Å; L344-R347 PolarHBondContact O-N 3.09Å; L344-I348 WeakPolarHBondContact O-CG1 3.49Å; L344-I348 PolarHBondContact O-N 3.1Å
345	E	92.5	Very high	92.2	Very high	120 Å²	120	106.4 Å²	106.4	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-59.9	-46.7	174.3	-73	173.5	172.9	0	0	111.3	L341 K342 R347 I348 V349	L341-E345 WeakPolarHBondContact O-CG 3.47Å; L341-E345 PolarHBondContact O-N 2.85Å; K342-E345 PolarHBondContact O-N 3.36Å; E345-R347 VanDerWaalsContact C-N 3.3Å; E345-R347 PolarHBondContact O-N 3.18Å; E345-I348 WeakPolarHBondContact O-CB 3.24Å; E345-I348 PolarHBondContact O-N 3.35Å; E345-I348 VanDerWaalsContact O-N 3.11Å; E345-V349 WeakPolarHBondContact O-CG2 3.29Å; E345-V349 PolarHBondContact O-N 2.72Å
346	E	92.7	Very high	92	Very high	138 Å²	138	105.7 Å²	105.7	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-59.1	-39.9	174.7	-74.2	179	-179.2	0	0	112.3	K342 V349 K350	K342-E346 WeakPolarHBondContact O-CG 3.46Å; K342-E346 PolarHBondContact O-N 3.04Å; E346-V349 PolarHBondContact O-N 2.99Å; E346-K350 WeakPolarHBondContact O-CB 3.46Å; E346-K350 PolarHBondContact O-N 3.27Å
347	R	93.3	Very high	91.7	Very high	160 Å²	160	103.7 Å²	103.7	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-66.7	-35.8	175.7	-75.5	173.5	65.4	-175.3	1.2	112.7	Q343 L344 E345 K351	Q343-R347 VanDerWaalsContact O-CG 3.27Å; Q343-R347 WeakPolarHBondContact O-CG 3.35Å; Q343-R347 PolarHBondContact O-N 3.15Å; Q343-R347 VanDerWaalsContact O-N 3.16Å; L344-R347 WeakPolarHBondContact O-CB 3.47Å; L344-R347 PolarHBondContact O-N 3.09Å; E345-R347 VanDerWaalsContact C-N 3.3Å; E345-R347 PolarHBondContact O-N 3.18Å; R347-K351 WeakPolarHBondContact O-CG 3.35Å; R347-K351 PolarHBondContact O-N 3.49Å
348	I	90.6	Very high	91.6	Very high	99 Å²	99	108.2 Å²	108.2	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-66.6	-46.3	175.8	-71.3	166.3	0	0	0	109.6	L344 E345 K350 K351 N352	L344-I348 WeakPolarHBondContact O-CG1 3.49Å; L344-I348 PolarHBondContact O-N 3.1Å; E345-I348 WeakPolarHBondContact O-CB 3.24Å; E345-I348 PolarHBondContact O-N 3.35Å; E345-I348 VanDerWaalsContact O-N 3.11Å; I348-K350 VanDerWaalsContact C-N 3.32Å; I348-K350 PolarHBondContact O-N 2.87Å; I348-K351 PolarHBondContact O-N 2.99Å; I348-N352 PolarHBondContact O-N 3.42Å
349	V	92.1	Very high	91.5	Very high	93 Å²	93	111.8 Å²	111.8	56%	0.564	53%	0.53	S	S	*	.	H	α-helix	trans	-57.1	-46.9	176.1	173.1	0	0	0	0	110.5	E345 E346 K351 N352 T353	E345-V349 WeakPolarHBondContact O-CG2 3.29Å; E345-V349 PolarHBondContact O-N 2.72Å; E346-V349 PolarHBondContact O-N 2.99Å; V349-K351 PolarHBondContact O-N 3.09Å; V349-N352 PolarHBondContact O-N 2.97Å; V349-T353 PolarHBondContact O-N 3.27Å; V349-T353 PolarHBondContact O-OG1 3.47Å
350	K	92.1	Very high	91.2	Very high	143 Å²	143	113.1 Å²	113.1	62%	0.622	54%	0.536	S	S	*	.	H	α-helix	trans	-61.7	-42.5	177.7	-169.9	173	-176.7	174.4	0	113.1	E346 I348 N352 T353 D354	E346-K350 WeakPolarHBondContact O-CB 3.46Å; E346-K350 PolarHBondContact O-N 3.27Å; I348-K350 VanDerWaalsContact C-N 3.32Å; I348-K350 PolarHBondContact O-N 2.87Å; K350-N352 VanDerWaalsContact C-N 3.32Å; K350-N352 PolarHBondContact O-N 3.28Å; K350-T353 WeakPolarHBondContact CA-OG1 3.45Å; K350-T353 PolarHBondContact O-N 3.35Å; K350-T353 PolarHBondContact O-OG1 2.96Å; K350-D354 VanDerWaalsContact O-CG 3.27Å; K350-D354 PolarHBondContact O-N 2.64Å
351	K	92.2	Very high	91.1	Very high	133 Å²	133	110.3 Å²	110.3	58%	0.578	53%	0.531	S	S	*	.	H	α-helix	trans	-65.2	-36	175.5	-80.6	-172.1	171.2	-169	0	112.5	R347 I348 V349 D354 I355	R347-K351 WeakPolarHBondContact O-CG 3.35Å; R347-K351 PolarHBondContact O-N 3.49Å; I348-K351 PolarHBondContact O-N 2.99Å; V349-K351 PolarHBondContact O-N 3.09Å; K351-D354 PolarHBondContact O-N 3.39Å; K351-I355 VanDerWaalsContact O-CG1 3.3Å; K351-I355 WeakPolarHBondContact O-CG1 3.47Å; K351-I355 PolarHBondContact O-N 3.47Å
352	N	91.5	Very high	90.9	Very high	83 Å²	83	109.1 Å²	109.1	44%	0.444	53%	0.528	S	S	.	.	H	α-helix	trans	-65.9	-41	176.4	-75.9	-22.1	0	0	0	111.4	I348 V349 K350 D354 I355 E356	I348-N352 PolarHBondContact O-N 3.42Å; V349-N352 PolarHBondContact O-N 2.97Å; K350-N352 VanDerWaalsContact C-N 3.32Å; K350-N352 PolarHBondContact O-N 3.28Å; N352-D354 VanDerWaalsContact C-N 3.3Å; N352-D354 PolarHBondContact O-N 3Å; N352-I355 PolarHBondContact O-N 3.37Å; N352-E356 WeakPolarHBondContact O-CG 3.47Å; N352-E356 PolarHBondContact O-N 2.9Å
353	T	92.2	Very high	90.6	Very high	71 Å²	71	112 Å²	112	44%	0.436	54%	0.536	S	S	.	.	H	α-helix	trans	-62.5	-38	173.3	51.5	0	0	0	0	112.3	V349 K350 E356 S357	V349-T353 PolarHBondContact O-N 3.27Å; V349-T353 PolarHBondContact O-OG1 3.47Å; K350-T353 WeakPolarHBondContact CA-OG1 3.45Å; K350-T353 PolarHBondContact O-N 3.35Å; K350-T353 PolarHBondContact O-OG1 2.96Å; T353-E356 PolarHBondContact O-N 2.86Å; T353-S357 PolarHBondContact O-N 3.2Å
354	D	92.1	Very high	90.3	Very high	72 Å²	72	109.6 Å²	109.6	39%	0.385	53%	0.531	S	S	.	.	H	α-helix	trans	-64.3	-44.6	175	-64.6	-19.7	0	0	0	110.9	K350 K351 N352 E356 S357 F358	K350-D354 VanDerWaalsContact O-CG 3.27Å; K350-D354 PolarHBondContact O-N 2.64Å; K351-D354 PolarHBondContact O-N 3.39Å; N352-D354 VanDerWaalsContact C-N 3.3Å; N352-D354 PolarHBondContact O-N 3Å; D354-E356 VanDerWaalsContact C-N 3.32Å; D354-E356 PolarHBondContact O-N 3.39Å; D354-S357 PolarHBondContact O-N 3.42Å; D354-S357 PolarHBondContact O-OG 3.44Å; D354-F358 HydrophobicContact CB-CE2 4.21Å; D354-F358 WeakPolarHBondContact O-CD2 3.49Å; D354-F358 WeakPolarHBondContact O-CG 3.41Å; D354-F358 PolarHBondContact O-N 2.87Å
355	I	87.9	Confident	90	Very high	76 Å²	76	111.5 Å²	111.5	39%	0.39	54%	0.536	S	S	.	.	H	α-helix	trans	-60.1	-42	176.9	-70.4	165.3	0	0	0	111.4	K351 N352 F358 R359	K351-I355 VanDerWaalsContact O-CG1 3.3Å; K351-I355 WeakPolarHBondContact O-CG1 3.47Å; K351-I355 PolarHBondContact O-N 3.47Å; N352-I355 PolarHBondContact O-N 3.37Å; I355-F358 PolarHBondContact O-N 3.05Å; I355-R359 HydrophobicContact CG2-CG 4.48Å; I355-R359 VanDerWaalsContact O-CG 3.32Å; I355-R359 WeakPolarHBondContact O-CG 3.37Å; I355-R359 PolarHBondContact O-N 2.94Å
356	E	88.9	Confident	89.5	Confident	125 Å²	125	109.9 Å²	109.9	58%	0.584	53%	0.531	S	S	*	.	H	α-helix	trans	-63.4	-41.9	176	-75	171.9	176.8	0	0	111.7	N352 T353 D354 F358 R359 Q360	N352-E356 WeakPolarHBondContact O-CG 3.47Å; N352-E356 PolarHBondContact O-N 2.9Å; T353-E356 PolarHBondContact O-N 2.86Å; D354-E356 VanDerWaalsContact C-N 3.32Å; D354-E356 PolarHBondContact O-N 3.39Å; E356-F358 PolarHBondContact O-N 3.39Å; E356-R359 PolarHBondContact O-N 3.12Å; E356-Q360 PolarHBondContact O-N 2.84Å
357	S	88	Confident	89.2	Confident	62 Å²	62	109.1 Å²	109.1	43%	0.434	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-40.2	174.6	81.2	0	0	0	0	112.5	T353 D354 Q360 C361	T353-S357 PolarHBondContact O-N 3.2Å; D354-S357 PolarHBondContact O-N 3.42Å; D354-S357 PolarHBondContact O-OG 3.44Å; S357-Q360 PolarHBondContact O-N 3.12Å; S357-C361 PolarHBondContact O-N 3.23Å
358	F	89.2	Confident	88.7	Confident	142 Å²	142	105.9 Å²	105.9	62%	0.623	52%	0.522	S	S	*	.	H	α-helix	trans	-66.4	-41.9	175.8	-71.2	-54.3	0	0	0	111.9	D354 I355 E356 Q360 C361 V362	D354-F358 HydrophobicContact CB-CE2 4.21Å; D354-F358 WeakPolarHBondContact O-CD2 3.49Å; D354-F358 WeakPolarHBondContact O-CG 3.41Å; D354-F358 PolarHBondContact O-N 2.87Å; I355-F358 PolarHBondContact O-N 3.05Å; E356-F358 PolarHBondContact O-N 3.39Å; F358-Q360 VanDerWaalsContact C-N 3.29Å; F358-Q360 PolarHBondContact O-N 2.77Å; F358-C361 WeakPolarHBondContact O-CB 3.46Å; F358-C361 PolarHBondContact O-N 3.42Å; F358-V362 WeakPolarHBondContact O-CG2 3.38Å; F358-V362 PolarHBondContact O-N 2.95Å
359	R	89	Confident	88.1	Confident	169 Å²	169	106.1 Å²	106.1	64%	0.638	52%	0.523	S	S	*	.	H	α-helix	trans	-61	-38.7	175.5	-75.4	175.2	175.1	-177.3	-0.3	111.8	I355 E356 V362 R363	I355-R359 HydrophobicContact CG2-CG 4.48Å; I355-R359 VanDerWaalsContact O-CG 3.32Å; I355-R359 WeakPolarHBondContact O-CG 3.37Å; I355-R359 PolarHBondContact O-N 2.94Å; E356-R359 PolarHBondContact O-N 3.12Å; R359-V362 PolarHBondContact O-N 3.2Å; R359-R363 WeakPolarHBondContact O-CG 3.47Å; R359-R363 PolarHBondContact O-N 3.47Å
360	Q	88.3	Confident	87.6	Confident	145 Å²	145	105.7 Å²	105.7	68%	0.678	52%	0.52	S	S	*	.	H	α-helix	trans	-68.2	-39.5	176.3	-167.5	171.7	2.4	0	0	112.2	E356 S357 F358 R363 S364	E356-Q360 PolarHBondContact O-N 2.84Å; S357-Q360 PolarHBondContact O-N 3.12Å; F358-Q360 VanDerWaalsContact C-N 3.29Å; F358-Q360 PolarHBondContact O-N 2.77Å; Q360-R363 PolarHBondContact O-N 3.28Å; Q360-S364 PolarHBondContact O-N 2.99Å
361	C	89.8	Confident	87	Confident	62 Å²	62	104.1 Å²	104.1	42%	0.419	52%	0.515	S	S	.	.	H	α-helix	trans	-61.9	-41.7	173.7	-178.4	0	0	0	0	112.3	S357 F358 S364 K365	S357-C361 PolarHBondContact O-N 3.23Å; F358-C361 WeakPolarHBondContact O-CB 3.46Å; F358-C361 PolarHBondContact O-N 3.42Å; C361-S364 PolarHBondContact O-N 3.14Å; C361-K365 WeakPolarHBondContact O-CG 3.27Å; C361-K365 PolarHBondContact O-N 3.18Å; C361-K365 VanDerWaalsContact O-N 3.13Å
362	V	86.7	Confident	86.3	Confident	81 Å²	81	102.8 Å²	102.8	49%	0.491	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-48.1	175.5	172.6	0	0	0	0	111	F358 R359 S364 K365 D366	F358-V362 WeakPolarHBondContact O-CG2 3.38Å; F358-V362 PolarHBondContact O-N 2.95Å; R359-V362 PolarHBondContact O-N 3.2Å; V362-S364 VanDerWaalsContact C-N 3.33Å; V362-S364 PolarHBondContact O-N 2.92Å; V362-K365 WeakPolarHBondContact O-CB 3.37Å; V362-K365 PolarHBondContact O-N 3.01Å; V362-D366 PolarHBondContact O-N 3.39Å
363	R	86.8	Confident	85.6	Confident	181 Å²	181	100.9 Å²	100.9	68%	0.683	51%	0.51	S	S	*	.	H	α-helix	trans	-56.1	-45.1	177.2	-75.8	176.9	172.6	177.9	-2.6	112.7	R359 Q360 K365 D366 E367	R359-R363 WeakPolarHBondContact O-CG 3.47Å; R359-R363 PolarHBondContact O-N 3.47Å; Q360-R363 PolarHBondContact O-N 3.28Å; R363-K365 VanDerWaalsContact C-N 3.3Å; R363-K365 PolarHBondContact O-N 3.08Å; R363-D366 PolarHBondContact O-N 3.26Å; R363-E367 WeakPolarHBondContact O-CG 3.26Å; R363-E367 PolarHBondContact O-N 3.46Å
364	S	87.4	Confident	84.8	Confident	61 Å²	61	100.5 Å²	100.5	43%	0.427	51%	0.505	S	S	.	.	H	α-helix	trans	-62.8	-36.2	177.3	174	0	0	0	0	112.7	Q360 C361 V362 L368	Q360-S364 PolarHBondContact O-N 2.99Å; C361-S364 PolarHBondContact O-N 3.14Å; V362-S364 VanDerWaalsContact C-N 3.33Å; V362-S364 PolarHBondContact O-N 2.92Å; S364-L368 WeakPolarHBondContact O-CG 3.39Å; S364-L368 PolarHBondContact O-N 2.67Å
365	K	85.7	Confident	84	Confident	125 Å²	125	102.2 Å²	102.2	54%	0.543	51%	0.511	S	S	.	.	H	α-helix	trans	-68.4	-41.7	174.7	-72.5	177.6	178.4	-174.5	0	112	C361 V362 R363 E367 L368 I369	C361-K365 WeakPolarHBondContact O-CG 3.27Å; C361-K365 PolarHBondContact O-N 3.18Å; C361-K365 VanDerWaalsContact O-N 3.13Å; V362-K365 WeakPolarHBondContact O-CB 3.37Å; V362-K365 PolarHBondContact O-N 3.01Å; R363-K365 VanDerWaalsContact C-N 3.3Å; R363-K365 PolarHBondContact O-N 3.08Å; K365-E367 VanDerWaalsContact C-N 3.33Å; K365-E367 PolarHBondContact O-N 3.41Å; K365-L368 PolarHBondContact O-N 2.96Å; K365-I369 WeakPolarHBondContact O-CG1 3.27Å; K365-I369 PolarHBondContact O-N 2.89Å
366	D	83.7	Confident	83.2	Confident	86 Å²	86	102.4 Å²	102.4	46%	0.46	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-39.9	177.5	-66.9	-27.5	0	0	0	111.3	V362 R363 L368 I369 V370	V362-D366 PolarHBondContact O-N 3.39Å; R363-D366 PolarHBondContact O-N 3.26Å; D366-L368 VanDerWaalsContact C-N 3.35Å; D366-L368 PolarHBondContact O-N 3.43Å; D366-I369 PolarHBondContact O-N 3.01Å; D366-V370 WeakPolarHBondContact O-CG2 3.5Å; D366-V370 PolarHBondContact O-N 3.32Å
367	E	85	Confident	82	Confident	122 Å²	122	103.9 Å²	103.9	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-60.3	-42.1	174	-74.2	171.3	-171.5	0	0	112.2	R363 K365 V370 Q371	R363-E367 WeakPolarHBondContact O-CG 3.26Å; R363-E367 PolarHBondContact O-N 3.46Å; K365-E367 VanDerWaalsContact C-N 3.33Å; K365-E367 PolarHBondContact O-N 3.41Å; E367-V370 PolarHBondContact O-N 2.97Å; E367-Q371 WeakPolarHBondContact O-CG 3.4Å; E367-Q371 PolarHBondContact O-N 3.24Å
368	L	83.3	Confident	80.6	Confident	92 Å²	92	106.9 Å²	106.9	48%	0.482	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-38	175	-72.4	169.9	0	0	0	112.4	S364 K365 D366 V370 Q371 L372	S364-L368 WeakPolarHBondContact O-CG 3.39Å; S364-L368 PolarHBondContact O-N 2.67Å; K365-L368 PolarHBondContact O-N 2.96Å; D366-L368 VanDerWaalsContact C-N 3.35Å; D366-L368 PolarHBondContact O-N 3.43Å; L368-V370 VanDerWaalsContact C-N 3.34Å; L368-Q371 PolarHBondContact O-N 3.13Å; L368-L372 WeakPolarHBondContact O-CB 3.49Å; L368-L372 WeakPolarHBondContact O-CG 3.44Å; L368-L372 PolarHBondContact O-N 3.46Å
369	I	79.1	Confident	79	Confident	105 Å²	105	107.3 Å²	107.3	54%	0.538	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-42.5	176	-68.7	165.4	0	0	0	110.4	K365 D366 L372 A373	K365-I369 WeakPolarHBondContact O-CG1 3.27Å; K365-I369 PolarHBondContact O-N 2.89Å; D366-I369 PolarHBondContact O-N 3.01Å; I369-L372 PolarHBondContact O-N 3.04Å; I369-A373 WeakPolarHBondContact O-CB 3.33Å; I369-A373 PolarHBondContact O-N 3.33Å
370	V	79.7	Confident	77.1	Confident	83 Å²	83	104.9 Å²	104.9	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-43.5	177.4	173.7	0	0	0	0	110.8	D366 E367 L368 L372 A373 D374	D366-V370 WeakPolarHBondContact O-CG2 3.5Å; D366-V370 PolarHBondContact O-N 3.32Å; E367-V370 PolarHBondContact O-N 2.97Å; L368-V370 VanDerWaalsContact C-N 3.34Å; V370-L372 PolarHBondContact O-N 3.4Å; V370-A373 PolarHBondContact O-N 3.41Å; V370-D374 PolarHBondContact O-N 2.87Å
371	Q	80.8	Confident	75.3	Confident	111 Å²	111	106 Å²	106	52%	0.519	54%	0.539	S	S	.	.	H	α-helix	trans	-59.9	-47	176.1	-73.5	175.1	3.8	0	0	111.9	E367 L368 A373 D374 E375	E367-Q371 WeakPolarHBondContact O-CG 3.4Å; E367-Q371 PolarHBondContact O-N 3.24Å; L368-Q371 PolarHBondContact O-N 3.13Å; Q371-A373 VanDerWaalsContact C-N 3.32Å; Q371-A373 PolarHBondContact O-N 2.92Å; Q371-D374 PolarHBondContact O-N 3.48Å; Q371-E375 WeakPolarHBondContact O-CG 3.48Å; Q371-E375 PolarHBondContact O-N 3.28Å
372	L	76.3	Confident	73	Confident	105 Å²	105	107.4 Å²	107.4	55%	0.55	55%	0.549	S	S	.	.	H	α-helix	trans	-63.5	-36.6	176.7	-72.6	168.1	0	0	0	112.4	L368 I369 V370 E375 C376	L368-L372 WeakPolarHBondContact O-CB 3.49Å; L368-L372 WeakPolarHBondContact O-CG 3.44Å; L368-L372 PolarHBondContact O-N 3.46Å; I369-L372 PolarHBondContact O-N 3.04Å; V370-L372 PolarHBondContact O-N 3.4Å; L372-E375 PolarHBondContact O-N 2.91Å; L372-C376 PolarHBondContact O-N 2.8Å; L372-C376 PolarHBondContact O-SG 2.73Å
373	A	76.9	Confident	70.5	Confident	43 Å²	43	107.2 Å²	107.2	36%	0.355	56%	0.564	S	S	.	*	H	α-helix	trans	-68.1	-37.4	176.4	0	0	0	0	0	112.3	I369 V370 Q371 C376 R377	I369-A373 WeakPolarHBondContact O-CB 3.33Å; I369-A373 PolarHBondContact O-N 3.33Å; V370-A373 PolarHBondContact O-N 3.41Å; Q371-A373 VanDerWaalsContact C-N 3.32Å; Q371-A373 PolarHBondContact O-N 2.92Å; A373-C376 PolarHBondContact O-N 3.14Å; A373-R377 PolarHBondContact O-N 2.96Å
374	D	76	Confident	68.1	Low	63 Å²	63	102 Å²	102	34%	0.337	56%	0.559	S	S	.	*	H	α-helix	trans	-72.2	-37.2	175.2	-76.3	-11.3	0	0	0	111.9	V370 Q371 C376 R377 Q378	V370-D374 PolarHBondContact O-N 2.87Å; Q371-D374 PolarHBondContact O-N 3.48Å; D374-C376 VanDerWaalsContact C-N 3.35Å; D374-C376 PolarHBondContact O-N 2.83Å; D374-R377 PolarHBondContact O-N 3.48Å; D374-R377 IonicContact OD1-CZ 2.73Å; D374-R377 IonicContact OD1-NE 3.48Å; D374-R377 PolarHBondContact OD1-NE 2.76Å; D374-R377 IonicContact OD1-NH2 3.42Å; D374-R377 PolarHBondContact OD1-NH2 2.67Å; D374-Q378 WeakPolarHBondContact O-CB 3.05Å; D374-Q378 WeakPolarHBondContact O-CG 3.41Å; D374-Q378 PolarHBondContact O-N 2.79Å
375	E	76.1	Confident	65.8	Low	108 Å²	108	105.3 Å²	105.3	51%	0.505	58%	0.579	S	S	.	*	H	α-helix	trans	-59.3	-44.3	170.5	-75.8	-179.5	177.7	0	0	111.5	Q371 L372 R377 Q378 Q379	Q371-E375 WeakPolarHBondContact O-CG 3.48Å; Q371-E375 PolarHBondContact O-N 3.28Å; L372-E375 PolarHBondContact O-N 2.91Å; E375-R377 PolarHBondContact O-N 3.48Å; E375-Q378 PolarHBondContact O-N 3.4Å; E375-Q379 WeakPolarHBondContact O-CG 3.49Å; E375-Q379 PolarHBondContact O-N 2.79Å
376	C	69.5	Low	63.8	Low	80 Å²	80	105.5 Å²	105.5	54%	0.541	59%	0.59	S	S	.	*	H	α-helix	trans	-61.4	-40.8	173.8	-79.6	0	0	0	0	112.6	L372 A373 D374 T380	L372-C376 PolarHBondContact O-N 2.8Å; L372-C376 PolarHBondContact O-SG 2.73Å; A373-C376 PolarHBondContact O-N 3.14Å; D374-C376 VanDerWaalsContact C-N 3.35Å; D374-C376 PolarHBondContact O-N 2.83Å; C376-T380 PolarHBondContact O-N 2.85Å; C376-T380 PolarHBondContact O-OG1 2.83Å
377	R	64	Low	61.5	Low	155 Å²	155	106.9 Å²	106.9	59%	0.585	60%	0.598	S	S	*	*	H	α-helix	trans	-66.8	-43	176.1	-84.5	-171.2	-78.4	-155.7	-0.5	112.3	A373 D374 E375 Q379 T380 E381	A373-R377 PolarHBondContact O-N 2.96Å; D374-R377 PolarHBondContact O-N 3.48Å; D374-R377 IonicContact OD1-CZ 2.73Å; D374-R377 IonicContact OD1-NE 3.48Å; D374-R377 PolarHBondContact OD1-NE 2.76Å; D374-R377 IonicContact OD1-NH2 3.42Å; D374-R377 PolarHBondContact OD1-NH2 2.67Å; E375-R377 PolarHBondContact O-N 3.48Å; R377-Q379 VanDerWaalsContact C-N 3.31Å; R377-Q379 PolarHBondContact O-N 3.44Å; R377-T380 WeakPolarHBondContact O-CA 3.49Å; R377-T380 WeakPolarHBondContact O-CB 3.35Å; R377-T380 PolarHBondContact O-N 3.49Å; R377-E381 PolarHBondContact O-N 3.18Å
378	Q	59.3	Low	59.2	Low	126 Å²	126	109.9 Å²	109.9	59%	0.589	61%	0.612	S	S	*	*	H	α-helix	trans	-65.8	-33.4	178.6	-72.4	176.2	23.8	0	0	112.6	D374 E375 T380 E381 S382	D374-Q378 WeakPolarHBondContact O-CB 3.05Å; D374-Q378 WeakPolarHBondContact O-CG 3.41Å; D374-Q378 PolarHBondContact O-N 2.79Å; E375-Q378 PolarHBondContact O-N 3.4Å; Q378-T380 PolarHBondContact O-N 3.24Å; Q378-E381 PolarHBondContact O-N 2.72Å; Q378-S382 WeakPolarHBondContact O-CB 3.42Å; Q378-S382 PolarHBondContact O-N 3.07Å; Q378-S382 PolarHBondContact O-OG 3.41Å; Q378-S382 VanDerWaalsContact O-OG 3.09Å
379	Q	55	Low	56.9	Low	151 Å²	151	114.7 Å²	114.7	71%	0.706	62%	0.624	S	S	*	*	H	α-helix	trans	-65.4	-25.2	170.1	-73.9	-179.3	11.8	0	0	112.7	E375 R377	E375-Q379 WeakPolarHBondContact O-CG 3.49Å; E375-Q379 PolarHBondContact O-N 2.79Å; R377-Q379 VanDerWaalsContact C-N 3.31Å; R377-Q379 PolarHBondContact O-N 3.44Å
380	T	50.4	Low	54.9	Low	117 Å²	117	116.8 Å²	116.8	72%	0.718	64%	0.635	S	S	*	*	H	α-helix	trans	-82.4	-35.2	177.1	-43.5	0	0	0	0	111.9	C376 R377 Q378	C376-T380 PolarHBondContact O-N 2.85Å; C376-T380 PolarHBondContact O-OG1 2.83Å; R377-T380 WeakPolarHBondContact O-CA 3.49Å; R377-T380 WeakPolarHBondContact O-CB 3.35Å; R377-T380 PolarHBondContact O-N 3.49Å; Q378-T380 PolarHBondContact O-N 3.24Å
381	E	49.4	Very low	53	Low	170 Å²	170	118.3 Å²	118.3	79%	0.794	65%	0.645	S	S	*	*	H	α-helix	trans	-83.2	-23.5	179.7	-71	-172.7	174	0	0	114	R377 Q378 G383	R377-E381 PolarHBondContact O-N 3.18Å; Q378-E381 PolarHBondContact O-N 2.72Å; E381-G383 VanDerWaalsContact C-N 3.29Å; E381-G383 PolarHBondContact O-N 3.26Å
382	S	41.4	Very low	50.9	Low	90 Å²	90	121.2 Å²	121.2	63%	0.629	66%	0.664	S	S	*	*	S	Bend	trans	-76.2	85.7	171.1	-60.9	0	0	0	0	109.3	Q378 A384	Q378-S382 WeakPolarHBondContact O-CB 3.42Å; Q378-S382 PolarHBondContact O-N 3.07Å; Q378-S382 PolarHBondContact O-OG 3.41Å; Q378-S382 VanDerWaalsContact O-OG 3.09Å; S382-A384 PolarHBondContact O-N 2.79Å
383	G	35.6	Very low	49	Very low	78 Å²	78	120.5 Å²	120.5	80%	0.804	67%	0.673	S	S	*	*			trans	-42.7	96.4	-176.2	0	0	0	0	0	114.6	E381	E381-G383 VanDerWaalsContact C-N 3.29Å; E381-G383 PolarHBondContact O-N 3.26Å
384	A	35.4	Very low	47.1	Very low	71 Å²	71	125.2 Å²	125.2	59%	0.587	69%	0.691	S	S	*	*			trans	-106.7	127	149.2	0	0	0	0	0	106.2	S382 V386	S382-A384 PolarHBondContact O-N 2.79Å; A384-V386 PolarHBondContact O-N 2.98Å
385	P	39.7	Very low	45.1	Very low	131 Å²	131	131 Å²	131	85%	0.851	72%	0.716	S	S	*	*			trans	-67.9	98.9	176.8	28.2	-29.9	0	0	0	107.1	D387	P385-D387 PolarHBondContact O-N 3.38Å
386	V	42.2	Very low	43.3	Very low	128 Å²	128	131 Å²	131	78%	0.776	73%	0.726	S	S	*	*			trans	-80	82.9	168.4	-176.7	0	0	0	0	106.6	A384	A384-V386 PolarHBondContact O-N 2.98Å
387	D	35.8	Very low	41.4	Very low	116 Å²	116	132.8 Å²	132.8	62%	0.62	74%	0.737	S	S	*	*			trans	29.4	106.1	135.7	-137.4	20.7	0	0	0	115.9	P385 W389	P385-D387 PolarHBondContact O-N 3.38Å; D387-W389 PolarHBondContact O-N 3.3Å; D387-W389 PolarHBondContact O-NE1 2.82Å
388	E	36.8	Very low	39.9	Very low	185 Å²	185	130.5 Å²	130.5	86%	0.864	74%	0.744	S	S	*	*	S	Bend	trans	-15.4	27.7	158.1	-114.3	172.3	-178.7	0	0	122.8
389	W	36.1	Very low	38.7	Very low	193 Å²	193	132.5 Å²	132.5	73%	0.731	75%	0.753	S	S	*	*			trans	-120.4	35.5	179	58	-78.2	0	0	0	115.2	D387	D387-W389 PolarHBondContact O-N 3.3Å; D387-W389 PolarHBondContact O-NE1 2.82Å
390	L	36.5	Very low	37.8	Very low	149 Å²	149	133.3 Å²	133.3	78%	0.78	76%	0.757	S	S	*	*	S	Bend	trans	-130.8	7.9	165.7	-136.7	84.4	0	0	0	115.5
391	T	40.3	Very low	37.6	Very low	114 Å²	114	134.9 Å²	134.9	70%	0.699	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-7.3	-175.1	-16.7	0	0	0	0	114.5
392	D	36.9	Very low	37.3	Very low	172 Å²	172	134.3 Å²	134.3	92%	0.92	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	13.8	-171.2	-93.4	2	0	0	0	115.8
393	A	36.1	Very low	37.6	Very low	90 Å²	90	134.4 Å²	134.4	74%	0.744	75%	0.754	S	S	*	*	S	Bend	trans	-125.3	10.4	-178.6	0	0	0	0	0	116.2
394	I	37.4	Very low	38.6	Very low	143 Å²	143	134.9 Å²	134.9	73%	0.733	74%	0.741	S	S	*	*			trans	-127	86	175.1	-51.4	178.4	0	0	0	108.7	P396	I394-P396 WeakPolarHBondContact O-CD 3.43Å
395	E	33.5	Very low	39.6	Very low	185 Å²	185	137.2 Å²	137.2	86%	0.864	74%	0.743	S	S	*	*			trans	-51.5	120.5	159	-95	179.5	154.7	0	0	108.2	C397	E395-C397 VanDerWaalsContact C-N 3.29Å; E395-C397 PolarHBondContact O-N 3.03Å
396	P	37.5	Very low	40.4	Very low	108 Å²	108	133.9 Å²	133.9	70%	0.701	73%	0.727	S	S	*	*			trans	-72.9	91.2	176.3	29.4	-31	0	0	0	107.5	I394 C398	I394-P396 WeakPolarHBondContact O-CD 3.43Å; P396-C398 PolarHBondContact O-N 3.41Å
397	C	29.8	Very low	41.5	Very low	117 Å²	117	129.7 Å²	129.7	79%	0.791	70%	0.703	S	S	*	*			trans	-71.6	64.1	160.6	-153.8	0	0	0	0	108	E395 E399	E395-C397 VanDerWaalsContact C-N 3.29Å; E395-C397 PolarHBondContact O-N 3.03Å; C397-E399 VanDerWaalsContact C-N 3.27Å; C397-E399 PolarHBondContact O-N 2.92Å
398	C	33.1	Very low	43.2	Very low	107 Å²	107	129.4 Å²	129.4	72%	0.723	70%	0.698	S	S	*	*			trans	-90.3	73.8	167.3	-69.5	0	0	0	0	106.4	P396 E400	P396-C398 PolarHBondContact O-N 3.41Å; C398-E400 VanDerWaalsContact C-N 3.3Å; C398-E400 PolarHBondContact O-N 3.25Å
399	E	33.7	Very low	44.9	Very low	168 Å²	168	125.7 Å²	125.7	79%	0.785	68%	0.681	S	S	*	*			trans	-59.3	108.5	149.7	-77	-174.3	166.3	0	0	105.4	C397 I401	C397-E399 VanDerWaalsContact C-N 3.27Å; C397-E399 PolarHBondContact O-N 2.92Å; E399-I401 VanDerWaalsContact C-N 3.3Å; E399-I401 PolarHBondContact O-N 3.35Å
400	E	36.5	Very low	46.8	Very low	167 Å²	167	120.7 Å²	120.7	78%	0.78	67%	0.666	S	S	*	*			trans	-49.1	103.4	163.6	-69.9	-180	161.3	0	0	106.3	C398 Q402	C398-E400 VanDerWaalsContact C-N 3.3Å; C398-E400 PolarHBondContact O-N 3.25Å; E400-Q402 PolarHBondContact O-N 3.37Å
401	I	45.4	Very low	48.7	Very low	150 Å²	150	117.2 Å²	117.2	77%	0.769	65%	0.647	S	S	*	*			trans	-63.1	95.2	171.1	-61	172.2	0	0	0	104.2	E399 V403	E399-I401 VanDerWaalsContact C-N 3.3Å; E399-I401 PolarHBondContact O-N 3.35Å; I401-V403 PolarHBondContact O-N 2.66Å
402	Q	43.6	Very low	50.5	Low	159 Å²	159	115.4 Å²	115.4	74%	0.743	63%	0.633	S	S	*	*			trans	-59	100	165.3	-71.4	177.5	-3.3	0	0	104.6	E400 T404	E400-Q402 PolarHBondContact O-N 3.37Å; Q402-T404 PolarHBondContact O-N 3.43Å
403	V	47.7	Very low	52.4	Low	92 Å²	92	113.9 Å²	113.9	56%	0.558	61%	0.614	S	S	*	*			trans	-59.8	87.9	171.1	177.5	0	0	0	0	104.9	I401 S407 E408	I401-V403 PolarHBondContact O-N 2.66Å; V403-S407 WeakPolarHBondContact CG1-OG 3.4Å; V403-E408 HydrophobicContact CG1-CG 4.25Å
404	T	56.5	Low	54.3	Low	87 Å²	87	113.9 Å²	113.9	53%	0.534	60%	0.601	S	S	.	*			trans	-57.8	146.4	-179.4	45	0	0	0	0	108.5	Q402 A406 S407	Q402-T404 PolarHBondContact O-N 3.43Å; T404-A406 PolarHBondContact O-N 2.95Å; T404-S407 PolarHBondContact O-N 2.93Å; T404-S407 PolarHBondContact O-OG 3.08Å
405	D	56.9	Low	56.4	Low	120 Å²	120	114.5 Å²	114.5	64%	0.642	60%	0.595	S	S	*	*	H	α-helix	trans	-47.1	-26.6	173.4	-73.8	-21.2	0	0	0	112.8	S407 E408 Q409	D405-S407 VanDerWaalsContact C-N 3.33Å; D405-S407 PolarHBondContact O-N 3.06Å; D405-E408 PolarHBondContact O-N 3.39Å; D405-Q409 WeakPolarHBondContact O-CB 3.48Å; D405-Q409 VanDerWaalsContact O-CG 3.27Å; D405-Q409 WeakPolarHBondContact O-CG 3.25Å; D405-Q409 PolarHBondContact O-N 3.21Å
406	A	56.5	Low	58.6	Low	62 Å²	62	111.7 Å²	111.7	51%	0.512	59%	0.585	S	S	.	*	H	α-helix	trans	-60.6	-38.5	174.2	0	0	0	0	0	113.2	T404 E410	T404-A406 PolarHBondContact O-N 2.95Å; A406-E410 WeakPolarHBondContact O-CB 3.4Å; A406-E410 PolarHBondContact O-N 3.44Å
407	S	65.7	Low	60.6	Low	39 Å²	39	109.6 Å²	109.6	27%	0.273	57%	0.568	S	S	.	*	H	α-helix	trans	-74.4	-37.3	178.6	62.2	0	0	0	0	112.4	V403 T404 D405 E410 I411	V403-S407 WeakPolarHBondContact CG1-OG 3.4Å; T404-S407 PolarHBondContact O-N 2.93Å; T404-S407 PolarHBondContact O-OG 3.08Å; D405-S407 VanDerWaalsContact C-N 3.33Å; D405-S407 PolarHBondContact O-N 3.06Å; S407-E410 PolarHBondContact O-N 3.35Å; S407-I411 WeakPolarHBondContact O-CB 3.47Å; S407-I411 WeakPolarHBondContact O-CD1 3.47Å; S407-I411 WeakPolarHBondContact O-CG1 3.32Å; S407-I411 PolarHBondContact O-N 3.08Å
408	E	70.3	Confident	63	Low	111 Å²	111	108 Å²	108	52%	0.519	56%	0.555	S	S	.	*	H	α-helix	trans	-64.5	-43.2	172.3	-69.9	-162.1	155.1	0	0	111.4	V403 D405 E410 I411 D412	V403-E408 HydrophobicContact CG1-CG 4.25Å; D405-E408 PolarHBondContact O-N 3.39Å; E408-E410 VanDerWaalsContact C-N 3.31Å; E408-E410 PolarHBondContact O-N 3.47Å; E408-I411 PolarHBondContact O-N 3.37Å; E408-D412 PolarHBondContact O-N 3Å
409	Q	73.3	Confident	65.4	Low	107 Å²	107	104.8 Å²	104.8	50%	0.5	54%	0.535	S	S	.	.	H	α-helix	trans	-61.3	-38.7	174.9	-73.2	175.1	22.7	0	0	112.6	D405 D412 R413	D405-Q409 WeakPolarHBondContact O-CB 3.48Å; D405-Q409 VanDerWaalsContact O-CG 3.27Å; D405-Q409 WeakPolarHBondContact O-CG 3.25Å; D405-Q409 PolarHBondContact O-N 3.21Å; Q409-D412 PolarHBondContact O-N 2.88Å; Q409-R413 VanDerWaalsContact O-CG 3.3Å; Q409-R413 WeakPolarHBondContact O-CG 3.38Å; Q409-R413 PolarHBondContact O-N 3Å
410	E	75.7	Confident	67.6	Low	88 Å²	88	97.4 Å²	97.4	41%	0.411	50%	0.504	S	S	.	.	H	α-helix	trans	-69.9	-39.4	177	-168.8	61.3	-164.7	0	0	111.6	A406 S407 E408 D412 R413 L414	A406-E410 WeakPolarHBondContact O-CB 3.4Å; A406-E410 PolarHBondContact O-N 3.44Å; S407-E410 PolarHBondContact O-N 3.35Å; E408-E410 VanDerWaalsContact C-N 3.31Å; E408-E410 PolarHBondContact O-N 3.47Å; E410-D412 VanDerWaalsContact C-N 3.31Å; E410-D412 PolarHBondContact O-N 2.94Å; E410-R413 PolarHBondContact O-N 3.04Å; E410-R413 IonicContact OE2-CZ 3.82Å; E410-R413 IonicContact OE2-NH1 2.79Å; E410-R413 PolarHBondContact OE2-NH1 2.98Å; E410-L414 HydrophobicContact CG-CD1 4.39Å; E410-L414 WeakPolarHBondContact O-CB 3.35Å; E410-L414 VanDerWaalsContact O-CG 3.25Å; E410-L414 WeakPolarHBondContact O-CG 3.45Å; E410-L414 PolarHBondContact O-N 3.27Å
411	I	75.8	Confident	69.7	Low	76 Å²	76	93.2 Å²	93.2	39%	0.39	48%	0.482	S	S	.	.	H	α-helix	trans	-60.5	-42.6	173.2	-70.9	165.3	0	0	0	110.6	S407 E408 L414 R415	S407-I411 WeakPolarHBondContact O-CB 3.47Å; S407-I411 WeakPolarHBondContact O-CD1 3.47Å; S407-I411 WeakPolarHBondContact O-CG1 3.32Å; S407-I411 PolarHBondContact O-N 3.08Å; E408-I411 PolarHBondContact O-N 3.37Å; I411-L414 PolarHBondContact O-N 2.91Å; I411-R415 VanDerWaalsContact O-CG 3.27Å; I411-R415 WeakPolarHBondContact O-CG 3.41Å; I411-R415 PolarHBondContact O-N 2.9Å
412	D	79	Confident	71.5	Confident	76 Å²	76	90 Å²	90	41%	0.406	46%	0.464	S	S	.	.	H	α-helix	trans	-69.3	-39.3	178.7	-74.9	-20.1	0	0	0	112.4	E408 Q409 E410 L414 R415 D416	E408-D412 PolarHBondContact O-N 3Å; Q409-D412 PolarHBondContact O-N 2.88Å; E410-D412 VanDerWaalsContact C-N 3.31Å; E410-D412 PolarHBondContact O-N 2.94Å; D412-L414 VanDerWaalsContact C-N 3.31Å; D412-L414 PolarHBondContact O-N 3.48Å; D412-R415 WeakPolarHBondContact O-CB 3.34Å; D412-R415 PolarHBondContact O-N 2.92Å; D412-R415 IonicContact OD1-CZ 3.87Å; D412-R415 IonicContact OD1-NH1 2.96Å; D412-R415 PolarHBondContact OD1-NH1 3.25Å; D412-D416 PolarHBondContact O-N 3.39Å
413	R	76	Confident	73.2	Confident	139 Å²	139	87.7 Å²	87.7	53%	0.525	45%	0.448	S	S	.	.	H	α-helix	trans	-59.1	-42.8	170.4	-73.4	173.3	-169.6	152.6	4.4	112.1	Q409 E410 D416 L417	Q409-R413 VanDerWaalsContact O-CG 3.3Å; Q409-R413 WeakPolarHBondContact O-CG 3.38Å; Q409-R413 PolarHBondContact O-N 3Å; E410-R413 PolarHBondContact O-N 3.04Å; E410-R413 IonicContact OE2-CZ 3.82Å; E410-R413 IonicContact OE2-NH1 2.79Å; E410-R413 PolarHBondContact OE2-NH1 2.98Å; R413-D416 PolarHBondContact O-N 3.24Å; R413-L417 WeakPolarHBondContact O-CB 3.34Å; R413-L417 WeakPolarHBondContact O-CG 3.39Å; R413-L417 PolarHBondContact O-N 3.02Å
414	L	76.1	Confident	74.9	Confident	90 Å²	90	84.7 Å²	84.7	47%	0.471	43%	0.428	S	S	.	.	H	α-helix	trans	-65.4	-39.8	176.9	-72.8	170.5	0	0	0	111.2	E410 I411 D412 L417 V418	E410-L414 HydrophobicContact CG-CD1 4.39Å; E410-L414 WeakPolarHBondContact O-CB 3.35Å; E410-L414 VanDerWaalsContact O-CG 3.25Å; E410-L414 WeakPolarHBondContact O-CG 3.45Å; E410-L414 PolarHBondContact O-N 3.27Å; I411-L414 PolarHBondContact O-N 2.91Å; D412-L414 VanDerWaalsContact C-N 3.31Å; D412-L414 PolarHBondContact O-N 3.48Å; L414-L417 PolarHBondContact O-N 3.05Å; L414-V418 WeakPolarHBondContact O-CB 3.35Å; L414-V418 WeakPolarHBondContact O-CG2 3.43Å; L414-V418 PolarHBondContact O-N 3.37Å
415	R	81.3	Confident	76.1	Confident	157 Å²	157	84.5 Å²	84.5	59%	0.592	42%	0.424	S	S	*	.	H	α-helix	trans	-62.3	-44.1	174.7	-74.9	169.4	178.8	169.1	0.3	112.1	I411 D412 V418 A419	I411-R415 VanDerWaalsContact O-CG 3.27Å; I411-R415 WeakPolarHBondContact O-CG 3.41Å; I411-R415 PolarHBondContact O-N 2.9Å; D412-R415 WeakPolarHBondContact O-CB 3.34Å; D412-R415 PolarHBondContact O-N 2.92Å; D412-R415 IonicContact OD1-CZ 3.87Å; D412-R415 IonicContact OD1-NH1 2.96Å; D412-R415 PolarHBondContact OD1-NH1 3.25Å; R415-V418 PolarHBondContact O-N 3.34Å; R415-A419 WeakPolarHBondContact O-CB 3.45Å; R415-A419 PolarHBondContact O-N 2.97Å
416	D	80.1	Confident	77.4	Confident	125 Å²	125	85 Å²	85	67%	0.668	42%	0.423	S	S	*	.	H	α-helix	trans	-64.4	-42.1	176.8	-76.9	-16.9	0	0	0	111.7	D412 R413 A419 G420	D412-D416 PolarHBondContact O-N 3.39Å; R413-D416 PolarHBondContact O-N 3.24Å; D416-A419 PolarHBondContact O-N 3.32Å; D416-G420 PolarHBondContact O-N 3.03Å
417	L	80.1	Confident	78.7	Confident	65 Å²	65	83 Å²	83	34%	0.34	40%	0.402	S	S	.	.	H	α-helix	trans	-62	-44.5	174.2	-77.9	171.3	0	0	0	111.7	K72 R413 L414 G420 Y421	K72-L417 HydrophobicContact CG-CD2 4.17Å; R413-L417 WeakPolarHBondContact O-CB 3.34Å; R413-L417 WeakPolarHBondContact O-CG 3.39Å; R413-L417 PolarHBondContact O-N 3.02Å; L414-L417 PolarHBondContact O-N 3.05Å; L417-G420 PolarHBondContact O-N 3.44Å; L417-Y421 WeakPolarHBondContact O-CD2 3.22Å; L417-Y421 PolarHBondContact O-N 3.02Å
418	V	79.4	Confident	79.5	Confident	83 Å²	83	83.6 Å²	83.6	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-60.4	-46.8	176.3	168.4	0	0	0	0	110.5	L414 R415 G420 Y421 E422	L414-V418 WeakPolarHBondContact O-CB 3.35Å; L414-V418 WeakPolarHBondContact O-CG2 3.43Å; L414-V418 PolarHBondContact O-N 3.37Å; R415-V418 PolarHBondContact O-N 3.34Å; V418-G420 VanDerWaalsContact C-N 3.3Å; V418-G420 PolarHBondContact O-N 2.68Å; V418-Y421 PolarHBondContact O-N 3.36Å; V418-E422 WeakPolarHBondContact O-CG 3.48Å; V418-E422 PolarHBondContact O-N 3.45Å
419	A	83.5	Confident	80.2	Confident	39 Å²	39	80.4 Å²	80.4	32%	0.322	39%	0.388	S	S	.	.	H	α-helix	trans	-62.3	-36.9	176.1	0	0	0	0	0	112.5	R415 D416 E422 R423	R415-A419 WeakPolarHBondContact O-CB 3.45Å; R415-A419 PolarHBondContact O-N 2.97Å; D416-A419 PolarHBondContact O-N 3.32Å; A419-E422 PolarHBondContact O-N 3.3Å; A419-R423 PolarHBondContact O-N 3.22Å
420	G	79.8	Confident	80.7	Confident	13 Å²	13	80 Å²	80	13%	0.134	39%	0.385	C	S	.	.	H	α-helix	trans	-61.4	-46.5	172.4	0	0	0	0	0	112.6	D416 L417 V418 R423 Q424	D416-G420 PolarHBondContact O-N 3.03Å; L417-G420 PolarHBondContact O-N 3.44Å; V418-G420 VanDerWaalsContact C-N 3.3Å; V418-G420 PolarHBondContact O-N 2.68Å; G420-R423 PolarHBondContact O-N 3.47Å; G420-Q424 WeakPolarHBondContact O-CB 3.15Å; G420-Q424 PolarHBondContact O-N 3.36Å
421	Y	80.2	Confident	81	Confident	80 Å²	80	76 Å²	76	31%	0.314	37%	0.366	S	S	.	.	H	α-helix	trans	-63.7	-38.6	174.6	-81.2	-62	0	0	0	112.6	P71 K72 L417 V418 R423 Q424 N425	P71-Y421 HydrophobicContact CG-CD1 3.42Å; P71-Y421 VanDerWaalsContact CG-CD1 3.42Å; P71-Y421 HydrophobicContact CG-CD2 4.25Å; P71-Y421 HydrophobicContact CG-CE1 3.4Å; P71-Y421 VanDerWaalsContact CG-CE1 3.4Å; P71-Y421 HydrophobicContact CG-CE2 4.26Å; P71-Y421 HydrophobicContact CG-CG 3.83Å; K72-Y421 WeakPolarHBondContact CE-OH 3.4Å; L417-Y421 WeakPolarHBondContact O-CD2 3.22Å; L417-Y421 PolarHBondContact O-N 3.02Å; V418-Y421 PolarHBondContact O-N 3.36Å; Y421-R423 VanDerWaalsContact C-N 3.35Å; Y421-R423 PolarHBondContact O-N 2.91Å; Y421-Q424 VanDerWaalsContact CD1-OE1 3.24Å; Y421-Q424 PolarHBondContact O-N 3.18Å; Y421-N425 WeakPolarHBondContact O-CB 3.27Å; Y421-N425 PolarHBondContact O-N 2.96Å; Y421-N425 PolarHBondContact O-ND2 2.94Å
422	E	83.5	Confident	81.1	Confident	83 Å²	83	76.8 Å²	76.8	39%	0.388	37%	0.371	S	S	.	.	H	α-helix	trans	-60.3	-44.3	173.9	-73.7	-175.5	158.8	0	0	111.8	Q243 V418 A419 N425 Q426	Q243-E422 PolarHBondContact NE2-OE1 3Å; V418-E422 WeakPolarHBondContact O-CG 3.48Å; V418-E422 PolarHBondContact O-N 3.45Å; A419-E422 PolarHBondContact O-N 3.3Å; E422-N425 PolarHBondContact O-N 3.06Å; E422-Q426 VanDerWaalsContact O-CG 3.32Å; E422-Q426 WeakPolarHBondContact O-CG 3.22Å; E422-Q426 PolarHBondContact O-N 3.01Å
423	R	80.8	Confident	81.3	Confident	109 Å²	109	78.6 Å²	78.6	41%	0.411	38%	0.38	S	S	.	.	H	α-helix	trans	-66.9	-40.7	177.9	-167.3	-179	-65.7	139.4	4	112	E93 F97 A419 G420 Y421 Q426 F427	E93-R423 IonicContact OE1-CZ 3.98Å; E93-R423 IonicContact OE1-NH1 2.98Å; E93-R423 PolarHBondContact OE1-NH1 2.91Å; E93-R423 IonicContact OE2-NH1 3.88Å; E93-R423 PolarHBondContact OE2-NH1 3.21Å; F97-R423 HydrophobicContact CE1-CG 4.43Å; F97-R423 HydrophobicContact CZ-CG 3.98Å; A419-R423 PolarHBondContact O-N 3.22Å; G420-R423 PolarHBondContact O-N 3.47Å; Y421-R423 VanDerWaalsContact C-N 3.35Å; Y421-R423 PolarHBondContact O-N 2.91Å; R423-Q426 PolarHBondContact O-N 2.84Å; R423-F427 PolarHBondContact O-N 3.34Å
424	Q	82	Confident	81.4	Confident	29 Å²	29	73.3 Å²	73.3	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-47.7	173.6	-173.4	-160.2	15.8	0	0	111.5	F69 P71 G420 Y421 Q426 F427 L428	F69-Q424 HydrophobicContact CD2-CG 4.34Å; F69-Q424 HydrophobicContact CE1-CB 4.45Å; F69-Q424 HydrophobicContact CE1-CG 4.32Å; F69-Q424 HydrophobicContact CE2-CB 3.78Å; F69-Q424 HydrophobicContact CE2-CG 3.99Å; F69-Q424 VanDerWaalsContact CZ-CA 3.42Å; F69-Q424 HydrophobicContact CZ-CB 3.72Å; F69-Q424 HydrophobicContact CZ-CG 4Å; F69-Q424 VanDerWaalsContact O-CD 3.3Å; F69-Q424 WeakPolarHBondContact O-CG 3.33Å; F69-Q424 PolarHBondContact O-NE2 3.1Å; P71-Q424 VanDerWaalsContact CD-CD 3.43Å; P71-Q424 HydrophobicContact CG-CB 4.46Å; G420-Q424 WeakPolarHBondContact O-CB 3.15Å; G420-Q424 PolarHBondContact O-N 3.36Å; Y421-Q424 VanDerWaalsContact CD1-OE1 3.24Å; Y421-Q424 PolarHBondContact O-N 3.18Å; Q424-Q426 VanDerWaalsContact C-N 3.31Å; Q424-Q426 PolarHBondContact O-N 3.42Å; Q424-F427 WeakPolarHBondContact O-CB 3.37Å; Q424-F427 PolarHBondContact O-N 3.46Å; Q424-F427 VanDerWaalsContact O-N 3.09Å; Q424-L428 HydrophobicContact CG-CD1 3.97Å; Q424-L428 HydrophobicContact CG-CG 4.33Å; Q424-L428 WeakPolarHBondContact O-CG 3.46Å; Q424-L428 PolarHBondContact O-N 2.95Å
425	N	81.9	Confident	81.5	Confident	83 Å²	83	71 Å²	71	44%	0.444	35%	0.349	S	S	.	.	H	α-helix	trans	-58.7	-44.2	177	-74.8	-29.2	0	0	0	110.9	Y421 E422 F427 L428 N429	Y421-N425 WeakPolarHBondContact O-CB 3.27Å; Y421-N425 PolarHBondContact O-N 2.96Å; Y421-N425 PolarHBondContact O-ND2 2.94Å; E422-N425 PolarHBondContact O-N 3.06Å; N425-F427 VanDerWaalsContact C-N 3.32Å; N425-F427 PolarHBondContact O-N 3.08Å; N425-L428 PolarHBondContact O-N 3.21Å; N425-N429 VanDerWaalsContact O-CB 3.26Å; N425-N429 WeakPolarHBondContact O-CB 3.35Å; N425-N429 PolarHBondContact O-N 3.04Å; N425-N429 PolarHBondContact O-ND2 3.27Å; N425-N429 PolarHBondContact O-OD1 3.43Å
426	Q	85.3	Confident	81.5	Confident	132 Å²	132	68.3 Å²	68.3	62%	0.617	34%	0.343	S	S	*	.	H	α-helix	trans	-58.3	-42.4	174.3	-71.4	171.9	21.1	0	0	112.6	E422 R423 Q424 K430	E422-Q426 VanDerWaalsContact O-CG 3.32Å; E422-Q426 WeakPolarHBondContact O-CG 3.22Å; E422-Q426 PolarHBondContact O-N 3.01Å; R423-Q426 PolarHBondContact O-N 2.84Å; Q424-Q426 VanDerWaalsContact C-N 3.31Å; Q424-Q426 PolarHBondContact O-N 3.42Å; Q426-K430 PolarHBondContact O-N 3.34Å; Q426-K430 VanDerWaalsContact O-N 3.15Å
427	F	83.4	Confident	81.5	Confident	20 Å²	20	64.1 Å²	64.1	9%	0.088	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-51.7	176.4	175.9	-94.1	0	0	0	112.3	F67 F69 L100 Q104 R423 Q424 N425 N429 K430 E431	F67-F427 HydrophobicContact CB-CZ 4.37Å; F69-F427 AromaticContact CD1-CD1 3.88Å; F69-F427 HydrophobicContact CD1-CD1 3.88Å; F69-F427 HydrophobicContact CD1-CE1 4.22Å; F69-F427 HydrophobicContact CD1-CG 4.3Å; F69-F427 HydrophobicContact CE1-CB 3.74Å; F69-F427 AromaticContact CE1-CD1 3.65Å; F69-F427 HydrophobicContact CE1-CD1 3.65Å; F69-F427 HydrophobicContact CE1-CD2 4.38Å; F69-F427 HydrophobicContact CE1-CE1 4.39Å; F69-F427 AromaticContact CE1-CG 3.66Å; F69-F427 HydrophobicContact CE1-CG 3.66Å; F69-F427 HydrophobicContact CZ-CB 4.39Å; L100-F427 HydrophobicContact CB-CE2 3.85Å; L100-F427 HydrophobicContact CB-CZ 3.96Å; L100-F427 HydrophobicContact CD1-CE1 4.39Å; L100-F427 HydrophobicContact CD1-CE2 4.04Å; L100-F427 HydrophobicContact CD1-CZ 3.91Å; L100-F427 HydrophobicContact CD2-CZ 3.99Å; L100-F427 HydrophobicContact CG-CE2 4.42Å; L100-F427 HydrophobicContact CG-CZ 4.18Å; Q104-F427 VanDerWaalsContact NE2-CE2 3.26Å; R423-F427 PolarHBondContact O-N 3.34Å; Q424-F427 WeakPolarHBondContact O-CB 3.37Å; Q424-F427 PolarHBondContact O-N 3.46Å; Q424-F427 VanDerWaalsContact O-N 3.09Å; N425-F427 VanDerWaalsContact C-N 3.32Å; N425-F427 PolarHBondContact O-N 3.08Å; F427-N429 VanDerWaalsContact C-N 3.26Å; F427-N429 PolarHBondContact O-N 3.16Å; F427-K430 WeakPolarHBondContact O-CB 3.48Å; F427-K430 PolarHBondContact O-N 3.49Å; F427-K430 VanDerWaalsContact O-N 3.11Å; F427-E431 PolarHBondContact O-N 3.33Å
428	L	81.3	Confident	81.4	Confident	50 Å²	50	62.3 Å²	62.3	26%	0.262	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-35.4	-179.8	-69.4	174.5	0	0	0	111.9	Q424 N425 E431 L432	Q424-L428 HydrophobicContact CG-CD1 3.97Å; Q424-L428 HydrophobicContact CG-CG 4.33Å; Q424-L428 WeakPolarHBondContact O-CG 3.46Å; Q424-L428 PolarHBondContact O-N 2.95Å; N425-L428 PolarHBondContact O-N 3.21Å; L428-E431 PolarHBondContact O-N 2.8Å; L428-L432 WeakPolarHBondContact O-CB 3.3Å; L428-L432 WeakPolarHBondContact O-CG 3.33Å; L428-L432 PolarHBondContact O-N 3.13Å
429	N	86.4	Confident	81.4	Confident	44 Å²	44	62.6 Å²	62.6	24%	0.235	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-40.3	175.3	-68.1	-25.3	0	0	0	112.5	F250 N425 F427 L433	F250-N429 WeakPolarHBondContact CE1-OD1 3.38Å; F250-N429 WeakPolarHBondContact CE2-ND2 3.36Å; F250-N429 HydrophobicContact CZ-CB 4.19Å; F250-N429 WeakPolarHBondContact CZ-ND2 3.47Å; F250-N429 WeakPolarHBondContact CZ-OD1 3.29Å; N425-N429 VanDerWaalsContact O-CB 3.26Å; N425-N429 WeakPolarHBondContact O-CB 3.35Å; N425-N429 PolarHBondContact O-N 3.04Å; N425-N429 PolarHBondContact O-ND2 3.27Å; N425-N429 PolarHBondContact O-OD1 3.43Å; F427-N429 VanDerWaalsContact C-N 3.26Å; F427-N429 PolarHBondContact O-N 3.16Å; N429-L433 WeakPolarHBondContact O-CG 3.49Å; N429-L433 PolarHBondContact O-N 2.94Å; N429-L433 VanDerWaalsContact O-N 3.15Å
430	K	83.4	Confident	81.2	Confident	98 Å²	98	65.7 Å²	65.7	43%	0.426	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-45.5	173.9	-173.2	-174.4	175.2	-162.6	0	110.4	Q426 F427 L432 L433 E434	Q426-K430 PolarHBondContact O-N 3.34Å; Q426-K430 VanDerWaalsContact O-N 3.15Å; F427-K430 WeakPolarHBondContact O-CB 3.48Å; F427-K430 PolarHBondContact O-N 3.49Å; F427-K430 VanDerWaalsContact O-N 3.11Å; K430-L432 PolarHBondContact O-N 2.9Å; K430-L433 PolarHBondContact O-N 3.1Å; K430-E434 VanDerWaalsContact CE-OE1 3.29Å; K430-E434 WeakPolarHBondContact CE-OE1 3.39Å; K430-E434 WeakPolarHBondContact O-CG 3.38Å; K430-E434 PolarHBondContact O-N 3.44Å
431	E	81	Confident	81	Confident	4 Å²	4	68 Å²	68	2%	0.019	34%	0.337	C	S	.	.	H	α-helix	trans	-59.2	-45	177	179.7	65.6	-177.5	0	0	111.9	Q104 R107 F427 L428 L433 E434 L435	Q104-E431 PolarHBondContact NE2-OE2 3.15Å; R107-E431 IonicContact CZ-OE1 3.65Å; R107-E431 VanDerWaalsContact CZ-OE1 3.25Å; R107-E431 IonicContact CZ-OE2 3.88Å; R107-E431 IonicContact NH1-OE1 3.97Å; R107-E431 PolarHBondContact NH1-OE1 3.06Å; R107-E431 VanDerWaalsContact NH2-CD 3.26Å; R107-E431 IonicContact NH2-OE1 3.47Å; R107-E431 PolarHBondContact NH2-OE1 3.01Å; R107-E431 IonicContact NH2-OE2 3.67Å; R107-E431 PolarHBondContact NH2-OE2 3.36Å; F427-E431 PolarHBondContact O-N 3.33Å; L428-E431 PolarHBondContact O-N 2.8Å; E431-L433 PolarHBondContact O-N 3.37Å; E431-E434 PolarHBondContact O-N 2.96Å; E431-L435 HydrophobicContact CG-CD1 4Å; E431-L435 HydrophobicContact CG-CG 4.44Å; E431-L435 WeakPolarHBondContact O-CB 3.3Å; E431-L435 WeakPolarHBondContact O-CG 3.42Å; E431-L435 PolarHBondContact O-N 2.92Å
432	L	79	Confident	80.8	Confident	93 Å²	93	67.4 Å²	67.4	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-42.3	175.7	-87.3	165.4	0	0	0	112.6	L428 K430 E434 L435 H436	L428-L432 WeakPolarHBondContact O-CB 3.3Å; L428-L432 WeakPolarHBondContact O-CG 3.33Å; L428-L432 PolarHBondContact O-N 3.13Å; K430-L432 PolarHBondContact O-N 2.9Å; L432-E434 VanDerWaalsContact C-N 3.32Å; L432-L435 PolarHBondContact O-N 3.11Å; L432-H436 WeakPolarHBondContact O-CB 3.3Å; L432-H436 PolarHBondContact O-CD2 3.02Å; L432-H436 PolarHBondContact O-N 2.93Å
433	L	82.3	Confident	80.6	Confident	115 Å²	115	68.4 Å²	68.4	60%	0.602	34%	0.344	S	S	*	.	H	α-helix	trans	-64.4	-39.2	176.9	-73.7	168.6	0	0	0	111.6	N429 K430 E431 G437	N429-L433 WeakPolarHBondContact O-CG 3.49Å; N429-L433 PolarHBondContact O-N 2.94Å; N429-L433 VanDerWaalsContact O-N 3.15Å; K430-L433 PolarHBondContact O-N 3.1Å; E431-L433 PolarHBondContact O-N 3.37Å; L433-G437 PolarHBondContact O-N 2.74Å
434	E	79.1	Confident	80.4	Confident	28 Å²	28	66.1 Å²	66.1	13%	0.131	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-48	176	-69.7	-178.3	-178	0	0	111.6	R108 K430 E431 L432 H436 G437 L438	R108-E434 IonicContact CZ-OE1 3.52Å; R108-E434 IonicContact CZ-OE2 3.47Å; R108-E434 IonicContact NH1-OE1 3.98Å; R108-E434 IonicContact NH2-OE1 2.85Å; R108-E434 PolarHBondContact NH2-OE1 3.28Å; R108-E434 IonicContact NH2-OE2 3.59Å; R108-E434 PolarHBondContact NH2-OE2 3.39Å; K430-E434 VanDerWaalsContact CE-OE1 3.29Å; K430-E434 WeakPolarHBondContact CE-OE1 3.39Å; K430-E434 WeakPolarHBondContact O-CG 3.38Å; K430-E434 PolarHBondContact O-N 3.44Å; E431-E434 PolarHBondContact O-N 2.96Å; L432-E434 VanDerWaalsContact C-N 3.32Å; E434-H436 VanDerWaalsContact C-N 3.34Å; E434-H436 PolarHBondContact O-N 2.72Å; E434-G437 PolarHBondContact O-N 2.82Å; E434-G437 VanDerWaalsContact O-N 3.15Å; E434-L438 WeakPolarHBondContact O-CG 3.49Å; E434-L438 PolarHBondContact O-N 3.2Å
435	L	77.9	Confident	80.1	Confident	40 Å²	40	69.1 Å²	69.1	21%	0.209	35%	0.35	C	S	.	.	H	α-helix	trans	-60.5	-41.8	176.4	-73.3	174.1	0	0	0	112	I66 E431 L432 G437 L438 L439	I66-L435 HydrophobicContact CG1-CD1 4.49Å; I66-L435 HydrophobicContact CG2-CD1 4.33Å; E431-L435 HydrophobicContact CG-CD1 4Å; E431-L435 HydrophobicContact CG-CG 4.44Å; E431-L435 WeakPolarHBondContact O-CB 3.3Å; E431-L435 WeakPolarHBondContact O-CG 3.42Å; E431-L435 PolarHBondContact O-N 2.92Å; L432-L435 PolarHBondContact O-N 3.11Å; L435-G437 PolarHBondContact O-N 3.17Å; L435-L438 PolarHBondContact O-N 3.45Å; L435-L439 WeakPolarHBondContact O-CB 3.13Å; L435-L439 WeakPolarHBondContact O-CG 3.32Å; L435-L439 PolarHBondContact O-N 2.72Å
436	H	81.8	Confident	79.7	Confident	101 Å²	101	71.3 Å²	71.3	47%	0.468	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-41.5	173.8	-95.9	-70.5	0	0	0	112.4	L432 E434 L438 L439 H440	L432-H436 WeakPolarHBondContact O-CB 3.3Å; L432-H436 PolarHBondContact O-CD2 3.02Å; L432-H436 PolarHBondContact O-N 2.93Å; E434-H436 VanDerWaalsContact C-N 3.34Å; E434-H436 PolarHBondContact O-N 2.72Å; H436-L438 VanDerWaalsContact C-N 3.33Å; H436-L439 PolarHBondContact O-N 3.2Å; H436-H440 WeakPolarHBondContact O-CB 3.44Å; H436-H440 PolarHBondContact O-N 3Å
437	G	80.1	Confident	79.5	Confident	38 Å²	38	70 Å²	70	39%	0.392	35%	0.354	S	S	.	.	H	α-helix	trans	-60.9	-43.2	175.3	0	0	0	0	0	112.1	L433 E434 L435 T441	L433-G437 PolarHBondContact O-N 2.74Å; E434-G437 PolarHBondContact O-N 2.82Å; E434-G437 VanDerWaalsContact O-N 3.15Å; L435-G437 PolarHBondContact O-N 3.17Å; G437-T441 PolarHBondContact O-N 2.91Å; G437-T441 VanDerWaalsContact O-N 3.11Å; G437-T441 PolarHBondContact O-OG1 3.15Å
438	L	76.8	Confident	79.2	Confident	26 Å²	26	75.8 Å²	75.8	14%	0.136	38%	0.379	C	S	.	.	H	α-helix	trans	-65	-47.7	176.3	-67.4	171.4	0	0	0	111.8	I111 E434 L435 H436 H440 T441 L442	I111-L438 HydrophobicContact CB-CD2 4.25Å; I111-L438 HydrophobicContact CD1-CD1 3.75Å; I111-L438 HydrophobicContact CD1-CD2 3.81Å; I111-L438 HydrophobicContact CD1-CG 4.3Å; I111-L438 HydrophobicContact CG2-CD2 3.91Å; E434-L438 WeakPolarHBondContact O-CG 3.49Å; E434-L438 PolarHBondContact O-N 3.2Å; L435-L438 PolarHBondContact O-N 3.45Å; H436-L438 VanDerWaalsContact C-N 3.33Å; L438-H440 PolarHBondContact O-N 2.96Å; L438-T441 PolarHBondContact O-N 3.31Å; L438-T441 VanDerWaalsContact O-N 3.15Å; L438-L442 WeakPolarHBondContact O-CG 3.27Å; L438-L442 PolarHBondContact O-N 3.42Å
439	L	79.7	Confident	78.7	Confident	90 Å²	90	77.4 Å²	77.4	47%	0.471	39%	0.385	S	S	.	.	H	α-helix	trans	-58.8	-48.1	177.2	-77.2	172.6	0	0	0	111.9	L435 H436 T441 L442 E443	L435-L439 WeakPolarHBondContact O-CB 3.13Å; L435-L439 WeakPolarHBondContact O-CG 3.32Å; L435-L439 PolarHBondContact O-N 2.72Å; H436-L439 PolarHBondContact O-N 3.2Å; L439-T441 PolarHBondContact O-N 2.51Å; L439-L442 WeakPolarHBondContact O-CB 3.38Å; L439-L442 PolarHBondContact O-N 3.33Å; L439-E443 WeakPolarHBondContact O-CG 3.14Å; L439-E443 PolarHBondContact O-N 2.9Å
440	H	79.8	Confident	78.3	Confident	104 Å²	104	78.3 Å²	78.3	48%	0.481	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-35.1	177.9	-171.9	56.9	0	0	0	111.9	H436 L438 N444	H436-H440 WeakPolarHBondContact O-CB 3.44Å; H436-H440 PolarHBondContact O-N 3Å; L438-H440 PolarHBondContact O-N 2.96Å; H440-N444 PolarHBondContact CD2-ND2 3.31Å; H440-N444 VanDerWaalsContact CD2-ND2 3.26Å; H440-N444 PolarHBondContact CE1-ND2 3.47Å; H440-N444 PolarHBondContact NE2-ND2 2.89Å; H440-N444 VanDerWaalsContact O-CB 3.29Å; H440-N444 WeakPolarHBondContact O-CB 3.39Å; H440-N444 PolarHBondContact O-N 3.27Å; H440-N444 PolarHBondContact O-ND2 3.42Å
441	T	76.1	Confident	78.1	Confident	60 Å²	60	82 Å²	82	37%	0.368	40%	0.403	S	S	.	.	H	α-helix	trans	-69.9	-38.4	175.8	-48.3	0	0	0	0	111.6	M115 G437 L438 L439 R445	M115-T441 HydrophobicContact CE-CG2 3.19Å; M115-T441 HydrophobicContact SD-CG2 3.69Å; G437-T441 PolarHBondContact O-N 2.91Å; G437-T441 VanDerWaalsContact O-N 3.11Å; G437-T441 PolarHBondContact O-OG1 3.15Å; L438-T441 PolarHBondContact O-N 3.31Å; L438-T441 VanDerWaalsContact O-N 3.15Å; L439-T441 PolarHBondContact O-N 2.51Å; T441-R445 WeakPolarHBondContact O-CB 3.31Å; T441-R445 PolarHBondContact O-N 2.9Å
442	L	75.7	Confident	77.6	Confident	69 Å²	69	86.8 Å²	86.8	36%	0.361	42%	0.421	S	S	.	.	H	α-helix	trans	-65.3	-45.7	174	-70.7	172.5	0	0	0	112.2	L438 L439 R445 E446	L438-L442 WeakPolarHBondContact O-CG 3.27Å; L438-L442 PolarHBondContact O-N 3.42Å; L439-L442 WeakPolarHBondContact O-CB 3.38Å; L439-L442 PolarHBondContact O-N 3.33Å; L442-R445 WeakPolarHBondContact O-CB 3.45Å; L442-R445 PolarHBondContact O-N 3.31Å; L442-R445 VanDerWaalsContact O-N 3.14Å; L442-E446 PolarHBondContact O-N 3Å
443	E	78.5	Confident	77.1	Confident	103 Å²	103	89.3 Å²	89.3	48%	0.481	43%	0.425	S	S	.	.	H	α-helix	trans	-61	-46.8	175.5	-73.9	174.3	173.3	0	0	111.4	L439 R445 E446 I447	L439-E443 WeakPolarHBondContact O-CG 3.14Å; L439-E443 PolarHBondContact O-N 2.9Å; E443-R445 PolarHBondContact O-N 2.77Å; E443-E446 WeakPolarHBondContact O-CB 3.22Å; E443-E446 PolarHBondContact O-N 3.21Å; E443-E446 VanDerWaalsContact O-N 3.13Å; E443-I447 VanDerWaalsContact O-CG1 3.32Å; E443-I447 WeakPolarHBondContact O-CG1 3.2Å; E443-I447 PolarHBondContact O-N 3.31Å
444	N	77.7	Confident	76.7	Confident	61 Å²	61	90.6 Å²	90.6	33%	0.326	42%	0.423	S	S	.	.	H	α-helix	trans	-60.1	-33	175.8	-76.8	-33.4	0	0	0	112.1	H440 K448	H440-N444 PolarHBondContact CD2-ND2 3.31Å; H440-N444 VanDerWaalsContact CD2-ND2 3.26Å; H440-N444 PolarHBondContact CE1-ND2 3.47Å; H440-N444 PolarHBondContact NE2-ND2 2.89Å; H440-N444 VanDerWaalsContact O-CB 3.29Å; H440-N444 WeakPolarHBondContact O-CB 3.39Å; H440-N444 PolarHBondContact O-N 3.27Å; H440-N444 PolarHBondContact O-ND2 3.42Å; N444-K448 WeakPolarHBondContact O-CB 3.26Å; N444-K448 VanDerWaalsContact O-CG 3.24Å; N444-K448 WeakPolarHBondContact O-CG 3.39Å; N444-K448 PolarHBondContact O-N 3.21Å
445	R	74.5	Confident	76.6	Confident	92 Å²	92	93.6 Å²	93.6	35%	0.347	44%	0.44	S	S	.	.	H	α-helix	trans	-70.2	-44.6	174.5	-174.2	-179.2	69.2	144.3	-0.2	111.4	T441 L442 E443 I447 K448 H449	T441-R445 WeakPolarHBondContact O-CB 3.31Å; T441-R445 PolarHBondContact O-N 2.9Å; L442-R445 WeakPolarHBondContact O-CB 3.45Å; L442-R445 PolarHBondContact O-N 3.31Å; L442-R445 VanDerWaalsContact O-N 3.14Å; E443-R445 PolarHBondContact O-N 2.77Å; R445-I447 VanDerWaalsContact C-N 3.34Å; R445-I447 PolarHBondContact O-N 3.01Å; R445-K448 WeakPolarHBondContact O-CB 3.41Å; R445-K448 PolarHBondContact O-N 3.12Å; R445-K448 VanDerWaalsContact O-N 3.17Å; R445-H449 WeakPolarHBondContact CG-NE2 3.25Å; R445-H449 PolarHBondContact O-CD2 3.41Å; R445-H449 PolarHBondContact O-N 2.96Å
446	E	73.4	Confident	75.8	Confident	129 Å²	129	96.3 Å²	96.3	60%	0.603	45%	0.453	S	S	*	.	H	α-helix	trans	-57.2	-48.7	174.3	-174.3	176.9	-177.7	0	0	110.7	L442 E443 K448 H449 V450	L442-E446 PolarHBondContact O-N 3Å; E443-E446 WeakPolarHBondContact O-CB 3.22Å; E443-E446 PolarHBondContact O-N 3.21Å; E443-E446 VanDerWaalsContact O-N 3.13Å; E446-K448 VanDerWaalsContact C-N 3.31Å; E446-K448 PolarHBondContact O-N 3.3Å; E446-H449 PolarHBondContact O-N 2.97Å; E446-H449 VanDerWaalsContact O-N 3.14Å; E446-V450 HydrophobicContact CG-CG2 4.4Å; E446-V450 WeakPolarHBondContact O-CB 3.32Å; E446-V450 VanDerWaalsContact O-CG2 3.25Å; E446-V450 WeakPolarHBondContact O-CG2 3.43Å; E446-V450 PolarHBondContact O-N 2.96Å
447	I	81.6	Confident	75.1	Confident	106 Å²	106	94.1 Å²	94.1	54%	0.544	44%	0.443	S	S	.	.	H	α-helix	trans	-58.4	-41.4	175.6	-66.7	166.3	0	0	0	111.5	E443 R445 V450 R451	E443-I447 VanDerWaalsContact O-CG1 3.32Å; E443-I447 WeakPolarHBondContact O-CG1 3.2Å; E443-I447 PolarHBondContact O-N 3.31Å; R445-I447 VanDerWaalsContact C-N 3.34Å; R445-I447 PolarHBondContact O-N 3.01Å; I447-V450 PolarHBondContact O-N 3.1Å; I447-R451 WeakPolarHBondContact O-CB 3.27Å; I447-R451 PolarHBondContact O-N 3.24Å
448	K	77.7	Confident	74.9	Confident	141 Å²	141	93.9 Å²	93.9	61%	0.613	44%	0.44	S	S	*	.	H	α-helix	trans	-64	-43.3	175.8	-78.2	172.7	-177.2	-179.7	0	112.2	N444 R445 E446 R451 R452	N444-K448 WeakPolarHBondContact O-CB 3.26Å; N444-K448 VanDerWaalsContact O-CG 3.24Å; N444-K448 WeakPolarHBondContact O-CG 3.39Å; N444-K448 PolarHBondContact O-N 3.21Å; R445-K448 WeakPolarHBondContact O-CB 3.41Å; R445-K448 PolarHBondContact O-N 3.12Å; R445-K448 VanDerWaalsContact O-N 3.17Å; E446-K448 VanDerWaalsContact C-N 3.31Å; E446-K448 PolarHBondContact O-N 3.3Å; K448-R451 PolarHBondContact O-N 3.05Å; K448-R452 WeakPolarHBondContact O-CG 3.4Å; K448-R452 PolarHBondContact O-N 2.95Å
449	H	70.8	Confident	74.5	Confident	84 Å²	84	94.9 Å²	94.9	39%	0.389	44%	0.444	S	S	.	.	H	α-helix	trans	-66.5	-41.7	176.9	-74.4	-59.1	0	0	0	111.7	R445 E446 R451 R452 Y453	R445-H449 WeakPolarHBondContact CG-NE2 3.25Å; R445-H449 PolarHBondContact O-CD2 3.41Å; R445-H449 PolarHBondContact O-N 2.96Å; E446-H449 PolarHBondContact O-N 2.97Å; E446-H449 VanDerWaalsContact O-N 3.14Å; H449-R451 VanDerWaalsContact C-N 3.33Å; H449-R451 PolarHBondContact O-N 3.04Å; H449-R452 PolarHBondContact O-N 3.45Å; H449-Y453 WeakPolarHBondContact O-CB 3.39Å; H449-Y453 PolarHBondContact O-N 2.94Å
450	V	78.4	Confident	74	Confident	63 Å²	63	96.8 Å²	96.8	38%	0.382	45%	0.446	S	S	.	.	H	α-helix	trans	-61.2	-43.1	174.8	169.9	0	0	0	0	110.5	E446 I447 Y453 Y454	E446-V450 HydrophobicContact CG-CG2 4.4Å; E446-V450 WeakPolarHBondContact O-CB 3.32Å; E446-V450 VanDerWaalsContact O-CG2 3.25Å; E446-V450 WeakPolarHBondContact O-CG2 3.43Å; E446-V450 PolarHBondContact O-N 2.96Å; I447-V450 PolarHBondContact O-N 3.1Å; V450-Y453 WeakPolarHBondContact O-CB 3.26Å; V450-Y453 PolarHBondContact O-N 2.95Å; V450-Y454 HydrophobicContact CG1-CD2 3.66Å; V450-Y454 HydrophobicContact CG1-CE2 3.26Å; V450-Y454 WeakPolarHBondContact O-CD2 3.39Å; V450-Y454 PolarHBondContact O-N 3.29Å
451	R	78.2	Confident	73.6	Confident	174 Å²	174	97.7 Å²	97.7	66%	0.657	45%	0.446	S	S	*	.	H	α-helix	trans	-61.3	-49.5	173	-179.1	-177.7	-78.7	-170.2	-4.6	111.9	I447 K448 H449 Y453 Y454 D455	I447-R451 WeakPolarHBondContact O-CB 3.27Å; I447-R451 PolarHBondContact O-N 3.24Å; K448-R451 PolarHBondContact O-N 3.05Å; H449-R451 VanDerWaalsContact C-N 3.33Å; H449-R451 PolarHBondContact O-N 3.04Å; R451-Y453 PolarHBondContact O-N 3.39Å; R451-Y454 PolarHBondContact O-N 3.41Å; R451-Y454 VanDerWaalsContact O-N 3.16Å; R451-D455 VanDerWaalsContact O-CG 3.32Å; R451-D455 PolarHBondContact O-N 3.45Å
452	R	71.7	Confident	73.5	Confident	106 Å²	106	99.4 Å²	99.4	40%	0.4	45%	0.45	S	S	.	.	H	α-helix	trans	-57.7	-40.1	176.9	-75.5	178.8	178.1	-173.8	-1.5	111.4	K448 H449 D455 M456	K448-R452 WeakPolarHBondContact O-CG 3.4Å; K448-R452 PolarHBondContact O-N 2.95Å; H449-R452 PolarHBondContact O-N 3.45Å; R452-D455 PolarHBondContact O-N 3.37Å; R452-M456 WeakPolarHBondContact O-CB 3.43Å; R452-M456 VanDerWaalsContact O-CG 3.27Å; R452-M456 WeakPolarHBondContact O-CG 3.25Å; R452-M456 PolarHBondContact O-N 2.72Å
453	Y	66.9	Low	72.8	Confident	146 Å²	146	100 Å²	100	57%	0.573	45%	0.453	S	S	*	.	H	α-helix	trans	-61.1	-49.6	175.3	176	-93.8	0	0	0	111.3	H449 V450 R451 D455 M456 E457	H449-Y453 WeakPolarHBondContact O-CB 3.39Å; H449-Y453 PolarHBondContact O-N 2.94Å; V450-Y453 WeakPolarHBondContact O-CB 3.26Å; V450-Y453 PolarHBondContact O-N 2.95Å; R451-Y453 PolarHBondContact O-N 3.39Å; Y453-D455 VanDerWaalsContact C-N 3.35Å; Y453-D455 PolarHBondContact O-N 2.85Å; Y453-M456 PolarHBondContact O-N 2.92Å; Y453-E457 VanDerWaalsContact O-CB 3.3Å; Y453-E457 WeakPolarHBondContact O-CB 3.45Å; Y453-E457 PolarHBondContact O-N 3.4Å
454	Y	75.5	Confident	72.1	Confident	141 Å²	141	99.6 Å²	99.6	55%	0.553	45%	0.45	S	S	*	.	H	α-helix	trans	-65.2	-35.5	177	-72	-52.6	0	0	0	113.2	V450 R451 E457 G458	V450-Y454 HydrophobicContact CG1-CD2 3.66Å; V450-Y454 HydrophobicContact CG1-CE2 3.26Å; V450-Y454 WeakPolarHBondContact O-CD2 3.39Å; V450-Y454 PolarHBondContact O-N 3.29Å; R451-Y454 PolarHBondContact O-N 3.41Å; R451-Y454 VanDerWaalsContact O-N 3.16Å; Y454-E457 WeakPolarHBondContact CD1-OE2 3.21Å; Y454-E457 PolarHBondContact O-N 3.35Å; Y454-G458 PolarHBondContact O-N 2.68Å
455	D	76.6	Confident	71.7	Confident	91 Å²	91	100 Å²	100	49%	0.487	46%	0.457	S	S	.	.	H	α-helix	trans	-64.5	-43.8	174.5	-71.2	-26	0	0	0	110.7	R451 R452 Y453 G458 Q459	R451-D455 VanDerWaalsContact O-CG 3.32Å; R451-D455 PolarHBondContact O-N 3.45Å; R452-D455 PolarHBondContact O-N 3.37Å; Y453-D455 VanDerWaalsContact C-N 3.35Å; Y453-D455 PolarHBondContact O-N 2.85Å; D455-G458 PolarHBondContact O-N 3.47Å; D455-Q459 WeakPolarHBondContact O-CG 3.35Å; D455-Q459 PolarHBondContact O-N 3.07Å
456	M	60.1	Low	71.2	Confident	97 Å²	97	100.2 Å²	100.2	48%	0.478	46%	0.458	S	S	.	.	H	α-helix	trans	-67	-41	175.7	-74.6	-62.6	-67	0	0	112.6	M126 R452 Y453 G458 Q459 Y460	M126-M456 HydrophobicContact CE-SD 4.38Å; M126-M456 HydrophobicContact SD-CE 4.46Å; M126-M456 HydrophobicContact SD-SD 3.61Å; M126-M456 VanDerWaalsContact SD-SD 3.61Å; R452-M456 WeakPolarHBondContact O-CB 3.43Å; R452-M456 VanDerWaalsContact O-CG 3.27Å; R452-M456 WeakPolarHBondContact O-CG 3.25Å; R452-M456 PolarHBondContact O-N 2.72Å; Y453-M456 PolarHBondContact O-N 2.92Å; M456-G458 VanDerWaalsContact C-N 3.34Å; M456-Q459 PolarHBondContact O-N 3.39Å; M456-Y460 WeakPolarHBondContact O-CB 3.31Å; M456-Y460 PolarHBondContact O-N 3.27Å
457	E	68.5	Low	70.6	Confident	56 Å²	56	100.6 Å²	100.6	26%	0.262	46%	0.455	S	S	.	.	H	α-helix	trans	-63.7	-41.8	175	-177	175.5	-148.3	0	0	110.9	Y453 Y454 Y460 Y461	Y453-E457 VanDerWaalsContact O-CB 3.3Å; Y453-E457 WeakPolarHBondContact O-CB 3.45Å; Y453-E457 PolarHBondContact O-N 3.4Å; Y454-E457 WeakPolarHBondContact CD1-OE2 3.21Å; Y454-E457 PolarHBondContact O-N 3.35Å; E457-Y460 WeakPolarHBondContact O-CB 3.48Å; E457-Y460 PolarHBondContact O-N 3.16Å; E457-Y461 HydrophobicContact CG-CD2 3.74Å; E457-Y461 HydrophobicContact CG-CE2 3.43Å; E457-Y461 VanDerWaalsContact CG-CE2 3.43Å; E457-Y461 WeakPolarHBondContact O-CD2 3.34Å; E457-Y461 PolarHBondContact O-N 2.81Å
458	G	75	Confident	69.8	Low	32 Å²	32	100.2 Å²	100.2	33%	0.33	45%	0.453	S	S	.	.	H	α-helix	trans	-59.4	-46.7	172.2	0	0	0	0	0	112.5	Y454 D455 M456 Y461 Q462	Y454-G458 PolarHBondContact O-N 2.68Å; D455-G458 PolarHBondContact O-N 3.47Å; M456-G458 VanDerWaalsContact C-N 3.34Å; G458-Y461 PolarHBondContact O-N 3.25Å; G458-Q462 VanDerWaalsContact O-CG 3.31Å; G458-Q462 WeakPolarHBondContact O-CG 3.18Å; G458-Q462 PolarHBondContact O-N 2.93Å
459	Q	67.3	Low	69.1	Low	48 Å²	48	98.8 Å²	98.8	22%	0.224	45%	0.452	C	S	.	.	H	α-helix	trans	-62.1	-42.6	175	-73.3	177.5	52.8	0	0	112.1	M126 D455 M456 Y461 Q462 L463	M126-Q459 PolarHBondContact SD-OE1 3.03Å; D455-Q459 WeakPolarHBondContact O-CG 3.35Å; D455-Q459 PolarHBondContact O-N 3.07Å; M456-Q459 PolarHBondContact O-N 3.39Å; Q459-Y461 PolarHBondContact O-N 3.24Å; Q459-Q462 PolarHBondContact O-N 3.03Å; Q459-L463 WeakPolarHBondContact O-CB 3.49Å; Q459-L463 PolarHBondContact O-N 3.27Å
460	Y	70.5	Confident	68.4	Low	130 Å²	130	96.9 Å²	96.9	51%	0.51	45%	0.445	S	S	.	.	H	α-helix	trans	-58.8	-47.2	175.1	169	-96	0	0	0	111.4	M456 E457 L463 K464	M456-Y460 WeakPolarHBondContact O-CB 3.31Å; M456-Y460 PolarHBondContact O-N 3.27Å; E457-Y460 WeakPolarHBondContact O-CB 3.48Å; E457-Y460 PolarHBondContact O-N 3.16Å; Y460-L463 PolarHBondContact O-N 3.18Å; Y460-K464 HydrophobicContact CE1-CD 4.07Å; Y460-K464 VanDerWaalsContact O-CB 3.28Å; Y460-K464 WeakPolarHBondContact O-CB 3.46Å; Y460-K464 PolarHBondContact O-N 3.21Å
461	Y	70.2	Confident	67.2	Low	123 Å²	123	97.1 Å²	97.1	48%	0.482	44%	0.443	S	S	.	.	H	α-helix	trans	-68.4	-34.6	178.3	-76	-57.7	0	0	0	112.9	E457 G458 Q459 K464 S465	E457-Y461 HydrophobicContact CG-CD2 3.74Å; E457-Y461 HydrophobicContact CG-CE2 3.43Å; E457-Y461 VanDerWaalsContact CG-CE2 3.43Å; E457-Y461 WeakPolarHBondContact O-CD2 3.34Å; E457-Y461 PolarHBondContact O-N 2.81Å; G458-Y461 PolarHBondContact O-N 3.25Å; Q459-Y461 PolarHBondContact O-N 3.24Å; Y461-K464 HydrophobicContact CD1-CD 4.35Å; Y461-K464 PolarHBondContact O-N 2.9Å; Y461-S465 VanDerWaalsContact O-CB 3.3Å; Y461-S465 WeakPolarHBondContact O-CB 3.22Å; Y461-S465 PolarHBondContact O-N 2.67Å
462	Q	74.1	Confident	66.3	Low	96 Å²	96	94 Å²	94	45%	0.449	44%	0.44	S	S	.	.	H	α-helix	trans	-62.7	-46.6	171.7	-75	178.4	10.7	0	0	111.5	G458 Q459 S465 R466	G458-Q462 VanDerWaalsContact O-CG 3.31Å; G458-Q462 WeakPolarHBondContact O-CG 3.18Å; G458-Q462 PolarHBondContact O-N 2.93Å; Q459-Q462 PolarHBondContact O-N 3.03Å; Q462-S465 PolarHBondContact O-N 3.17Å; Q462-R466 WeakPolarHBondContact O-CB 3.15Å; Q462-R466 VanDerWaalsContact O-CG 3.28Å; Q462-R466 WeakPolarHBondContact O-CG 3.46Å; Q462-R466 PolarHBondContact O-N 3.4Å
463	L	61.3	Low	65.4	Low	82 Å²	82	93 Å²	93	43%	0.429	44%	0.439	S	S	.	.	H	α-helix	trans	-62.8	-44.1	176.8	-174.3	65.5	0	0	0	111.1	Q459 Y460 R466 Y467 L508	Q459-L463 WeakPolarHBondContact O-CB 3.49Å; Q459-L463 PolarHBondContact O-N 3.27Å; Y460-L463 PolarHBondContact O-N 3.18Å; L463-R466 PolarHBondContact O-N 2.67Å; L463-Y467 VanDerWaalsContact O-CB 3.29Å; L463-Y467 WeakPolarHBondContact O-CB 3.46Å; L463-Y467 PolarHBondContact O-N 3.14Å; L463-L508 HydrophobicContact CD1-CD2 3.79Å
464	K	64.4	Low	64.4	Low	94 Å²	94	92.1 Å²	92.1	41%	0.409	44%	0.438	S	S	.	.	H	α-helix	trans	-60.7	-45.3	176.6	-175.1	176.5	-177.4	174	0	112.2	Y460 Y461 Y467 L468	Y460-K464 HydrophobicContact CE1-CD 4.07Å; Y460-K464 VanDerWaalsContact O-CB 3.28Å; Y460-K464 WeakPolarHBondContact O-CB 3.46Å; Y460-K464 PolarHBondContact O-N 3.21Å; Y461-K464 HydrophobicContact CD1-CD 4.35Å; Y461-K464 PolarHBondContact O-N 2.9Å; K464-Y467 PolarHBondContact O-N 3.11Å; K464-L468 HydrophobicContact CG-CD1 4.3Å; K464-L468 WeakPolarHBondContact O-CB 3.39Å; K464-L468 WeakPolarHBondContact O-CG 3.46Å; K464-L468 PolarHBondContact O-N 3.22Å
465	S	68.5	Low	63	Low	69 Å²	69	91.4 Å²	91.4	48%	0.483	44%	0.44	S	S	.	.	H	α-helix	trans	-60.6	-46.7	176.1	179	0	0	0	0	111.2	Y461 Q462 L468 L469	Y461-S465 VanDerWaalsContact O-CB 3.3Å; Y461-S465 WeakPolarHBondContact O-CB 3.22Å; Y461-S465 PolarHBondContact O-N 2.67Å; Q462-S465 PolarHBondContact O-N 3.17Å; S465-L468 PolarHBondContact O-N 2.98Å; S465-L469 PolarHBondContact O-N 3.4Å
466	R	64.3	Low	61.5	Low	96 Å²	96	91.9 Å²	91.9	36%	0.362	45%	0.448	S	S	.	.	H	α-helix	trans	-64.2	-42	177.8	-71.2	175.8	-178.9	-167.4	1.5	112.3	Q462 L463 L469 L470	Q462-R466 WeakPolarHBondContact O-CB 3.15Å; Q462-R466 VanDerWaalsContact O-CG 3.28Å; Q462-R466 WeakPolarHBondContact O-CG 3.46Å; Q462-R466 PolarHBondContact O-N 3.4Å; L463-R466 PolarHBondContact O-N 2.67Å; R466-L469 WeakPolarHBondContact O-CB 3.38Å; R466-L469 PolarHBondContact O-N 3.43Å; R466-L470 PolarHBondContact O-N 2.95Å
467	Y	61.7	Low	60.5	Low	137 Å²	137	93.2 Å²	93.2	54%	0.537	46%	0.458	S	S	.	.	H	α-helix	trans	-62.4	-42.7	175	177.3	-106.7	0	0	0	112.1	L463 K464 L469 L470 L471	L463-Y467 VanDerWaalsContact O-CB 3.29Å; L463-Y467 WeakPolarHBondContact O-CB 3.46Å; L463-Y467 PolarHBondContact O-N 3.14Å; K464-Y467 PolarHBondContact O-N 3.11Å; Y467-L469 VanDerWaalsContact C-N 3.32Å; Y467-L469 PolarHBondContact O-N 2.89Å; Y467-L470 WeakPolarHBondContact O-CB 3.46Å; Y467-L470 PolarHBondContact O-N 3.34Å; Y467-L471 HydrophobicContact CD1-CD1 3.76Å; Y467-L471 HydrophobicContact CE1-CD1 3.21Å; Y467-L471 HydrophobicContact CE1-CG 4.12Å; Y467-L471 HydrophobicContact CE2-CD1 4.41Å; Y467-L471 PolarHBondContact O-N 2.93Å
468	L	64.9	Low	59	Low	98 Å²	98	100.2 Å²	100.2	51%	0.513	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-39	173.9	-78.4	168.9	0	0	0	112.1	K464 S465 L470 L471 N472	K464-L468 HydrophobicContact CG-CD1 4.3Å; K464-L468 WeakPolarHBondContact O-CB 3.39Å; K464-L468 WeakPolarHBondContact O-CG 3.46Å; K464-L468 PolarHBondContact O-N 3.22Å; S465-L468 PolarHBondContact O-N 2.98Å; L468-L470 VanDerWaalsContact C-N 3.34Å; L468-L471 PolarHBondContact O-N 3.16Å; L468-N472 WeakPolarHBondContact O-CB 3.37Å; L468-N472 PolarHBondContact O-N 3.32Å
469	L	62.2	Low	57.2	Low	111 Å²	111	102.3 Å²	102.3	58%	0.581	50%	0.497	S	S	*	.	H	α-helix	trans	-62.5	-42.1	175.2	-131.7	127.5	0	0	0	111.4	S465 R466 Y467 N472 H473	S465-L469 PolarHBondContact O-N 3.4Å; R466-L469 WeakPolarHBondContact O-CB 3.38Å; R466-L469 PolarHBondContact O-N 3.43Å; Y467-L469 VanDerWaalsContact C-N 3.32Å; Y467-L469 PolarHBondContact O-N 2.89Å; L469-N472 PolarHBondContact O-N 3.48Å; L469-H473 PolarHBondContact O-N 3.24Å; L469-H473 VanDerWaalsContact O-N 3.12Å
470	L	55.3	Low	55.7	Low	45 Å²	45	105.3 Å²	105.3	24%	0.236	52%	0.519	C	S	.	.	H	α-helix	trans	-61.5	-48.8	174.3	-136.7	97.8	0	0	0	111.2	R466 Y467 L468 N472 H473 F474 L508	R466-L470 PolarHBondContact O-N 2.95Å; Y467-L470 WeakPolarHBondContact O-CB 3.46Å; Y467-L470 PolarHBondContact O-N 3.34Å; L468-L470 VanDerWaalsContact C-N 3.34Å; L470-N472 VanDerWaalsContact C-N 3.32Å; L470-N472 PolarHBondContact O-N 3.36Å; L470-H473 VanDerWaalsContact O-CB 3.29Å; L470-H473 WeakPolarHBondContact O-CB 3.36Å; L470-H473 PolarHBondContact O-N 2.93Å; L470-H473 VanDerWaalsContact O-N 3.14Å; L470-F474 HydrophobicContact CD2-CD2 4.48Å; L470-F474 HydrophobicContact CD2-CE2 3.71Å; L470-F474 HydrophobicContact CG-CE2 3.91Å; L470-F474 WeakPolarHBondContact O-CD2 3.45Å; L470-F474 PolarHBondContact O-N 2.94Å; L470-F474 VanDerWaalsContact O-N 3.15Å; L470-L508 HydrophobicContact CD1-CD1 3.75Å
471	L	54.9	Low	54	Low	68 Å²	68	104.7 Å²	104.7	36%	0.356	53%	0.53	S	S	.	.	H	α-helix	trans	-58.8	-41.9	177.2	-90	167	0	0	0	112.3	Y467 L468 H473 F474 Q475	Y467-L471 HydrophobicContact CD1-CD1 3.76Å; Y467-L471 HydrophobicContact CE1-CD1 3.21Å; Y467-L471 HydrophobicContact CE1-CG 4.12Å; Y467-L471 HydrophobicContact CE2-CD1 4.41Å; Y467-L471 PolarHBondContact O-N 2.93Å; L468-L471 PolarHBondContact O-N 3.16Å; L471-H473 VanDerWaalsContact C-N 3.26Å; L471-H473 PolarHBondContact O-N 2.93Å; L471-F474 CarbonylContact O-C 3.58Å; L471-F474 PolarHBondContact O-N 3.11Å; L471-F474 VanDerWaalsContact O-N 3.11Å; L471-Q475 PolarHBondContact O-N 2.76Å
472	N	58.4	Low	52.1	Low	108 Å²	108	107 Å²	107	58%	0.578	55%	0.55	S	S	*	.	H	α-helix	trans	-66.7	-31.7	179	-151.9	15.8	0	0	0	111.5	L468 L469 L470 F474 Q475	L468-N472 WeakPolarHBondContact O-CB 3.37Å; L468-N472 PolarHBondContact O-N 3.32Å; L469-N472 PolarHBondContact O-N 3.48Å; L470-N472 VanDerWaalsContact C-N 3.32Å; L470-N472 PolarHBondContact O-N 3.36Å; N472-F474 VanDerWaalsContact C-N 3.34Å; N472-Q475 PolarHBondContact O-N 3.08Å
473	H	53.7	Low	50.2	Low	86 Å²	86	107.3 Å²	107.3	40%	0.398	56%	0.56	S	S	.	*	H	α-helix	trans	-66.3	-32.4	170.7	-101.4	-87.7	0	0	0	113.6	L469 L470 L471 F496	L469-H473 PolarHBondContact O-N 3.24Å; L469-H473 VanDerWaalsContact O-N 3.12Å; L470-H473 VanDerWaalsContact O-CB 3.29Å; L470-H473 WeakPolarHBondContact O-CB 3.36Å; L470-H473 PolarHBondContact O-N 2.93Å; L470-H473 VanDerWaalsContact O-N 3.14Å; L471-H473 VanDerWaalsContact C-N 3.26Å; L471-H473 PolarHBondContact O-N 2.93Å; H473-F496 AromaticContact CE1-CE1 3.28Å; H473-F496 WeakPolarHBondContact CE1-CE1 3.09Å; H473-F496 AromaticContact CE1-CZ 3.53Å; H473-F496 AromaticContact ND1-CE1 3.47Å; H473-F496 WeakPolarHBondContact ND1-CE1 3.12Å
474	F	44.2	Very low	49.1	Very low	126 Å²	126	109 Å²	109	55%	0.553	58%	0.58	S	S	*	*	H	α-helix	trans	-88	-10.5	177.3	-68.8	-65.7	0	0	0	113.9	L470 L471 N472 P476	L470-F474 HydrophobicContact CD2-CD2 4.48Å; L470-F474 HydrophobicContact CD2-CE2 3.71Å; L470-F474 HydrophobicContact CG-CE2 3.91Å; L470-F474 WeakPolarHBondContact O-CD2 3.45Å; L470-F474 PolarHBondContact O-N 2.94Å; L470-F474 VanDerWaalsContact O-N 3.15Å; L471-F474 CarbonylContact O-C 3.58Å; L471-F474 PolarHBondContact O-N 3.11Å; L471-F474 VanDerWaalsContact O-N 3.11Å; N472-F474 VanDerWaalsContact C-N 3.34Å; F474-P476 VanDerWaalsContact O-CD 3.27Å; F474-P476 WeakPolarHBondContact O-CD 3.28Å
475	Q	46.5	Very low	47.8	Very low	126 Å²	126	111.6 Å²	111.6	59%	0.589	59%	0.593	S	S	*	*	S	Bend	trans	-69.7	120.8	177.4	-84.3	-166.2	4.5	0	0	110	L471 N472 N477	L471-Q475 PolarHBondContact O-N 2.76Å; N472-Q475 PolarHBondContact O-N 3.08Å; Q475-N477 PolarHBondContact O-N 3.31Å
476	P	44.7	Very low	46.2	Very low	101 Å²	101	115.6 Å²	115.6	66%	0.656	61%	0.607	S	S	*	*			trans	-63.7	123.5	171.7	25.4	-30.6	0	0	0	107.8	F474 K478	F474-P476 VanDerWaalsContact O-CD 3.27Å; F474-P476 WeakPolarHBondContact O-CD 3.28Å; P476-K478 PolarHBondContact O-N 3.02Å
477	N	39.2	Very low	45	Very low	126 Å²	126	114.4 Å²	114.4	67%	0.674	61%	0.614	S	S	*	*			trans	-49	106.9	176.1	-118.8	-12.9	0	0	0	108.9	Q475 S479	Q475-N477 PolarHBondContact O-N 3.31Å; N477-S479 PolarHBondContact O-N 2.92Å
478	K	38.5	Very low	44	Very low	202 Å²	202	112.6 Å²	112.6	88%	0.878	62%	0.617	S	S	*	*			trans	-72.7	15.1	-173.2	-84.6	-173.3	176.6	178.3	0	113.8	P476	P476-K478 PolarHBondContact O-N 3.02Å
479	S	37.3	Very low	42.6	Very low	76 Å²	76	113.6 Å²	113.6	53%	0.531	62%	0.621	S	S	.	*			trans	-138.1	71.5	-168.3	44.2	0	0	0	0	111.2	N477	N477-S479 PolarHBondContact O-N 2.92Å
480	T	34.2	Very low	41.7	Very low	112 Å²	112	112.1 Å²	112.1	69%	0.687	62%	0.62	S	S	*	*			trans	-162.7	113.9	136.8	3.2	0	0	0	0	110.7	L482	T480-L482 PolarHBondContact O-N 3.34Å
481	P	35.4	Very low	40.9	Very low	117 Å²	117	115.1 Å²	115.1	76%	0.76	64%	0.635	S	S	*	*			trans	-64.5	126.8	171.4	27.3	-30.3	0	0	0	108.1	P483	P481-P483 WeakPolarHBondContact O-CD 3.48Å
482	L	30.4	Very low	40.2	Very low	170 Å²	170	121.6 Å²	121.6	89%	0.89	66%	0.655	S	S	*	*			trans	-33.2	112.9	-176.3	-74.5	76.2	0	0	0	113.6	T480	T480-L482 PolarHBondContact O-N 3.34Å
483	P	35.3	Very low	39.4	Very low	103 Å²	103	121 Å²	121	67%	0.669	65%	0.649	S	S	*	*			trans	-96	138.8	144.3	10.6	11.1	0	0	0	107.5	P481 H485	P481-P483 WeakPolarHBondContact O-CD 3.48Å; P483-H485 PolarHBondContact O-N 2.83Å
484	S	37.9	Very low	38.7	Very low	119 Å²	119	122.3 Å²	122.3	83%	0.832	66%	0.658	S	S	*	*	S	Bend	trans	-67.2	50.3	-166	42.3	0	0	0	0	116.7
485	H	36.3	Very low	38.6	Very low	147 Å²	147	120.4 Å²	120.4	68%	0.681	66%	0.657	S	S	*	*			trans	-126.8	75.4	173.4	-119.8	-91.9	0	0	0	111.7	P483 S487	P483-H485 PolarHBondContact O-N 2.83Å; H485-S487 PolarHBondContact O-N 2.91Å; H485-S487 VanDerWaalsContact O-N 3.14Å
486	I	34.1	Very low	38.4	Very low	153 Å²	153	120.4 Å²	120.4	79%	0.785	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-8.9	-175.3	-75.1	170.9	0	0	0	114.1
487	S	39.4	Very low	38.3	Very low	72 Å²	72	119 Å²	119	50%	0.503	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93	-25.1	-167.7	44.6	0	0	0	0	116.9	H485 I491	H485-S487 PolarHBondContact O-N 2.91Å; H485-S487 VanDerWaalsContact O-N 3.14Å; S487-I491 VanDerWaalsContact O-CD1 3.26Å; S487-I491 WeakPolarHBondContact O-CD1 3.17Å; S487-I491 WeakPolarHBondContact O-CG1 3.43Å
488	V	40.9	Very low	38.3	Very low	99 Å²	99	119.2 Å²	119.2	60%	0.6	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-36.5	-168.6	-172.9	0	0	0	0	113.8	R492	V488-R492 PolarHBondContact O-N 3.31Å
489	I	36.7	Very low	38.7	Very low	118 Å²	118	113 Å²	113	61%	0.605	63%	0.634	S	S	*	*	H	α-helix	trans	-76.5	-32.2	-177.1	-60.6	172.5	0	0	0	111.4	R492 H493	I489-R492 PolarHBondContact O-N 3.48Å; I489-H493 PolarHBondContact O-N 3.32Å; I489-H493 VanDerWaalsContact O-N 3.09Å
490	S	42.1	Very low	39.2	Very low	80 Å²	80	112 Å²	112	56%	0.559	62%	0.622	S	S	*	*	H	α-helix	trans	-65.6	-38.9	176.8	-169.2	0	0	0	0	111.9	R492 H493 L494	S490-R492 PolarHBondContact O-N 2.96Å; S490-H493 PolarHBondContact O-N 2.87Å; S490-L494 WeakPolarHBondContact O-CB 3.31Å; S490-L494 PolarHBondContact O-N 3.33Å
491	I	39.6	Very low	39.9	Very low	109 Å²	109	109.5 Å²	109.5	56%	0.559	61%	0.61	S	S	*	*	H	α-helix	trans	-68.1	-38.6	177.7	-60.6	174.2	0	0	0	110.9	S487 L494 T495	S487-I491 VanDerWaalsContact O-CD1 3.26Å; S487-I491 WeakPolarHBondContact O-CD1 3.17Å; S487-I491 WeakPolarHBondContact O-CG1 3.43Å; I491-L494 PolarHBondContact O-N 2.49Å; I491-T495 VanDerWaalsContact O-CB 3.25Å; I491-T495 WeakPolarHBondContact O-CB 3.3Å; I491-T495 PolarHBondContact O-N 3.32Å; I491-T495 PolarHBondContact O-OG1 3.18Å
492	R	39.3	Very low	40.5	Very low	204 Å²	204	108.5 Å²	108.5	77%	0.77	60%	0.603	S	S	*	*	H	α-helix	trans	-64.5	-42.4	175.8	-107.6	-176.1	176.3	179.5	-0.8	112.3	V488 I489 S490 F496	V488-R492 PolarHBondContact O-N 3.31Å; I489-R492 PolarHBondContact O-N 3.48Å; S490-R492 PolarHBondContact O-N 2.96Å; R492-F496 WeakPolarHBondContact O-CB 3.3Å; R492-F496 PolarHBondContact O-N 3.24Å
493	H	42.2	Very low	41.4	Very low	95 Å²	95	105 Å²	105	44%	0.44	59%	0.585	S	S	.	*	H	α-helix	trans	-63	-45.5	173.1	-91.1	87.7	0	0	0	111.5	I489 S490 T495 F496 C497	I489-H493 PolarHBondContact O-N 3.32Å; I489-H493 VanDerWaalsContact O-N 3.09Å; S490-H493 PolarHBondContact O-N 2.87Å; H493-T495 PolarHBondContact O-N 3.48Å; H493-F496 PolarHBondContact O-N 3.3Å; H493-C497 WeakPolarHBondContact O-CB 3.42Å; H493-C497 PolarHBondContact O-N 3.33Å; H493-C497 PolarHBondContact O-SG 2.84Å
494	L	39	Very low	42.2	Very low	114 Å²	114	102.4 Å²	102.4	60%	0.597	57%	0.572	S	S	*	*	H	α-helix	trans	-64.6	-42.6	179.9	-157.8	78.4	0	0	0	111.8	S490 I491 F496 C497 L498	S490-L494 WeakPolarHBondContact O-CB 3.31Å; S490-L494 PolarHBondContact O-N 3.33Å; I491-L494 PolarHBondContact O-N 2.49Å; L494-F496 VanDerWaalsContact C-N 3.33Å; L494-F496 PolarHBondContact O-N 3.42Å; L494-C497 PolarHBondContact O-N 3.3Å; L494-L498 HydrophobicContact CG-CD1 4.31Å; L494-L498 WeakPolarHBondContact O-CB 3.48Å; L494-L498 VanDerWaalsContact O-CG 3.24Å; L494-L498 WeakPolarHBondContact O-CG 3.41Å; L494-L498 PolarHBondContact O-N 2.78Å
495	T	42	Very low	42.8	Very low	86 Å²	86	100.4 Å²	100.4	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-65.9	-37.2	177.9	-52.1	0	0	0	0	111	I491 H493 A499	I491-T495 VanDerWaalsContact O-CB 3.25Å; I491-T495 WeakPolarHBondContact O-CB 3.3Å; I491-T495 PolarHBondContact O-N 3.32Å; I491-T495 PolarHBondContact O-OG1 3.18Å; H493-T495 PolarHBondContact O-N 3.48Å; T495-A499 WeakPolarHBondContact O-CB 3.5Å; T495-A499 PolarHBondContact O-N 3.4Å
496	F	41.8	Very low	43.8	Very low	125 Å²	125	98.8 Å²	98.8	55%	0.548	54%	0.544	S	S	.	.	H	α-helix	trans	-74.6	-38.7	177.3	-169	-107.2	0	0	0	112.6	H473 R492 H493 L494 L498 A499 L500	H473-F496 AromaticContact CE1-CE1 3.28Å; H473-F496 WeakPolarHBondContact CE1-CE1 3.09Å; H473-F496 AromaticContact CE1-CZ 3.53Å; H473-F496 AromaticContact ND1-CE1 3.47Å; H473-F496 WeakPolarHBondContact ND1-CE1 3.12Å; R492-F496 WeakPolarHBondContact O-CB 3.3Å; R492-F496 PolarHBondContact O-N 3.24Å; H493-F496 PolarHBondContact O-N 3.3Å; L494-F496 VanDerWaalsContact C-N 3.33Å; L494-F496 PolarHBondContact O-N 3.42Å; F496-L498 VanDerWaalsContact C-N 3.29Å; F496-L498 PolarHBondContact O-N 2.94Å; F496-A499 PolarHBondContact O-N 2.84Å; F496-A499 VanDerWaalsContact O-N 3.16Å; F496-L500 PolarHBondContact O-N 3.45Å
497	C	42.2	Very low	44.7	Very low	72 Å²	72	94.9 Å²	94.9	49%	0.486	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-34.1	171.8	-69.5	0	0	0	0	112.1	H493 L494	H493-C497 WeakPolarHBondContact O-CB 3.42Å; H493-C497 PolarHBondContact O-N 3.33Å; H493-C497 PolarHBondContact O-SG 2.84Å; L494-C497 PolarHBondContact O-N 3.3Å
498	L	40.6	Very low	45.3	Very low	130 Å²	130	93.9 Å²	93.9	68%	0.681	51%	0.511	S	S	*	.	H	α-helix	trans	-78	-22.4	173.1	-71.2	169.6	0	0	0	113.2	L494 F496 L500	L494-L498 HydrophobicContact CG-CD1 4.31Å; L494-L498 WeakPolarHBondContact O-CB 3.48Å; L494-L498 VanDerWaalsContact O-CG 3.24Å; L494-L498 WeakPolarHBondContact O-CG 3.41Å; L494-L498 PolarHBondContact O-N 2.78Å; F496-L498 VanDerWaalsContact C-N 3.29Å; F496-L498 PolarHBondContact O-N 2.94Å; L498-L500 PolarHBondContact O-N 2.88Å
499	A	46.1	Very low	46	Very low	73 Å²	73	92.4 Å²	92.4	60%	0.603	50%	0.502	S	S	*	.	H	α-helix	trans	-74	-12.3	174.9	0	0	0	0	0	113	T495 F496 S501	T495-A499 WeakPolarHBondContact O-CB 3.5Å; T495-A499 PolarHBondContact O-N 3.4Å; F496-A499 PolarHBondContact O-N 2.84Å; F496-A499 VanDerWaalsContact O-N 3.16Å; A499-S501 PolarHBondContact O-N 3.24Å
500	L	47.5	Very low	47	Very low	53 Å²	53	91.5 Å²	91.5	28%	0.277	49%	0.494	S	S	.	.	S	Bend	trans	-69.5	100.4	160.3	-134.6	79.5	0	0	0	106.6	F496 L498 P502 I505	F496-L500 PolarHBondContact O-N 3.45Å; L498-L500 PolarHBondContact O-N 2.88Å; L500-P502 WeakPolarHBondContact O-CD 3.34Å; L500-I505 HydrophobicContact CD2-CD1 4.33Å; L500-I505 HydrophobicContact CD2-CG1 4.27Å
501	S	48.5	Very low	47.6	Very low	61 Å²	61	89.3 Å²	89.3	43%	0.427	48%	0.475	S	S	.	.			trans	-52.2	129	173.5	64.2	0	0	0	0	107.5	A499 N503 A504	A499-S501 PolarHBondContact O-N 3.24Å; S501-N503 PolarHBondContact O-N 3.43Å; S501-A504 PolarHBondContact O-N 2.92Å
502	P	48.9	Very low	48	Very low	96 Å²	96	85.2 Å²	85.2	62%	0.623	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.5	-28.6	177.1	-31.2	34.4	0	0	0	113.7	L500 A504 I505 E506	L500-P502 WeakPolarHBondContact O-CD 3.34Å; P502-A504 VanDerWaalsContact C-N 3.32Å; P502-A504 PolarHBondContact O-N 2.98Å; P502-I505 PolarHBondContact O-N 3.48Å; P502-E506 WeakPolarHBondContact O-CB 3.48Å; P502-E506 PolarHBondContact O-N 2.9Å
503	N	49.6	Very low	48.4	Very low	97 Å²	97	80.1 Å²	80.1	52%	0.519	44%	0.441	S	S	.	.	H	α-helix	trans	-51.2	-38.3	175.6	-57.3	18.5	0	0	0	114.9	S501 E506 E507	S501-N503 PolarHBondContact O-N 3.43Å; N503-E506 PolarHBondContact O-N 3.49Å; N503-E507 WeakPolarHBondContact O-CB 3.36Å; N503-E507 WeakPolarHBondContact O-CG 3.39Å; N503-E507 PolarHBondContact O-N 3.37Å
504	A	51.5	Low	48.8	Very low	48 Å²	48	81.8 Å²	81.8	40%	0.397	45%	0.447	S	S	.	.	H	α-helix	trans	-69.4	-38.1	-175.5	0	0	0	0	0	112.2	S501 P502 L508	S501-A504 PolarHBondContact O-N 2.92Å; P502-A504 VanDerWaalsContact C-N 3.32Å; P502-A504 PolarHBondContact O-N 2.98Å; A504-L508 PolarHBondContact O-N 3.34Å
505	I	51.5	Low	49.1	Very low	76 Å²	76	78.5 Å²	78.5	39%	0.39	43%	0.431	S	S	.	.	H	α-helix	trans	-72.6	-42.3	174.4	-62.1	174.6	0	0	0	109.4	L500 P502 E507 L508 V509	L500-I505 HydrophobicContact CD2-CD1 4.33Å; L500-I505 HydrophobicContact CD2-CG1 4.27Å; P502-I505 PolarHBondContact O-N 3.48Å; I505-E507 VanDerWaalsContact C-N 3.35Å; I505-E507 PolarHBondContact O-N 3.24Å; I505-L508 PolarHBondContact O-N 3.32Å; I505-V509 HydrophobicContact CG2-CG2 4.49Å; I505-V509 WeakPolarHBondContact O-CG2 3.45Å; I505-V509 PolarHBondContact O-N 2.76Å
506	E	55.7	Low	49.3	Very low	114 Å²	114	79.6 Å²	79.6	53%	0.533	43%	0.434	S	S	.	.	H	α-helix	trans	-63.9	-37.7	-178.2	-153.3	172.7	-146	0	0	112.5	P502 N503 V509 K510	P502-E506 WeakPolarHBondContact O-CB 3.48Å; P502-E506 PolarHBondContact O-N 2.9Å; N503-E506 PolarHBondContact O-N 3.49Å; E506-V509 PolarHBondContact O-N 3.36Å; E506-K510 WeakPolarHBondContact O-CG 3.16Å; E506-K510 PolarHBondContact O-N 2.89Å
507	E	54.4	Low	49.4	Very low	71 Å²	71	78.4 Å²	78.4	33%	0.332	43%	0.432	S	S	.	.	H	α-helix	trans	-72.3	-37.6	174.5	-76.4	-58.7	139.5	0	0	112.8	N503 I505 V509 K510 E511	N503-E507 WeakPolarHBondContact O-CB 3.36Å; N503-E507 WeakPolarHBondContact O-CG 3.39Å; N503-E507 PolarHBondContact O-N 3.37Å; I505-E507 VanDerWaalsContact C-N 3.35Å; I505-E507 PolarHBondContact O-N 3.24Å; E507-V509 VanDerWaalsContact C-N 3.28Å; E507-V509 PolarHBondContact O-N 3.04Å; E507-K510 PolarHBondContact O-N 3.35Å; E507-K510 WeakPolarHBondContact OE1-CD 3.38Å; E507-K510 IonicContact OE1-NZ 2.7Å; E507-K510 PolarHBondContact OE1-NZ 2.98Å; E507-E511 WeakPolarHBondContact O-CB 3.47Å; E507-E511 PolarHBondContact O-N 3.25Å
508	L	50.7	Low	49.4	Very low	51 Å²	51	78.8 Å²	78.8	27%	0.267	44%	0.436	S	S	.	.	H	α-helix	trans	-60.3	-40.1	171.6	-110.3	153.8	0	0	0	111.7	L463 L470 A504 I505 E511 A512	L463-L508 HydrophobicContact CD1-CD2 3.79Å; L470-L508 HydrophobicContact CD1-CD1 3.75Å; A504-L508 PolarHBondContact O-N 3.34Å; I505-L508 PolarHBondContact O-N 3.32Å; L508-E511 PolarHBondContact O-N 3.4Å; L508-A512 VanDerWaalsContact O-CB 3.29Å; L508-A512 WeakPolarHBondContact O-CB 3.42Å; L508-A512 PolarHBondContact O-N 3.01Å
509	V	56.1	Low	49.2	Very low	67 Å²	67	76 Å²	76	41%	0.406	44%	0.439	S	S	.	.	H	α-helix	trans	-68.5	-43.2	174.9	172.5	0	0	0	0	111.1	I505 E506 E507 E511 A512 K513	I505-V509 HydrophobicContact CG2-CG2 4.49Å; I505-V509 WeakPolarHBondContact O-CG2 3.45Å; I505-V509 PolarHBondContact O-N 2.76Å; E506-V509 PolarHBondContact O-N 3.36Å; E507-V509 VanDerWaalsContact C-N 3.28Å; E507-V509 PolarHBondContact O-N 3.04Å; V509-E511 VanDerWaalsContact C-N 3.29Å; V509-E511 PolarHBondContact O-N 3.17Å; V509-A512 PolarHBondContact O-N 2.89Å; V509-K513 HydrophobicContact CG1-CD 4.28Å; V509-K513 WeakPolarHBondContact O-CB 3.47Å; V509-K513 WeakPolarHBondContact O-CG 3.27Å; V509-K513 PolarHBondContact O-N 3.09Å
510	K	58.3	Low	49	Very low	100 Å²	100	78.4 Å²	78.4	44%	0.435	44%	0.441	S	S	.	.	H	α-helix	trans	-60.6	-38.9	174.7	-84.4	169.3	172	166.4	0	112.2	E506 E507 K513 K514	E506-K510 WeakPolarHBondContact O-CG 3.16Å; E506-K510 PolarHBondContact O-N 2.89Å; E507-K510 PolarHBondContact O-N 3.35Å; E507-K510 WeakPolarHBondContact OE1-CD 3.38Å; E507-K510 IonicContact OE1-NZ 2.7Å; E507-K510 PolarHBondContact OE1-NZ 2.98Å; K510-K513 WeakPolarHBondContact O-CB 3.31Å; K510-K513 PolarHBondContact O-N 2.92Å; K510-K514 PolarHBondContact O-N 3.19Å
511	E	53.9	Low	48.8	Very low	33 Å²	33	81.2 Å²	81.2	15%	0.154	47%	0.466	C	S	.	.	H	α-helix	trans	-75.3	-40.1	-179.6	-160.6	62.5	-163.4	0	0	111.9	L128 E507 L508 V509 K513 K514 T515	L128-E511 HydrophobicContact CD1-CG 4.26Å; E507-E511 WeakPolarHBondContact O-CB 3.47Å; E507-E511 PolarHBondContact O-N 3.25Å; L508-E511 PolarHBondContact O-N 3.4Å; V509-E511 VanDerWaalsContact C-N 3.29Å; V509-E511 PolarHBondContact O-N 3.17Å; E511-K513 PolarHBondContact O-N 3.4Å; E511-K514 PolarHBondContact O-N 2.77Å; E511-K514 VanDerWaalsContact O-N 3.11Å; E511-T515 PolarHBondContact O-N 2.95Å; E511-T515 PolarHBondContact O-OG1 3.08Å
512	A	49	Very low	48.5	Very low	23 Å²	23	85 Å²	85	19%	0.19	48%	0.476	C	S	.	.	H	α-helix	trans	-57.7	-38.4	168.9	0	0	0	0	0	111.4	L508 V509 T515 L516	L508-A512 VanDerWaalsContact O-CB 3.29Å; L508-A512 WeakPolarHBondContact O-CB 3.42Å; L508-A512 PolarHBondContact O-N 3.01Å; V509-A512 PolarHBondContact O-N 2.89Å; A512-T515 WeakPolarHBondContact CA-OG1 3.5Å; A512-T515 PolarHBondContact O-OG1 3.17Å; A512-L516 WeakPolarHBondContact O-CB 3.38Å; A512-L516 PolarHBondContact O-N 2.76Å
513	K	47.7	Very low	48.5	Very low	97 Å²	97	87.3 Å²	87.3	42%	0.422	48%	0.477	S	S	.	.	H	α-helix	trans	-65.8	-42.7	172.8	-73.2	177.7	175.3	-170.8	0	112.1	V509 K510 E511 L517	V509-K513 HydrophobicContact CG1-CD 4.28Å; V509-K513 WeakPolarHBondContact O-CB 3.47Å; V509-K513 WeakPolarHBondContact O-CG 3.27Å; V509-K513 PolarHBondContact O-N 3.09Å; K510-K513 WeakPolarHBondContact O-CB 3.31Å; K510-K513 PolarHBondContact O-N 2.92Å; E511-K513 PolarHBondContact O-N 3.4Å; K513-L517 HydrophobicContact CB-CD1 4.01Å; K513-L517 HydrophobicContact CG-CD1 3.8Å; K513-L517 CarbonylContact O-C 3.56Å; K513-L517 VanDerWaalsContact O-CA 3.31Å; K513-L517 WeakPolarHBondContact O-CA 3.26Å; K513-L517 WeakPolarHBondContact O-CB 3.47Å; K513-L517 PolarHBondContact O-N 2.89Å
514	K	49.2	Very low	48.3	Very low	131 Å²	131	87.7 Å²	87.7	57%	0.57	48%	0.479	S	S	*	.	H	α-helix	trans	-65.8	-36.7	177.1	-79.1	-180	-177.5	170.2	0	113.4	K510 E511 S518	K510-K514 PolarHBondContact O-N 3.19Å; E511-K514 PolarHBondContact O-N 2.77Å; E511-K514 VanDerWaalsContact O-N 3.11Å; K514-S518 WeakPolarHBondContact O-CB 3.43Å
515	T	46.1	Very low	48.6	Very low	44 Å²	44	87 Å²	87	27%	0.27	47%	0.47	S	S	.	.	H	α-helix	trans	-84.8	-33.3	-175.2	44.8	0	0	0	0	113.7	M126 E511 A512	M126-T515 HydrophobicContact CE-CG2 4.36Å; E511-T515 PolarHBondContact O-N 2.95Å; E511-T515 PolarHBondContact O-OG1 3.08Å; A512-T515 WeakPolarHBondContact CA-OG1 3.5Å; A512-T515 PolarHBondContact O-OG1 3.17Å
516	L	45.4	Very low	49.1	Very low	110 Å²	110	86.3 Å²	86.3	58%	0.576	46%	0.464	S	S	*	.	H	α-helix	trans	-99.9	-23.6	-179.7	-67.8	170.2	0	0	0	113.7	A512 L548	A512-L516 WeakPolarHBondContact O-CB 3.38Å; A512-L516 PolarHBondContact O-N 2.76Å; L516-L548 HydrophobicContact CD1-CD2 3.62Å
517	L	44.2	Very low	49.6	Very low	99 Å²	99	83 Å²	83	52%	0.518	45%	0.452	S	S	.	.			trans	-115	25.3	-177.1	-49.4	165.2	0	0	0	112	K513 G519	K513-L517 HydrophobicContact CB-CD1 4.01Å; K513-L517 HydrophobicContact CG-CD1 3.8Å; K513-L517 CarbonylContact O-C 3.56Å; K513-L517 VanDerWaalsContact O-CA 3.31Å; K513-L517 WeakPolarHBondContact O-CA 3.26Å; K513-L517 WeakPolarHBondContact O-CB 3.47Å; K513-L517 PolarHBondContact O-N 2.89Å; L517-G519 PolarHBondContact O-N 2.86Å
518	S	42.8	Very low	50.6	Low	80 Å²	80	81.6 Å²	81.6	56%	0.559	45%	0.446	S	S	*	.			trans	-61.8	87.2	168.9	54.2	0	0	0	0	109.5	K514 D520	K514-S518 WeakPolarHBondContact O-CB 3.43Å; S518-D520 PolarHBondContact O-N 3.02Å
519	G	37.6	Very low	51.7	Low	73 Å²	73	84.4 Å²	84.4	75%	0.753	46%	0.462	S	S	*	.	S	Bend	trans	55.1	-40.8	144.2	0	0	0	0	0	120.2	L517 S521	L517-G519 PolarHBondContact O-N 2.86Å; G519-S521 VanDerWaalsContact C-N 3.34Å; G519-S521 PolarHBondContact O-N 2.75Å
520	D	41.1	Very low	52.7	Low	122 Å²	122	82 Å²	82	65%	0.652	45%	0.447	S	S	*	.			trans	-78.7	94.4	177.5	-84.6	-13.4	0	0	0	108.3	S518 Q522	S518-D520 PolarHBondContact O-N 3.02Å; D520-Q522 HydrophobicContact CB-CG 4.42Å; D520-Q522 PolarHBondContact O-N 3.34Å
521	S	42.5	Very low	53.7	Low	113 Å²	113	77.3 Å²	77.3	79%	0.79	43%	0.426	S	S	*	.			trans	-58.5	27.3	159.3	-163.6	0	0	0	0	112.6	G519 K523	G519-S521 VanDerWaalsContact C-N 3.34Å; G519-S521 PolarHBondContact O-N 2.75Å; S521-K523 PolarHBondContact O-N 3.1Å
522	Q	43.6	Very low	55	Low	139 Å²	139	76.4 Å²	76.4	65%	0.65	42%	0.422	S	S	*	.			trans	-54.1	101.2	154	-81.1	-169.2	-5.2	0	0	104.8	D520 N524	D520-Q522 HydrophobicContact CB-CG 4.42Å; D520-Q522 PolarHBondContact O-N 3.34Å; Q522-N524 VanDerWaalsContact C-N 3.28Å; Q522-N524 PolarHBondContact O-N 2.85Å
523	K	47.8	Very low	56.1	Low	145 Å²	145	77 Å²	77	63%	0.63	42%	0.42	S	S	*	.			trans	-46.1	102	170.4	-62.1	171.9	170.8	177.8	0	105.6	S521 T525 E673	S521-K523 PolarHBondContact O-N 3.1Å; K523-T525 WeakPolarHBondContact CB-OG1 3.37Å; K523-T525 PolarHBondContact O-N 2.79Å; K523-E673 IonicContact NZ-OE1 3.52Å; K523-E673 PolarHBondContact NZ-OE1 2.98Å
524	N	46.1	Very low	57	Low	106 Å²	106	75.4 Å²	75.4	57%	0.567	42%	0.415	S	S	*	.			trans	-72.8	50	175.9	-99.4	-22	0	0	0	108	Q522 F526	Q522-N524 VanDerWaalsContact C-N 3.28Å; Q522-N524 PolarHBondContact O-N 2.85Å; N524-F526 VanDerWaalsContact C-N 3.34Å; N524-F526 HydrophobicContact CB-CE2 4.46Å; N524-F526 HydrophobicContact CB-CZ 4.49Å; N524-F526 VanDerWaalsContact O-CD2 3.27Å; N524-F526 WeakPolarHBondContact O-CD2 3.33Å; N524-F526 PolarHBondContact O-N 2.91Å
525	T	56.9	Low	57.2	Low	33 Å²	33	69.9 Å²	69.9	20%	0.202	39%	0.392	C	S	.	.			trans	-79.1	93.1	178.5	-27.5	0	0	0	0	105.8	K523 T527 Y533	K523-T525 WeakPolarHBondContact CB-OG1 3.37Å; K523-T525 PolarHBondContact O-N 2.79Å; T525-T527 PolarHBondContact O-N 3.45Å; T525-Y533 HydrophobicContact CG2-CD1 3.12Å; T525-Y533 HydrophobicContact CG2-CD2 4.44Å; T525-Y533 HydrophobicContact CG2-CE1 3.54Å; T525-Y533 HydrophobicContact CG2-CG 3.66Å
526	F	62.7	Low	57.4	Low	61 Å²	61	73.5 Å²	73.5	27%	0.268	42%	0.415	S	S	.	.			trans	-61.6	121.5	177.3	-62.2	-74.8	0	0	0	109.3	N524 L534 L555 K558	N524-F526 VanDerWaalsContact C-N 3.34Å; N524-F526 HydrophobicContact CB-CE2 4.46Å; N524-F526 HydrophobicContact CB-CZ 4.49Å; N524-F526 VanDerWaalsContact O-CD2 3.27Å; N524-F526 WeakPolarHBondContact O-CD2 3.33Å; N524-F526 PolarHBondContact O-N 2.91Å; F526-L534 PolarHBondContact O-N 3.3Å; F526-L555 HydrophobicContact CE2-CD2 4.4Å; F526-K558 VanDerWaalsContact CG-NZ 3.34Å
527	T	66.8	Low	57.5	Low	45 Å²	45	71.9 Å²	71.9	28%	0.276	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-101.7	155.5	172.9	57.3	0	0	0	0	111	T525 G531 F532 Y533 R670	T525-T527 PolarHBondContact O-N 3.45Å; T527-G531 WeakPolarHBondContact CG2-O 3.38Å; T527-F532 CarbonylContact C-O 3.59Å; T527-F532 VanDerWaalsContact CA-O 3.25Å; T527-F532 WeakPolarHBondContact CA-O 3.43Å; T527-Y533 HydrophobicContact CG2-CD1 3.4Å; T527-Y533 VanDerWaalsContact CG2-CD1 3.4Å; T527-Y533 HydrophobicContact CG2-CE1 3.36Å; T527-Y533 HydrophobicContact CG2-CG 4.45Å; T527-R670 HydrophobicContact CG2-CB 3.82Å
528	D	74.4	Confident	57.5	Low	41 Å²	41	72.5 Å²	72.5	22%	0.219	40%	0.401	C	S	.	.			trans	-77.8	-178.1	165.6	69.5	4.8	0	0	0	111	L530 G531 F532 L534 H790	D528-L530 PolarHBondContact O-N 2.87Å; D528-L530 VanDerWaalsContact O-N 3.08Å; D528-L530 WeakPolarHBondContact OD1-CA 3.21Å; D528-L530 WeakPolarHBondContact OD1-CB 3.48Å; D528-L530 PolarHBondContact OD1-N 2.91Å; D528-G531 PolarHBondContact O-N 3.3Å; D528-G531 PolarHBondContact OD1-N 3.26Å; D528-F532 PolarHBondContact N-O 3.01Å; D528-F532 PolarHBondContact OD1-N 3.18Å; D528-L534 HydrophobicContact CB-CD1 3.78Å; D528-H790 IonicContact OD2-CE1 2.82Å; D528-H790 IonicContact OD2-NE2 2.93Å; D528-H790 PolarHBondContact OD2-NE2 3.07Å
529	D	74.2	Confident	57.5	Low	111 Å²	111	72.2 Å²	72.2	59%	0.594	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20	179.1	-55.9	-34	0	0	0	112.5	K565	D529-K565 IonicContact OD2-NZ 3.72Å; D529-K565 PolarHBondContact OD2-NZ 3.46Å
530	L	77.1	Confident	57.7	Low	16 Å²	16	73 Å²	73	8%	0.084	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	0.4	179.9	-76.2	168.4	0	0	0	113.7	D528 F532 H609 N669 Y671 L712 Y713 L794	D528-L530 PolarHBondContact O-N 2.87Å; D528-L530 VanDerWaalsContact O-N 3.08Å; D528-L530 WeakPolarHBondContact OD1-CA 3.21Å; D528-L530 WeakPolarHBondContact OD1-CB 3.48Å; D528-L530 PolarHBondContact OD1-N 2.91Å; L530-F532 VanDerWaalsContact C-N 3.34Å; L530-F532 HydrophobicContact CB-CD2 3.58Å; L530-F532 HydrophobicContact CB-CE2 3.8Å; L530-F532 HydrophobicContact CD1-CD2 4.35Å; L530-F532 HydrophobicContact CD1-CE2 4.19Å; L530-H609 VanDerWaalsContact CD2-CE1 3.49Å; L530-H609 WeakPolarHBondContact CD2-CE1 3.4Å; L530-N669 PolarHBondContact O-ND2 2.61Å; L530-Y671 WeakPolarHBondContact O-CD2 3.42Å; L530-Y671 VanDerWaalsContact O-CE2 3.26Å; L530-Y671 WeakPolarHBondContact O-CE2 3.43Å; L530-L712 HydrophobicContact CD2-CB 4.42Å; L530-Y713 WeakPolarHBondContact CD1-OH 3.21Å; L530-Y713 HydrophobicContact CD2-CE1 4.04Å; L530-Y713 HydrophobicContact CD2-CE2 3.89Å; L530-L794 HydrophobicContact CD1-CD1 3.65Å
531	G	78.3	Confident	57.8	Low	1 Å²	1	71.4 Å²	71.4	1%	0.01	40%	0.399	C	S	.	.	S	Bend	trans	83.6	1.7	-177	0	0	0	0	0	114.4	T527 D528 N669 R670	T527-G531 WeakPolarHBondContact CG2-O 3.38Å; D528-G531 PolarHBondContact O-N 3.3Å; D528-G531 PolarHBondContact OD1-N 3.26Å; G531-N669 CarbonylContact O-C 3.42Å; G531-N669 WeakPolarHBondContact O-CA 3.43Å; G531-R670 WeakPolarHBondContact O-CB 3.44Å; G531-R670 PolarHBondContact O-N 3.29Å
532	F	82.4	Confident	57.7	Low	15 Å²	15	71.8 Å²	71.8	7%	0.066	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-74	134	175.8	-66.4	-78.5	0	0	0	110.9	T527 D528 L530 L534 H668 N669 L712 H790 Y793	T527-F532 CarbonylContact C-O 3.59Å; T527-F532 VanDerWaalsContact CA-O 3.25Å; T527-F532 WeakPolarHBondContact CA-O 3.43Å; D528-F532 PolarHBondContact N-O 3.01Å; D528-F532 PolarHBondContact OD1-N 3.18Å; L530-F532 VanDerWaalsContact C-N 3.34Å; L530-F532 HydrophobicContact CB-CD2 3.58Å; L530-F532 HydrophobicContact CB-CE2 3.8Å; L530-F532 HydrophobicContact CD1-CD2 4.35Å; L530-F532 HydrophobicContact CD1-CE2 4.19Å; F532-L534 PolarHBondContact O-N 3.17Å; F532-H668 WeakPolarHBondContact CA-O 3.39Å; F532-N669 HydrophobicContact CD1-CB 3.79Å; F532-N669 WeakPolarHBondContact CD1-ND2 3.42Å; F532-N669 WeakPolarHBondContact CD2-ND2 3.29Å; F532-N669 HydrophobicContact CE1-CB 3.81Å; F532-N669 WeakPolarHBondContact CE1-ND2 3.18Å; F532-N669 WeakPolarHBondContact CE2-ND2 3.32Å; F532-N669 HydrophobicContact CG-CB 4.48Å; F532-N669 HydrophobicContact CZ-CB 4.5Å; F532-N669 WeakPolarHBondContact CZ-ND2 3.41Å; F532-L712 HydrophobicContact CE2-CD1 3.91Å; F532-L712 HydrophobicContact CZ-CD1 3.79Å; F532-H790 HydrophobicContact CD2-CB 4.28Å; F532-H790 AromaticContact CD2-CD2 3.91Å; F532-H790 AromaticContact CD2-CG 3.79Å; F532-H790 AromaticContact CD2-ND1 3.89Å; F532-H790 HydrophobicContact CE1-CB 4.4Å; F532-H790 HydrophobicContact CE2-CB 3.91Å; F532-H790 AromaticContact CE2-CG 3.92Å; F532-H790 AromaticContact CG-ND1 3.8Å; F532-H790 HydrophobicContact CZ-CB 3.98Å; F532-Y793 VanDerWaalsContact CZ-OH 3.24Å; F532-Y793 WeakPolarHBondContact CZ-OH 3.27Å
533	Y	72.1	Confident	57.8	Low	36 Å²	36	71 Å²	71	14%	0.141	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-68.2	125.8	179.3	-64.1	-55.8	0	0	0	111.4	T525 T527 T535 H668 R670 E673	T525-Y533 HydrophobicContact CG2-CD1 3.12Å; T525-Y533 HydrophobicContact CG2-CD2 4.44Å; T525-Y533 HydrophobicContact CG2-CE1 3.54Å; T525-Y533 HydrophobicContact CG2-CG 3.66Å; T527-Y533 HydrophobicContact CG2-CD1 3.4Å; T527-Y533 VanDerWaalsContact CG2-CD1 3.4Å; T527-Y533 HydrophobicContact CG2-CE1 3.36Å; T527-Y533 HydrophobicContact CG2-CG 4.45Å; Y533-T535 VanDerWaalsContact C-N 3.25Å; Y533-H668 VanDerWaalsContact CD2-O 3.29Å; Y533-H668 WeakPolarHBondContact CD2-O 3.46Å; Y533-H668 PolarHBondContact N-O 3.41Å; Y533-R670 HydrophobicContact CE1-CB 4.11Å; Y533-R670 VanDerWaalsContact OH-CA 3.26Å; Y533-R670 WeakPolarHBondContact OH-CA 3.33Å; Y533-R670 WeakPolarHBondContact OH-CB 3.29Å; Y533-E673 HydrophobicContact CE2-CB 4.36Å; Y533-E673 HydrophobicContact CE2-CG 4.28Å; Y533-E673 PolarHBondContact OH-OE2 3.37Å
534	L	64.7	Low	57.8	Low	63 Å²	63	65.6 Å²	65.6	33%	0.33	38%	0.38	S	S	.	.	S	Bend	trans	-74.2	-21.5	174.3	-82.2	75.9	0	0	0	112.1	F526 D528 F532 K558	F526-L534 PolarHBondContact O-N 3.3Å; D528-L534 HydrophobicContact CB-CD1 3.78Å; F532-L534 PolarHBondContact O-N 3.17Å; L534-K558 HydrophobicContact CD2-CD 4.31Å; L534-K558 HydrophobicContact CD2-CG 4.12Å
535	T	53.5	Low	57.7	Low	14 Å²	14	69 Å²	69	9%	0.086	39%	0.389	C	S	.	.	S	Bend	trans	-126.4	132.4	-165.2	51.7	0	0	0	0	110.8	Y533 W537 E554	Y533-T535 VanDerWaalsContact C-N 3.25Å; T535-W537 VanDerWaalsContact C-N 3.25Å; T535-W537 PolarHBondContact O-N 3.38Å; T535-W537 VanDerWaalsContact O-N 3.1Å; T535-W537 VanDerWaalsContact OG1-CD1 3.26Å; T535-E554 HydrophobicContact CG2-CB 4.48Å; T535-E554 VanDerWaalsContact CG2-OE2 3.3Å; T535-E554 WeakPolarHBondContact CG2-OE2 3.49Å
536	T	50.5	Low	57.4	Low	120 Å²	120	72.9 Å²	72.9	74%	0.736	41%	0.409	S	S	*	.			trans	-84.8	44.6	-177.7	48.1	0	0	0	0	113	H538	T536-H538 PolarHBondContact O-N 3.13Å
537	W	48.5	Very low	57.2	Low	76 Å²	76	71.5 Å²	71.5	29%	0.288	40%	0.404	S	S	.	.			trans	-68	16.3	177.5	-68.3	90.4	0	0	0	114.3	T535 G539 M551 E554	T535-W537 VanDerWaalsContact C-N 3.25Å; T535-W537 PolarHBondContact O-N 3.38Å; T535-W537 VanDerWaalsContact O-N 3.1Å; T535-W537 VanDerWaalsContact OG1-CD1 3.26Å; W537-G539 VanDerWaalsContact C-N 3.3Å; W537-G539 PolarHBondContact O-N 3.11Å; W537-M551 HydrophobicContact CH2-CB 4.1Å; W537-M551 HydrophobicContact CH2-CE 3.53Å; W537-M551 HydrophobicContact CH2-SD 4.33Å; W537-M551 HydrophobicContact CZ2-CB 4.03Å; W537-M551 HydrophobicContact CZ2-CE 3.17Å; W537-M551 HydrophobicContact CZ2-CG 4.41Å; W537-M551 HydrophobicContact CZ2-SD 3.59Å; W537-M551 VanDerWaalsContact CZ2-SD 3.59Å; W537-M551 HydrophobicContact CZ3-CE 4.44Å; W537-E554 PolarHBondContact NE1-OE2 2.95Å
538	H	43.7	Very low	56.8	Low	112 Å²	112	72.5 Å²	72.5	52%	0.519	41%	0.407	S	S	.	.	S	Bend	trans	-74.5	86.4	171.2	-71.8	-57.7	0	0	0	109.7	T536	T536-H538 PolarHBondContact O-N 3.13Å
539	G	42.7	Very low	56.2	Low	75 Å²	75	77 Å²	77	77%	0.773	43%	0.431	S	S	*	.	S	Bend	trans	109.3	17.9	155.3	0	0	0	0	0	117.8	W537 S541	W537-G539 VanDerWaalsContact C-N 3.3Å; W537-G539 PolarHBondContact O-N 3.11Å; G539-S541 PolarHBondContact O-N 2.98Å
540	V	42.4	Very low	55.7	Low	89 Å²	89	75.9 Å²	75.9	54%	0.539	42%	0.424	S	S	.	.			trans	-78.5	123.6	173	-172.5	0	0	0	0	109.9
541	S	42.1	Very low	55.1	Low	88 Å²	88	77.3 Å²	77.3	62%	0.615	43%	0.431	S	S	*	.			trans	-57.9	148.4	177.6	174.7	0	0	0	0	111.9	G539 D543	G539-S541 PolarHBondContact O-N 2.98Å; S541-D543 PolarHBondContact O-N 3.31Å
542	P	41.8	Very low	54.5	Low	122 Å²	122	80 Å²	80	79%	0.792	45%	0.453	S	S	*	.	S	Bend	trans	-75.6	45	-169	31.9	-37.5	0	0	0	115.4	C544	P542-C544 PolarHBondContact O-N 2.89Å
543	D	44.2	Very low	53.7	Low	122 Å²	122	80.5 Å²	80.5	65%	0.652	46%	0.463	S	S	*	.			trans	-92.1	88.6	173.7	-148.7	-0.5	0	0	0	111.1	S541 K545 D546	S541-D543 PolarHBondContact O-N 3.31Å; D543-K545 PolarHBondContact O-N 3.04Å; D543-D546 PolarHBondContact O-N 3.37Å
544	C	48.1	Very low	53.4	Low	32 Å²	32	80.3 Å²	80.3	22%	0.216	46%	0.463	C	S	.	.	H	α-helix	trans	-50.5	-15.7	-165.2	172.7	0	0	0	0	118	P542	P542-C544 PolarHBondContact O-N 2.89Å
545	K	45.1	Very low	53.7	Low	177 Å²	177	81.2 Å²	81.2	77%	0.77	47%	0.468	S	S	*	.	H	α-helix	trans	-84.1	-42.1	-177.6	-76.2	-174.8	178.5	178.5	0	113.5	D543 D547	D543-K545 PolarHBondContact O-N 3.04Å; K545-D547 VanDerWaalsContact C-N 3.28Å
546	D	49.4	Very low	54.7	Low	115 Å²	115	85.6 Å²	85.6	62%	0.615	49%	0.487	S	S	*	.	H	α-helix	trans	-72.4	-29.6	176.3	-75.6	-13.3	0	0	0	110.4	D543 L548 L549 L550	D543-D546 PolarHBondContact O-N 3.37Å; D546-L548 PolarHBondContact O-N 3.39Å; D546-L549 PolarHBondContact O-N 2.99Å; D546-L550 WeakPolarHBondContact O-CB 3.37Å; D546-L550 VanDerWaalsContact O-CG 3.31Å; D546-L550 WeakPolarHBondContact O-CG 3.27Å; D546-L550 PolarHBondContact O-N 3.06Å
547	D	58.2	Low	55.6	Low	32 Å²	32	87.5 Å²	87.5	17%	0.171	48%	0.481	C	S	.	.	H	α-helix	trans	-58.2	-42.6	176.7	-78.8	-19.3	0	0	0	113.5	K545 L550 M551	K545-D547 VanDerWaalsContact C-N 3.28Å; D547-L550 PolarHBondContact O-N 3.39Å; D547-M551 WeakPolarHBondContact O-CB 3.25Å; D547-M551 PolarHBondContact O-N 3.44Å
548	L	58.5	Low	56.6	Low	65 Å²	65	86.5 Å²	86.5	34%	0.34	48%	0.479	S	S	.	.	H	α-helix	trans	-70.2	-38.4	-177	-71.4	178	0	0	0	112.5	L516 D546 A552	L516-L548 HydrophobicContact CD1-CD2 3.62Å; D546-L548 PolarHBondContact O-N 3.39Å; L548-A552 VanDerWaalsContact O-CB 3.23Å; L548-A552 WeakPolarHBondContact O-CB 3.38Å; L548-A552 PolarHBondContact O-N 2.97Å
549	L	63.7	Low	58	Low	136 Å²	136	84.2 Å²	84.2	71%	0.712	48%	0.476	S	S	*	.	H	α-helix	trans	-68.2	-42.3	176.4	-97.4	158	0	0	0	111.2	D546 A552 G553	D546-L549 PolarHBondContact O-N 2.99Å; L549-A552 PolarHBondContact O-N 3.46Å; L549-G553 PolarHBondContact O-N 3.08Å
550	L	63.3	Low	59.6	Low	87 Å²	87	84 Å²	84	46%	0.455	46%	0.457	S	S	.	.	H	α-helix	trans	-63.2	-47.8	174.5	-71	173.6	0	0	0	111.1	D546 D547 A552 G553 E554	D546-L550 WeakPolarHBondContact O-CB 3.37Å; D546-L550 VanDerWaalsContact O-CG 3.31Å; D546-L550 WeakPolarHBondContact O-CG 3.27Å; D546-L550 PolarHBondContact O-N 3.06Å; D547-L550 PolarHBondContact O-N 3.39Å; L550-A552 PolarHBondContact O-N 3.04Å; L550-G553 PolarHBondContact O-N 3.18Å; L550-E554 WeakPolarHBondContact O-CG 3.5Å; L550-E554 PolarHBondContact O-N 3.39Å
551	M	63.1	Low	61.1	Low	47 Å²	47	84.5 Å²	84.5	23%	0.232	45%	0.453	C	S	.	.	H	α-helix	trans	-58.6	-45.9	175.5	-177.8	66.9	82.9	0	0	111.6	W537 D547 G553 E554 L555	W537-M551 HydrophobicContact CH2-CB 4.1Å; W537-M551 HydrophobicContact CH2-CE 3.53Å; W537-M551 HydrophobicContact CH2-SD 4.33Å; W537-M551 HydrophobicContact CZ2-CB 4.03Å; W537-M551 HydrophobicContact CZ2-CE 3.17Å; W537-M551 HydrophobicContact CZ2-CG 4.41Å; W537-M551 HydrophobicContact CZ2-SD 3.59Å; W537-M551 VanDerWaalsContact CZ2-SD 3.59Å; W537-M551 HydrophobicContact CZ3-CE 4.44Å; D547-M551 WeakPolarHBondContact O-CB 3.25Å; D547-M551 PolarHBondContact O-N 3.44Å; M551-G553 VanDerWaalsContact C-N 3.34Å; M551-G553 PolarHBondContact O-N 3.33Å; M551-E554 PolarHBondContact O-N 3.37Å; M551-L555 HydrophobicContact CG-CD1 4.05Å; M551-L555 HydrophobicContact CG-CG 4.38Å; M551-L555 WeakPolarHBondContact O-CB 3.26Å; M551-L555 WeakPolarHBondContact O-CG 3.26Å; M551-L555 PolarHBondContact O-N 3.19Å; M551-L555 HydrophobicContact SD-CD1 4.45Å; M551-L555 HydrophobicContact SD-CG 4.33Å
552	A	65.7	Low	62.6	Low	56 Å²	56	84.4 Å²	84.4	46%	0.463	45%	0.445	S	S	.	.	H	α-helix	trans	-61.4	-42.7	176.7	0	0	0	0	0	111.7	L548 L549 L550 E554 Q556	L548-A552 VanDerWaalsContact O-CB 3.23Å; L548-A552 WeakPolarHBondContact O-CB 3.38Å; L548-A552 PolarHBondContact O-N 2.97Å; L549-A552 PolarHBondContact O-N 3.46Å; L550-A552 PolarHBondContact O-N 3.04Å; A552-E554 VanDerWaalsContact C-N 3.35Å; A552-Q556 WeakPolarHBondContact O-CB 3.49Å; A552-Q556 PolarHBondContact O-N 2.96Å
553	G	66.8	Low	64.4	Low	27 Å²	27	85.8 Å²	85.8	28%	0.278	44%	0.435	S	S	.	.	H	α-helix	trans	-62.7	-38.7	174.5	0	0	0	0	0	113.1	L549 L550 M551 R557	L549-G553 PolarHBondContact O-N 3.08Å; L550-G553 PolarHBondContact O-N 3.18Å; M551-G553 VanDerWaalsContact C-N 3.34Å; M551-G553 PolarHBondContact O-N 3.33Å; G553-R557 WeakPolarHBondContact O-CG 3.35Å; G553-R557 PolarHBondContact O-N 3.45Å
554	E	65.9	Low	66	Low	31 Å²	31	84.4 Å²	84.4	15%	0.145	43%	0.428	C	S	.	.	H	α-helix	trans	-69.2	-45.9	176.1	-74.9	-179.5	-178.1	0	0	112.9	T535 W537 L550 M551 A552 Q556 R557 K558	T535-E554 HydrophobicContact CG2-CB 4.48Å; T535-E554 VanDerWaalsContact CG2-OE2 3.3Å; T535-E554 WeakPolarHBondContact CG2-OE2 3.49Å; W537-E554 PolarHBondContact NE1-OE2 2.95Å; L550-E554 WeakPolarHBondContact O-CG 3.5Å; L550-E554 PolarHBondContact O-N 3.39Å; M551-E554 PolarHBondContact O-N 3.37Å; A552-E554 VanDerWaalsContact C-N 3.35Å; E554-Q556 VanDerWaalsContact C-N 3.25Å; E554-Q556 PolarHBondContact O-N 3.05Å; E554-R557 PolarHBondContact O-N 3.16Å; E554-K558 WeakPolarHBondContact O-CB 3.38Å; E554-K558 PolarHBondContact O-N 3.3Å
555	L	70.3	Confident	67.4	Low	82 Å²	82	87.5 Å²	87.5	43%	0.429	44%	0.437	S	S	.	.	H	α-helix	trans	-60.1	-37.6	174.6	-71.7	174.5	0	0	0	111.3	F526 M551 K558 S559	F526-L555 HydrophobicContact CE2-CD2 4.4Å; M551-L555 HydrophobicContact CG-CD1 4.05Å; M551-L555 HydrophobicContact CG-CG 4.38Å; M551-L555 WeakPolarHBondContact O-CB 3.26Å; M551-L555 WeakPolarHBondContact O-CG 3.26Å; M551-L555 PolarHBondContact O-N 3.19Å; M551-L555 HydrophobicContact SD-CD1 4.45Å; M551-L555 HydrophobicContact SD-CG 4.33Å; L555-K558 PolarHBondContact O-N 2.86Å; L555-S559 WeakPolarHBondContact O-CB 3.29Å; L555-S559 PolarHBondContact O-N 2.84Å
556	Q	75	Confident	68.9	Low	106 Å²	106	87.6 Å²	87.6	50%	0.495	43%	0.433	S	S	.	.	H	α-helix	trans	-64	-49.9	172.8	-177.1	60.8	37.4	0	0	111.6	A552 E554 K558 S559 D560	A552-Q556 WeakPolarHBondContact O-CB 3.49Å; A552-Q556 PolarHBondContact O-N 2.96Å; E554-Q556 VanDerWaalsContact C-N 3.25Å; E554-Q556 PolarHBondContact O-N 3.05Å; Q556-K558 PolarHBondContact O-N 3.46Å; Q556-S559 WeakPolarHBondContact O-CB 3.44Å; Q556-S559 PolarHBondContact O-N 2.82Å; Q556-S559 VanDerWaalsContact O-N 3.13Å; Q556-D560 PolarHBondContact NE2-OD1 3.34Å; Q556-D560 PolarHBondContact NE2-OD2 3.05Å; Q556-D560 VanDerWaalsContact O-CG 3.25Å; Q556-D560 PolarHBondContact O-N 3.34Å
557	R	68.8	Low	70.3	Confident	161 Å²	161	87.2 Å²	87.2	61%	0.608	43%	0.426	S	S	*	.	H	α-helix	trans	-57.1	-38.9	175.8	-72.1	-173.8	-144.7	104	2.6	112	G553 E554 D560 Q561	G553-R557 WeakPolarHBondContact O-CG 3.35Å; G553-R557 PolarHBondContact O-N 3.45Å; E554-R557 PolarHBondContact O-N 3.16Å; R557-D560 PolarHBondContact O-N 3.4Å; R557-Q561 WeakPolarHBondContact O-CB 3.36Å; R557-Q561 PolarHBondContact O-N 2.87Å
558	K	69.2	Low	71.2	Confident	55 Å²	55	92 Å²	92	24%	0.239	45%	0.445	C	S	.	.	H	α-helix	trans	-65.8	-46.1	175.7	-177.9	178.3	178.8	-178.4	0	111.8	F526 L534 E554 L555 Q556 D560 Q561 I562	F526-K558 VanDerWaalsContact CG-NZ 3.34Å; L534-K558 HydrophobicContact CD2-CD 4.31Å; L534-K558 HydrophobicContact CD2-CG 4.12Å; E554-K558 WeakPolarHBondContact O-CB 3.38Å; E554-K558 PolarHBondContact O-N 3.3Å; L555-K558 PolarHBondContact O-N 2.86Å; Q556-K558 PolarHBondContact O-N 3.46Å; K558-D560 PolarHBondContact O-N 2.98Å; K558-Q561 PolarHBondContact O-N 2.79Å; K558-Q561 VanDerWaalsContact O-N 3.16Å; K558-I562 HydrophobicContact CG-CD1 3.92Å; K558-I562 HydrophobicContact CG-CG1 4.45Å; K558-I562 WeakPolarHBondContact O-CG1 3.38Å; K558-I562 PolarHBondContact O-N 2.94Å
559	S	72.7	Confident	72.1	Confident	64 Å²	64	92.7 Å²	92.7	45%	0.448	45%	0.446	S	S	.	.	H	α-helix	trans	-55.2	-45.2	173.9	177.3	0	0	0	0	110.5	L555 Q556 I562 Y563	L555-S559 WeakPolarHBondContact O-CB 3.29Å; L555-S559 PolarHBondContact O-N 2.84Å; Q556-S559 WeakPolarHBondContact O-CB 3.44Å; Q556-S559 PolarHBondContact O-N 2.82Å; Q556-S559 VanDerWaalsContact O-N 3.13Å; S559-I562 PolarHBondContact O-N 3.32Å; S559-Y563 WeakPolarHBondContact O-CB 3.42Å; S559-Y563 PolarHBondContact O-N 3.25Å
560	D	77	Confident	72.7	Confident	70 Å²	70	89.9 Å²	89.9	37%	0.374	44%	0.438	S	S	.	.	H	α-helix	trans	-65.6	-40.5	177.7	-63.4	-24.5	0	0	0	111.7	Q556 R557 K558 Y563 L564	Q556-D560 PolarHBondContact NE2-OD1 3.34Å; Q556-D560 PolarHBondContact NE2-OD2 3.05Å; Q556-D560 VanDerWaalsContact O-CG 3.25Å; Q556-D560 PolarHBondContact O-N 3.34Å; R557-D560 PolarHBondContact O-N 3.4Å; K558-D560 PolarHBondContact O-N 2.98Å; D560-Y563 PolarHBondContact O-N 3.35Å; D560-L564 VanDerWaalsContact O-CB 3.29Å; D560-L564 WeakPolarHBondContact O-CB 3.49Å; D560-L564 WeakPolarHBondContact O-CG 3.24Å; D560-L564 PolarHBondContact O-N 3.44Å
561	Q	74.8	Confident	73.6	Confident	100 Å²	100	89.2 Å²	89.2	47%	0.467	44%	0.435	S	S	.	.	H	α-helix	trans	-65.4	-43.9	176.7	-172.5	-179.4	4.9	0	0	112.4	R557 K558 L564 K565	R557-Q561 WeakPolarHBondContact O-CB 3.36Å; R557-Q561 PolarHBondContact O-N 2.87Å; K558-Q561 PolarHBondContact O-N 2.79Å; K558-Q561 VanDerWaalsContact O-N 3.16Å; Q561-L564 PolarHBondContact O-N 2.97Å; Q561-K565 WeakPolarHBondContact O-CB 3.12Å; Q561-K565 PolarHBondContact O-N 2.98Å
562	I	73.9	Confident	74.5	Confident	85 Å²	85	95.1 Å²	95.1	44%	0.436	46%	0.462	S	S	.	.	H	α-helix	trans	-64.3	-44.2	176.1	-68.4	169.4	0	0	0	109.8	K558 S559 L564 K565 R566	K558-I562 HydrophobicContact CG-CD1 3.92Å; K558-I562 HydrophobicContact CG-CG1 4.45Å; K558-I562 WeakPolarHBondContact O-CG1 3.38Å; K558-I562 PolarHBondContact O-N 2.94Å; S559-I562 PolarHBondContact O-N 3.32Å; I562-L564 VanDerWaalsContact C-N 3.35Å; I562-L564 PolarHBondContact O-N 3.1Å; I562-K565 PolarHBondContact O-N 3.26Å; I562-R566 WeakPolarHBondContact O-CB 3.26Å; I562-R566 PolarHBondContact O-N 2.87Å
563	Y	78	Confident	75.3	Confident	151 Å²	151	99.6 Å²	99.6	59%	0.592	48%	0.477	S	S	*	.	H	α-helix	trans	-60.3	-44.3	175.4	178	-100.2	0	0	0	111.5	S559 D560 R566 K567	S559-Y563 WeakPolarHBondContact O-CB 3.42Å; S559-Y563 PolarHBondContact O-N 3.25Å; D560-Y563 PolarHBondContact O-N 3.35Å; Y563-R566 PolarHBondContact O-N 3.24Å; Y563-K567 VanDerWaalsContact O-CB 3.26Å; Y563-K567 WeakPolarHBondContact O-CB 3.43Å; Y563-K567 PolarHBondContact O-N 3.05Å
564	L	77.8	Confident	76	Confident	94 Å²	94	101.9 Å²	101.9	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-38.2	176.1	-74.4	169.3	0	0	0	112.6	D560 Q561 I562 K567 K568	D560-L564 VanDerWaalsContact O-CB 3.29Å; D560-L564 WeakPolarHBondContact O-CB 3.49Å; D560-L564 WeakPolarHBondContact O-CG 3.24Å; D560-L564 PolarHBondContact O-N 3.44Å; Q561-L564 PolarHBondContact O-N 2.97Å; I562-L564 VanDerWaalsContact C-N 3.35Å; I562-L564 PolarHBondContact O-N 3.1Å; L564-K567 PolarHBondContact O-N 3.31Å; L564-K568 WeakPolarHBondContact O-CB 3.49Å; L564-K568 VanDerWaalsContact O-CG 3.29Å; L564-K568 WeakPolarHBondContact O-CG 3.37Å; L564-K568 PolarHBondContact O-N 3.29Å
565	K	77.6	Confident	76.8	Confident	97 Å²	97	104.5 Å²	104.5	42%	0.422	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-52	174	-176.7	178.5	178	-177.7	0	109.8	D529 Q561 I562 K567 K568 E569	D529-K565 IonicContact OD2-NZ 3.72Å; D529-K565 PolarHBondContact OD2-NZ 3.46Å; Q561-K565 WeakPolarHBondContact O-CB 3.12Å; Q561-K565 PolarHBondContact O-N 2.98Å; I562-K565 PolarHBondContact O-N 3.26Å; K565-K567 VanDerWaalsContact C-N 3.32Å; K565-K567 PolarHBondContact O-N 3.3Å; K565-K568 WeakPolarHBondContact O-CB 3.46Å; K565-K568 PolarHBondContact O-N 3.31Å; K565-K568 VanDerWaalsContact O-N 3.17Å; K565-E569 WeakPolarHBondContact CE-OE1 3.34Å; K565-E569 WeakPolarHBondContact CG-OE1 3.41Å; K565-E569 WeakPolarHBondContact O-CB 3.2Å; K565-E569 WeakPolarHBondContact O-CG 3.25Å; K565-E569 PolarHBondContact O-N 2.97Å
566	R	78.1	Confident	77.5	Confident	179 Å²	179	104.2 Å²	104.2	68%	0.675	49%	0.492	S	S	*	.	H	α-helix	trans	-60.1	-40.6	177.4	-171.6	179.3	-70.7	173.8	-2.9	112.1	I562 Y563 E569 S570	I562-R566 WeakPolarHBondContact O-CB 3.26Å; I562-R566 PolarHBondContact O-N 2.87Å; Y563-R566 PolarHBondContact O-N 3.24Å; R566-E569 PolarHBondContact O-N 2.89Å; R566-S570 WeakPolarHBondContact O-CB 3.38Å; R566-S570 PolarHBondContact O-N 3.36Å; R566-S570 PolarHBondContact O-OG 2.82Å
567	K	78.8	Confident	78.1	Confident	107 Å²	107	101.5 Å²	101.5	47%	0.465	48%	0.477	S	S	.	.	H	α-helix	trans	-62.1	-48.3	175.2	-174.8	176	178.3	179.6	0	111.3	Y563 L564 K565 E569 S570 D571	Y563-K567 VanDerWaalsContact O-CB 3.26Å; Y563-K567 WeakPolarHBondContact O-CB 3.43Å; Y563-K567 PolarHBondContact O-N 3.05Å; L564-K567 PolarHBondContact O-N 3.31Å; K565-K567 VanDerWaalsContact C-N 3.32Å; K565-K567 PolarHBondContact O-N 3.3Å; K567-E569 VanDerWaalsContact C-N 3.31Å; K567-E569 PolarHBondContact O-N 3.44Å; K567-S570 WeakPolarHBondContact CA-OG 3.4Å; K567-S570 CarbonylContact O-C 3.58Å; K567-S570 PolarHBondContact O-N 3.47Å; K567-S570 VanDerWaalsContact O-N 3.14Å; K567-S570 PolarHBondContact O-OG 2.91Å; K567-D571 VanDerWaalsContact O-CG 3.25Å; K567-D571 PolarHBondContact O-N 2.85Å
568	K	75.2	Confident	78.9	Confident	133 Å²	133	95.7 Å²	95.7	58%	0.578	46%	0.458	S	S	*	.	H	α-helix	trans	-60.2	-40.7	175.6	-76.2	175.6	179.8	179.8	0	112.1	L564 K565 S570 D571 Y574	L564-K568 WeakPolarHBondContact O-CB 3.49Å; L564-K568 VanDerWaalsContact O-CG 3.29Å; L564-K568 WeakPolarHBondContact O-CG 3.37Å; L564-K568 PolarHBondContact O-N 3.29Å; K565-K568 WeakPolarHBondContact O-CB 3.46Å; K565-K568 PolarHBondContact O-N 3.31Å; K565-K568 VanDerWaalsContact O-N 3.17Å; K568-S570 VanDerWaalsContact C-N 3.28Å; K568-S570 PolarHBondContact O-N 3.48Å; K568-D571 WeakPolarHBondContact O-CB 3.28Å; K568-D571 PolarHBondContact O-N 3.47Å; K568-Y574 WeakPolarHBondContact O-CB 3.44Å
569	E	79	Confident	79.8	Confident	79 Å²	79	96.7 Å²	96.7	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-67.2	-29.9	177.2	-72.9	167.4	177.9	0	0	112.2	K565 R566 K567 Y574	K565-E569 WeakPolarHBondContact CE-OE1 3.34Å; K565-E569 WeakPolarHBondContact CG-OE1 3.41Å; K565-E569 WeakPolarHBondContact O-CB 3.2Å; K565-E569 WeakPolarHBondContact O-CG 3.25Å; K565-E569 PolarHBondContact O-N 2.97Å; R566-E569 PolarHBondContact O-N 2.89Å; K567-E569 VanDerWaalsContact C-N 3.31Å; K567-E569 PolarHBondContact O-N 3.44Å; E569-Y574 HydrophobicContact CB-CD1 4.47Å; E569-Y574 HydrophobicContact CB-CE1 4.29Å; E569-Y574 HydrophobicContact CG-CE1 3.99Å
570	S	76.6	Confident	80.6	Confident	77 Å²	77	98.5 Å²	98.5	54%	0.538	47%	0.468	S	S	.	.	H	α-helix	trans	-82.7	-12.1	173.9	68.2	0	0	0	0	114.7	R566 K567 K568	R566-S570 WeakPolarHBondContact O-CB 3.38Å; R566-S570 PolarHBondContact O-N 3.36Å; R566-S570 PolarHBondContact O-OG 2.82Å; K567-S570 WeakPolarHBondContact CA-OG 3.4Å; K567-S570 CarbonylContact O-C 3.58Å; K567-S570 PolarHBondContact O-N 3.47Å; K567-S570 VanDerWaalsContact O-N 3.14Å; K567-S570 PolarHBondContact O-OG 2.91Å; K568-S570 VanDerWaalsContact C-N 3.28Å; K568-S570 PolarHBondContact O-N 3.48Å
571	D	82	Confident	81.2	Confident	73 Å²	73	95.2 Å²	95.2	39%	0.39	45%	0.451	S	S	.	.	S	Bend	trans	-68.9	132.4	-179.4	-71.6	-25.5	0	0	0	110.1	K567 K568 L573 Y574 L575	K567-D571 VanDerWaalsContact O-CG 3.25Å; K567-D571 PolarHBondContact O-N 2.85Å; K568-D571 WeakPolarHBondContact O-CB 3.28Å; K568-D571 PolarHBondContact O-N 3.47Å; D571-L573 PolarHBondContact O-N 3.46Å; D571-L573 VanDerWaalsContact O-N 3.17Å; D571-Y574 WeakPolarHBondContact O-CB 3.27Å; D571-Y574 PolarHBondContact O-N 3.39Å; D571-L575 PolarHBondContact O-N 2.81Å
572	E	81.4	Confident	81.8	Confident	171 Å²	171	93.1 Å²	93.1	80%	0.799	44%	0.443	S	S	*	.	H	α-helix	trans	-56	-37.6	-178.1	-68.8	179.8	175.1	0	0	113	Y574 L575 D576	E572-Y574 VanDerWaalsContact C-N 3.25Å; E572-Y574 PolarHBondContact O-N 2.84Å; E572-L575 PolarHBondContact O-N 2.94Å; E572-D576 PolarHBondContact O-N 3.39Å
573	L	81.7	Confident	82.4	Confident	150 Å²	150	92.1 Å²	92.1	79%	0.785	44%	0.443	S	S	*	.	H	α-helix	trans	-64.1	-30.8	177.5	-66.2	177.5	0	0	0	112.7	D571 W577	D571-L573 PolarHBondContact O-N 3.46Å; D571-L573 VanDerWaalsContact O-N 3.17Å; L573-W577 VanDerWaalsContact O-CB 3.29Å; L573-W577 WeakPolarHBondContact O-CB 3.27Å; L573-W577 PolarHBondContact O-N 2.79Å; L573-W577 VanDerWaalsContact O-N 3.17Å
574	Y	81.1	Confident	82.8	Confident	75 Å²	75	85.1 Å²	85.1	29%	0.294	42%	0.416	S	S	.	.	H	α-helix	trans	-75.3	-41.9	176.5	-179.2	-92.6	0	0	0	110.9	K568 E569 D571 E572 W577 L578	K568-Y574 WeakPolarHBondContact O-CB 3.44Å; E569-Y574 HydrophobicContact CB-CD1 4.47Å; E569-Y574 HydrophobicContact CB-CE1 4.29Å; E569-Y574 HydrophobicContact CG-CE1 3.99Å; D571-Y574 WeakPolarHBondContact O-CB 3.27Å; D571-Y574 PolarHBondContact O-N 3.39Å; E572-Y574 VanDerWaalsContact C-N 3.25Å; E572-Y574 PolarHBondContact O-N 2.84Å; Y574-W577 AromaticContact CD2-CE3 3.88Å; Y574-W577 HydrophobicContact CD2-CE3 3.88Å; Y574-W577 AromaticContact CD2-CZ3 3.98Å; Y574-W577 HydrophobicContact CD2-CZ3 3.98Å; Y574-W577 AromaticContact CE2-CE3 3.79Å; Y574-W577 HydrophobicContact CE2-CE3 3.79Å; Y574-W577 HydrophobicContact CE2-CH2 4.44Å; Y574-W577 AromaticContact CE2-CZ3 3.41Å; Y574-W577 HydrophobicContact CE2-CZ3 3.41Å; Y574-W577 VanDerWaalsContact CE2-CZ3 3.41Å; Y574-W577 AromaticContact CZ-CZ3 3.91Å; Y574-W577 WeakPolarHBondContact O-CB 3.41Å; Y574-W577 PolarHBondContact O-N 3.22Å; Y574-L578 WeakPolarHBondContact O-CB 3.36Å; Y574-L578 PolarHBondContact O-N 3.45Å
575	L	82.9	Confident	83.2	Confident	86 Å²	86	80.9 Å²	80.9	45%	0.45	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-41.4	176.5	-64.8	175.4	0	0	0	112.2	D571 E572 L578 T579	D571-L575 PolarHBondContact O-N 2.81Å; E572-L575 PolarHBondContact O-N 2.94Å; L575-L578 PolarHBondContact O-N 2.88Å; L575-T579 WeakPolarHBondContact O-CB 3.28Å; L575-T579 PolarHBondContact O-N 3.1Å; L575-T579 PolarHBondContact O-OG1 3.07Å
576	D	86.2	Confident	83.5	Confident	76 Å²	76	81.4 Å²	81.4	41%	0.406	41%	0.405	S	S	.	.	H	α-helix	trans	-63	-42.4	173.5	178.8	46.4	0	0	0	111.5	E572 L578 T579 K580	E572-D576 PolarHBondContact O-N 3.39Å; D576-L578 PolarHBondContact O-N 3.5Å; D576-T579 PolarHBondContact O-N 3.34Å; D576-K580 WeakPolarHBondContact O-CG 3.49Å; D576-K580 PolarHBondContact O-N 2.7Å; D576-K580 WeakPolarHBondContact OD1-CE 3.28Å; D576-K580 IonicContact OD1-NZ 2.85Å; D576-K580 VanDerWaalsContact OD2-CE 3.26Å; D576-K580 WeakPolarHBondContact OD2-CE 3.49Å; D576-K580 IonicContact OD2-NZ 3.69Å; D576-K580 PolarHBondContact OD2-NZ 3.48Å
577	W	86.8	Confident	83.6	Confident	48 Å²	48	78.7 Å²	78.7	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-61.6	-42	174.3	171.8	77.6	0	0	0	112.6	L573 Y574 K580 W581 S605 G606 P608	L573-W577 VanDerWaalsContact O-CB 3.29Å; L573-W577 WeakPolarHBondContact O-CB 3.27Å; L573-W577 PolarHBondContact O-N 2.79Å; L573-W577 VanDerWaalsContact O-N 3.17Å; Y574-W577 AromaticContact CD2-CE3 3.88Å; Y574-W577 HydrophobicContact CD2-CE3 3.88Å; Y574-W577 AromaticContact CD2-CZ3 3.98Å; Y574-W577 HydrophobicContact CD2-CZ3 3.98Å; Y574-W577 AromaticContact CE2-CE3 3.79Å; Y574-W577 HydrophobicContact CE2-CE3 3.79Å; Y574-W577 HydrophobicContact CE2-CH2 4.44Å; Y574-W577 AromaticContact CE2-CZ3 3.41Å; Y574-W577 HydrophobicContact CE2-CZ3 3.41Å; Y574-W577 VanDerWaalsContact CE2-CZ3 3.41Å; Y574-W577 AromaticContact CZ-CZ3 3.91Å; Y574-W577 WeakPolarHBondContact O-CB 3.41Å; Y574-W577 PolarHBondContact O-N 3.22Å; W577-K580 PolarHBondContact O-N 2.83Å; W577-W581 AromaticContact CE2-CD1 3.71Å; W577-W581 AromaticContact CE2-NE1 3.59Å; W577-W581 AromaticContact CZ2-NE1 3.8Å; W577-W581 AromaticContact NE1-CD1 3.72Å; W577-W581 AromaticContact NE1-NE1 3.41Å; W577-W581 PolarHBondContact O-N 3.48Å; W577-S605 PolarHBondContact NE1-OG 3.38Å; W577-G606 WeakPolarHBondContact CZ2-O 3.08Å; W577-P608 HydrophobicContact CE3-CG 4.4Å; W577-P608 HydrophobicContact CH2-CB 3.97Å; W577-P608 HydrophobicContact CH2-CG 3.44Å; W577-P608 VanDerWaalsContact CH2-CG 3.44Å; W577-P608 HydrophobicContact CZ2-CG 3.91Å; W577-P608 HydrophobicContact CZ3-CB 4.19Å; W577-P608 HydrophobicContact CZ3-CG 3.69Å
578	L	86.9	Confident	83.4	Confident	40 Å²	40	75.2 Å²	75.2	21%	0.209	39%	0.389	C	S	.	.	H	α-helix	trans	-66.4	-41.9	176	-172.2	64.7	0	0	0	111.6	Y574 L575 D576 K580 W581 D582 P608 Y611	Y574-L578 WeakPolarHBondContact O-CB 3.36Å; Y574-L578 PolarHBondContact O-N 3.45Å; L575-L578 PolarHBondContact O-N 2.88Å; D576-L578 PolarHBondContact O-N 3.5Å; L578-K580 VanDerWaalsContact C-N 3.28Å; L578-K580 PolarHBondContact O-N 3.21Å; L578-W581 WeakPolarHBondContact O-CA 3.28Å; L578-W581 WeakPolarHBondContact O-CB 3.3Å; L578-W581 PolarHBondContact O-N 3.29Å; L578-D582 PolarHBondContact O-N 3.15Å; L578-P608 HydrophobicContact CD1-CB 4.15Å; L578-P608 HydrophobicContact CD1-CG 3.98Å; L578-Y611 HydrophobicContact CD1-CE2 3.86Å
579	T	88.1	Confident	83.2	Confident	76 Å²	76	71.8 Å²	71.8	47%	0.466	39%	0.385	S	S	.	.	H	α-helix	trans	-61.5	-36.4	177.8	-54.7	0	0	0	0	111.8	L575 D576 D582 S583	L575-T579 WeakPolarHBondContact O-CB 3.28Å; L575-T579 PolarHBondContact O-N 3.1Å; L575-T579 PolarHBondContact O-OG1 3.07Å; D576-T579 PolarHBondContact O-N 3.34Å; T579-D582 PolarHBondContact O-N 3.47Å; T579-S583 WeakPolarHBondContact O-CB 3.47Å; T579-S583 PolarHBondContact O-N 3.21Å; T579-S583 PolarHBondContact O-OG 2.89Å
580	K	87.7	Confident	82.7	Confident	102 Å²	102	75.8 Å²	75.8	44%	0.443	41%	0.409	S	S	.	.	H	α-helix	trans	-63.9	-42.5	172.7	-72.4	169	-170.2	161.4	0	111.9	D576 W577 L578 F584 L602	D576-K580 WeakPolarHBondContact O-CG 3.49Å; D576-K580 PolarHBondContact O-N 2.7Å; D576-K580 WeakPolarHBondContact OD1-CE 3.28Å; D576-K580 IonicContact OD1-NZ 2.85Å; D576-K580 VanDerWaalsContact OD2-CE 3.26Å; D576-K580 WeakPolarHBondContact OD2-CE 3.49Å; D576-K580 IonicContact OD2-NZ 3.69Å; D576-K580 PolarHBondContact OD2-NZ 3.48Å; W577-K580 PolarHBondContact O-N 2.83Å; L578-K580 VanDerWaalsContact C-N 3.28Å; L578-K580 PolarHBondContact O-N 3.21Å; K580-F584 WeakPolarHBondContact O-CB 3.29Å; K580-F584 PolarHBondContact O-N 3.16Å; K580-L602 HydrophobicContact CB-CD2 4.17Å
581	W	89.7	Confident	82.5	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-63	-44.5	174.4	-88.2	104.8	0	0	0	112.1	W577 L578 F584 L585 L599 L602 I603 G606 V607 P608 Y611 V615	W577-W581 AromaticContact CE2-CD1 3.71Å; W577-W581 AromaticContact CE2-NE1 3.59Å; W577-W581 AromaticContact CZ2-NE1 3.8Å; W577-W581 AromaticContact NE1-CD1 3.72Å; W577-W581 AromaticContact NE1-NE1 3.41Å; W577-W581 PolarHBondContact O-N 3.48Å; L578-W581 WeakPolarHBondContact O-CA 3.28Å; L578-W581 WeakPolarHBondContact O-CB 3.3Å; L578-W581 PolarHBondContact O-N 3.29Å; W581-F584 PolarHBondContact O-N 2.84Å; W581-L585 HydrophobicContact CE3-CD1 4.39Å; W581-L585 HydrophobicContact CE3-CG 4.33Å; W581-L585 WeakPolarHBondContact O-CB 3.47Å; W581-L585 WeakPolarHBondContact O-CG 3.33Å; W581-L585 PolarHBondContact O-N 3.13Å; W581-L599 HydrophobicContact CH2-CD1 4.47Å; W581-L602 HydrophobicContact CH2-CB 4.17Å; W581-L602 HydrophobicContact CZ2-CB 3.8Å; W581-I603 HydrophobicContact CH2-CG1 3.9Å; W581-I603 HydrophobicContact CZ2-CG1 4.39Å; W581-G606 VanDerWaalsContact CZ2-O 3.32Å; W581-G606 WeakPolarHBondContact CZ2-O 3.21Å; W581-G606 PolarHBondContact NE1-O 2.93Å; W581-G606 VanDerWaalsContact NE1-O 3.08Å; W581-V607 HydrophobicContact CH2-CB 4.35Å; W581-V607 HydrophobicContact CH2-CG1 4.1Å; W581-V607 HydrophobicContact CH2-CG2 3.77Å; W581-V607 HydrophobicContact CZ2-CB 4.17Å; W581-V607 HydrophobicContact CZ2-CG1 4.27Å; W581-V607 HydrophobicContact CZ2-CG2 3.75Å; W581-V607 HydrophobicContact CZ3-CG1 4.5Å; W581-P608 HydrophobicContact CB-CG 4.15Å; W581-P608 HydrophobicContact CD2-CG 4.25Å; W581-P608 HydrophobicContact CG-CG 3.74Å; W581-Y611 HydrophobicContact CB-CD2 4.07Å; W581-Y611 HydrophobicContact CB-CE2 4.11Å; W581-V615 HydrophobicContact CH2-CG2 4.31Å; W581-V615 HydrophobicContact CZ3-CG2 3.77Å
582	D	87.9	Confident	82	Confident	56 Å²	56	79.4 Å²	79.4	30%	0.299	41%	0.414	S	S	.	.	H	α-helix	trans	-59.4	-50.3	176.7	-68	-14.6	0	0	0	111.2	L578 T579 F584 L585 V586 Y611	L578-D582 PolarHBondContact O-N 3.15Å; T579-D582 PolarHBondContact O-N 3.47Å; D582-F584 VanDerWaalsContact C-N 3.29Å; D582-F584 PolarHBondContact O-N 3.46Å; D582-L585 PolarHBondContact O-N 2.83Å; D582-V586 WeakPolarHBondContact O-CB 3.38Å; D582-V586 VanDerWaalsContact O-CG2 3.26Å; D582-V586 WeakPolarHBondContact O-CG2 3.46Å; D582-V586 PolarHBondContact O-N 3.19Å; D582-Y611 WeakPolarHBondContact OD1-CE2 3.36Å; D582-Y611 PolarHBondContact OD1-OH 2.83Å
583	S	87.4	Confident	81.7	Confident	64 Å²	64	71.2 Å²	71.2	45%	0.448	38%	0.376	S	S	.	.	H	α-helix	trans	-58.4	-42.5	178.5	-57.8	0	0	0	0	111.5	T579 N587	T579-S583 WeakPolarHBondContact O-CB 3.47Å; T579-S583 PolarHBondContact O-N 3.21Å; T579-S583 PolarHBondContact O-OG 2.89Å; S583-N587 VanDerWaalsContact O-CG 3.25Å; S583-N587 PolarHBondContact O-N 3.29Å; S583-N587 PolarHBondContact O-ND2 3.31Å; S583-N587 VanDerWaalsContact O-ND2 3.1Å
584	F	85.7	Confident	81.5	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-48.2	177.2	-173	-87.4	0	0	0	111.7	K580 W581 D582 V586 N587 F588 M593 E598 L599 L602	K580-F584 WeakPolarHBondContact O-CB 3.29Å; K580-F584 PolarHBondContact O-N 3.16Å; W581-F584 PolarHBondContact O-N 2.84Å; D582-F584 VanDerWaalsContact C-N 3.29Å; D582-F584 PolarHBondContact O-N 3.46Å; F584-V586 PolarHBondContact O-N 3.12Å; F584-N587 WeakPolarHBondContact O-CB 3.35Å; F584-N587 PolarHBondContact O-N 3.44Å; F584-F588 HydrophobicContact CD1-CD2 4.15Å; F584-F588 HydrophobicContact CD2-CE2 4.29Å; F584-F588 AromaticContact CE1-CD2 3.67Å; F584-F588 HydrophobicContact CE1-CD2 3.67Å; F584-F588 AromaticContact CE1-CE2 3.92Å; F584-F588 HydrophobicContact CE1-CE2 3.92Å; F584-F588 HydrophobicContact CE1-CG 4.4Å; F584-F588 HydrophobicContact CE2-CD2 4.13Å; F584-F588 AromaticContact CE2-CE2 3.63Å; F584-F588 HydrophobicContact CE2-CE2 3.63Å; F584-F588 HydrophobicContact CE2-CZ 4.5Å; F584-F588 AromaticContact CZ-CD2 3.67Å; F584-F588 HydrophobicContact CZ-CD2 3.67Å; F584-F588 AromaticContact CZ-CE2 3.39Å; F584-F588 HydrophobicContact CZ-CE2 3.39Å; F584-F588 HydrophobicContact CZ-CZ 4.12Å; F584-F588 WeakPolarHBondContact O-CD2 3.34Å; F584-F588 PolarHBondContact O-N 3.16Å; F584-M593 HydrophobicContact CD1-CE 4.44Å; F584-M593 HydrophobicContact CE1-CE 3.66Å; F584-E598 HydrophobicContact CD2-CG 4.12Å; F584-E598 HydrophobicContact CE2-CB 4.41Å; F584-E598 HydrophobicContact CE2-CG 4.14Å; F584-L599 HydrophobicContact CE1-CB 4.45Å; F584-L599 HydrophobicContact CE1-CD1 3.83Å; F584-L599 HydrophobicContact CE2-CB 4.3Å; F584-L599 HydrophobicContact CZ-CB 3.76Å; F584-L599 HydrophobicContact CZ-CD1 4.01Å; F584-L599 HydrophobicContact CZ-CG 4.32Å; F584-L602 HydrophobicContact CB-CD1 3.73Å; F584-L602 HydrophobicContact CD1-CD1 4.15Å; F584-L602 HydrophobicContact CD2-CD1 3.52Å; F584-L602 HydrophobicContact CE2-CD1 4.19Å; F584-L602 HydrophobicContact CG-CD1 3.5Å
585	L	85.2	Confident	81.3	Confident	5 Å²	5	66.1 Å²	66.1	3%	0.026	36%	0.36	C	S	.	.	H	α-helix	trans	-69.8	-29.6	-176.6	-70.8	175.1	0	0	0	113.7	W581 D582 F588 A589 M593 Y611 R614 V615	W581-L585 HydrophobicContact CE3-CD1 4.39Å; W581-L585 HydrophobicContact CE3-CG 4.33Å; W581-L585 WeakPolarHBondContact O-CB 3.47Å; W581-L585 WeakPolarHBondContact O-CG 3.33Å; W581-L585 PolarHBondContact O-N 3.13Å; D582-L585 PolarHBondContact O-N 2.83Å; L585-F588 CarbonylContact O-C 3.52Å; L585-F588 PolarHBondContact O-N 3.05Å; L585-A589 PolarHBondContact O-N 3.24Å; L585-A589 VanDerWaalsContact O-N 3.13Å; L585-M593 HydrophobicContact CD2-SD 4.18Å; L585-Y611 HydrophobicContact CD1-CD1 3.75Å; L585-Y611 HydrophobicContact CD1-CD2 3.48Å; L585-Y611 VanDerWaalsContact CD1-CD2 3.48Å; L585-Y611 HydrophobicContact CD1-CE1 4.21Å; L585-Y611 HydrophobicContact CD1-CE2 3.94Å; L585-Y611 HydrophobicContact CD1-CG 3.39Å; L585-R614 PolarHBondContact O-NH2 2.72Å; L585-V615 HydrophobicContact CD2-CG2 4.29Å
586	V	84.1	Confident	81.3	Confident	109 Å²	109	64.8 Å²	64.8	66%	0.661	35%	0.353	S	S	*	.	H	α-helix	trans	-66	-40.1	171.9	170.3	0	0	0	0	110.5	D582 F584 F588 A589	D582-V586 WeakPolarHBondContact O-CB 3.38Å; D582-V586 VanDerWaalsContact O-CG2 3.26Å; D582-V586 WeakPolarHBondContact O-CG2 3.46Å; D582-V586 PolarHBondContact O-N 3.19Å; F584-V586 PolarHBondContact O-N 3.12Å; V586-F588 PolarHBondContact O-N 2.89Å; V586-A589 PolarHBondContact O-N 3.28Å
587	N	80.5	Confident	81.1	Confident	122 Å²	122	66.1 Å²	66.1	65%	0.652	37%	0.366	S	S	*	.	H	α-helix	trans	-66	-20.9	176.3	-69.4	-26.7	0	0	0	113.3	S583 F584	S583-N587 VanDerWaalsContact O-CG 3.25Å; S583-N587 PolarHBondContact O-N 3.29Å; S583-N587 PolarHBondContact O-ND2 3.31Å; S583-N587 VanDerWaalsContact O-ND2 3.1Å; F584-N587 WeakPolarHBondContact O-CB 3.35Å; F584-N587 PolarHBondContact O-N 3.44Å
588	F	76	Confident	81	Confident	34 Å²	34	69.5 Å²	69.5	15%	0.149	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	23.3	178.5	-73.4	-90.2	0	0	0	113.3	F584 L585 V586 D590 K591 M593 R614	F584-F588 HydrophobicContact CD1-CD2 4.15Å; F584-F588 HydrophobicContact CD2-CE2 4.29Å; F584-F588 AromaticContact CE1-CD2 3.67Å; F584-F588 HydrophobicContact CE1-CD2 3.67Å; F584-F588 AromaticContact CE1-CE2 3.92Å; F584-F588 HydrophobicContact CE1-CE2 3.92Å; F584-F588 HydrophobicContact CE1-CG 4.4Å; F584-F588 HydrophobicContact CE2-CD2 4.13Å; F584-F588 AromaticContact CE2-CE2 3.63Å; F584-F588 HydrophobicContact CE2-CE2 3.63Å; F584-F588 HydrophobicContact CE2-CZ 4.5Å; F584-F588 AromaticContact CZ-CD2 3.67Å; F584-F588 HydrophobicContact CZ-CD2 3.67Å; F584-F588 AromaticContact CZ-CE2 3.39Å; F584-F588 HydrophobicContact CZ-CE2 3.39Å; F584-F588 HydrophobicContact CZ-CZ 4.12Å; F584-F588 WeakPolarHBondContact O-CD2 3.34Å; F584-F588 PolarHBondContact O-N 3.16Å; L585-F588 CarbonylContact O-C 3.52Å; L585-F588 PolarHBondContact O-N 3.05Å; V586-F588 PolarHBondContact O-N 2.89Å; F588-D590 VanDerWaalsContact C-N 3.34Å; F588-D590 PolarHBondContact O-N 3.21Å; F588-K591 HydrophobicContact CD1-CB 4.43Å; F588-K591 VanDerWaalsContact O-O 3.14Å; F588-M593 HydrophobicContact CB-CG 4.39Å; F588-R614 PolarHBondContact O-NH2 3.43Å
589	A	70.3	Confident	81	Confident	60 Å²	60	67.6 Å²	67.6	50%	0.496	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-44.4	179.7	0	0	0	0	0	113.5	L585 V586 R614	L585-A589 PolarHBondContact O-N 3.24Å; L585-A589 VanDerWaalsContact O-N 3.13Å; V586-A589 PolarHBondContact O-N 3.28Å; A589-R614 VanDerWaalsContact CA-NH2 3.33Å
590	D	68	Low	80.9	Confident	164 Å²	164	67.1 Å²	67.1	88%	0.877	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	6.9	-173.1	-57.4	-43.2	0	0	0	113.9	F588	F588-D590 VanDerWaalsContact C-N 3.34Å; F588-D590 PolarHBondContact O-N 3.21Å
591	K	73.1	Confident	80.8	Confident	153 Å²	153	67.1 Å²	67.1	67%	0.665	37%	0.37	S	S	*	.	S	Bend	trans	-130.6	137.4	-173.4	-65.3	179.9	-176.3	172.9	0	110.5	F588 M593	F588-K591 HydrophobicContact CD1-CB 4.43Å; F588-K591 VanDerWaalsContact O-O 3.14Å; K591-M593 PolarHBondContact O-N 3.37Å
592	L	71.5	Confident	80.7	Confident	72 Å²	72	68 Å²	68	38%	0.377	38%	0.375	S	S	.	.			trans	-54.7	134.6	168.4	-73.5	167.6	0	0	0	109.8	V594 H621	L592-V594 PolarHBondContact O-N 3.19Å; L592-H621 HydrophobicContact CD2-CB 4.06Å
593	M	75	Confident	80.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.361	C	S	.	.			trans	-66.6	113.6	178.3	-66.5	-178.5	58	0	0	109.6	F584 L585 F588 K591 L599 V615 D618	F584-M593 HydrophobicContact CD1-CE 4.44Å; F584-M593 HydrophobicContact CE1-CE 3.66Å; L585-M593 HydrophobicContact CD2-SD 4.18Å; F588-M593 HydrophobicContact CB-CG 4.39Å; K591-M593 PolarHBondContact O-N 3.37Å; M593-L599 HydrophobicContact CB-CD2 4.36Å; M593-L599 HydrophobicContact CE-CD1 3.24Å; M593-L599 HydrophobicContact CE-CD2 3.69Å; M593-L599 HydrophobicContact CE-CG 4.11Å; M593-V615 HydrophobicContact CE-CG1 4.31Å; M593-V615 HydrophobicContact CE-CG2 4.32Å; M593-V615 HydrophobicContact SD-CG2 4.28Å; M593-D618 HydrophobicContact CB-CB 3.9Å; M593-D618 HydrophobicContact CG-CB 3.83Å; M593-D618 HydrophobicContact SD-CB 3.97Å
594	V	76.9	Confident	80.6	Confident	66 Å²	66	65.9 Å²	65.9	40%	0.4	35%	0.353	S	S	.	.			trans	-91.2	140.8	175	-179.2	0	0	0	0	109	L592 N596 Y622	L592-V594 PolarHBondContact O-N 3.19Å; V594-N596 PolarHBondContact O-N 3.31Å; V594-N596 PolarHBondContact O-OD1 2.81Å; V594-Y622 HydrophobicContact CG1-CE2 4.31Å
595	P	77.1	Confident	80.5	Confident	52 Å²	52	68 Å²	68	34%	0.338	37%	0.368	S	S	.	.			trans	-56	102.9	175.7	-27.5	36	0	0	0	112.8	Y622 L802	P595-Y622 VanDerWaalsContact CD-CZ 3.41Å; P595-Y622 HydrophobicContact CG-CD1 4.08Å; P595-Y622 HydrophobicContact CG-CE1 3.59Å; P595-Y622 HydrophobicContact CG-CE2 4.43Å; P595-L802 HydrophobicContact CB-CD1 3.98Å; P595-L802 HydrophobicContact CG-CD1 4.22Å
596	N	82.8	Confident	80.5	Confident	58 Å²	58	67.8 Å²	67.8	31%	0.31	37%	0.368	S	S	.	.			trans	-114.6	153.3	179	-72.3	-10.6	0	0	0	110.5	V594 E598 L599 K600	V594-N596 PolarHBondContact O-N 3.31Å; V594-N596 PolarHBondContact O-OD1 2.81Å; N596-E598 VanDerWaalsContact C-N 3.25Å; N596-E598 PolarHBondContact O-N 2.78Å; N596-L599 HydrophobicContact CB-CB 4.25Å; N596-L599 WeakPolarHBondContact O-CB 3.35Å; N596-L599 PolarHBondContact O-N 3.24Å; N596-K600 WeakPolarHBondContact O-CB 3.08Å; N596-K600 PolarHBondContact O-N 3.06Å
597	P	82.5	Confident	80.7	Confident	103 Å²	103	62.9 Å²	62.9	67%	0.669	34%	0.338	S	S	*	.	H	α-helix	trans	-60.5	-36.2	176.9	24.5	-33.6	0	0	0	112.2	K600 D601	P597-K600 WeakPolarHBondContact O-CB 3.45Å; P597-K600 PolarHBondContact O-N 3.21Å; P597-D601 PolarHBondContact O-N 3.35Å
598	E	85	Confident	81	Confident	120 Å²	120	57.2 Å²	57.2	56%	0.561	31%	0.308	S	S	*	.	H	α-helix	trans	-63.4	-46.8	174.6	-174.7	178.9	-171.5	0	0	111.8	F584 N596 K600 D601 L602	F584-E598 HydrophobicContact CD2-CG 4.12Å; F584-E598 HydrophobicContact CE2-CB 4.41Å; F584-E598 HydrophobicContact CE2-CG 4.14Å; N596-E598 VanDerWaalsContact C-N 3.25Å; N596-E598 PolarHBondContact O-N 2.78Å; E598-K600 PolarHBondContact O-N 3.1Å; E598-D601 PolarHBondContact O-N 3.46Å; E598-L602 HydrophobicContact CG-CD1 4.34Å; E598-L602 WeakPolarHBondContact O-CG 3.3Å; E598-L602 PolarHBondContact O-N 3.12Å
599	L	86.5	Confident	81.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.8	-40.3	175.2	177.8	55.6	0	0	0	111.4	W581 F584 M593 N596 L602 I603 L619 L802	W581-L599 HydrophobicContact CH2-CD1 4.47Å; F584-L599 HydrophobicContact CE1-CB 4.45Å; F584-L599 HydrophobicContact CE1-CD1 3.83Å; F584-L599 HydrophobicContact CE2-CB 4.3Å; F584-L599 HydrophobicContact CZ-CB 3.76Å; F584-L599 HydrophobicContact CZ-CD1 4.01Å; F584-L599 HydrophobicContact CZ-CG 4.32Å; M593-L599 HydrophobicContact CB-CD2 4.36Å; M593-L599 HydrophobicContact CE-CD1 3.24Å; M593-L599 HydrophobicContact CE-CD2 3.69Å; M593-L599 HydrophobicContact CE-CG 4.11Å; N596-L599 HydrophobicContact CB-CB 4.25Å; N596-L599 WeakPolarHBondContact O-CB 3.35Å; N596-L599 PolarHBondContact O-N 3.24Å; L599-L602 PolarHBondContact O-N 2.72Å; L599-I603 HydrophobicContact CD1-CD1 3.72Å; L599-I603 HydrophobicContact CD1-CG1 3.92Å; L599-I603 HydrophobicContact CG-CD1 3.94Å; L599-I603 HydrophobicContact CG-CG1 4.44Å; L599-I603 WeakPolarHBondContact O-CB 3.32Å; L599-I603 WeakPolarHBondContact O-CG1 3.43Å; L599-I603 PolarHBondContact O-N 3.37Å; L599-L619 HydrophobicContact CD2-CD2 4.37Å; L599-L802 HydrophobicContact CD2-CD1 4.17Å
600	K	86.3	Confident	82.1	Confident	65 Å²	65	60.6 Å²	60.6	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-44	178.4	-177	171.1	180	145.4	0	112.3	N596 P597 E598 R604 L802 E803	N596-K600 WeakPolarHBondContact O-CB 3.08Å; N596-K600 PolarHBondContact O-N 3.06Å; P597-K600 WeakPolarHBondContact O-CB 3.45Å; P597-K600 PolarHBondContact O-N 3.21Å; E598-K600 PolarHBondContact O-N 3.1Å; K600-R604 WeakPolarHBondContact O-CB 3.44Å; K600-R604 WeakPolarHBondContact O-CD 3.32Å; K600-R604 WeakPolarHBondContact O-CG 3.43Å; K600-R604 PolarHBondContact O-N 3.11Å; K600-R604 VanDerWaalsContact O-N 3.08Å; K600-L802 VanDerWaalsContact CA-CD2 3.49Å; K600-L802 HydrophobicContact CB-CD2 3.79Å; K600-L802 HydrophobicContact CG-CD2 4.05Å; K600-E803 WeakPolarHBondContact CE-OE1 3.49Å; K600-E803 WeakPolarHBondContact CE-OE2 3.11Å; K600-E803 VanDerWaalsContact NZ-CD 3.33Å; K600-E803 IonicContact NZ-OE1 2.81Å; K600-E803 IonicContact NZ-OE2 3.61Å; K600-E803 PolarHBondContact NZ-OE2 3.43Å
601	D	85.8	Confident	83.1	Confident	102 Å²	102	55.7 Å²	55.7	55%	0.545	29%	0.292	S	S	.	.	H	α-helix	trans	-70.8	-36.9	177.7	-69.3	-23.2	0	0	0	111.8	P597 E598 R604 S605	P597-D601 PolarHBondContact O-N 3.35Å; E598-D601 PolarHBondContact O-N 3.46Å; D601-R604 PolarHBondContact O-N 3.46Å; D601-R604 IonicContact OD1-NH1 3.86Å; D601-S605 PolarHBondContact O-N 3.36Å
602	L	86.5	Confident	84	Confident	19 Å²	19	48.9 Å²	48.9	10%	0.099	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-52.6	172.8	-73.7	173.8	0	0	0	111.6	K580 W581 F584 E598 L599 R604 S605 G606	K580-L602 HydrophobicContact CB-CD2 4.17Å; W581-L602 HydrophobicContact CH2-CB 4.17Å; W581-L602 HydrophobicContact CZ2-CB 3.8Å; F584-L602 HydrophobicContact CB-CD1 3.73Å; F584-L602 HydrophobicContact CD1-CD1 4.15Å; F584-L602 HydrophobicContact CD2-CD1 3.52Å; F584-L602 HydrophobicContact CE2-CD1 4.19Å; F584-L602 HydrophobicContact CG-CD1 3.5Å; E598-L602 HydrophobicContact CG-CD1 4.34Å; E598-L602 WeakPolarHBondContact O-CG 3.3Å; E598-L602 PolarHBondContact O-N 3.12Å; L599-L602 PolarHBondContact O-N 2.72Å; L602-R604 VanDerWaalsContact C-N 3.29Å; L602-R604 PolarHBondContact O-N 2.95Å; L602-S605 WeakPolarHBondContact O-CB 3.38Å; L602-S605 PolarHBondContact O-N 3.48Å; L602-S605 PolarHBondContact O-OG 3.27Å; L602-G606 PolarHBondContact O-N 2.91Å; L602-G606 VanDerWaalsContact O-O 3.12Å
603	I	88	Confident	84.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-41.4	179	-78.8	-179.5	0	0	0	111.4	W581 L599 S605 G606 V607 V615 L619 D798 C799 L802	W581-I603 HydrophobicContact CH2-CG1 3.9Å; W581-I603 HydrophobicContact CZ2-CG1 4.39Å; L599-I603 HydrophobicContact CD1-CD1 3.72Å; L599-I603 HydrophobicContact CD1-CG1 3.92Å; L599-I603 HydrophobicContact CG-CD1 3.94Å; L599-I603 HydrophobicContact CG-CG1 4.44Å; L599-I603 WeakPolarHBondContact O-CB 3.32Å; L599-I603 WeakPolarHBondContact O-CG1 3.43Å; L599-I603 PolarHBondContact O-N 3.37Å; I603-S605 VanDerWaalsContact C-N 3.29Å; I603-S605 PolarHBondContact O-N 2.93Å; I603-G606 WeakPolarHBondContact O-CA 3.35Å; I603-G606 PolarHBondContact O-N 3.41Å; I603-V607 HydrophobicContact CG1-CG2 3.98Å; I603-V615 HydrophobicContact CD1-CG1 4.15Å; I603-L619 HydrophobicContact CD1-CD1 3.94Å; I603-D798 VanDerWaalsContact CG2-C 3.49Å; I603-D798 HydrophobicContact CG2-CB 3.99Å; I603-D798 VanDerWaalsContact CG2-O 3.28Å; I603-D798 WeakPolarHBondContact CG2-O 3.45Å; I603-C799 HydrophobicContact CG2-CB 4.49Å; I603-L802 HydrophobicContact CB-CD2 4.44Å; I603-L802 HydrophobicContact CD1-CB 4.11Å; I603-L802 HydrophobicContact CD1-CD2 4.02Å; I603-L802 HydrophobicContact CD1-CG 4.44Å
604	R	85.9	Confident	85.7	Confident	75 Å²	75	52 Å²	52	28%	0.283	28%	0.276	S	S	.	.	H	α-helix	trans	-64.9	-32.6	177	-75.4	167.6	174.9	-174.5	-15.9	113.2	K600 D601 L602 G606 E803 R810 Y846	K600-R604 WeakPolarHBondContact O-CB 3.44Å; K600-R604 WeakPolarHBondContact O-CD 3.32Å; K600-R604 WeakPolarHBondContact O-CG 3.43Å; K600-R604 PolarHBondContact O-N 3.11Å; K600-R604 VanDerWaalsContact O-N 3.08Å; D601-R604 PolarHBondContact O-N 3.46Å; D601-R604 IonicContact OD1-NH1 3.86Å; L602-R604 VanDerWaalsContact C-N 3.29Å; L602-R604 PolarHBondContact O-N 2.95Å; R604-G606 PolarHBondContact O-N 3.35Å; R604-E803 IonicContact CZ-OE1 3.96Å; R604-E803 IonicContact CZ-OE2 3.73Å; R604-E803 IonicContact NE-OE1 3.09Å; R604-E803 PolarHBondContact NE-OE1 2.95Å; R604-E803 VanDerWaalsContact NH2-CD 3.31Å; R604-E803 IonicContact NH2-OE1 3.59Å; R604-E803 PolarHBondContact NH2-OE1 3.34Å; R604-E803 IonicContact NH2-OE2 2.8Å; R604-E803 PolarHBondContact NH2-OE2 3.12Å; R604-R810 VanDerWaalsContact NH2-NH1 3.13Å; R604-Y846 WeakPolarHBondContact O-CE1 3.36Å; R604-Y846 PolarHBondContact O-OH 2.93Å
605	S	83.8	Confident	86.4	Confident	49 Å²	49	48.9 Å²	48.9	34%	0.343	26%	0.257	S	S	.	.	H	α-helix	trans	-68.2	-15.4	171.8	80.5	0	0	0	0	113.1	W577 D601 L602 I603	W577-S605 PolarHBondContact NE1-OG 3.38Å; D601-S605 PolarHBondContact O-N 3.36Å; L602-S605 WeakPolarHBondContact O-CB 3.38Å; L602-S605 PolarHBondContact O-N 3.48Å; L602-S605 PolarHBondContact O-OG 3.27Å; I603-S605 VanDerWaalsContact C-N 3.29Å; I603-S605 PolarHBondContact O-N 2.93Å
606	G	85.2	Confident	87.2	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.01	24%	0.241	C	C	.	.			trans	111.8	155.6	-176.5	0	0	0	0	0	111.2	W577 W581 L602 I603 R604	W577-G606 WeakPolarHBondContact CZ2-O 3.08Å; W581-G606 VanDerWaalsContact CZ2-O 3.32Å; W581-G606 WeakPolarHBondContact CZ2-O 3.21Å; W581-G606 PolarHBondContact NE1-O 2.93Å; W581-G606 VanDerWaalsContact NE1-O 3.08Å; L602-G606 PolarHBondContact O-N 2.91Å; L602-G606 VanDerWaalsContact O-O 3.12Å; I603-G606 WeakPolarHBondContact O-CA 3.35Å; I603-G606 PolarHBondContact O-N 3.41Å; R604-G606 PolarHBondContact O-N 3.35Å
607	V	88	Confident	87.7	Confident	6 Å²	6	47.3 Å²	47.3	4%	0.036	24%	0.242	C	C	.	.			trans	-105.4	130.8	172.3	-174.2	0	0	0	0	109.8	W581 I603 R612 V615 D798	W581-V607 HydrophobicContact CH2-CB 4.35Å; W581-V607 HydrophobicContact CH2-CG1 4.1Å; W581-V607 HydrophobicContact CH2-CG2 3.77Å; W581-V607 HydrophobicContact CZ2-CB 4.17Å; W581-V607 HydrophobicContact CZ2-CG1 4.27Å; W581-V607 HydrophobicContact CZ2-CG2 3.75Å; W581-V607 HydrophobicContact CZ3-CG1 4.5Å; I603-V607 HydrophobicContact CG1-CG2 3.98Å; V607-R612 HydrophobicContact CG1-CB 4.25Å; V607-V615 HydrophobicContact CG1-CB 4.3Å; V607-V615 HydrophobicContact CG1-CG2 4.09Å; V607-D798 WeakPolarHBondContact CB-OD2 3.2Å; V607-D798 HydrophobicContact CG2-CB 3.67Å; V607-D798 VanDerWaalsContact CG2-CG 3.41Å; V607-D798 WeakPolarHBondContact CG2-OD2 3.07Å; V607-D798 PolarHBondContact N-OD2 3.23Å
608	P	87.4	Confident	88.1	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.019	22%	0.216	C	C	.	.			trans	-57.3	139.6	171.6	-23.3	31.3	0	0	0	111.5	W577 L578 W581 S610 Y611 R612	W577-P608 HydrophobicContact CE3-CG 4.4Å; W577-P608 HydrophobicContact CH2-CB 3.97Å; W577-P608 HydrophobicContact CH2-CG 3.44Å; W577-P608 VanDerWaalsContact CH2-CG 3.44Å; W577-P608 HydrophobicContact CZ2-CG 3.91Å; W577-P608 HydrophobicContact CZ3-CB 4.19Å; W577-P608 HydrophobicContact CZ3-CG 3.69Å; L578-P608 HydrophobicContact CD1-CB 4.15Å; L578-P608 HydrophobicContact CD1-CG 3.98Å; W581-P608 HydrophobicContact CB-CG 4.15Å; W581-P608 HydrophobicContact CD2-CG 4.25Å; W581-P608 HydrophobicContact CG-CG 3.74Å; P608-S610 VanDerWaalsContact C-N 3.27Å; P608-S610 PolarHBondContact O-N 3.31Å; P608-Y611 HydrophobicContact CB-CD2 3.83Å; P608-Y611 HydrophobicContact CB-CE2 4.45Å; P608-Y611 HydrophobicContact CB-CG 4.38Å; P608-Y611 HydrophobicContact CG-CD2 3.75Å; P608-Y611 HydrophobicContact CG-CE2 4.35Å; P608-Y611 PolarHBondContact O-N 2.88Å; P608-R612 PolarHBondContact O-N 2.78Å; P608-R612 VanDerWaalsContact O-N 3.09Å
609	H	83	Confident	88.5	Confident	84 Å²	84	37.9 Å²	37.9	39%	0.389	19%	0.19	S	C	.	.	H	α-helix	trans	-55.3	-42.4	-177.7	173.7	93.1	0	0	0	112.3	L530 Y611 R612 Y713	L530-H609 VanDerWaalsContact CD2-CE1 3.49Å; L530-H609 WeakPolarHBondContact CD2-CE1 3.4Å; H609-Y611 PolarHBondContact O-N 3.12Å; H609-R612 PolarHBondContact O-N 3.46Å; H609-Y713 AromaticContact CE1-CE1 3.63Å; H609-Y713 AromaticContact CE1-CZ 3.94Å; H609-Y713 AromaticContact ND1-CE1 3.72Å; H609-Y713 AromaticContact ND1-CZ 3.83Å; H609-Y713 PolarHBondContact ND1-OH 2.92Å
610	S	85.4	Confident	88.9	Confident	81 Å²	81	38 Å²	38	57%	0.566	19%	0.191	S	C	*	.	H	α-helix	trans	-60.8	-27	177.9	49.3	0	0	0	0	113.9	P608	P608-S610 VanDerWaalsContact C-N 3.27Å; P608-S610 PolarHBondContact O-N 3.31Å
611	Y	89.3	Confident	89.1	Confident	60 Å²	60	36.8 Å²	36.8	24%	0.235	19%	0.186	C	C	.	.	H	α-helix	trans	-100.9	-12.8	-176.3	-59.3	-30.2	0	0	0	113.7	L578 W581 D582 L585 P608 H609 S613 R614 V615	L578-Y611 HydrophobicContact CD1-CE2 3.86Å; W581-Y611 HydrophobicContact CB-CD2 4.07Å; W581-Y611 HydrophobicContact CB-CE2 4.11Å; D582-Y611 WeakPolarHBondContact OD1-CE2 3.36Å; D582-Y611 PolarHBondContact OD1-OH 2.83Å; L585-Y611 HydrophobicContact CD1-CD1 3.75Å; L585-Y611 HydrophobicContact CD1-CD2 3.48Å; L585-Y611 VanDerWaalsContact CD1-CD2 3.48Å; L585-Y611 HydrophobicContact CD1-CE1 4.21Å; L585-Y611 HydrophobicContact CD1-CE2 3.94Å; L585-Y611 HydrophobicContact CD1-CG 3.39Å; P608-Y611 HydrophobicContact CB-CD2 3.83Å; P608-Y611 HydrophobicContact CB-CE2 4.45Å; P608-Y611 HydrophobicContact CB-CG 4.38Å; P608-Y611 HydrophobicContact CG-CD2 3.75Å; P608-Y611 HydrophobicContact CG-CE2 4.35Å; P608-Y611 PolarHBondContact O-N 2.88Å; H609-Y611 PolarHBondContact O-N 3.12Å; Y611-S613 VanDerWaalsContact C-N 3.33Å; Y611-S613 PolarHBondContact O-N 3.4Å; Y611-R614 PolarHBondContact O-N 3.32Å; Y611-R614 VanDerWaalsContact O-N 3.1Å; Y611-V615 WeakPolarHBondContact O-CG2 3.49Å; Y611-V615 PolarHBondContact O-N 2.98Å
612	R	91.6	Very high	89.4	Confident	11 Å²	11	36.3 Å²	36.3	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-58.1	-42.4	-176.6	-168.9	173.7	-95.3	143.1	-2.9	112.5	V607 P608 H609 R614 V615 W616 Y713 L794 N795 D798	V607-R612 HydrophobicContact CG1-CB 4.25Å; P608-R612 PolarHBondContact O-N 2.78Å; P608-R612 VanDerWaalsContact O-N 3.09Å; H609-R612 PolarHBondContact O-N 3.46Å; R612-R614 VanDerWaalsContact C-N 3.34Å; R612-R614 PolarHBondContact O-N 2.95Å; R612-V615 PolarHBondContact O-N 3.24Å; R612-W616 VanDerWaalsContact CD-CZ2 3.46Å; R612-W616 HydrophobicContact CG-CD2 3.81Å; R612-W616 HydrophobicContact CG-CG 4.04Å; R612-W616 HydrophobicContact CG-CZ2 3.81Å; R612-W616 VanDerWaalsContact CG-NE1 3.3Å; R612-W616 VanDerWaalsContact O-CB 3.26Å; R612-W616 WeakPolarHBondContact O-CB 3.39Å; R612-W616 VanDerWaalsContact O-CG 3.29Å; R612-W616 PolarHBondContact O-N 3.29Å; R612-Y713 HydrophobicContact CB-CD1 3.96Å; R612-Y713 HydrophobicContact CB-CE1 3.83Å; R612-Y713 HydrophobicContact CG-CD1 4.13Å; R612-Y713 HydrophobicContact CG-CD2 4.46Å; R612-Y713 HydrophobicContact CG-CE1 4.09Å; R612-Y713 HydrophobicContact CG-CE2 4.42Å; R612-Y713 HydrophobicContact CG-CG 4.29Å; R612-Y713 PolarHBondContact NH1-OH 3.2Å; R612-L794 PolarHBondContact NH2-O 3.48Å; R612-N795 PolarHBondContact NH2-OD1 3.18Å; R612-D798 IonicContact CZ-OD1 3.86Å; R612-D798 IonicContact CZ-OD2 3.88Å; R612-D798 IonicContact NE-OD1 3.94Å; R612-D798 PolarHBondContact NE-OD1 3.41Å; R612-D798 IonicContact NE-OD2 3.86Å; R612-D798 PolarHBondContact NE-OD2 3.49Å; R612-D798 IonicContact NH2-OD1 3.39Å; R612-D798 IonicContact NH2-OD2 3.73Å; R612-D798 PolarHBondContact NH2-OD2 3.06Å
613	S	92	Very high	89.6	Confident	48 Å²	48	39 Å²	39	34%	0.336	19%	0.186	S	C	.	.	H	α-helix	trans	-56.1	-44.9	175.1	-66.9	0	0	0	0	113.1	Y611 K617 Y713	Y611-S613 VanDerWaalsContact C-N 3.33Å; Y611-S613 PolarHBondContact O-N 3.4Å; S613-K617 VanDerWaalsContact O-CB 3.25Å; S613-K617 WeakPolarHBondContact O-CB 3.29Å; S613-K617 PolarHBondContact O-N 3.38Å; S613-Y713 VanDerWaalsContact CB-O 3.22Å; S613-Y713 WeakPolarHBondContact CB-O 3.34Å; S613-Y713 PolarHBondContact OG-O 2.95Å
614	R	91.1	Very high	89.8	Confident	90 Å²	90	39 Å²	39	34%	0.34	19%	0.186	S	C	.	.	H	α-helix	trans	-70.7	-49.6	179.3	179.3	173.6	171.4	-163.2	-10.4	111.2	L585 F588 A589 Y611 R612 W616 K617 D618	L585-R614 PolarHBondContact O-NH2 2.72Å; F588-R614 PolarHBondContact O-NH2 3.43Å; A589-R614 VanDerWaalsContact CA-NH2 3.33Å; Y611-R614 PolarHBondContact O-N 3.32Å; Y611-R614 VanDerWaalsContact O-N 3.1Å; R612-R614 VanDerWaalsContact C-N 3.34Å; R612-R614 PolarHBondContact O-N 2.95Å; R614-W616 PolarHBondContact O-N 3.11Å; R614-K617 PolarHBondContact O-N 2.83Å; R614-D618 IonicContact NE-OD2 3.37Å; R614-D618 PolarHBondContact O-N 3.21Å
615	V	91.2	Very high	90	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-46.5	-178.3	173.6	0	0	0	0	111.1	W581 L585 M593 I603 V607 Y611 R612 D618 L619	W581-V615 HydrophobicContact CH2-CG2 4.31Å; W581-V615 HydrophobicContact CZ3-CG2 3.77Å; L585-V615 HydrophobicContact CD2-CG2 4.29Å; M593-V615 HydrophobicContact CE-CG1 4.31Å; M593-V615 HydrophobicContact CE-CG2 4.32Å; M593-V615 HydrophobicContact SD-CG2 4.28Å; I603-V615 HydrophobicContact CD1-CG1 4.15Å; V607-V615 HydrophobicContact CG1-CB 4.3Å; V607-V615 HydrophobicContact CG1-CG2 4.09Å; Y611-V615 WeakPolarHBondContact O-CG2 3.49Å; Y611-V615 PolarHBondContact O-N 2.98Å; R612-V615 PolarHBondContact O-N 3.24Å; V615-D618 PolarHBondContact O-N 3.26Å; V615-L619 HydrophobicContact CG1-CD1 3.96Å; V615-L619 HydrophobicContact CG1-CG 4.45Å; V615-L619 WeakPolarHBondContact O-CB 3.26Å; V615-L619 VanDerWaalsContact O-CG 3.26Å; V615-L619 WeakPolarHBondContact O-CG 3.28Å; V615-L619 PolarHBondContact O-N 2.99Å
616	W	94.7	Very high	90.3	Very high	1 Å²	1	46.2 Å²	46.2	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-63.3	-45	178.7	-74.2	14.4	0	0	0	111.3	R612 R614 D618 L619 I620 V709 Y713 L714 L794 W797 D798 L801	R612-W616 VanDerWaalsContact CD-CZ2 3.46Å; R612-W616 HydrophobicContact CG-CD2 3.81Å; R612-W616 HydrophobicContact CG-CG 4.04Å; R612-W616 HydrophobicContact CG-CZ2 3.81Å; R612-W616 VanDerWaalsContact CG-NE1 3.3Å; R612-W616 VanDerWaalsContact O-CB 3.26Å; R612-W616 WeakPolarHBondContact O-CB 3.39Å; R612-W616 VanDerWaalsContact O-CG 3.29Å; R612-W616 PolarHBondContact O-N 3.29Å; R614-W616 PolarHBondContact O-N 3.11Å; W616-D618 PolarHBondContact O-N 3.37Å; W616-L619 PolarHBondContact O-N 2.97Å; W616-I620 HydrophobicContact CB-CD1 4.44Å; W616-I620 WeakPolarHBondContact O-CB 3.49Å; W616-I620 VanDerWaalsContact O-CD1 3.27Å; W616-I620 WeakPolarHBondContact O-CD1 3.21Å; W616-I620 WeakPolarHBondContact O-CG1 3.38Å; W616-I620 PolarHBondContact O-N 3.31Å; W616-V709 HydrophobicContact CH2-CG1 3.93Å; W616-V709 HydrophobicContact CZ3-CG1 4.11Å; W616-Y713 HydrophobicContact CE3-CD2 4.15Å; W616-Y713 HydrophobicContact CE3-CG 4.37Å; W616-Y713 AromaticContact CH2-CD2 3.93Å; W616-Y713 HydrophobicContact CH2-CD2 3.93Å; W616-Y713 HydrophobicContact CH2-CE2 4.24Å; W616-Y713 AromaticContact CZ3-CD2 3.63Å; W616-Y713 HydrophobicContact CZ3-CD2 3.63Å; W616-Y713 HydrophobicContact CZ3-CE2 4.4Å; W616-Y713 HydrophobicContact CZ3-CG 4.29Å; W616-L714 HydrophobicContact CB-CD2 4.12Å; W616-L794 HydrophobicContact CH2-CD2 3.81Å; W616-L794 HydrophobicContact CZ2-CD2 4.43Å; W616-W797 HydrophobicContact CH2-CB 3.94Å; W616-W797 HydrophobicContact CH2-CD2 4.21Å; W616-W797 AromaticContact CH2-CE3 3.84Å; W616-W797 HydrophobicContact CH2-CE3 3.84Å; W616-W797 HydrophobicContact CH2-CG 4.29Å; W616-W797 HydrophobicContact CZ2-CB 3.6Å; W616-W797 HydrophobicContact CZ2-CE3 4.35Å; W616-W797 HydrophobicContact CZ2-CG 4.41Å; W616-W797 AromaticContact CZ3-CE3 3.99Å; W616-W797 HydrophobicContact CZ3-CE3 3.99Å; W616-W797 HydrophobicContact CZ3-CZ3 4.47Å; W616-D798 PolarHBondContact NE1-OD1 2.91Å; W616-L801 HydrophobicContact CB-CD1 4.02Å; W616-L801 HydrophobicContact CD2-CD1 3.59Å; W616-L801 HydrophobicContact CE3-CD1 4.25Å; W616-L801 HydrophobicContact CG-CD1 3.47Å; W616-L801 VanDerWaalsContact CG-CD1 3.47Å
617	K	93	Very high	90.4	Very high	75 Å²	75	48.6 Å²	48.6	33%	0.326	23%	0.226	S	C	.	.	H	α-helix	trans	-57.1	-49	177.1	-178.5	172.1	-177.9	143.8	0	111.8	S613 R614 L619 I620 H621 L714 D718	S613-K617 VanDerWaalsContact O-CB 3.25Å; S613-K617 WeakPolarHBondContact O-CB 3.29Å; S613-K617 PolarHBondContact O-N 3.38Å; R614-K617 PolarHBondContact O-N 2.83Å; K617-L619 PolarHBondContact O-N 3.49Å; K617-I620 PolarHBondContact O-N 2.83Å; K617-H621 VanDerWaalsContact CE-CE1 3.47Å; K617-H621 WeakPolarHBondContact CE-CE1 3.46Å; K617-H621 WeakPolarHBondContact O-CB 3.48Å; K617-H621 PolarHBondContact O-CD2 3.47Å; K617-H621 PolarHBondContact O-N 3.36Å; K617-L714 HydrophobicContact CB-CD2 4.01Å; K617-D718 WeakPolarHBondContact CE-OD1 3.28Å; K617-D718 WeakPolarHBondContact CE-OD2 3.43Å; K617-D718 IonicContact NZ-OD1 3.38Å; K617-D718 PolarHBondContact NZ-OD1 3.49Å; K617-D718 IonicContact NZ-OD2 3.46Å; K617-D718 PolarHBondContact NZ-OD2 3.4Å
618	D	91.5	Very high	90.4	Very high	24 Å²	24	50.8 Å²	50.8	13%	0.128	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-40.4	-178.8	-68.3	-18.9	0	0	0	111.7	M593 R614 V615 W616 Y622	M593-D618 HydrophobicContact CB-CB 3.9Å; M593-D618 HydrophobicContact CG-CB 3.83Å; M593-D618 HydrophobicContact SD-CB 3.97Å; R614-D618 IonicContact NE-OD2 3.37Å; R614-D618 PolarHBondContact O-N 3.21Å; V615-D618 PolarHBondContact O-N 3.26Å; W616-D618 PolarHBondContact O-N 3.37Å; D618-Y622 WeakPolarHBondContact O-CB 3.47Å; D618-Y622 PolarHBondContact O-N 3.29Å
619	L	92.6	Very high	90.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-44.1	175.4	-70.2	173.9	0	0	0	112	L599 I603 V615 W616 K617 Y622 W623 L801 L802	L599-L619 HydrophobicContact CD2-CD2 4.37Å; I603-L619 HydrophobicContact CD1-CD1 3.94Å; V615-L619 HydrophobicContact CG1-CD1 3.96Å; V615-L619 HydrophobicContact CG1-CG 4.45Å; V615-L619 WeakPolarHBondContact O-CB 3.26Å; V615-L619 VanDerWaalsContact O-CG 3.26Å; V615-L619 WeakPolarHBondContact O-CG 3.28Å; V615-L619 PolarHBondContact O-N 2.99Å; W616-L619 PolarHBondContact O-N 2.97Å; K617-L619 PolarHBondContact O-N 3.49Å; L619-Y622 WeakPolarHBondContact O-CB 3.49Å; L619-Y622 PolarHBondContact O-N 3.18Å; L619-W623 PolarHBondContact O-N 3.3Å; L619-W623 VanDerWaalsContact O-N 3.12Å; L619-L801 HydrophobicContact CD1-CB 3.99Å; L619-L802 HydrophobicContact CD1-CB 4.42Å; L619-L802 HydrophobicContact CD2-CD1 3.75Å
620	I	93.9	Very high	90.7	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-46.4	178.8	-70.4	158.6	0	0	0	110.5	W616 K617 Y622 W623 V624 L714 W721 A722 A725 L801	W616-I620 HydrophobicContact CB-CD1 4.44Å; W616-I620 WeakPolarHBondContact O-CB 3.49Å; W616-I620 VanDerWaalsContact O-CD1 3.27Å; W616-I620 WeakPolarHBondContact O-CD1 3.21Å; W616-I620 WeakPolarHBondContact O-CG1 3.38Å; W616-I620 PolarHBondContact O-N 3.31Å; K617-I620 PolarHBondContact O-N 2.83Å; I620-Y622 PolarHBondContact O-N 2.85Å; I620-W623 PolarHBondContact O-N 2.93Å; I620-W623 VanDerWaalsContact O-N 3.1Å; I620-V624 WeakPolarHBondContact O-CG2 3.07Å; I620-V624 PolarHBondContact O-N 3.14Å; I620-L714 HydrophobicContact CD1-CD1 3.33Å; I620-W721 HydrophobicContact CG2-CB 3.95Å; I620-A722 HydrophobicContact CD1-CB 3.38Å; I620-A722 HydrophobicContact CG1-CB 4.13Å; I620-A722 HydrophobicContact CG2-CB 4.45Å; I620-A725 HydrophobicContact CG2-CB 4.24Å; I620-L801 HydrophobicContact CG1-CD2 4.42Å
621	H	91.6	Very high	90.9	Very high	41 Å²	41	56.3 Å²	56.3	19%	0.19	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-28.2	177.2	-77.3	-160.1	0	0	0	112.2	L592 K617 K625 D718	L592-H621 HydrophobicContact CD2-CB 4.06Å; K617-H621 VanDerWaalsContact CE-CE1 3.47Å; K617-H621 WeakPolarHBondContact CE-CE1 3.46Å; K617-H621 WeakPolarHBondContact O-CB 3.48Å; K617-H621 PolarHBondContact O-CD2 3.47Å; K617-H621 PolarHBondContact O-N 3.36Å; H621-K625 WeakPolarHBondContact O-CA 3.35Å; H621-K625 VanDerWaalsContact O-CB 3.31Å; H621-K625 WeakPolarHBondContact O-CB 3.46Å; H621-K625 PolarHBondContact O-N 3.34Å; H621-D718 IonicContact CD2-OD1 3.5Å; H621-D718 IonicContact CE1-OD1 3.62Å; H621-D718 IonicContact NE2-OD1 2.61Å; H621-D718 PolarHBondContact NE2-OD1 2.94Å
622	Y	91.4	Very high	90.6	Very high	91 Å²	91	54.8 Å²	54.8	36%	0.357	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-45.3	170.7	173.6	-91.8	0	0	0	111.9	V594 P595 D618 L619 I620	V594-Y622 HydrophobicContact CG1-CE2 4.31Å; P595-Y622 VanDerWaalsContact CD-CZ 3.41Å; P595-Y622 HydrophobicContact CG-CD1 4.08Å; P595-Y622 HydrophobicContact CG-CE1 3.59Å; P595-Y622 HydrophobicContact CG-CE2 4.43Å; D618-Y622 WeakPolarHBondContact O-CB 3.47Å; D618-Y622 PolarHBondContact O-N 3.29Å; L619-Y622 WeakPolarHBondContact O-CB 3.49Å; L619-Y622 PolarHBondContact O-N 3.18Å; I620-Y622 PolarHBondContact O-N 2.85Å
623	W	91.9	Very high	90.2	Very high	75 Å²	75	61.2 Å²	61.2	28%	0.284	32%	0.316	S	S	.	.	H	α-helix	trans	-67	-42.3	-179.9	-74	112.3	0	0	0	113.3	L619 I620 A725 H729 L730 L801	L619-W623 PolarHBondContact O-N 3.3Å; L619-W623 VanDerWaalsContact O-N 3.12Å; I620-W623 PolarHBondContact O-N 2.93Å; I620-W623 VanDerWaalsContact O-N 3.1Å; W623-A725 HydrophobicContact CB-CB 4.1Å; W623-H729 HydrophobicContact CE3-CB 3.97Å; W623-L730 HydrophobicContact CD2-CD2 4.11Å; W623-L730 VanDerWaalsContact CE2-CD2 3.46Å; W623-L730 HydrophobicContact CH2-CD2 4.27Å; W623-L730 HydrophobicContact CZ2-CD2 3.56Å; W623-L801 PolarHBondContact NE1-O 3.3Å
624	V	91.7	Very high	89.9	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.012	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	19.7	-172	-159.4	0	0	0	0	112.1	I620 E626 E627 L628 W721 V724 A725	I620-V624 WeakPolarHBondContact O-CG2 3.07Å; I620-V624 PolarHBondContact O-N 3.14Å; V624-E626 VanDerWaalsContact C-N 3.29Å; V624-E626 PolarHBondContact O-N 3.49Å; V624-E627 WeakPolarHBondContact CA-OE2 3.44Å; V624-E627 HydrophobicContact CG1-CB 3.67Å; V624-E627 HydrophobicContact CG1-CG 4.19Å; V624-L628 WeakPolarHBondContact O-CB 3.27Å; V624-L628 PolarHBondContact O-N 3.17Å; V624-W721 HydrophobicContact CB-CE3 4.28Å; V624-W721 HydrophobicContact CG1-CD2 4.36Å; V624-W721 HydrophobicContact CG1-CE3 3.37Å; V624-W721 HydrophobicContact CG1-CZ3 3.48Å; V624-W721 VanDerWaalsContact CG1-CZ3 3.48Å; V624-V724 HydrophobicContact CG1-CG1 4.14Å; V624-A725 HydrophobicContact CG2-CB 3.55Å
625	K	89.9	Confident	89.9	Confident	130 Å²	130	58.6 Å²	58.6	57%	0.565	31%	0.308	S	S	*	.	H	α-helix	trans	-60.4	-39.8	-174.3	-172.7	-176.8	172.4	-169.9	0	112.1	H621 S629	H621-K625 WeakPolarHBondContact O-CA 3.35Å; H621-K625 VanDerWaalsContact O-CB 3.31Å; H621-K625 WeakPolarHBondContact O-CB 3.46Å; H621-K625 PolarHBondContact O-N 3.34Å; K625-S629 WeakPolarHBondContact O-CB 3.32Å; K625-S629 PolarHBondContact O-N 2.92Å; K625-S629 PolarHBondContact O-OG 2.86Å
626	E	89.3	Confident	90	Very high	144 Å²	144	59.3 Å²	59.3	67%	0.673	31%	0.311	S	S	*	.	H	α-helix	trans	-71.2	-51.5	-176.9	-64.2	-172.1	170	0	0	109.9	V624 L628 S629 D630	V624-E626 VanDerWaalsContact C-N 3.29Å; V624-E626 PolarHBondContact O-N 3.49Å; E626-L628 VanDerWaalsContact C-N 3.34Å; E626-L628 PolarHBondContact O-N 3.02Å; E626-S629 WeakPolarHBondContact O-CA 3.37Å; E626-S629 WeakPolarHBondContact O-CB 3.48Å; E626-S629 PolarHBondContact O-N 3.44Å; E626-S629 PolarHBondContact O-OG 2.91Å; E626-D630 PolarHBondContact O-N 3.24Å
627	E	88.2	Confident	89.9	Confident	51 Å²	51	59.8 Å²	59.8	24%	0.238	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-43	178.3	-64.8	70	-160.3	0	0	111.5	V624 S629 D630 V631 W721 H729	V624-E627 WeakPolarHBondContact CA-OE2 3.44Å; V624-E627 HydrophobicContact CG1-CB 3.67Å; V624-E627 HydrophobicContact CG1-CG 4.19Å; E627-S629 PolarHBondContact O-N 3.03Å; E627-D630 PolarHBondContact O-N 2.88Å; E627-D630 VanDerWaalsContact O-N 3.15Å; E627-V631 WeakPolarHBondContact O-CG2 3.38Å; E627-V631 PolarHBondContact O-N 3.44Å; E627-W721 HydrophobicContact CB-CZ3 4.41Å; E627-H729 VanDerWaalsContact CD-CE1 3.43Å; E627-H729 IonicContact OE1-CE1 3.68Å; E627-H729 PolarHBondContact OE1-CE1 2.99Å; E627-H729 IonicContact OE1-NE2 2.61Å; E627-H729 PolarHBondContact OE1-NE2 3.35Å; E627-H729 IonicContact OE2-CE1 2.7Å; E627-H729 PolarHBondContact OE2-CE1 3.32Å; E627-H729 IonicContact OE2-NE2 3.59Å
628	L	88.1	Confident	89.9	Confident	53 Å²	53	59 Å²	59	28%	0.277	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-35.1	177.2	-172.7	67.7	0	0	0	111.4	V624 E626 G632 W721	V624-L628 WeakPolarHBondContact O-CB 3.27Å; V624-L628 PolarHBondContact O-N 3.17Å; E626-L628 VanDerWaalsContact C-N 3.34Å; E626-L628 PolarHBondContact O-N 3.02Å; L628-G632 PolarHBondContact O-N 3.45Å; L628-W721 HydrophobicContact CD1-CD2 4.39Å; L628-W721 HydrophobicContact CD1-CH2 4.23Å; L628-W721 HydrophobicContact CD1-CZ2 3.42Å; L628-W721 VanDerWaalsContact CD1-CZ2 3.42Å
629	S	88.3	Confident	89.9	Confident	89 Å²	89	58.2 Å²	58.2	62%	0.622	32%	0.315	S	S	*	.	H	α-helix	trans	-72.4	-32.5	175.9	75.2	0	0	0	0	113	K625 E626 E627	K625-S629 WeakPolarHBondContact O-CB 3.32Å; K625-S629 PolarHBondContact O-N 2.92Å; K625-S629 PolarHBondContact O-OG 2.86Å; E626-S629 WeakPolarHBondContact O-CA 3.37Å; E626-S629 WeakPolarHBondContact O-CB 3.48Å; E626-S629 PolarHBondContact O-N 3.44Å; E626-S629 PolarHBondContact O-OG 2.91Å; E627-S629 PolarHBondContact O-N 3.03Å
630	D	88.8	Confident	89.9	Confident	136 Å²	136	58.8 Å²	58.8	73%	0.727	32%	0.318	S	S	*	.	H	α-helix	trans	-76.7	-43.7	-179.8	-74.6	-15.8	0	0	0	112.7	E626 E627	E626-D630 PolarHBondContact O-N 3.24Å; E627-D630 PolarHBondContact O-N 2.88Å; E627-D630 VanDerWaalsContact O-N 3.15Å
631	V	88.1	Confident	89.7	Confident	59 Å²	59	65 Å²	65	36%	0.358	34%	0.342	S	S	.	.	H	α-helix	trans	-83	-26.9	-178.1	-56.1	0	0	0	0	113.4	E627 Y635 W721	E627-V631 WeakPolarHBondContact O-CG2 3.38Å; E627-V631 PolarHBondContact O-N 3.44Å; V631-Y635 HydrophobicContact CB-CD1 4.2Å; V631-Y635 HydrophobicContact CB-CD2 3.72Å; V631-Y635 HydrophobicContact CB-CE2 4.21Å; V631-Y635 HydrophobicContact CB-CG 3.72Å; V631-Y635 HydrophobicContact CG1-CD1 4.37Å; V631-Y635 HydrophobicContact CG1-CD2 4.09Å; V631-Y635 HydrophobicContact CG1-CE1 4.32Å; V631-Y635 HydrophobicContact CG1-CE2 4.06Å; V631-Y635 HydrophobicContact CG1-CG 4.25Å; V631-Y635 HydrophobicContact CG2-CD1 3.76Å; V631-Y635 HydrophobicContact CG2-CD2 4.1Å; V631-Y635 HydrophobicContact CG2-CE1 4.47Å; V631-Y635 HydrophobicContact CG2-CG 3.53Å; V631-W721 HydrophobicContact CG2-CH2 3.66Å; V631-W721 HydrophobicContact CG2-CZ2 3.92Å
632	G	83	Confident	89.6	Confident	28 Å²	28	67.5 Å²	67.5	29%	0.289	35%	0.353	S	S	.	.			trans	75	-178.6	-178.8	0	0	0	0	0	115.5	L628	L628-G632 PolarHBondContact O-N 3.45Å
633	T	83	Confident	89.5	Confident	146 Å²	146	63.1 Å²	63.1	90%	0.896	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	136.2	-174.3	57.5	0	0	0	0	112.4
634	G	86.1	Confident	89.2	Confident	29 Å²	29	64.1 Å²	64.1	30%	0.299	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	9.5	176.6	0	0	0	0	0	114.6	A637 C638	G634-A637 PolarHBondContact O-N 2.81Å; G634-C638 PolarHBondContact O-N 2.81Å
635	Y	92.1	Very high	88.9	Confident	54 Å²	54	66.2 Å²	66.2	21%	0.212	36%	0.362	C	S	.	.	H	α-helix	trans	-55.8	-49.4	174.9	179.6	-114.7	0	0	0	112.2	V631 A637 C638 L639 H693 F720 W721	V631-Y635 HydrophobicContact CB-CD1 4.2Å; V631-Y635 HydrophobicContact CB-CD2 3.72Å; V631-Y635 HydrophobicContact CB-CE2 4.21Å; V631-Y635 HydrophobicContact CB-CG 3.72Å; V631-Y635 HydrophobicContact CG1-CD1 4.37Å; V631-Y635 HydrophobicContact CG1-CD2 4.09Å; V631-Y635 HydrophobicContact CG1-CE1 4.32Å; V631-Y635 HydrophobicContact CG1-CE2 4.06Å; V631-Y635 HydrophobicContact CG1-CG 4.25Å; V631-Y635 HydrophobicContact CG2-CD1 3.76Å; V631-Y635 HydrophobicContact CG2-CD2 4.1Å; V631-Y635 HydrophobicContact CG2-CE1 4.47Å; V631-Y635 HydrophobicContact CG2-CG 3.53Å; Y635-A637 VanDerWaalsContact C-N 3.33Å; Y635-A637 PolarHBondContact O-N 3.48Å; Y635-C638 WeakPolarHBondContact O-CA 3.45Å; Y635-C638 VanDerWaalsContact O-CB 3.27Å; Y635-C638 WeakPolarHBondContact O-CB 3.35Å; Y635-C638 PolarHBondContact O-N 2.86Å; Y635-L639 HydrophobicContact CD1-CD1 3.87Å; Y635-L639 HydrophobicContact CD1-CG 4.49Å; Y635-L639 HydrophobicContact CE1-CD1 3.36Å; Y635-L639 HydrophobicContact CE1-CG 4.14Å; Y635-L639 HydrophobicContact CE2-CD1 4.32Å; Y635-L639 HydrophobicContact CE2-CD2 4.28Å; Y635-L639 HydrophobicContact CE2-CG 4.24Å; Y635-L639 PolarHBondContact O-N 3.46Å; Y635-H693 AromaticContact CE1-ND1 3.39Å; Y635-H693 WeakPolarHBondContact CE1-ND1 3.43Å; Y635-H693 AromaticContact CZ-ND1 3.55Å; Y635-H693 PolarHBondContact OH-ND1 3.12Å; Y635-F720 HydrophobicContact CD1-CE1 4.15Å; Y635-F720 HydrophobicContact CD1-CZ 4.33Å; Y635-F720 HydrophobicContact CE1-CE1 4.26Å; Y635-F720 HydrophobicContact CE1-CZ 4.03Å; Y635-W721 AromaticContact CD1-CH2 3.8Å; Y635-W721 HydrophobicContact CD1-CH2 3.8Å; Y635-W721 AromaticContact CD1-CZ2 3.91Å; Y635-W721 HydrophobicContact CD1-CZ2 3.91Å; Y635-W721 HydrophobicContact CE1-CH2 4.28Å
636	F	92.8	Very high	88.6	Confident	15 Å²	15	62.1 Å²	62.1	7%	0.066	35%	0.346	C	S	.	.	H	α-helix	trans	-56.2	-44.7	176.3	173.3	-112.1	0	0	0	112.7	C638 L639 C640 V686 A689 E716 E717 F720	F636-C638 VanDerWaalsContact C-N 3.27Å; F636-C638 PolarHBondContact O-N 3.17Å; F636-L639 PolarHBondContact O-N 2.87Å; F636-C640 VanDerWaalsContact CE2-SG 3.53Å; F636-C640 WeakPolarHBondContact CZ-SG 3.39Å; F636-C640 PolarHBondContact O-N 3.3Å; F636-C640 PolarHBondContact O-SG 3.37Å; F636-V686 HydrophobicContact CE2-CG2 4.26Å; F636-V686 HydrophobicContact CZ-CG2 4.1Å; F636-A689 HydrophobicContact CD2-CB 3.74Å; F636-A689 HydrophobicContact CE2-CB 3.56Å; F636-E716 HydrophobicContact CE1-CB 3.93Å; F636-E716 HydrophobicContact CZ-CB 4.11Å; F636-E717 HydrophobicContact CB-CB 4.49Å; F636-E717 HydrophobicContact CB-CG 3.97Å; F636-E717 HydrophobicContact CD1-CB 3.88Å; F636-E717 HydrophobicContact CD1-CG 4.28Å; F636-E717 HydrophobicContact CE1-CB 4.48Å; F636-E717 HydrophobicContact CG-CB 4.33Å; F636-E717 HydrophobicContact CG-CG 4.33Å; F636-F720 HydrophobicContact CB-CD1 4.22Å; F636-F720 HydrophobicContact CD2-CB 3.53Å; F636-F720 AromaticContact CD2-CD1 3.9Å; F636-F720 HydrophobicContact CD2-CD1 3.9Å; F636-F720 AromaticContact CD2-CD2 3.84Å; F636-F720 HydrophobicContact CD2-CD2 3.84Å; F636-F720 AromaticContact CD2-CG 3.46Å; F636-F720 HydrophobicContact CD2-CG 3.46Å; F636-F720 VanDerWaalsContact CD2-CG 3.46Å; F636-F720 HydrophobicContact CE2-CB 3.66Å; F636-F720 HydrophobicContact CE2-CD2 4.2Å; F636-F720 AromaticContact CE2-CG 3.99Å; F636-F720 HydrophobicContact CE2-CG 3.99Å; F636-F720 HydrophobicContact CG-CB 4.35Å; F636-F720 HydrophobicContact CG-CD1 4.42Å; F636-F720 HydrophobicContact CG-CG 4.35Å
637	A	92	Very high	88.2	Confident	10 Å²	10	57.8 Å²	57.8	8%	0.083	33%	0.331	C	S	.	.	H	α-helix	trans	-64.4	-33.1	178	0	0	0	0	0	112.3	G634 Y635 R641	G634-A637 PolarHBondContact O-N 2.81Å; Y635-A637 VanDerWaalsContact C-N 3.33Å; Y635-A637 PolarHBondContact O-N 3.48Å; A637-R641 WeakPolarHBondContact O-CG 3.49Å; A637-R641 PolarHBondContact O-N 3.35Å
638	C	92.9	Very high	87.7	Confident	60 Å²	60	60.5 Å²	60.5	41%	0.405	36%	0.356	S	S	.	.	H	α-helix	trans	-66.2	-49.5	173.3	-164.7	0	0	0	0	111.3	G634 Y635 F636 C640 R641 Q642	G634-C638 PolarHBondContact O-N 2.81Å; Y635-C638 WeakPolarHBondContact O-CA 3.45Å; Y635-C638 VanDerWaalsContact O-CB 3.27Å; Y635-C638 WeakPolarHBondContact O-CB 3.35Å; Y635-C638 PolarHBondContact O-N 2.86Å; F636-C638 VanDerWaalsContact C-N 3.27Å; F636-C638 PolarHBondContact O-N 3.17Å; C638-C640 VanDerWaalsContact C-N 3.32Å; C638-C640 PolarHBondContact O-N 2.96Å; C638-R641 PolarHBondContact O-N 2.89Å; C638-R641 VanDerWaalsContact O-N 3.15Å; C638-Q642 PolarHBondContact O-N 2.85Å
639	L	92.6	Very high	87.3	Confident	7 Å²	7	66.1 Å²	66.1	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-59.3	-41.4	177.7	-68.5	176.8	0	0	0	112.2	Y635 F636 R641 Q642 A643 A689 Q692 H693 F720	Y635-L639 HydrophobicContact CD1-CD1 3.87Å; Y635-L639 HydrophobicContact CD1-CG 4.49Å; Y635-L639 HydrophobicContact CE1-CD1 3.36Å; Y635-L639 HydrophobicContact CE1-CG 4.14Å; Y635-L639 HydrophobicContact CE2-CD1 4.32Å; Y635-L639 HydrophobicContact CE2-CD2 4.28Å; Y635-L639 HydrophobicContact CE2-CG 4.24Å; Y635-L639 PolarHBondContact O-N 3.46Å; F636-L639 PolarHBondContact O-N 2.87Å; L639-R641 PolarHBondContact O-N 3.38Å; L639-Q642 PolarHBondContact O-N 3.27Å; L639-A643 VanDerWaalsContact O-CB 3.31Å; L639-A643 WeakPolarHBondContact O-CB 3.46Å; L639-A643 PolarHBondContact O-N 3.42Å; L639-A689 HydrophobicContact CB-CB 3.89Å; L639-A689 HydrophobicContact CD1-CB 4.47Å; L639-Q692 HydrophobicContact CD2-CB 3.88Å; L639-H693 HydrophobicContact CD1-CB 3.92Å; L639-F720 HydrophobicContact CD1-CE1 4.39Å; L639-F720 HydrophobicContact CD1-CE2 3.83Å; L639-F720 HydrophobicContact CD1-CZ 3.53Å
640	C	91.8	Very high	86.7	Confident	13 Å²	13	65.4 Å²	65.4	9%	0.088	38%	0.376	C	S	.	.	H	α-helix	trans	-58.4	-46.4	175.4	-71.5	0	0	0	0	111.8	F636 C638 A643 M644	F636-C640 VanDerWaalsContact CE2-SG 3.53Å; F636-C640 WeakPolarHBondContact CZ-SG 3.39Å; F636-C640 PolarHBondContact O-N 3.3Å; F636-C640 PolarHBondContact O-SG 3.37Å; C638-C640 VanDerWaalsContact C-N 3.32Å; C638-C640 PolarHBondContact O-N 2.96Å; C640-A643 PolarHBondContact O-N 2.87Å; C640-M644 WeakPolarHBondContact O-CB 3.4Å; C640-M644 VanDerWaalsContact O-CG 3.26Å; C640-M644 WeakPolarHBondContact O-CG 3.37Å; C640-M644 PolarHBondContact O-N 3.19Å
641	R	90.9	Very high	86.1	Confident	132 Å²	132	66.2 Å²	66.2	50%	0.498	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-43.1	177.8	-73.1	-173.3	-67.2	-100.6	2.9	111.8	A637 C638 L639 M644 A645	A637-R641 WeakPolarHBondContact O-CG 3.49Å; A637-R641 PolarHBondContact O-N 3.35Å; C638-R641 PolarHBondContact O-N 2.89Å; C638-R641 VanDerWaalsContact O-N 3.15Å; L639-R641 PolarHBondContact O-N 3.38Å; R641-M644 PolarHBondContact O-N 3.4Å; R641-A645 PolarHBondContact O-N 3.13Å
642	Q	89.2	Confident	85.9	Confident	93 Å²	93	64.5 Å²	64.5	44%	0.435	36%	0.359	S	S	.	.	H	α-helix	trans	-64	-45.5	177.7	-179.4	175.2	-9.5	0	0	111.5	C638 L639 M644 A645 I646	C638-Q642 PolarHBondContact O-N 2.85Å; L639-Q642 PolarHBondContact O-N 3.27Å; Q642-M644 PolarHBondContact O-N 3.02Å; Q642-A645 PolarHBondContact O-N 2.86Å; Q642-I646 HydrophobicContact CG-CD1 3.87Å; Q642-I646 WeakPolarHBondContact O-CG1 3.49Å; Q642-I646 PolarHBondContact O-N 3.08Å
643	A	88.7	Confident	86.1	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-62.4	-42.1	178.7	0	0	0	0	0	112	L639 C640 I646 C647 F655 Y688 Q692	L639-A643 VanDerWaalsContact O-CB 3.31Å; L639-A643 WeakPolarHBondContact O-CB 3.46Å; L639-A643 PolarHBondContact O-N 3.42Å; C640-A643 PolarHBondContact O-N 2.87Å; A643-I646 PolarHBondContact O-N 3.32Å; A643-C647 VanDerWaalsContact O-CB 3.3Å; A643-C647 WeakPolarHBondContact O-CB 3.4Å; A643-C647 PolarHBondContact O-N 2.92Å; A643-F655 HydrophobicContact CB-CZ 4.05Å; A643-Y688 HydrophobicContact CB-CD2 4.38Å; A643-Q692 HydrophobicContact CB-CG 3.62Å
644	M	85.9	Confident	86.3	Confident	96 Å²	96	60.7 Å²	60.7	47%	0.473	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-39.7	176.1	-72.9	176.4	176.6	0	0	112.5	C640 R641 Q642 S648 R685	C640-M644 WeakPolarHBondContact O-CB 3.4Å; C640-M644 VanDerWaalsContact O-CG 3.26Å; C640-M644 WeakPolarHBondContact O-CG 3.37Å; C640-M644 PolarHBondContact O-N 3.19Å; R641-M644 PolarHBondContact O-N 3.4Å; Q642-M644 PolarHBondContact O-N 3.02Å; M644-S648 PolarHBondContact O-N 3.3Å; M644-S648 VanDerWaalsContact O-N 3.15Å; M644-S648 PolarHBondContact O-OG 2.85Å; M644-R685 HydrophobicContact CE-CG 3.9Å
645	A	86.2	Confident	86.6	Confident	45 Å²	45	59.5 Å²	59.5	37%	0.372	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-47.7	175.2	0	0	0	0	0	111	R641 Q642 C647 S648 E649	R641-A645 PolarHBondContact O-N 3.13Å; Q642-A645 PolarHBondContact O-N 2.86Å; A645-C647 PolarHBondContact O-N 3.16Å; A645-S648 PolarHBondContact O-N 2.9Å; A645-S648 VanDerWaalsContact O-N 3.15Å; A645-E649 WeakPolarHBondContact O-CG 3.37Å; A645-E649 PolarHBondContact O-N 2.86Å
646	I	82.7	Confident	86.5	Confident	44 Å²	44	62.3 Å²	62.3	23%	0.226	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-42.9	178.4	-66.2	165.1	0	0	0	111.3	Q642 A643 S648 E649 S650 F655	Q642-I646 HydrophobicContact CG-CD1 3.87Å; Q642-I646 WeakPolarHBondContact O-CG1 3.49Å; Q642-I646 PolarHBondContact O-N 3.08Å; A643-I646 PolarHBondContact O-N 3.32Å; I646-S648 PolarHBondContact O-N 2.6Å; I646-E649 PolarHBondContact O-N 3.06Å; I646-S650 WeakPolarHBondContact O-CA 3.42Å; I646-S650 WeakPolarHBondContact O-CB 3.22Å; I646-S650 PolarHBondContact O-N 3.32Å; I646-S650 VanDerWaalsContact O-O 3.09Å; I646-F655 HydrophobicContact CB-CE2 4.23Å; I646-F655 HydrophobicContact CG2-CE2 3.93Å
647	C	80.7	Confident	86.4	Confident	53 Å²	53	65.5 Å²	65.5	36%	0.358	35%	0.347	S	S	.	.	H	α-helix	trans	-62.2	-29	178	-173.1	0	0	0	0	112.7	A643 A645 F655 Y688	A643-C647 VanDerWaalsContact O-CB 3.3Å; A643-C647 WeakPolarHBondContact O-CB 3.4Å; A643-C647 PolarHBondContact O-N 2.92Å; A645-C647 PolarHBondContact O-N 3.16Å; C647-F655 HydrophobicContact CB-CD2 3.73Å; C647-F655 HydrophobicContact CB-CE2 3.84Å; C647-Y688 HydrophobicContact CB-CE2 4.22Å
648	S	77.7	Confident	86.4	Confident	108 Å²	108	65 Å²	65	76%	0.755	34%	0.343	S	S	*	.	H	α-helix	trans	-83	-35.4	179.2	-56	0	0	0	0	112.5	M644 A645 I646	M644-S648 PolarHBondContact O-N 3.3Å; M644-S648 VanDerWaalsContact O-N 3.15Å; M644-S648 PolarHBondContact O-OG 2.85Å; A645-S648 PolarHBondContact O-N 2.9Å; A645-S648 VanDerWaalsContact O-N 3.15Å; I646-S648 PolarHBondContact O-N 2.6Å
649	E	79.5	Confident	86.4	Confident	172 Å²	172	64.6 Å²	64.6	80%	0.804	34%	0.337	S	S	*	.	H	α-helix	trans	-95.4	-28.8	-173.4	-67.3	179.6	-178.8	0	0	113.7	A645 I646	A645-E649 WeakPolarHBondContact O-CG 3.37Å; A645-E649 PolarHBondContact O-N 2.86Å; I646-E649 PolarHBondContact O-N 3.06Å
650	S	75.4	Confident	86.3	Confident	74 Å²	74	69.4 Å²	69.4	52%	0.517	36%	0.362	S	S	.	.	S	Bend	trans	-134.2	151.7	-166.5	-174.8	0	0	0	0	112.8	I646 D652	I646-S650 WeakPolarHBondContact O-CA 3.42Å; I646-S650 WeakPolarHBondContact O-CB 3.22Å; I646-S650 PolarHBondContact O-N 3.32Å; I646-S650 VanDerWaalsContact O-O 3.09Å; S650-D652 PolarHBondContact O-N 3.38Å
651	Y	77.5	Confident	86.3	Confident	153 Å²	153	68.9 Å²	68.9	60%	0.6	36%	0.358	S	S	*	.			trans	-86.8	99.3	174.2	179.7	-119	0	0	0	111	K656	Y651-K656 HydrophobicContact CD2-CD 4.47Å; Y651-K656 HydrophobicContact CE2-CD 3.47Å; Y651-K656 VanDerWaalsContact CE2-CD 3.47Å; Y651-K656 HydrophobicContact CE2-CG 3.97Å
652	D	83.9	Confident	86.4	Confident	23 Å²	23	62.7 Å²	62.7	12%	0.123	34%	0.335	C	S	.	.			trans	-99	117.5	169	-168	-17.3	0	0	0	110.5	S650 A654 F655 R691	S650-D652 PolarHBondContact O-N 3.38Å; D652-A654 PolarHBondContact O-N 2.93Å; D652-A654 WeakPolarHBondContact OD1-CB 3.39Å; D652-A654 PolarHBondContact OD1-N 3.03Å; D652-F655 HydrophobicContact CB-CB 4.44Å; D652-F655 HydrophobicContact CB-CD2 3.66Å; D652-F655 HydrophobicContact CB-CE2 4.08Å; D652-F655 HydrophobicContact CB-CG 4.03Å; D652-F655 PolarHBondContact O-N 3.32Å; D652-R691 IonicContact OD1-CZ 3.07Å; D652-R691 IonicContact OD1-NE 2.95Å; D652-R691 IonicContact OD1-NH2 2.9Å; D652-R691 PolarHBondContact OD1-NH2 2.94Å; D652-R691 IonicContact OD2-CZ 3.92Å; D652-R691 IonicContact OD2-NE 3.76Å; D652-R691 PolarHBondContact OD2-NE 3.48Å; D652-R691 VanDerWaalsContact OD2-NE 3.14Å; D652-R691 IonicContact OD2-NH2 2.69Å; D652-R691 PolarHBondContact OD2-NH2 3.41Å
653	P	86.3	Confident	86.3	Confident	82 Å²	82	62.2 Å²	62.2	53%	0.532	34%	0.339	S	S	.	.	H	α-helix	trans	-60.2	-28.4	176.2	25	-35.2	0	0	0	113.2	K656 Q657	P653-K656 PolarHBondContact O-N 3.34Å; P653-Q657 PolarHBondContact O-N 3.22Å; P653-Q657 VanDerWaalsContact O-N 3.08Å
654	A	88.3	Confident	86.3	Confident	11 Å²	11	66.6 Å²	66.6	9%	0.091	36%	0.355	C	S	.	.	H	α-helix	trans	-66.3	-40.3	179	0	0	0	0	0	111.9	D652 Q657 I658 R691	D652-A654 PolarHBondContact O-N 2.93Å; D652-A654 WeakPolarHBondContact OD1-CB 3.39Å; D652-A654 PolarHBondContact OD1-N 3.03Å; A654-Q657 PolarHBondContact O-N 2.96Å; A654-I658 VanDerWaalsContact O-CG1 3.29Å; A654-I658 WeakPolarHBondContact O-CG1 3.04Å; A654-I658 PolarHBondContact O-N 3.4Å; A654-R691 HydrophobicContact CB-CG 4.13Å; A654-R691 VanDerWaalsContact CB-NE 3.33Å
655	F	91.1	Very high	86.5	Confident	5 Å²	5	62 Å²	62	2%	0.022	33%	0.333	C	S	.	.	H	α-helix	trans	-64	-42.4	177.6	-65.6	-22.5	0	0	0	112	A643 I646 C647 D652 Q657 I658 D659 Y688 R691	A643-F655 HydrophobicContact CB-CZ 4.05Å; I646-F655 HydrophobicContact CB-CE2 4.23Å; I646-F655 HydrophobicContact CG2-CE2 3.93Å; C647-F655 HydrophobicContact CB-CD2 3.73Å; C647-F655 HydrophobicContact CB-CE2 3.84Å; D652-F655 HydrophobicContact CB-CB 4.44Å; D652-F655 HydrophobicContact CB-CD2 3.66Å; D652-F655 HydrophobicContact CB-CE2 4.08Å; D652-F655 HydrophobicContact CB-CG 4.03Å; D652-F655 PolarHBondContact O-N 3.32Å; F655-Q657 VanDerWaalsContact C-N 3.32Å; F655-Q657 PolarHBondContact O-N 3.29Å; F655-I658 HydrophobicContact CD1-CD1 4.29Å; F655-I658 WeakPolarHBondContact O-CB 3.26Å; F655-I658 PolarHBondContact O-N 2.93Å; F655-D659 VanDerWaalsContact O-CG 3.29Å; F655-D659 PolarHBondContact O-N 3.2Å; F655-Y688 HydrophobicContact CB-CE1 4.01Å; F655-Y688 HydrophobicContact CB-CE2 4.49Å; F655-Y688 AromaticContact CD1-CD1 3.66Å; F655-Y688 HydrophobicContact CD1-CD1 3.66Å; F655-Y688 HydrophobicContact CD1-CD2 4.19Å; F655-Y688 AromaticContact CD1-CE1 3.77Å; F655-Y688 HydrophobicContact CD1-CE1 3.77Å; F655-Y688 HydrophobicContact CD1-CE2 4.28Å; F655-Y688 AromaticContact CD1-CG 3.89Å; F655-Y688 HydrophobicContact CD1-CG 3.89Å; F655-Y688 HydrophobicContact CE1-CD1 4.05Å; F655-Y688 HydrophobicContact CE1-CD2 4.17Å; F655-Y688 AromaticContact CE1-CG 3.85Å; F655-Y688 HydrophobicContact CE1-CG 3.85Å; F655-Y688 HydrophobicContact CG-CD1 4.39Å; F655-Y688 HydrophobicContact CG-CE1 4.09Å; F655-Y688 HydrophobicContact CG-CE2 4.21Å; F655-Y688 HydrophobicContact CZ-CD2 4.47Å; F655-R691 HydrophobicContact CD1-CG 4.33Å; F655-R691 HydrophobicContact CE1-CB 4.14Å; F655-R691 HydrophobicContact CE1-CG 3.77Å
656	K	89.5	Confident	86.6	Confident	113 Å²	113	60.4 Å²	60.4	49%	0.491	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-40.7	173.5	-75.2	-158.1	-179.2	156.2	0	112.6	Y651 P653 I658 D659 L660	Y651-K656 HydrophobicContact CD2-CD 4.47Å; Y651-K656 HydrophobicContact CE2-CD 3.47Å; Y651-K656 VanDerWaalsContact CE2-CD 3.47Å; Y651-K656 HydrophobicContact CE2-CG 3.97Å; P653-K656 PolarHBondContact O-N 3.34Å; K656-I658 VanDerWaalsContact C-N 3.33Å; K656-D659 PolarHBondContact O-N 2.86Å; K656-L660 VanDerWaalsContact O-CG 3.3Å; K656-L660 WeakPolarHBondContact O-CG 3.29Å; K656-L660 PolarHBondContact O-N 2.98Å
657	Q	91.5	Very high	86.6	Confident	81 Å²	81	60.5 Å²	60.5	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-66.7	-37.9	178	-168.6	60.6	49.2	0	0	111.6	P653 A654 F655 L660 D661 Y699	P653-Q657 PolarHBondContact O-N 3.22Å; P653-Q657 VanDerWaalsContact O-N 3.08Å; A654-Q657 PolarHBondContact O-N 2.96Å; F655-Q657 VanDerWaalsContact C-N 3.32Å; F655-Q657 PolarHBondContact O-N 3.29Å; Q657-L660 PolarHBondContact O-N 3.22Å; Q657-D661 PolarHBondContact NE2-OD1 3.04Å; Q657-D661 WeakPolarHBondContact O-CB 3.35Å; Q657-D661 VanDerWaalsContact O-CG 3.28Å; Q657-D661 PolarHBondContact O-N 3.04Å; Q657-Y699 HydrophobicContact CB-CD1 4.13Å; Q657-Y699 HydrophobicContact CB-CE1 4.31Å; Q657-Y699 HydrophobicContact CG-CD1 3.97Å; Q657-Y699 HydrophobicContact CG-CE1 3.84Å
658	I	93.2	Very high	86.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-58.4	-53.2	172	-71	162	0	0	0	109.5	A654 F655 K656 L660 D661 L662 L687 Y688 Y699	A654-I658 VanDerWaalsContact O-CG1 3.29Å; A654-I658 WeakPolarHBondContact O-CG1 3.04Å; A654-I658 PolarHBondContact O-N 3.4Å; F655-I658 HydrophobicContact CD1-CD1 4.29Å; F655-I658 WeakPolarHBondContact O-CB 3.26Å; F655-I658 PolarHBondContact O-N 2.93Å; K656-I658 VanDerWaalsContact C-N 3.33Å; I658-L660 VanDerWaalsContact C-N 3.29Å; I658-L660 PolarHBondContact O-N 3.08Å; I658-D661 CarbonylContact O-C 3.58Å; I658-D661 WeakPolarHBondContact O-CA 3.5Å; I658-D661 PolarHBondContact O-N 2.61Å; I658-L662 HydrophobicContact CG2-CD1 4.27Å; I658-L662 HydrophobicContact CG2-CD2 4.5Å; I658-L662 HydrophobicContact CG2-CG 4.19Å; I658-L662 WeakPolarHBondContact O-CG 3.48Å; I658-L662 PolarHBondContact O-N 2.87Å; I658-L687 HydrophobicContact CD1-CB 3.93Å; I658-L687 HydrophobicContact CG1-CB 4.22Å; I658-L687 HydrophobicContact CG2-CB 3.94Å; I658-L687 HydrophobicContact CG2-CD1 3.75Å; I658-Y688 HydrophobicContact CB-CD1 4.43Å; I658-Y688 HydrophobicContact CB-CE1 3.99Å; I658-Y688 HydrophobicContact CD1-CD1 3.81Å; I658-Y688 HydrophobicContact CD1-CE1 4.12Å; I658-Y688 HydrophobicContact CG2-CD1 4Å; I658-Y688 HydrophobicContact CG2-CE1 3.69Å; I658-Y699 HydrophobicContact CD1-CD2 3.83Å; I658-Y699 HydrophobicContact CD1-CE2 4.43Å; I658-Y699 HydrophobicContact CD1-CG 3.98Å; I658-Y699 HydrophobicContact CG1-CD1 3.85Å; I658-Y699 HydrophobicContact CG1-CD2 3.35Å; I658-Y699 HydrophobicContact CG1-CE1 4.04Å; I658-Y699 HydrophobicContact CG1-CE2 3.57Å; I658-Y699 HydrophobicContact CG1-CG 3.5Å
659	D	91	Very high	87	Confident	52 Å²	52	58.7 Å²	58.7	28%	0.278	30%	0.295	S	S	.	.	H	α-helix	trans	-59.4	-38.5	-177.5	-63.3	-24.6	0	0	0	112.8	F655 K656 D661 R684 Y688	F655-D659 VanDerWaalsContact O-CG 3.29Å; F655-D659 PolarHBondContact O-N 3.2Å; K656-D659 PolarHBondContact O-N 2.86Å; D659-D661 VanDerWaalsContact C-N 3.32Å; D659-R684 IonicContact OD1-NE 3.25Å; D659-Y688 VanDerWaalsContact CG-OH 3.29Å; D659-Y688 PolarHBondContact OD1-OH 3.2Å; D659-Y688 PolarHBondContact OD2-OH 3.06Å; D659-Y688 VanDerWaalsContact OD2-OH 3.12Å
660	L	90.6	Very high	87.2	Confident	108 Å²	108	57.8 Å²	57.8	57%	0.565	29%	0.285	S	S	*	.	H	α-helix	trans	-67.2	-32	174	-71	173.6	0	0	0	113	K656 Q657 I658 T663	K656-L660 VanDerWaalsContact O-CG 3.3Å; K656-L660 WeakPolarHBondContact O-CG 3.29Å; K656-L660 PolarHBondContact O-N 2.98Å; Q657-L660 PolarHBondContact O-N 3.22Å; I658-L660 VanDerWaalsContact C-N 3.29Å; I658-L660 PolarHBondContact O-N 3.08Å; L660-T663 PolarHBondContact O-OG1 2.79Å
661	D	92.8	Very high	87.8	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-81	-29.2	179.2	-76.7	-2	0	0	0	112.2	Q657 I658 D659 T663 R664 T665 Y699 N704	Q657-D661 PolarHBondContact NE2-OD1 3.04Å; Q657-D661 WeakPolarHBondContact O-CB 3.35Å; Q657-D661 VanDerWaalsContact O-CG 3.28Å; Q657-D661 PolarHBondContact O-N 3.04Å; I658-D661 CarbonylContact O-C 3.58Å; I658-D661 WeakPolarHBondContact O-CA 3.5Å; I658-D661 PolarHBondContact O-N 2.61Å; D659-D661 VanDerWaalsContact C-N 3.32Å; D661-T663 VanDerWaalsContact C-N 3.3Å; D661-T663 PolarHBondContact O-N 2.93Å; D661-R664 VanDerWaalsContact CG-NH2 3.31Å; D661-R664 WeakPolarHBondContact O-CG 3.23Å; D661-R664 PolarHBondContact O-N 2.84Å; D661-R664 VanDerWaalsContact O-N 3.16Å; D661-R664 IonicContact OD1-CZ 3.65Å; D661-R664 VanDerWaalsContact OD1-CZ 3.25Å; D661-R664 IonicContact OD1-NE 3.09Å; D661-R664 PolarHBondContact OD1-NE 2.93Å; D661-R664 IonicContact OD1-NH2 2.87Å; D661-R664 PolarHBondContact OD1-NH2 3.19Å; D661-R664 IonicContact OD2-NH2 3.24Å; D661-T665 PolarHBondContact O-N 3.45Å; D661-T665 PolarHBondContact O-OG1 3.05Å; D661-Y699 VanDerWaalsContact CB-OH 3.3Å; D661-Y699 WeakPolarHBondContact CB-OH 3.37Å; D661-Y699 VanDerWaalsContact OD2-CE1 3.31Å; D661-Y699 WeakPolarHBondContact OD2-CE1 3.4Å; D661-Y699 PolarHBondContact OD2-OH 2.71Å; D661-N704 HydrophobicContact CB-CB 4.49Å
662	L	92.3	Very high	88.2	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-42.2	176.6	-69.9	179.1	0	0	0	111.7	I658 R664 T665 V680 L683 R684 L687	I658-L662 HydrophobicContact CG2-CD1 4.27Å; I658-L662 HydrophobicContact CG2-CD2 4.5Å; I658-L662 HydrophobicContact CG2-CG 4.19Å; I658-L662 WeakPolarHBondContact O-CG 3.48Å; I658-L662 PolarHBondContact O-N 2.87Å; L662-R664 PolarHBondContact O-N 3.08Å; L662-T665 PolarHBondContact O-N 2.82Å; L662-V680 HydrophobicContact CB-CG1 4.36Å; L662-V680 HydrophobicContact CD1-CG1 4.31Å; L662-L683 HydrophobicContact CD2-CB 4.17Å; L662-L683 HydrophobicContact CD2-CD2 3.45Å; L662-L683 VanDerWaalsContact CD2-CD2 3.45Å; L662-L683 HydrophobicContact CD2-CG 3.52Å; L662-R684 HydrophobicContact CD1-CB 3.66Å; L662-R684 HydrophobicContact CD1-CG 3.8Å; L662-L687 HydrophobicContact CD2-CD1 4.13Å
663	T	87.2	Confident	88.1	Confident	83 Å²	83	51.6 Å²	51.6	51%	0.509	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.5	-178.9	62	0	0	0	0	114.2	L660 D661 L675	L660-T663 PolarHBondContact O-OG1 2.79Å; D661-T663 VanDerWaalsContact C-N 3.3Å; D661-T663 PolarHBondContact O-N 2.93Å; T663-L675 HydrophobicContact CG2-CD1 3.94Å; T663-L675 HydrophobicContact CG2-CD2 3.64Å; T663-L675 HydrophobicContact CG2-CG 3.9Å
664	R	88.7	Confident	87.7	Confident	91 Å²	91	51.5 Å²	51.5	34%	0.343	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	7.1	-176.1	61.8	-178.6	-172.4	115.5	-6.3	113.2	D661 L662 Q701 R705	D661-R664 VanDerWaalsContact CG-NH2 3.31Å; D661-R664 WeakPolarHBondContact O-CG 3.23Å; D661-R664 PolarHBondContact O-N 2.84Å; D661-R664 VanDerWaalsContact O-N 3.16Å; D661-R664 IonicContact OD1-CZ 3.65Å; D661-R664 VanDerWaalsContact OD1-CZ 3.25Å; D661-R664 IonicContact OD1-NE 3.09Å; D661-R664 PolarHBondContact OD1-NE 2.93Å; D661-R664 IonicContact OD1-NH2 2.87Å; D661-R664 PolarHBondContact OD1-NH2 3.19Å; D661-R664 IonicContact OD2-NH2 3.24Å; L662-R664 PolarHBondContact O-N 3.08Å; R664-Q701 VanDerWaalsContact NH2-NE2 3.13Å; R664-R705 PolarHBondContact O-NH2 3.44Å
665	T	90.6	Very high	87.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-86.4	116.6	-175.9	-59.8	0	0	0	0	110.5	D661 L662 F672 L683 N704 A708	D661-T665 PolarHBondContact O-N 3.45Å; D661-T665 PolarHBondContact O-OG1 3.05Å; L662-T665 PolarHBondContact O-N 2.82Å; T665-F672 VanDerWaalsContact O-CB 3.22Å; T665-F672 WeakPolarHBondContact O-CB 3.47Å; T665-L683 HydrophobicContact CG2-CD2 3.89Å; T665-N704 HydrophobicContact CG2-CB 4.33Å; T665-N704 PolarHBondContact OG1-ND2 2.67Å; T665-A708 HydrophobicContact CG2-CB 3.54Å
666	L	87.9	Confident	86.7	Confident	12 Å²	12	62.5 Å²	62.5	6%	0.063	30%	0.296	C	S	.	.	S	Bend	trans	46.6	52.9	-179.5	-62.9	-178.6	0	0	0	114.5	H668 N669 F672 A708 V709 V785	L666-H668 PolarHBondContact O-N 2.95Å; L666-N669 HydrophobicContact CB-CB 4.27Å; L666-N669 WeakPolarHBondContact O-CB 3.17Å; L666-N669 PolarHBondContact O-N 3.08Å; L666-F672 HydrophobicContact CB-CB 4.37Å; L666-F672 HydrophobicContact CB-CD2 4.02Å; L666-F672 HydrophobicContact CB-CG 4.45Å; L666-F672 HydrophobicContact CD1-CD2 4.17Å; L666-F672 HydrophobicContact CD1-CE2 4.14Å; L666-A708 HydrophobicContact CD1-CB 3.77Å; L666-A708 HydrophobicContact CG-CB 4.35Å; L666-V709 HydrophobicContact CD1-CG2 4.19Å; L666-V785 HydrophobicContact CD2-CG1 3.71Å
667	P	82.7	Confident	86.4	Confident	46 Å²	46	57.8 Å²	57.8	30%	0.299	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.2	-175.2	28.4	-36.7	0	0	0	113.5	N669	P667-N669 PolarHBondContact O-N 3Å
668	H	81.5	Confident	86.1	Confident	122 Å²	122	60.9 Å²	60.9	57%	0.565	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	8.6	175.6	-55.5	-53.7	0	0	0	113.5	F532 Y533 L666	F532-H668 WeakPolarHBondContact CA-O 3.39Å; Y533-H668 VanDerWaalsContact CD2-O 3.29Å; Y533-H668 WeakPolarHBondContact CD2-O 3.46Å; Y533-H668 PolarHBondContact N-O 3.41Å; L666-H668 PolarHBondContact O-N 2.95Å
669	N	85.8	Confident	86.1	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-120.2	129.2	178.2	-170.2	-65.3	0	0	0	110.2	L530 G531 F532 L666 P667 Y671 F672 E673	L530-N669 PolarHBondContact O-ND2 2.61Å; G531-N669 CarbonylContact O-C 3.42Å; G531-N669 WeakPolarHBondContact O-CA 3.43Å; F532-N669 HydrophobicContact CD1-CB 3.79Å; F532-N669 WeakPolarHBondContact CD1-ND2 3.42Å; F532-N669 WeakPolarHBondContact CD2-ND2 3.29Å; F532-N669 HydrophobicContact CE1-CB 3.81Å; F532-N669 WeakPolarHBondContact CE1-ND2 3.18Å; F532-N669 WeakPolarHBondContact CE2-ND2 3.32Å; F532-N669 HydrophobicContact CG-CB 4.48Å; F532-N669 HydrophobicContact CZ-CB 4.5Å; F532-N669 WeakPolarHBondContact CZ-ND2 3.41Å; L666-N669 HydrophobicContact CB-CB 4.27Å; L666-N669 WeakPolarHBondContact O-CB 3.17Å; L666-N669 PolarHBondContact O-N 3.08Å; P667-N669 PolarHBondContact O-N 3Å; N669-Y671 PolarHBondContact O-N 3.11Å; N669-Y671 VanDerWaalsContact O-N 3.15Å; N669-Y671 WeakPolarHBondContact OD1-CB 3.37Å; N669-Y671 WeakPolarHBondContact OD1-CD2 3.37Å; N669-Y671 PolarHBondContact OD1-N 3.07Å; N669-F672 HydrophobicContact CB-CD2 4.26Å; N669-F672 CarbonylContact O-C 3.39Å; N669-F672 PolarHBondContact O-N 3.08Å; N669-E673 PolarHBondContact O-N 3.43Å
670	R	83.9	Confident	86.1	Confident	154 Å²	154	60.5 Å²	60.5	58%	0.581	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-53.4	-33.9	179.1	176.1	-178.6	173.4	-179.3	-0.6	114	T527 G531 Y533 F672	T527-R670 HydrophobicContact CG2-CB 3.82Å; G531-R670 WeakPolarHBondContact O-CB 3.44Å; G531-R670 PolarHBondContact O-N 3.29Å; Y533-R670 HydrophobicContact CE1-CB 4.11Å; Y533-R670 VanDerWaalsContact OH-CA 3.26Å; Y533-R670 WeakPolarHBondContact OH-CA 3.33Å; Y533-R670 WeakPolarHBondContact OH-CB 3.29Å; R670-F672 PolarHBondContact O-N 2.81Å
671	Y	86.6	Confident	86.3	Confident	63 Å²	63	59 Å²	59	25%	0.247	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-72.4	-10.6	-180	-59.8	-62.6	0	0	0	113.6	L530 N669 A677 E678 K679 L712	L530-Y671 WeakPolarHBondContact O-CD2 3.42Å; L530-Y671 VanDerWaalsContact O-CE2 3.26Å; L530-Y671 WeakPolarHBondContact O-CE2 3.43Å; N669-Y671 PolarHBondContact O-N 3.11Å; N669-Y671 VanDerWaalsContact O-N 3.15Å; N669-Y671 WeakPolarHBondContact OD1-CB 3.37Å; N669-Y671 WeakPolarHBondContact OD1-CD2 3.37Å; N669-Y671 PolarHBondContact OD1-N 3.07Å; Y671-A677 WeakPolarHBondContact O-CB 3.44Å; Y671-E678 HydrophobicContact CD1-CB 4.47Å; Y671-K679 HydrophobicContact CD1-CD 4.25Å; Y671-K679 HydrophobicContact CD1-CG 4.28Å; Y671-K679 HydrophobicContact CD2-CD 4.36Å; Y671-K679 HydrophobicContact CG-CD 3.87Å; Y671-K679 HydrophobicContact CG-CG 4.22Å; Y671-K679 PolarHBondContact O-N 3.31Å; Y671-L712 HydrophobicContact CD2-CD2 3.98Å
672	F	87.3	Confident	86.4	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.018	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-137	13.9	-177.9	-52.2	-76.9	0	0	0	113.9	T665 L666 N669 R670 D674 K679 V680 L683 A708 L711 L712	T665-F672 VanDerWaalsContact O-CB 3.22Å; T665-F672 WeakPolarHBondContact O-CB 3.47Å; L666-F672 HydrophobicContact CB-CB 4.37Å; L666-F672 HydrophobicContact CB-CD2 4.02Å; L666-F672 HydrophobicContact CB-CG 4.45Å; L666-F672 HydrophobicContact CD1-CD2 4.17Å; L666-F672 HydrophobicContact CD1-CE2 4.14Å; N669-F672 HydrophobicContact CB-CD2 4.26Å; N669-F672 CarbonylContact O-C 3.39Å; N669-F672 PolarHBondContact O-N 3.08Å; R670-F672 PolarHBondContact O-N 2.81Å; F672-D674 PolarHBondContact O-N 3.49Å; F672-K679 HydrophobicContact CD1-CB 4.14Å; F672-K679 HydrophobicContact CE1-CB 3.5Å; F672-K679 VanDerWaalsContact CE1-CB 3.5Å; F672-K679 HydrophobicContact CZ-CB 3.72Å; F672-K679 HydrophobicContact CZ-CD 4.14Å; F672-V680 HydrophobicContact CB-CG2 4.46Å; F672-V680 HydrophobicContact CD1-CG2 4.12Å; F672-L683 HydrophobicContact CD1-CD2 3.99Å; F672-L683 HydrophobicContact CE1-CB 4.16Å; F672-L683 HydrophobicContact CE1-CD2 3.84Å; F672-A708 HydrophobicContact CE1-CB 4.11Å; F672-A708 HydrophobicContact CE2-CB 4.12Å; F672-A708 HydrophobicContact CZ-CB 3.81Å; F672-L711 HydrophobicContact CZ-CB 4.38Å; F672-L712 HydrophobicContact CE2-CD2 3.86Å; F672-L712 HydrophobicContact CE2-CG 4.39Å
673	E	80.9	Confident	86.6	Confident	53 Å²	53	59.6 Å²	59.6	25%	0.248	28%	0.283	C	S	.	.	S	Bend	trans	-62.2	-42.3	-174.5	-177.2	-172.6	174.3	0	0	112.2	K523 Y533 N669	K523-E673 IonicContact NZ-OE1 3.52Å; K523-E673 PolarHBondContact NZ-OE1 2.98Å; Y533-E673 HydrophobicContact CE2-CB 4.36Å; Y533-E673 HydrophobicContact CE2-CG 4.28Å; Y533-E673 PolarHBondContact OH-OE2 3.37Å; N669-E673 PolarHBondContact O-N 3.43Å
674	D	78.8	Confident	87	Confident	80 Å²	80	58.8 Å²	58.8	43%	0.428	27%	0.27	S	S	.	.	S	Bend	trans	-133.2	170	-178.7	68.5	18.5	0	0	0	111.8	F672 H676 A677 V680	F672-D674 PolarHBondContact O-N 3.49Å; D674-H676 PolarHBondContact O-N 2.85Å; D674-H676 VanDerWaalsContact O-N 3.09Å; D674-H676 WeakPolarHBondContact OD1-CA 3.15Å; D674-H676 PolarHBondContact OD1-N 2.82Å; D674-A677 VanDerWaalsContact O-CB 3.27Å; D674-A677 WeakPolarHBondContact O-CB 3.47Å; D674-A677 PolarHBondContact O-N 3.2Å; D674-A677 VanDerWaalsContact O-N 3.1Å; D674-A677 WeakPolarHBondContact OD1-CA 3.39Å; D674-A677 WeakPolarHBondContact OD1-CB 3.28Å; D674-A677 PolarHBondContact OD1-N 3.11Å; D674-V680 WeakPolarHBondContact O-CG2 3.44Å
675	L	79.7	Confident	87.3	Confident	75 Å²	75	57.7 Å²	57.7	39%	0.393	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.5	178.4	-75.5	175	0	0	0	113.9	T663 V680	T663-L675 HydrophobicContact CG2-CD1 3.94Å; T663-L675 HydrophobicContact CG2-CD2 3.64Å; T663-L675 HydrophobicContact CG2-CG 3.9Å; L675-V680 HydrophobicContact CD2-CG1 4.36Å
676	H	77.5	Confident	87.6	Confident	172 Å²	172	57.7 Å²	57.7	80%	0.796	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	2.7	179.6	-60.7	-50.5	0	0	0	112.2	D674	D674-H676 PolarHBondContact O-N 2.85Å; D674-H676 VanDerWaalsContact O-N 3.09Å; D674-H676 WeakPolarHBondContact OD1-CA 3.15Å; D674-H676 PolarHBondContact OD1-N 2.82Å
677	A	83.7	Confident	88	Confident	13 Å²	13	57.2 Å²	57.2	11%	0.107	26%	0.264	C	S	.	.	S	Bend	trans	-69.7	149.2	-178.7	0	0	0	0	0	110.8	Y671 D674 K679 V680	Y671-A677 WeakPolarHBondContact O-CB 3.44Å; D674-A677 VanDerWaalsContact O-CB 3.27Å; D674-A677 WeakPolarHBondContact O-CB 3.47Å; D674-A677 PolarHBondContact O-N 3.2Å; D674-A677 VanDerWaalsContact O-N 3.1Å; D674-A677 WeakPolarHBondContact OD1-CA 3.39Å; D674-A677 WeakPolarHBondContact OD1-CB 3.28Å; D674-A677 PolarHBondContact OD1-N 3.11Å; A677-K679 VanDerWaalsContact C-N 3.26Å; A677-K679 PolarHBondContact O-N 3.12Å; A677-K679 VanDerWaalsContact O-N 3.07Å; A677-V680 HydrophobicContact CB-CG2 4.06Å; A677-V680 PolarHBondContact O-N 3.35Å; A677-V680 VanDerWaalsContact O-N 3.09Å
678	E	86.4	Confident	88.6	Confident	147 Å²	147	55.7 Å²	55.7	69%	0.687	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-38.2	-167.1	-170.7	-173.5	156.9	0	0	113.9	Y671 P682	Y671-E678 HydrophobicContact CD1-CB 4.47Å; E678-P682 VanDerWaalsContact O-CD 3.29Å; E678-P682 WeakPolarHBondContact O-CD 3.19Å; E678-P682 WeakPolarHBondContact O-CG 3.33Å
679	K	91.4	Very high	89.2	Confident	42 Å²	42	49.9 Å²	49.9	18%	0.183	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-0.3	-175.3	-64.9	-174.1	179.4	-82.8	0	114.7	Y671 F672 A677 L683 L711	Y671-K679 HydrophobicContact CD1-CD 4.25Å; Y671-K679 HydrophobicContact CD1-CG 4.28Å; Y671-K679 HydrophobicContact CD2-CD 4.36Å; Y671-K679 HydrophobicContact CG-CD 3.87Å; Y671-K679 HydrophobicContact CG-CG 4.22Å; Y671-K679 PolarHBondContact O-N 3.31Å; F672-K679 HydrophobicContact CD1-CB 4.14Å; F672-K679 HydrophobicContact CE1-CB 3.5Å; F672-K679 VanDerWaalsContact CE1-CB 3.5Å; F672-K679 HydrophobicContact CZ-CB 3.72Å; F672-K679 HydrophobicContact CZ-CD 4.14Å; A677-K679 VanDerWaalsContact C-N 3.26Å; A677-K679 PolarHBondContact O-N 3.12Å; A677-K679 VanDerWaalsContact O-N 3.07Å; K679-L683 VanDerWaalsContact O-CB 3.22Å; K679-L683 WeakPolarHBondContact O-CB 3.42Å; K679-L683 PolarHBondContact O-N 2.59Å; K679-L711 WeakPolarHBondContact CE-O 3.31Å; K679-L711 PolarHBondContact NZ-O 3.46Å
680	V	92.7	Very high	89.6	Confident	2 Å²	2	50 Å²	50	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-70.9	-43.9	-179.6	173.5	0	0	0	0	112.3	L662 F672 D674 L675 A677 L683 R684	L662-V680 HydrophobicContact CB-CG1 4.36Å; L662-V680 HydrophobicContact CD1-CG1 4.31Å; F672-V680 HydrophobicContact CB-CG2 4.46Å; F672-V680 HydrophobicContact CD1-CG2 4.12Å; D674-V680 WeakPolarHBondContact O-CG2 3.44Å; L675-V680 HydrophobicContact CD2-CG1 4.36Å; A677-V680 HydrophobicContact CB-CG2 4.06Å; A677-V680 PolarHBondContact O-N 3.35Å; A677-V680 VanDerWaalsContact O-N 3.09Å; V680-L683 WeakPolarHBondContact O-CB 3.46Å; V680-L683 PolarHBondContact O-N 3.12Å; V680-R684 PolarHBondContact O-N 3.21Å
681	E	93	Very high	90.1	Very high	76 Å²	76	44.9 Å²	44.9	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-66.1	-44.6	174.8	-71	-54.6	126.9	0	0	113.1	L683 R684 R685	E681-L683 VanDerWaalsContact C-N 3.31Å; E681-L683 PolarHBondContact O-N 3.09Å; E681-R684 WeakPolarHBondContact O-CB 3.48Å; E681-R684 PolarHBondContact O-N 3.2Å; E681-R684 IonicContact OE1-CZ 3.9Å; E681-R684 IonicContact OE1-NE 2.96Å; E681-R684 PolarHBondContact OE1-NE 3.46Å; E681-R684 IonicContact OE1-NH1 2.95Å; E681-R684 IonicContact OE1-NH2 3.97Å; E681-R684 PolarHBondContact OE1-NH2 3.13Å; E681-R684 IonicContact OE2-CZ 3.03Å; E681-R684 IonicContact OE2-NE 2.78Å; E681-R685 PolarHBondContact O-N 3.01Å
682	P	95.4	Very high	90.3	Very high	16 Å²	16	43.7 Å²	43.7	10%	0.104	20%	0.203	C	C	.	.	H	α-helix	trans	-49.9	-47.7	165.8	-32.4	37.6	0	0	0	113.6	E678 R684 R685 V686 L711 E716	E678-P682 VanDerWaalsContact O-CD 3.29Å; E678-P682 WeakPolarHBondContact O-CD 3.19Å; E678-P682 WeakPolarHBondContact O-CG 3.33Å; P682-R684 PolarHBondContact O-N 3.12Å; P682-R685 PolarHBondContact O-N 3.48Å; P682-V686 WeakPolarHBondContact O-CG2 3.46Å; P682-V686 PolarHBondContact O-N 3.15Å; P682-L711 HydrophobicContact CB-CD1 4.31Å; P682-L711 HydrophobicContact CB-CD2 4.35Å; P682-E716 HydrophobicContact CB-CG 3.84Å; P682-E716 WeakPolarHBondContact CB-OE1 3.41Å; P682-E716 WeakPolarHBondContact CG-OE1 3.33Å
683	L	96.4	Very high	90.5	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-43.6	178.3	178.3	61.6	0	0	0	112.1	L662 T665 F672 K679 V680 E681 R685 V686 L687 A707 A708 L711	L662-L683 HydrophobicContact CD2-CB 4.17Å; L662-L683 HydrophobicContact CD2-CD2 3.45Å; L662-L683 VanDerWaalsContact CD2-CD2 3.45Å; L662-L683 HydrophobicContact CD2-CG 3.52Å; T665-L683 HydrophobicContact CG2-CD2 3.89Å; F672-L683 HydrophobicContact CD1-CD2 3.99Å; F672-L683 HydrophobicContact CE1-CB 4.16Å; F672-L683 HydrophobicContact CE1-CD2 3.84Å; K679-L683 VanDerWaalsContact O-CB 3.22Å; K679-L683 WeakPolarHBondContact O-CB 3.42Å; K679-L683 PolarHBondContact O-N 2.59Å; V680-L683 WeakPolarHBondContact O-CB 3.46Å; V680-L683 PolarHBondContact O-N 3.12Å; E681-L683 VanDerWaalsContact C-N 3.31Å; E681-L683 PolarHBondContact O-N 3.09Å; L683-R685 PolarHBondContact O-N 2.91Å; L683-V686 PolarHBondContact O-N 3.14Å; L683-L687 HydrophobicContact CD1-CD1 4.01Å; L683-L687 HydrophobicContact CD1-CG 4.2Å; L683-L687 HydrophobicContact CG-CD1 4.09Å; L683-L687 WeakPolarHBondContact O-CG 2.97Å; L683-L687 PolarHBondContact O-N 3.16Å; L683-A707 HydrophobicContact CD1-CB 3.44Å; L683-A707 VanDerWaalsContact CD1-CB 3.44Å; L683-A708 HydrophobicContact CD1-CB 4.2Å; L683-A708 HydrophobicContact CD2-CB 4.05Å; L683-L711 VanDerWaalsContact CA-CD1 3.42Å; L683-L711 HydrophobicContact CB-CD1 3.68Å; L683-L711 HydrophobicContact CD1-CD1 3.95Å; L683-L711 HydrophobicContact CG-CD1 4.43Å
684	R	95.2	Very high	90.9	Very high	65 Å²	65	44.4 Å²	44.4	25%	0.245	21%	0.208	C	C	.	.	H	α-helix	trans	-57	-49.1	174.7	-168	-176.2	-53	-166	8	111.1	D659 L662 V680 E681 P682 V686 L687 Y688	D659-R684 IonicContact OD1-NE 3.25Å; L662-R684 HydrophobicContact CD1-CB 3.66Å; L662-R684 HydrophobicContact CD1-CG 3.8Å; V680-R684 PolarHBondContact O-N 3.21Å; E681-R684 WeakPolarHBondContact O-CB 3.48Å; E681-R684 PolarHBondContact O-N 3.2Å; E681-R684 IonicContact OE1-CZ 3.9Å; E681-R684 IonicContact OE1-NE 2.96Å; E681-R684 PolarHBondContact OE1-NE 3.46Å; E681-R684 IonicContact OE1-NH1 2.95Å; E681-R684 IonicContact OE1-NH2 3.97Å; E681-R684 PolarHBondContact OE1-NH2 3.13Å; E681-R684 IonicContact OE2-CZ 3.03Å; E681-R684 IonicContact OE2-NE 2.78Å; P682-R684 PolarHBondContact O-N 3.12Å; R684-V686 PolarHBondContact O-N 2.97Å; R684-L687 PolarHBondContact O-N 3.41Å; R684-Y688 HydrophobicContact CG-CD1 4.04Å; R684-Y688 HydrophobicContact CG-CE1 3.68Å; R684-Y688 HydrophobicContact CG-CE2 4.19Å; R684-Y688 HydrophobicContact CG-CG 4.43Å; R684-Y688 VanDerWaalsContact O-CB 3.27Å; R684-Y688 WeakPolarHBondContact O-CB 3.47Å; R684-Y688 VanDerWaalsContact O-CD1 3.27Å; R684-Y688 WeakPolarHBondContact O-CD1 3.42Å; R684-Y688 PolarHBondContact O-N 3.49Å
685	R	95.5	Very high	91.2	Very high	68 Å²	68	44.3 Å²	44.3	26%	0.257	21%	0.213	S	C	.	.	H	α-helix	trans	-60.9	-43.7	179.4	-73.9	-169.3	-67.6	-86.8	7.9	112.4	M644 E681 P682 L683 Y688 A689 E716	M644-R685 HydrophobicContact CE-CG 3.9Å; E681-R685 PolarHBondContact O-N 3.01Å; P682-R685 PolarHBondContact O-N 3.48Å; L683-R685 PolarHBondContact O-N 2.91Å; R685-Y688 PolarHBondContact O-N 3.44Å; R685-A689 VanDerWaalsContact O-CB 3.26Å; R685-A689 WeakPolarHBondContact O-CB 3.48Å; R685-A689 PolarHBondContact O-N 3.16Å; R685-E716 IonicContact CZ-OE1 3.19Å; R685-E716 IonicContact CZ-OE2 2.89Å; R685-E716 IonicContact NE-OE1 3.21Å; R685-E716 IonicContact NE-OE2 3.62Å; R685-E716 PolarHBondContact NE-OE2 3.1Å; R685-E716 VanDerWaalsContact NH2-CD 3.27Å; R685-E716 IonicContact NH2-OE1 3.67Å; R685-E716 PolarHBondContact NH2-OE1 3.13Å; R685-E716 IonicContact NH2-OE2 3.92Å; R685-E716 PolarHBondContact NH2-OE2 3.39Å; R685-E716 VanDerWaalsContact NH2-OE2 3.09Å
686	V	97	Very high	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-48.4	177.7	170.1	0	0	0	0	111.4	F636 P682 L683 R684 A689 Y690 A707 L711 E716 A719 F720 L723	F636-V686 HydrophobicContact CE2-CG2 4.26Å; F636-V686 HydrophobicContact CZ-CG2 4.1Å; P682-V686 WeakPolarHBondContact O-CG2 3.46Å; P682-V686 PolarHBondContact O-N 3.15Å; L683-V686 PolarHBondContact O-N 3.14Å; R684-V686 PolarHBondContact O-N 2.97Å; V686-A689 PolarHBondContact O-N 3.11Å; V686-Y690 PolarHBondContact O-N 3.32Å; V686-A707 HydrophobicContact CG1-CB 4.09Å; V686-L711 HydrophobicContact CG2-CD1 4.49Å; V686-L711 HydrophobicContact CG2-CD2 4.39Å; V686-E716 HydrophobicContact CG2-CB 4.4Å; V686-E716 WeakPolarHBondContact CG2-O 3.45Å; V686-A719 HydrophobicContact CG2-CB 4.46Å; V686-F720 HydrophobicContact CG1-CB 4.2Å; V686-L723 HydrophobicContact CG1-CD2 4.45Å
687	L	96.4	Very high	91.9	Very high	3 Å²	3	40 Å²	40	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-67.4	-38.7	180	-66.1	172.5	0	0	0	112.4	I658 L662 L683 R684 Y690 R691 Y699 L703 N704 A707 L723	I658-L687 HydrophobicContact CD1-CB 3.93Å; I658-L687 HydrophobicContact CG1-CB 4.22Å; I658-L687 HydrophobicContact CG2-CB 3.94Å; I658-L687 HydrophobicContact CG2-CD1 3.75Å; L662-L687 HydrophobicContact CD2-CD1 4.13Å; L683-L687 HydrophobicContact CD1-CD1 4.01Å; L683-L687 HydrophobicContact CD1-CG 4.2Å; L683-L687 HydrophobicContact CG-CD1 4.09Å; L683-L687 WeakPolarHBondContact O-CG 2.97Å; L683-L687 PolarHBondContact O-N 3.16Å; R684-L687 PolarHBondContact O-N 3.41Å; L687-Y690 PolarHBondContact O-N 2.89Å; L687-R691 PolarHBondContact O-N 3.03Å; L687-Y699 HydrophobicContact CD1-CE2 4.23Å; L687-Y699 HydrophobicContact CD2-CD2 4.48Å; L687-Y699 HydrophobicContact CD2-CE2 4.09Å; L687-L703 HydrophobicContact CD2-CB 4.24Å; L687-N704 HydrophobicContact CD1-CB 3.99Å; L687-A707 HydrophobicContact CD2-CB 3.81Å; L687-A707 HydrophobicContact CG-CB 4.29Å; L687-L723 HydrophobicContact CD2-CD2 4.11Å
688	Y	95	Very high	92	Very high	14 Å²	14	39.3 Å²	39.3	6%	0.055	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-44.3	175.5	-84.4	29.6	0	0	0	111.4	A643 C647 F655 I658 D659 R684 R685 Y690 R691 Q692	A643-Y688 HydrophobicContact CB-CD2 4.38Å; C647-Y688 HydrophobicContact CB-CE2 4.22Å; F655-Y688 HydrophobicContact CB-CE1 4.01Å; F655-Y688 HydrophobicContact CB-CE2 4.49Å; F655-Y688 AromaticContact CD1-CD1 3.66Å; F655-Y688 HydrophobicContact CD1-CD1 3.66Å; F655-Y688 HydrophobicContact CD1-CD2 4.19Å; F655-Y688 AromaticContact CD1-CE1 3.77Å; F655-Y688 HydrophobicContact CD1-CE1 3.77Å; F655-Y688 HydrophobicContact CD1-CE2 4.28Å; F655-Y688 AromaticContact CD1-CG 3.89Å; F655-Y688 HydrophobicContact CD1-CG 3.89Å; F655-Y688 HydrophobicContact CE1-CD1 4.05Å; F655-Y688 HydrophobicContact CE1-CD2 4.17Å; F655-Y688 AromaticContact CE1-CG 3.85Å; F655-Y688 HydrophobicContact CE1-CG 3.85Å; F655-Y688 HydrophobicContact CG-CD1 4.39Å; F655-Y688 HydrophobicContact CG-CE1 4.09Å; F655-Y688 HydrophobicContact CG-CE2 4.21Å; F655-Y688 HydrophobicContact CZ-CD2 4.47Å; I658-Y688 HydrophobicContact CB-CD1 4.43Å; I658-Y688 HydrophobicContact CB-CE1 3.99Å; I658-Y688 HydrophobicContact CD1-CD1 3.81Å; I658-Y688 HydrophobicContact CD1-CE1 4.12Å; I658-Y688 HydrophobicContact CG2-CD1 4Å; I658-Y688 HydrophobicContact CG2-CE1 3.69Å; D659-Y688 VanDerWaalsContact CG-OH 3.29Å; D659-Y688 PolarHBondContact OD1-OH 3.2Å; D659-Y688 PolarHBondContact OD2-OH 3.06Å; D659-Y688 VanDerWaalsContact OD2-OH 3.12Å; R684-Y688 HydrophobicContact CG-CD1 4.04Å; R684-Y688 HydrophobicContact CG-CE1 3.68Å; R684-Y688 HydrophobicContact CG-CE2 4.19Å; R684-Y688 HydrophobicContact CG-CG 4.43Å; R684-Y688 VanDerWaalsContact O-CB 3.27Å; R684-Y688 WeakPolarHBondContact O-CB 3.47Å; R684-Y688 VanDerWaalsContact O-CD1 3.27Å; R684-Y688 WeakPolarHBondContact O-CD1 3.42Å; R684-Y688 PolarHBondContact O-N 3.49Å; R685-Y688 PolarHBondContact O-N 3.44Å; Y688-Y690 VanDerWaalsContact C-N 3.35Å; Y688-R691 PolarHBondContact O-N 3.4Å; Y688-Q692 WeakPolarHBondContact O-CG 3.34Å; Y688-Q692 PolarHBondContact O-N 3.18Å
689	A	95.1	Very high	92.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-42.5	175.6	0	0	0	0	0	111.2	F636 L639 R685 V686 Q692 H693 F720	F636-A689 HydrophobicContact CD2-CB 3.74Å; F636-A689 HydrophobicContact CE2-CB 3.56Å; L639-A689 HydrophobicContact CB-CB 3.89Å; L639-A689 HydrophobicContact CD1-CB 4.47Å; R685-A689 VanDerWaalsContact O-CB 3.26Å; R685-A689 WeakPolarHBondContact O-CB 3.48Å; R685-A689 PolarHBondContact O-N 3.16Å; V686-A689 PolarHBondContact O-N 3.11Å; A689-Q692 WeakPolarHBondContact O-CB 3.37Å; A689-Q692 PolarHBondContact O-N 2.93Å; A689-Q692 VanDerWaalsContact O-N 3.12Å; A689-H693 PolarHBondContact O-N 3.35Å; A689-F720 HydrophobicContact CB-CD2 3.89Å; A689-F720 HydrophobicContact CB-CE2 4.04Å
690	Y	94.8	Very high	92.2	Very high	2 Å²	2	33 Å²	33	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-43.4	177	-174.6	-95.9	0	0	0	113	V686 L687 Y688 Q692 H693 N694 L703 L723 V724 I727	V686-Y690 PolarHBondContact O-N 3.32Å; L687-Y690 PolarHBondContact O-N 2.89Å; Y688-Y690 VanDerWaalsContact C-N 3.35Å; Y690-Q692 PolarHBondContact O-N 2.9Å; Y690-H693 WeakPolarHBondContact O-CB 3.09Å; Y690-H693 PolarHBondContact O-N 3Å; Y690-N694 PolarHBondContact O-N 3.38Å; Y690-L703 HydrophobicContact CD1-CD1 4.19Å; Y690-L703 HydrophobicContact CE1-CD1 4.06Å; Y690-L723 HydrophobicContact CD1-CD2 4.08Å; Y690-L723 HydrophobicContact CD2-CB 4.45Å; Y690-L723 HydrophobicContact CD2-CD2 3.95Å; Y690-L723 HydrophobicContact CD2-CG 4.02Å; Y690-L723 HydrophobicContact CE2-CG 4.46Å; Y690-L723 HydrophobicContact CG-CD2 3.58Å; Y690-L723 HydrophobicContact CG-CG 4.12Å; Y690-V724 HydrophobicContact CD2-CG2 4.01Å; Y690-V724 HydrophobicContact CE2-CG2 4.05Å; Y690-I727 HydrophobicContact CD1-CD1 4.22Å; Y690-I727 HydrophobicContact CD2-CD1 4.44Å; Y690-I727 HydrophobicContact CE1-CD1 3.47Å; Y690-I727 VanDerWaalsContact CE1-CD1 3.47Å; Y690-I727 HydrophobicContact CE2-CD1 3.76Å; Y690-I727 WeakPolarHBondContact OH-CD1 3.26Å; Y690-I727 WeakPolarHBondContact OH-CG2 3.35Å
691	R	92.8	Very high	92	Very high	47 Å²	47	38.1 Å²	38.1	18%	0.177	19%	0.187	C	C	.	.	H	α-helix	trans	-55.7	-34.6	172.9	170	57.7	173.6	179.5	-15.2	112.2	D652 A654 F655 L687 Y688 S695	D652-R691 IonicContact OD1-CZ 3.07Å; D652-R691 IonicContact OD1-NE 2.95Å; D652-R691 IonicContact OD1-NH2 2.9Å; D652-R691 PolarHBondContact OD1-NH2 2.94Å; D652-R691 IonicContact OD2-CZ 3.92Å; D652-R691 IonicContact OD2-NE 3.76Å; D652-R691 PolarHBondContact OD2-NE 3.48Å; D652-R691 VanDerWaalsContact OD2-NE 3.14Å; D652-R691 IonicContact OD2-NH2 2.69Å; D652-R691 PolarHBondContact OD2-NH2 3.41Å; A654-R691 HydrophobicContact CB-CG 4.13Å; A654-R691 VanDerWaalsContact CB-NE 3.33Å; F655-R691 HydrophobicContact CD1-CG 4.33Å; F655-R691 HydrophobicContact CE1-CB 4.14Å; F655-R691 HydrophobicContact CE1-CG 3.77Å; L687-R691 PolarHBondContact O-N 3.03Å; Y688-R691 PolarHBondContact O-N 3.4Å; R691-S695 PolarHBondContact NH1-O 3.04Å
692	Q	91.5	Very high	91.8	Very high	38 Å²	38	34.7 Å²	34.7	18%	0.178	17%	0.172	C	C	.	.	H	α-helix	trans	-79.4	-32.4	175.5	-66.2	-54.3	-54.4	0	0	113.5	L639 A643 Y688 A689 Y690	L639-Q692 HydrophobicContact CD2-CB 3.88Å; A643-Q692 HydrophobicContact CB-CG 3.62Å; Y688-Q692 WeakPolarHBondContact O-CG 3.34Å; Y688-Q692 PolarHBondContact O-N 3.18Å; A689-Q692 WeakPolarHBondContact O-CB 3.37Å; A689-Q692 PolarHBondContact O-N 2.93Å; A689-Q692 VanDerWaalsContact O-N 3.12Å; Y690-Q692 PolarHBondContact O-N 2.9Å
693	H	92.1	Very high	91.8	Very high	42 Å²	42	34 Å²	34	19%	0.194	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-48.3	175.1	179.3	64.6	0	0	0	111.3	Y635 L639 A689 Y690 F720 E728	Y635-H693 AromaticContact CE1-ND1 3.39Å; Y635-H693 WeakPolarHBondContact CE1-ND1 3.43Å; Y635-H693 AromaticContact CZ-ND1 3.55Å; Y635-H693 PolarHBondContact OH-ND1 3.12Å; L639-H693 HydrophobicContact CD1-CB 3.92Å; A689-H693 PolarHBondContact O-N 3.35Å; Y690-H693 WeakPolarHBondContact O-CB 3.09Å; Y690-H693 PolarHBondContact O-N 3Å; H693-F720 HydrophobicContact CB-CE2 4.04Å; H693-F720 HydrophobicContact CB-CZ 3.99Å; H693-F720 AromaticContact CG-CZ 3.99Å; H693-E728 IonicContact CD2-OE1 2.79Å; H693-E728 IonicContact NE2-OE1 3.48Å; H693-E728 IonicContact NE2-OE2 3.53Å
694	N	88.4	Confident	91.7	Very high	30 Å²	30	34 Å²	34	16%	0.16	17%	0.167	C	C	.	.			trans	-129.4	88.1	-177.5	-166.2	-33.1	0	0	0	111	Y690 D696 I697 G698 E728	Y690-N694 PolarHBondContact O-N 3.38Å; N694-D696 PolarHBondContact O-N 3.41Å; N694-D696 PolarHBondContact OD1-N 2.92Å; N694-I697 PolarHBondContact OD1-N 3.36Å; N694-G698 WeakPolarHBondContact O-CA 3.5Å; N694-G698 PolarHBondContact O-N 3.46Å; N694-E728 PolarHBondContact ND2-OE1 3.24Å
695	S	85.5	Confident	91.7	Very high	77 Å²	77	32.3 Å²	32.3	54%	0.538	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.4	-178.6	55.3	0	0	0	0	113.9	R691	R691-S695 PolarHBondContact NH1-O 3.04Å
696	D	85.2	Confident	91.8	Very high	133 Å²	133	29.1 Å²	29.1	71%	0.711	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-47.9	-176.2	-69	-20.7	0	0	0	111.5	N694	N694-D696 PolarHBondContact O-N 3.41Å; N694-D696 PolarHBondContact OD1-N 2.92Å
697	I	86.3	Confident	91.8	Very high	23 Å²	23	29.1 Å²	29.1	12%	0.118	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-50.9	170.4	-63.6	178.6	0	0	0	109	N694 Y699 I727	N694-I697 PolarHBondContact OD1-N 3.36Å; I697-Y699 PolarHBondContact O-N 3.25Å; I697-I727 HydrophobicContact CD1-CG2 3.61Å
698	G	86.9	Confident	91.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.			trans	73.4	-112.7	-178	0	0	0	0	0	113.6	N694	N694-G698 WeakPolarHBondContact O-CA 3.5Å; N694-G698 PolarHBondContact O-N 3.46Å
699	Y	91.8	Very high	91.8	Very high	32 Å²	32	28.3 Å²	28.3	13%	0.125	15%	0.145	C	C	.	.			trans	-131.5	124.3	176.5	178.9	-101.6	0	0	0	109.8	Q657 I658 D661 L687 I697 L703 N704	Q657-Y699 HydrophobicContact CB-CD1 4.13Å; Q657-Y699 HydrophobicContact CB-CE1 4.31Å; Q657-Y699 HydrophobicContact CG-CD1 3.97Å; Q657-Y699 HydrophobicContact CG-CE1 3.84Å; I658-Y699 HydrophobicContact CD1-CD2 3.83Å; I658-Y699 HydrophobicContact CD1-CE2 4.43Å; I658-Y699 HydrophobicContact CD1-CG 3.98Å; I658-Y699 HydrophobicContact CG1-CD1 3.85Å; I658-Y699 HydrophobicContact CG1-CD2 3.35Å; I658-Y699 HydrophobicContact CG1-CE1 4.04Å; I658-Y699 HydrophobicContact CG1-CE2 3.57Å; I658-Y699 HydrophobicContact CG1-CG 3.5Å; D661-Y699 VanDerWaalsContact CB-OH 3.3Å; D661-Y699 WeakPolarHBondContact CB-OH 3.37Å; D661-Y699 VanDerWaalsContact OD2-CE1 3.31Å; D661-Y699 WeakPolarHBondContact OD2-CE1 3.4Å; D661-Y699 PolarHBondContact OD2-OH 2.71Å; L687-Y699 HydrophobicContact CD1-CE2 4.23Å; L687-Y699 HydrophobicContact CD2-CD2 4.48Å; L687-Y699 HydrophobicContact CD2-CE2 4.09Å; I697-Y699 PolarHBondContact O-N 3.25Å; Y699-L703 HydrophobicContact CD2-CB 4.23Å; Y699-L703 HydrophobicContact CD2-CD1 4.37Å; Y699-L703 HydrophobicContact CE2-CB 3.98Å; Y699-N704 WeakPolarHBondContact OH-CB 3.34Å; Y699-N704 PolarHBondContact OH-OD1 2.92Å
700	C	90.1	Very high	91.8	Very high	23 Å²	23	28.3 Å²	28.3	16%	0.155	15%	0.146	C	C	.	.			trans	-113.4	141.3	174.3	-170.3	0	0	0	0	109.4	G702 L703 Y736	C700-G702 PolarHBondContact O-N 3.43Å; C700-L703 HydrophobicContact CB-CD1 4.34Å; C700-L703 HydrophobicContact CB-CG 4.24Å; C700-L703 WeakPolarHBondContact O-CB 3.44Å; C700-L703 VanDerWaalsContact O-CG 3.3Å; C700-L703 WeakPolarHBondContact O-CG 3.48Å; C700-L703 PolarHBondContact O-N 3.35Å; C700-L703 VanDerWaalsContact O-N 3.14Å; C700-Y736 HydrophobicContact CB-CD1 4.13Å
701	Q	88.4	Confident	91.9	Very high	110 Å²	110	28.3 Å²	28.3	51%	0.514	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	123.3	176.9	-178.6	-179.7	-22.3	0	0	109.8	R664	R664-Q701 VanDerWaalsContact NH2-NE2 3.13Å
702	G	89.1	Confident	91.9	Very high	4 Å²	4	27.1 Å²	27.1	4%	0.041	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	120.9	-29.8	-173.4	0	0	0	0	0	112.3	C700 N704 R705 L706	C700-G702 PolarHBondContact O-N 3.43Å; G702-N704 WeakPolarHBondContact CA-OD1 3.47Å; G702-N704 PolarHBondContact N-OD1 3.16Å; G702-N704 PolarHBondContact O-N 3.17Å; G702-R705 WeakPolarHBondContact O-CB 3.18Å; G702-R705 PolarHBondContact O-N 3.45Å; G702-L706 PolarHBondContact O-N 3.45Å
703	L	94.3	Very high	92	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-33.4	177.8	-63.9	-170.5	0	0	0	112.5	L687 Y690 Y699 C700 R705 L706 A707 L723 I727 Y736	L687-L703 HydrophobicContact CD2-CB 4.24Å; Y690-L703 HydrophobicContact CD1-CD1 4.19Å; Y690-L703 HydrophobicContact CE1-CD1 4.06Å; Y699-L703 HydrophobicContact CD2-CB 4.23Å; Y699-L703 HydrophobicContact CD2-CD1 4.37Å; Y699-L703 HydrophobicContact CE2-CB 3.98Å; C700-L703 HydrophobicContact CB-CD1 4.34Å; C700-L703 HydrophobicContact CB-CG 4.24Å; C700-L703 WeakPolarHBondContact O-CB 3.44Å; C700-L703 VanDerWaalsContact O-CG 3.3Å; C700-L703 WeakPolarHBondContact O-CG 3.48Å; C700-L703 PolarHBondContact O-N 3.35Å; C700-L703 VanDerWaalsContact O-N 3.14Å; L703-R705 VanDerWaalsContact C-N 3.29Å; L703-R705 PolarHBondContact O-N 3.42Å; L703-L706 HydrophobicContact CD2-CD1 3.9Å; L703-L706 PolarHBondContact O-N 2.92Å; L703-A707 WeakPolarHBondContact O-CB 3.06Å; L703-A707 PolarHBondContact O-N 3.14Å; L703-L723 HydrophobicContact CD2-CD1 4.32Å; L703-I727 HydrophobicContact CD1-CD1 4.05Å; L703-I727 HydrophobicContact CD2-CD1 3.51Å; L703-I727 HydrophobicContact CD2-CG1 4Å; L703-I727 HydrophobicContact CG-CD1 4.39Å; L703-Y736 HydrophobicContact CD2-CD1 3.61Å; L703-Y736 HydrophobicContact CD2-CD2 4.25Å; L703-Y736 HydrophobicContact CD2-CE1 3.73Å; L703-Y736 HydrophobicContact CD2-CE2 4.35Å; L703-Y736 HydrophobicContact CD2-CG 3.89Å; L703-Y736 HydrophobicContact CG-CD1 4.41Å
704	N	95	Very high	92.1	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-56.7	-39.5	171.3	59.3	-39	0	0	0	113.1	D661 T665 L687 Y699 G702 A708	D661-N704 HydrophobicContact CB-CB 4.49Å; T665-N704 HydrophobicContact CG2-CB 4.33Å; T665-N704 PolarHBondContact OG1-ND2 2.67Å; L687-N704 HydrophobicContact CD1-CB 3.99Å; Y699-N704 WeakPolarHBondContact OH-CB 3.34Å; Y699-N704 PolarHBondContact OH-OD1 2.92Å; G702-N704 WeakPolarHBondContact CA-OD1 3.47Å; G702-N704 PolarHBondContact N-OD1 3.16Å; G702-N704 PolarHBondContact O-N 3.17Å; N704-A708 WeakPolarHBondContact O-CB 3.39Å; N704-A708 PolarHBondContact O-N 3.43Å
705	R	95	Very high	92.4	Very high	29 Å²	29	26.3 Å²	26.3	11%	0.109	14%	0.144	C	C	.	.	H	α-helix	trans	-68.2	-42.3	178.1	-58	-64.1	163.5	128.9	2.6	111.2	R664 G702 L703 A708 V709 T782 V785 D786	R664-R705 PolarHBondContact O-NH2 3.44Å; G702-R705 WeakPolarHBondContact O-CB 3.18Å; G702-R705 PolarHBondContact O-N 3.45Å; L703-R705 VanDerWaalsContact C-N 3.29Å; L703-R705 PolarHBondContact O-N 3.42Å; R705-A708 PolarHBondContact O-N 3.4Å; R705-V709 WeakPolarHBondContact O-CG2 3.45Å; R705-V709 PolarHBondContact O-N 2.91Å; R705-T782 HydrophobicContact CB-CG2 4.24Å; R705-T782 HydrophobicContact CG-CG2 4.04Å; R705-V785 HydrophobicContact CB-CB 4.41Å; R705-V785 HydrophobicContact CB-CG1 4.25Å; R705-D786 VanDerWaalsContact CD-OD1 3.26Å; R705-D786 WeakPolarHBondContact CD-OD1 3.32Å; R705-D786 IonicContact CZ-OD1 3.94Å; R705-D786 IonicContact CZ-OD2 3.75Å; R705-D786 IonicContact NE-OD1 3.78Å; R705-D786 IonicContact NE-OD2 2.84Å; R705-D786 PolarHBondContact NE-OD2 3.5Å; R705-D786 IonicContact NH1-OD1 2.67Å; R705-D786 PolarHBondContact NH1-OD1 2.87Å; R705-D786 IonicContact NH1-OD2 3.55Å; R705-D786 PolarHBondContact NH1-OD2 2.96Å; R705-D786 VanDerWaalsContact NH1-OD2 3.07Å; R705-D786 IonicContact NH2-OD2 2.79Å
706	L	96.4	Very high	92.9	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-62.3	-50.4	178.3	-52.6	-180	0	0	0	111.1	G702 L703 A708 V709 A710 L723 I726 Y736 I783 W797	G702-L706 PolarHBondContact O-N 3.45Å; L703-L706 HydrophobicContact CD2-CD1 3.9Å; L703-L706 PolarHBondContact O-N 2.92Å; L706-A708 VanDerWaalsContact C-N 3.34Å; L706-A708 PolarHBondContact O-N 3.15Å; L706-V709 PolarHBondContact O-N 2.92Å; L706-A710 WeakPolarHBondContact O-CB 3.42Å; L706-A710 PolarHBondContact O-N 3.39Å; L706-L723 HydrophobicContact CB-CD1 3.93Å; L706-L723 HydrophobicContact CD1-CD1 4.29Å; L706-I726 HydrophobicContact CD1-CG2 4.04Å; L706-Y736 HydrophobicContact CD1-CE1 4.34Å; L706-Y736 WeakPolarHBondContact CD1-OH 3.39Å; L706-I783 HydrophobicContact CD2-CB 4.34Å; L706-I783 HydrophobicContact CD2-CD1 3.74Å; L706-I783 HydrophobicContact CD2-CG1 3.8Å; L706-W797 HydrophobicContact CB-CH2 4.14Å; L706-W797 HydrophobicContact CB-CZ2 4.33Å; L706-W797 HydrophobicContact CD2-CH2 4.26Å; L706-W797 HydrophobicContact CD2-CZ2 3.7Å; L706-W797 WeakPolarHBondContact O-CH2 3.37Å
707	A	97	Very high	93.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.8	-38.6	178.9	0	0	0	0	0	112.1	L683 V686 L687 L703 A710 L711 L723	L683-A707 HydrophobicContact CD1-CB 3.44Å; L683-A707 VanDerWaalsContact CD1-CB 3.44Å; V686-A707 HydrophobicContact CG1-CB 4.09Å; L687-A707 HydrophobicContact CD2-CB 3.81Å; L687-A707 HydrophobicContact CG-CB 4.29Å; L703-A707 WeakPolarHBondContact O-CB 3.06Å; L703-A707 PolarHBondContact O-N 3.14Å; A707-A710 PolarHBondContact O-N 2.99Å; A707-L711 WeakPolarHBondContact O-CB 3.48Å; A707-L711 WeakPolarHBondContact O-CG 3.49Å; A707-L711 PolarHBondContact O-N 3.07Å; A707-L723 HydrophobicContact CB-CD2 4.39Å
708	A	96.2	Very high	93.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.6	-43.6	178	0	0	0	0	0	112.2	T665 L666 F672 L683 N704 R705 L706 L711 L712	T665-A708 HydrophobicContact CG2-CB 3.54Å; L666-A708 HydrophobicContact CD1-CB 3.77Å; L666-A708 HydrophobicContact CG-CB 4.35Å; F672-A708 HydrophobicContact CE1-CB 4.11Å; F672-A708 HydrophobicContact CE2-CB 4.12Å; F672-A708 HydrophobicContact CZ-CB 3.81Å; L683-A708 HydrophobicContact CD1-CB 4.2Å; L683-A708 HydrophobicContact CD2-CB 4.05Å; N704-A708 WeakPolarHBondContact O-CB 3.39Å; N704-A708 PolarHBondContact O-N 3.43Å; R705-A708 PolarHBondContact O-N 3.4Å; L706-A708 VanDerWaalsContact C-N 3.34Å; L706-A708 PolarHBondContact O-N 3.15Å; A708-L711 PolarHBondContact O-N 3.38Å; A708-L712 PolarHBondContact O-N 3.35Å
709	V	95.3	Very high	94.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.6	-40.6	176.5	170.9	0	0	0	0	111.7	W616 L666 R705 L706 L711 L712 V785 Y793 L794 W797	W616-V709 HydrophobicContact CH2-CG1 3.93Å; W616-V709 HydrophobicContact CZ3-CG1 4.11Å; L666-V709 HydrophobicContact CD1-CG2 4.19Å; R705-V709 WeakPolarHBondContact O-CG2 3.45Å; R705-V709 PolarHBondContact O-N 2.91Å; L706-V709 PolarHBondContact O-N 2.92Å; V709-L711 VanDerWaalsContact C-N 3.31Å; V709-L711 PolarHBondContact O-N 3.47Å; V709-L712 WeakPolarHBondContact O-CB 3.4Å; V709-L712 PolarHBondContact O-N 3.22Å; V709-V785 HydrophobicContact CB-CG2 4.5Å; V709-V785 HydrophobicContact CG2-CB 4.34Å; V709-V785 HydrophobicContact CG2-CG1 3.69Å; V709-V785 HydrophobicContact CG2-CG2 3.61Å; V709-Y793 HydrophobicContact CG1-CE2 4.26Å; V709-Y793 HydrophobicContact CG2-CE2 3.87Å; V709-L794 HydrophobicContact CG1-CD2 3.82Å; V709-W797 HydrophobicContact CB-CH2 4.21Å; V709-W797 HydrophobicContact CB-CZ2 4.02Å; V709-W797 HydrophobicContact CG1-CD2 3.9Å; V709-W797 HydrophobicContact CG1-CE3 4.1Å; V709-W797 HydrophobicContact CG1-CG 4.48Å; V709-W797 HydrophobicContact CG1-CH2 4.19Å; V709-W797 HydrophobicContact CG1-CZ2 3.99Å; V709-W797 HydrophobicContact CG1-CZ3 4.23Å
710	A	96.4	Very high	94.5	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-58.5	-43.8	173.6	0	0	0	0	0	111.5	L706 A707 L712 Y713 L714 A719 A722	L706-A710 WeakPolarHBondContact O-CB 3.42Å; L706-A710 PolarHBondContact O-N 3.39Å; A707-A710 PolarHBondContact O-N 2.99Å; A710-L712 PolarHBondContact O-N 3.25Å; A710-Y713 PolarHBondContact O-N 3.46Å; A710-L714 HydrophobicContact CB-CD1 4.31Å; A710-L714 VanDerWaalsContact O-CB 3.25Å; A710-L714 WeakPolarHBondContact O-CB 3.44Å; A710-L714 WeakPolarHBondContact O-CG 3.36Å; A710-L714 PolarHBondContact O-N 2.76Å; A710-A719 HydrophobicContact CB-CB 3.94Å; A710-A722 HydrophobicContact CB-CB 3.87Å
711	L	96.1	Very high	94.8	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-66.4	-15.3	179.1	-79.9	171.4	0	0	0	114.9	F672 K679 P682 L683 V686 A707 A708 V709 Y713 E716 A719	F672-L711 HydrophobicContact CZ-CB 4.38Å; K679-L711 WeakPolarHBondContact CE-O 3.31Å; K679-L711 PolarHBondContact NZ-O 3.46Å; P682-L711 HydrophobicContact CB-CD1 4.31Å; P682-L711 HydrophobicContact CB-CD2 4.35Å; L683-L711 VanDerWaalsContact CA-CD1 3.42Å; L683-L711 HydrophobicContact CB-CD1 3.68Å; L683-L711 HydrophobicContact CD1-CD1 3.95Å; L683-L711 HydrophobicContact CG-CD1 4.43Å; V686-L711 HydrophobicContact CG2-CD1 4.49Å; V686-L711 HydrophobicContact CG2-CD2 4.39Å; A707-L711 WeakPolarHBondContact O-CB 3.48Å; A707-L711 WeakPolarHBondContact O-CG 3.49Å; A707-L711 PolarHBondContact O-N 3.07Å; A708-L711 PolarHBondContact O-N 3.38Å; V709-L711 VanDerWaalsContact C-N 3.31Å; V709-L711 PolarHBondContact O-N 3.47Å; L711-Y713 VanDerWaalsContact C-N 3.3Å; L711-E716 HydrophobicContact CD2-CG 4.27Å; L711-A719 HydrophobicContact CD2-CB 3.64Å; L711-A719 HydrophobicContact CG-CB 3.77Å
712	L	93.1	Very high	95.2	Very high	22 Å²	22	14.7 Å²	14.7	12%	0.115	8%	0.076	C	C	.	.	H	α-helix	trans	-68.3	-32.7	173.3	-68.3	176.5	0	0	0	111.9	L530 F532 Y671 F672 A708 V709 A710	L530-L712 HydrophobicContact CD2-CB 4.42Å; F532-L712 HydrophobicContact CE2-CD1 3.91Å; F532-L712 HydrophobicContact CZ-CD1 3.79Å; Y671-L712 HydrophobicContact CD2-CD2 3.98Å; F672-L712 HydrophobicContact CE2-CD2 3.86Å; F672-L712 HydrophobicContact CE2-CG 4.39Å; A708-L712 PolarHBondContact O-N 3.35Å; V709-L712 WeakPolarHBondContact O-CB 3.4Å; V709-L712 PolarHBondContact O-N 3.22Å; A710-L712 PolarHBondContact O-N 3.25Å
713	Y	92.5	Very high	95.6	Very high	18 Å²	18	14.6 Å²	14.6	7%	0.071	8%	0.075	C	C	.	.	H	α-helix	trans	-115.5	-19.8	-174.3	-72.1	-78.4	0	0	0	114.3	L530 H609 R612 S613 W616 A710 L711 L794	L530-Y713 WeakPolarHBondContact CD1-OH 3.21Å; L530-Y713 HydrophobicContact CD2-CE1 4.04Å; L530-Y713 HydrophobicContact CD2-CE2 3.89Å; H609-Y713 AromaticContact CE1-CE1 3.63Å; H609-Y713 AromaticContact CE1-CZ 3.94Å; H609-Y713 AromaticContact ND1-CE1 3.72Å; H609-Y713 AromaticContact ND1-CZ 3.83Å; H609-Y713 PolarHBondContact ND1-OH 2.92Å; R612-Y713 HydrophobicContact CB-CD1 3.96Å; R612-Y713 HydrophobicContact CB-CE1 3.83Å; R612-Y713 HydrophobicContact CG-CD1 4.13Å; R612-Y713 HydrophobicContact CG-CD2 4.46Å; R612-Y713 HydrophobicContact CG-CE1 4.09Å; R612-Y713 HydrophobicContact CG-CE2 4.42Å; R612-Y713 HydrophobicContact CG-CG 4.29Å; R612-Y713 PolarHBondContact NH1-OH 3.2Å; S613-Y713 VanDerWaalsContact CB-O 3.22Å; S613-Y713 WeakPolarHBondContact CB-O 3.34Å; S613-Y713 PolarHBondContact OG-O 2.95Å; W616-Y713 HydrophobicContact CE3-CD2 4.15Å; W616-Y713 HydrophobicContact CE3-CG 4.37Å; W616-Y713 AromaticContact CH2-CD2 3.93Å; W616-Y713 HydrophobicContact CH2-CD2 3.93Å; W616-Y713 HydrophobicContact CH2-CE2 4.24Å; W616-Y713 AromaticContact CZ3-CD2 3.63Å; W616-Y713 HydrophobicContact CZ3-CD2 3.63Å; W616-Y713 HydrophobicContact CZ3-CE2 4.4Å; W616-Y713 HydrophobicContact CZ3-CG 4.29Å; A710-Y713 PolarHBondContact O-N 3.46Å; L711-Y713 VanDerWaalsContact C-N 3.3Å; Y713-L794 HydrophobicContact CE2-CD1 4.15Å; Y713-L794 HydrophobicContact CE2-CD2 3.82Å
714	L	95	Very high	95.6	Very high	14 Å²	14	14.5 Å²	14.5	7%	0.073	7%	0.074	C	C	.	.	S	Bend	trans	-117	159.9	-170.9	-56	176.1	0	0	0	111.9	W616 K617 I620 A710 D718 A719 A722	W616-L714 HydrophobicContact CB-CD2 4.12Å; K617-L714 HydrophobicContact CB-CD2 4.01Å; I620-L714 HydrophobicContact CD1-CD1 3.33Å; A710-L714 HydrophobicContact CB-CD1 4.31Å; A710-L714 VanDerWaalsContact O-CB 3.25Å; A710-L714 WeakPolarHBondContact O-CB 3.44Å; A710-L714 WeakPolarHBondContact O-CG 3.36Å; A710-L714 PolarHBondContact O-N 2.76Å; L714-D718 HydrophobicContact CB-CB 3.92Å; L714-A719 HydrophobicContact CB-CB 4.38Å; L714-A722 HydrophobicContact CD1-CB 3.95Å
715	S	94.8	Very high	95.6	Very high	60 Å²	60	14.4 Å²	14.4	42%	0.42	7%	0.074	S	C	.	.			trans	-68.8	166.6	169.5	73.2	0	0	0	0	111	E717 D718 A719	S715-E717 VanDerWaalsContact C-N 3.32Å; S715-E717 PolarHBondContact O-N 2.97Å; S715-D718 PolarHBondContact O-N 2.78Å; S715-D718 WeakPolarHBondContact OG-CB 3.3Å; S715-D718 PolarHBondContact OG-N 3.34Å; S715-D718 PolarHBondContact OG-OD2 3.05Å; S715-A719 VanDerWaalsContact O-CB 3.22Å; S715-A719 WeakPolarHBondContact O-CB 3.41Å; S715-A719 PolarHBondContact O-N 3.43Å
716	E	95	Very high	95.7	Very high	58 Å²	58	13.1 Å²	13.1	27%	0.271	7%	0.069	S	C	.	.	H	α-helix	trans	-57.2	-44.6	179.3	-63.5	-173.4	-158.1	0	0	112.9	F636 P682 R685 V686 L711 A719 F720	F636-E716 HydrophobicContact CE1-CB 3.93Å; F636-E716 HydrophobicContact CZ-CB 4.11Å; P682-E716 HydrophobicContact CB-CG 3.84Å; P682-E716 WeakPolarHBondContact CB-OE1 3.41Å; P682-E716 WeakPolarHBondContact CG-OE1 3.33Å; R685-E716 IonicContact CZ-OE1 3.19Å; R685-E716 IonicContact CZ-OE2 2.89Å; R685-E716 IonicContact NE-OE1 3.21Å; R685-E716 IonicContact NE-OE2 3.62Å; R685-E716 PolarHBondContact NE-OE2 3.1Å; R685-E716 VanDerWaalsContact NH2-CD 3.27Å; R685-E716 IonicContact NH2-OE1 3.67Å; R685-E716 PolarHBondContact NH2-OE1 3.13Å; R685-E716 IonicContact NH2-OE2 3.92Å; R685-E716 PolarHBondContact NH2-OE2 3.39Å; R685-E716 VanDerWaalsContact NH2-OE2 3.09Å; V686-E716 HydrophobicContact CG2-CB 4.4Å; V686-E716 WeakPolarHBondContact CG2-O 3.45Å; L711-E716 HydrophobicContact CD2-CG 4.27Å; E716-A719 PolarHBondContact O-N 3.21Å; E716-F720 PolarHBondContact O-N 3.21Å
717	E	95	Very high	95.5	Very high	76 Å²	76	13.2 Å²	13.2	36%	0.355	7%	0.069	S	C	.	.	H	α-helix	trans	-68.5	-44.6	179.1	-178.7	168.6	-164.6	0	0	111.2	F636 S715 A719 F720 W721	F636-E717 HydrophobicContact CB-CB 4.49Å; F636-E717 HydrophobicContact CB-CG 3.97Å; F636-E717 HydrophobicContact CD1-CB 3.88Å; F636-E717 HydrophobicContact CD1-CG 4.28Å; F636-E717 HydrophobicContact CE1-CB 4.48Å; F636-E717 HydrophobicContact CG-CB 4.33Å; F636-E717 HydrophobicContact CG-CG 4.33Å; S715-E717 VanDerWaalsContact C-N 3.32Å; S715-E717 PolarHBondContact O-N 2.97Å; E717-A719 VanDerWaalsContact C-N 3.28Å; E717-A719 PolarHBondContact O-N 3.48Å; E717-F720 WeakPolarHBondContact O-CB 3.46Å; E717-F720 PolarHBondContact O-N 3.18Å; E717-W721 PolarHBondContact O-N 2.88Å
718	D	95.5	Very high	95.3	Very high	15 Å²	15	15.8 Å²	15.8	8%	0.08	8%	0.082	C	C	.	.	H	α-helix	trans	-64.8	-33.2	176.7	-67.4	-46.4	0	0	0	111.6	K617 H621 L714 S715 W721 A722	K617-D718 WeakPolarHBondContact CE-OD1 3.28Å; K617-D718 WeakPolarHBondContact CE-OD2 3.43Å; K617-D718 IonicContact NZ-OD1 3.38Å; K617-D718 PolarHBondContact NZ-OD1 3.49Å; K617-D718 IonicContact NZ-OD2 3.46Å; K617-D718 PolarHBondContact NZ-OD2 3.4Å; H621-D718 IonicContact CD2-OD1 3.5Å; H621-D718 IonicContact CE1-OD1 3.62Å; H621-D718 IonicContact NE2-OD1 2.61Å; H621-D718 PolarHBondContact NE2-OD1 2.94Å; L714-D718 HydrophobicContact CB-CB 3.92Å; S715-D718 PolarHBondContact O-N 2.78Å; S715-D718 WeakPolarHBondContact OG-CB 3.3Å; S715-D718 PolarHBondContact OG-N 3.34Å; S715-D718 PolarHBondContact OG-OD2 3.05Å; D718-W721 PolarHBondContact O-N 3.37Å; D718-A722 WeakPolarHBondContact O-CB 3.33Å; D718-A722 PolarHBondContact O-N 3.43Å
719	A	97.2	Very high	95.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-71.7	-35	175.7	0	0	0	0	0	112.6	V686 A710 L711 L714 S715 E716 E717 A722 L723	V686-A719 HydrophobicContact CG2-CB 4.46Å; A710-A719 HydrophobicContact CB-CB 3.94Å; L711-A719 HydrophobicContact CD2-CB 3.64Å; L711-A719 HydrophobicContact CG-CB 3.77Å; L714-A719 HydrophobicContact CB-CB 4.38Å; S715-A719 VanDerWaalsContact O-CB 3.22Å; S715-A719 WeakPolarHBondContact O-CB 3.41Å; S715-A719 PolarHBondContact O-N 3.43Å; E716-A719 PolarHBondContact O-N 3.21Å; E717-A719 VanDerWaalsContact C-N 3.28Å; E717-A719 PolarHBondContact O-N 3.48Å; A719-A722 WeakPolarHBondContact O-CB 3.26Å; A719-A722 PolarHBondContact O-N 3.33Å; A719-L723 PolarHBondContact O-N 3.03Å
720	F	97.1	Very high	95	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.4	-48.5	168.5	163.7	-95	0	0	0	111	Y635 F636 L639 V686 A689 H693 E716 E717 A722 L723 V724	Y635-F720 HydrophobicContact CD1-CE1 4.15Å; Y635-F720 HydrophobicContact CD1-CZ 4.33Å; Y635-F720 HydrophobicContact CE1-CE1 4.26Å; Y635-F720 HydrophobicContact CE1-CZ 4.03Å; F636-F720 HydrophobicContact CB-CD1 4.22Å; F636-F720 HydrophobicContact CD2-CB 3.53Å; F636-F720 AromaticContact CD2-CD1 3.9Å; F636-F720 HydrophobicContact CD2-CD1 3.9Å; F636-F720 AromaticContact CD2-CD2 3.84Å; F636-F720 HydrophobicContact CD2-CD2 3.84Å; F636-F720 AromaticContact CD2-CG 3.46Å; F636-F720 HydrophobicContact CD2-CG 3.46Å; F636-F720 VanDerWaalsContact CD2-CG 3.46Å; F636-F720 HydrophobicContact CE2-CB 3.66Å; F636-F720 HydrophobicContact CE2-CD2 4.2Å; F636-F720 AromaticContact CE2-CG 3.99Å; F636-F720 HydrophobicContact CE2-CG 3.99Å; F636-F720 HydrophobicContact CG-CB 4.35Å; F636-F720 HydrophobicContact CG-CD1 4.42Å; F636-F720 HydrophobicContact CG-CG 4.35Å; L639-F720 HydrophobicContact CD1-CE1 4.39Å; L639-F720 HydrophobicContact CD1-CE2 3.83Å; L639-F720 HydrophobicContact CD1-CZ 3.53Å; V686-F720 HydrophobicContact CG1-CB 4.2Å; A689-F720 HydrophobicContact CB-CD2 3.89Å; A689-F720 HydrophobicContact CB-CE2 4.04Å; H693-F720 HydrophobicContact CB-CE2 4.04Å; H693-F720 HydrophobicContact CB-CZ 3.99Å; H693-F720 AromaticContact CG-CZ 3.99Å; E716-F720 PolarHBondContact O-N 3.21Å; E717-F720 WeakPolarHBondContact O-CB 3.46Å; E717-F720 PolarHBondContact O-N 3.18Å; F720-A722 VanDerWaalsContact C-N 3.28Å; F720-A722 PolarHBondContact O-N 3.48Å; F720-L723 WeakPolarHBondContact O-CB 3.44Å; F720-L723 PolarHBondContact O-N 2.98Å; F720-L723 VanDerWaalsContact O-N 3.08Å; F720-V724 HydrophobicContact CE1-CG2 4.09Å; F720-V724 HydrophobicContact CE2-CG2 4.24Å; F720-V724 HydrophobicContact CZ-CG2 3.9Å; F720-V724 PolarHBondContact O-N 2.95Å; F720-V724 VanDerWaalsContact O-N 3.08Å
721	W	96.6	Very high	94.8	Very high	5 Å²	5	19.2 Å²	19.2	2%	0.019	10%	0.097	C	C	.	.	H	α-helix	trans	-65.4	-32.1	176.6	-69.5	120.8	0	0	0	112.7	I620 V624 E627 L628 V631 Y635 E717 D718 L723 V724 A725	I620-W721 HydrophobicContact CG2-CB 3.95Å; V624-W721 HydrophobicContact CB-CE3 4.28Å; V624-W721 HydrophobicContact CG1-CD2 4.36Å; V624-W721 HydrophobicContact CG1-CE3 3.37Å; V624-W721 HydrophobicContact CG1-CZ3 3.48Å; V624-W721 VanDerWaalsContact CG1-CZ3 3.48Å; E627-W721 HydrophobicContact CB-CZ3 4.41Å; L628-W721 HydrophobicContact CD1-CD2 4.39Å; L628-W721 HydrophobicContact CD1-CH2 4.23Å; L628-W721 HydrophobicContact CD1-CZ2 3.42Å; L628-W721 VanDerWaalsContact CD1-CZ2 3.42Å; V631-W721 HydrophobicContact CG2-CH2 3.66Å; V631-W721 HydrophobicContact CG2-CZ2 3.92Å; Y635-W721 AromaticContact CD1-CH2 3.8Å; Y635-W721 HydrophobicContact CD1-CH2 3.8Å; Y635-W721 AromaticContact CD1-CZ2 3.91Å; Y635-W721 HydrophobicContact CD1-CZ2 3.91Å; Y635-W721 HydrophobicContact CE1-CH2 4.28Å; E717-W721 PolarHBondContact O-N 2.88Å; D718-W721 PolarHBondContact O-N 3.37Å; W721-L723 VanDerWaalsContact C-N 3.29Å; W721-L723 PolarHBondContact O-N 3.24Å; W721-V724 HydrophobicContact CE3-CB 4.2Å; W721-V724 HydrophobicContact CE3-CG1 4.39Å; W721-V724 HydrophobicContact CE3-CG2 4.17Å; W721-V724 HydrophobicContact CZ3-CG1 4.46Å; W721-V724 PolarHBondContact O-N 3.28Å; W721-A725 WeakPolarHBondContact O-CB 3.37Å; W721-A725 PolarHBondContact O-N 3.07Å
722	A	97	Very high	94.5	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.008	11%	0.106	C	C	.	.	H	α-helix	trans	-58.7	-44.5	171	0	0	0	0	0	111	I620 A710 L714 D718 A719 F720 A725 I726	I620-A722 HydrophobicContact CD1-CB 3.38Å; I620-A722 HydrophobicContact CG1-CB 4.13Å; I620-A722 HydrophobicContact CG2-CB 4.45Å; A710-A722 HydrophobicContact CB-CB 3.87Å; L714-A722 HydrophobicContact CD1-CB 3.95Å; D718-A722 WeakPolarHBondContact O-CB 3.33Å; D718-A722 PolarHBondContact O-N 3.43Å; A719-A722 WeakPolarHBondContact O-CB 3.26Å; A719-A722 PolarHBondContact O-N 3.33Å; F720-A722 VanDerWaalsContact C-N 3.28Å; F720-A722 PolarHBondContact O-N 3.48Å; A722-A725 PolarHBondContact O-N 2.94Å; A722-I726 WeakPolarHBondContact O-CB 3.44Å; A722-I726 WeakPolarHBondContact O-CD1 3.29Å; A722-I726 WeakPolarHBondContact O-CG1 3.35Å; A722-I726 PolarHBondContact O-N 3.04Å
723	L	96.5	Very high	94.2	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-42.2	179.8	-167.8	62.4	0	0	0	111.5	V686 L687 Y690 L703 L706 A707 A719 F720 W721 I726 I727	V686-L723 HydrophobicContact CG1-CD2 4.45Å; L687-L723 HydrophobicContact CD2-CD2 4.11Å; Y690-L723 HydrophobicContact CD1-CD2 4.08Å; Y690-L723 HydrophobicContact CD2-CB 4.45Å; Y690-L723 HydrophobicContact CD2-CD2 3.95Å; Y690-L723 HydrophobicContact CD2-CG 4.02Å; Y690-L723 HydrophobicContact CE2-CG 4.46Å; Y690-L723 HydrophobicContact CG-CD2 3.58Å; Y690-L723 HydrophobicContact CG-CG 4.12Å; L703-L723 HydrophobicContact CD2-CD1 4.32Å; L706-L723 HydrophobicContact CB-CD1 3.93Å; L706-L723 HydrophobicContact CD1-CD1 4.29Å; A707-L723 HydrophobicContact CB-CD2 4.39Å; A719-L723 PolarHBondContact O-N 3.03Å; F720-L723 WeakPolarHBondContact O-CB 3.44Å; F720-L723 PolarHBondContact O-N 2.98Å; F720-L723 VanDerWaalsContact O-N 3.08Å; W721-L723 VanDerWaalsContact C-N 3.29Å; W721-L723 PolarHBondContact O-N 3.24Å; L723-I726 PolarHBondContact O-N 3.33Å; L723-I727 HydrophobicContact CD1-CD1 3.72Å; L723-I727 HydrophobicContact CD1-CG1 4.4Å; L723-I727 HydrophobicContact CG-CD1 3.68Å; L723-I727 WeakPolarHBondContact O-CB 3.41Å; L723-I727 WeakPolarHBondContact O-CD1 3.5Å; L723-I727 VanDerWaalsContact O-CG1 3.28Å; L723-I727 WeakPolarHBondContact O-CG1 3.24Å; L723-I727 PolarHBondContact O-N 2.95Å
724	V	95.2	Very high	93.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-50.5	173	177.7	0	0	0	0	110.8	V624 Y690 F720 W721 I726 I727 E728	V624-V724 HydrophobicContact CG1-CG1 4.14Å; Y690-V724 HydrophobicContact CD2-CG2 4.01Å; Y690-V724 HydrophobicContact CE2-CG2 4.05Å; F720-V724 HydrophobicContact CE1-CG2 4.09Å; F720-V724 HydrophobicContact CE2-CG2 4.24Å; F720-V724 HydrophobicContact CZ-CG2 3.9Å; F720-V724 PolarHBondContact O-N 2.95Å; F720-V724 VanDerWaalsContact O-N 3.08Å; W721-V724 HydrophobicContact CE3-CB 4.2Å; W721-V724 HydrophobicContact CE3-CG1 4.39Å; W721-V724 HydrophobicContact CE3-CG2 4.17Å; W721-V724 HydrophobicContact CZ3-CG1 4.46Å; W721-V724 PolarHBondContact O-N 3.28Å; V724-I726 VanDerWaalsContact C-N 3.29Å; V724-I726 PolarHBondContact O-N 3.03Å; V724-I727 PolarHBondContact O-N 2.88Å; V724-E728 HydrophobicContact CG1-CG 4.45Å; V724-E728 WeakPolarHBondContact O-CB 3.44Å; V724-E728 PolarHBondContact O-N 3.49Å
725	A	95.2	Very high	93.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.154	C	C	.	.	I	π-helix	trans	-54.5	-45.4	177.3	0	0	0	0	0	112.1	I620 W623 V624 W721 A722 H729 L730	I620-A725 HydrophobicContact CG2-CB 4.24Å; W623-A725 HydrophobicContact CB-CB 4.1Å; V624-A725 HydrophobicContact CG2-CB 3.55Å; W721-A725 WeakPolarHBondContact O-CB 3.37Å; W721-A725 PolarHBondContact O-N 3.07Å; A722-A725 PolarHBondContact O-N 2.94Å; A725-H729 WeakPolarHBondContact O-CB 3.04Å; A725-H729 PolarHBondContact O-N 2.69Å; A725-L730 PolarHBondContact O-N 3.27Å
726	I	95.8	Very high	93.3	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	13%	0.134	C	C	.	.	I	π-helix	trans	-66.1	-46.5	-178.1	-67.5	166.6	0	0	0	111.3	L706 A722 L723 V724 L730 Q731 I783 W797 F800 L801	L706-I726 HydrophobicContact CD1-CG2 4.04Å; A722-I726 WeakPolarHBondContact O-CB 3.44Å; A722-I726 WeakPolarHBondContact O-CD1 3.29Å; A722-I726 WeakPolarHBondContact O-CG1 3.35Å; A722-I726 PolarHBondContact O-N 3.04Å; L723-I726 PolarHBondContact O-N 3.33Å; V724-I726 VanDerWaalsContact C-N 3.29Å; V724-I726 PolarHBondContact O-N 3.03Å; I726-L730 HydrophobicContact CG1-CD1 4.06Å; I726-Q731 HydrophobicContact CG2-CG 4.33Å; I726-Q731 VanDerWaalsContact O-CB 3.25Å; I726-Q731 WeakPolarHBondContact O-CB 3.29Å; I726-Q731 WeakPolarHBondContact O-CG 3.14Å; I726-Q731 PolarHBondContact O-N 3.34Å; I726-I783 HydrophobicContact CG2-CD1 4.01Å; I726-W797 HydrophobicContact CD1-CH2 3.51Å; I726-W797 HydrophobicContact CD1-CZ2 4.48Å; I726-W797 HydrophobicContact CD1-CZ3 3.56Å; I726-F800 HydrophobicContact CG1-CE1 4.13Å; I726-F800 HydrophobicContact CG2-CE1 4.02Å; I726-F800 HydrophobicContact CG2-CZ 4.31Å; I726-L801 HydrophobicContact CD1-CD2 4.44Å; I726-L801 HydrophobicContact CG1-CD2 4.22Å
727	I	93.7	Very high	92.8	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.015	12%	0.123	C	C	.	.	I	π-helix	trans	-80.8	-38.4	-171	-63.7	165	0	0	0	112.2	Y690 I697 L703 L723 V724 Y736	Y690-I727 HydrophobicContact CD1-CD1 4.22Å; Y690-I727 HydrophobicContact CD2-CD1 4.44Å; Y690-I727 HydrophobicContact CE1-CD1 3.47Å; Y690-I727 VanDerWaalsContact CE1-CD1 3.47Å; Y690-I727 HydrophobicContact CE2-CD1 3.76Å; Y690-I727 WeakPolarHBondContact OH-CD1 3.26Å; Y690-I727 WeakPolarHBondContact OH-CG2 3.35Å; I697-I727 HydrophobicContact CD1-CG2 3.61Å; L703-I727 HydrophobicContact CD1-CD1 4.05Å; L703-I727 HydrophobicContact CD2-CD1 3.51Å; L703-I727 HydrophobicContact CD2-CG1 4Å; L703-I727 HydrophobicContact CG-CD1 4.39Å; L723-I727 HydrophobicContact CD1-CD1 3.72Å; L723-I727 HydrophobicContact CD1-CG1 4.4Å; L723-I727 HydrophobicContact CG-CD1 3.68Å; L723-I727 WeakPolarHBondContact O-CB 3.41Å; L723-I727 WeakPolarHBondContact O-CD1 3.5Å; L723-I727 VanDerWaalsContact O-CG1 3.28Å; L723-I727 WeakPolarHBondContact O-CG1 3.24Å; L723-I727 PolarHBondContact O-N 2.95Å; V724-I727 PolarHBondContact O-N 2.88Å; I727-Y736 HydrophobicContact CB-CD2 4.21Å; I727-Y736 HydrophobicContact CB-CE2 4.4Å; I727-Y736 HydrophobicContact CG1-CD2 3.79Å; I727-Y736 HydrophobicContact CG1-CE2 3.78Å; I727-Y736 HydrophobicContact CG2-CD2 3.81Å; I727-Y736 HydrophobicContact CG2-CE2 4.47Å
728	E	92.3	Very high	92.3	Very high	55 Å²	55	32.3 Å²	32.3	26%	0.257	15%	0.148	S	C	.	.	I	π-helix	trans	-99.4	-26.8	-169	-55.3	-166.1	-179.1	0	0	113	H693 N694 V724	H693-E728 IonicContact CD2-OE1 2.79Å; H693-E728 IonicContact NE2-OE1 3.48Å; H693-E728 IonicContact NE2-OE2 3.53Å; N694-E728 PolarHBondContact ND2-OE1 3.24Å; V724-E728 HydrophobicContact CG1-CG 4.45Å; V724-E728 WeakPolarHBondContact O-CB 3.44Å; V724-E728 PolarHBondContact O-N 3.49Å
729	H	92.3	Very high	91.8	Very high	59 Å²	59	35.9 Å²	35.9	27%	0.273	17%	0.17	S	C	.	.	I	π-helix	trans	-115.2	-45.4	-176	-56.5	-94.8	0	0	0	114.3	W623 E627 A725	W623-H729 HydrophobicContact CE3-CB 3.97Å; E627-H729 VanDerWaalsContact CD-CE1 3.43Å; E627-H729 IonicContact OE1-CE1 3.68Å; E627-H729 PolarHBondContact OE1-CE1 2.99Å; E627-H729 IonicContact OE1-NE2 2.61Å; E627-H729 PolarHBondContact OE1-NE2 3.35Å; E627-H729 IonicContact OE2-CE1 2.7Å; E627-H729 PolarHBondContact OE2-CE1 3.32Å; E627-H729 IonicContact OE2-NE2 3.59Å; A725-H729 WeakPolarHBondContact O-CB 3.04Å; A725-H729 PolarHBondContact O-N 2.69Å
730	L	92.8	Very high	91.3	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.042	18%	0.177	C	C	.	.	I	π-helix	trans	-83.4	-33.1	-173.5	-68.3	170.1	0	0	0	113.1	W623 A725 I726 F800 L801 N805	W623-L730 HydrophobicContact CD2-CD2 4.11Å; W623-L730 VanDerWaalsContact CE2-CD2 3.46Å; W623-L730 HydrophobicContact CH2-CD2 4.27Å; W623-L730 HydrophobicContact CZ2-CD2 3.56Å; A725-L730 PolarHBondContact O-N 3.27Å; I726-L730 HydrophobicContact CG1-CD1 4.06Å; L730-F800 HydrophobicContact CB-CE1 3.88Å; L730-F800 HydrophobicContact CB-CZ 3.79Å; L730-F800 HydrophobicContact CD1-CD1 4.2Å; L730-F800 HydrophobicContact CD1-CE1 3.73Å; L730-F800 HydrophobicContact CD1-CZ 4.49Å; L730-F800 HydrophobicContact CG-CE1 4.39Å; L730-L801 HydrophobicContact CD1-CD2 3.85Å; L730-N805 PolarHBondContact O-N 2.96Å
731	Q	93	Very high	90.8	Very high	5 Å²	5	42.4 Å²	42.4	2%	0.023	21%	0.205	C	C	.	.	S	Bend	trans	-93.2	153.8	174.5	-70.6	-66.3	-16.3	0	0	111.1	I726 Y735 Y736 F800 N805	I726-Q731 HydrophobicContact CG2-CG 4.33Å; I726-Q731 VanDerWaalsContact O-CB 3.25Å; I726-Q731 WeakPolarHBondContact O-CB 3.29Å; I726-Q731 WeakPolarHBondContact O-CG 3.14Å; I726-Q731 PolarHBondContact O-N 3.34Å; Q731-Y735 HydrophobicContact CB-CG 4.21Å; Q731-Y735 HydrophobicContact CG-CD1 4.49Å; Q731-Y736 HydrophobicContact CB-CE2 4.47Å; Q731-Y736 HydrophobicContact CG-CE2 4.11Å; Q731-F800 HydrophobicContact CG-CZ 4.12Å; Q731-N805 PolarHBondContact OE1-OD1 3.42Å
732	P	89.4	Confident	90.4	Very high	31 Å²	31	43 Å²	43	20%	0.201	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-55.5	152.8	172.3	-23.4	32.8	0	0	0	112.2	N734 Y735 A742 N805	P732-N734 PolarHBondContact O-N 3.3Å; P732-Y735 HydrophobicContact CB-CD2 4.22Å; P732-Y735 HydrophobicContact CG-CD2 3.95Å; P732-Y735 HydrophobicContact CG-CE2 4.24Å; P732-Y735 WeakPolarHBondContact O-CB 3.23Å; P732-Y735 PolarHBondContact O-N 3.16Å; P732-A742 HydrophobicContact CB-CB 4.14Å; P732-N805 WeakPolarHBondContact CD-ND2 3.35Å; P732-N805 WeakPolarHBondContact CG-ND2 3.46Å
733	H	85.9	Confident	90.1	Very high	165 Å²	165	43 Å²	43	76%	0.764	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	137.2	-178.5	-66	20.6	0	0	0	111.4	Y735	H733-Y735 PolarHBondContact O-N 3.33Å
734	N	84.7	Confident	89.8	Confident	92 Å²	92	47.9 Å²	47.9	49%	0.492	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	28.9	-179.7	-158.1	33.7	0	0	0	114	P732 Y736 G737	P732-N734 PolarHBondContact O-N 3.3Å; N734-Y736 VanDerWaalsContact C-N 3.32Å; N734-Y736 PolarHBondContact O-N 2.98Å; N734-G737 PolarHBondContact O-N 3.5Å; N734-G737 VanDerWaalsContact O-N 3.11Å; N734-G737 WeakPolarHBondContact OD1-CA 3.18Å
735	Y	89.8	Confident	89.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-45.4	176.3	-157.5	-102.5	0	0	0	113.3	Q731 P732 H733 G737 A742 A743 D746 L781	Q731-Y735 HydrophobicContact CB-CG 4.21Å; Q731-Y735 HydrophobicContact CG-CD1 4.49Å; P732-Y735 HydrophobicContact CB-CD2 4.22Å; P732-Y735 HydrophobicContact CG-CD2 3.95Å; P732-Y735 HydrophobicContact CG-CE2 4.24Å; P732-Y735 WeakPolarHBondContact O-CB 3.23Å; P732-Y735 PolarHBondContact O-N 3.16Å; H733-Y735 PolarHBondContact O-N 3.33Å; Y735-G737 VanDerWaalsContact C-N 3.3Å; Y735-A742 HydrophobicContact CD2-CB 3.78Å; Y735-A742 HydrophobicContact CE2-CB 4.45Å; Y735-A743 HydrophobicContact CD1-CB 4.12Å; Y735-A743 HydrophobicContact CD2-CB 4.31Å; Y735-A743 HydrophobicContact CE1-CB 3.69Å; Y735-A743 VanDerWaalsContact CE2-CA 3.44Å; Y735-A743 HydrophobicContact CE2-CB 3.91Å; Y735-A743 HydrophobicContact CG-CB 4.42Å; Y735-D746 HydrophobicContact CE2-CB 4.34Å; Y735-D746 WeakPolarHBondContact CE2-OD2 3.37Å; Y735-D746 VanDerWaalsContact CZ-OD2 3.3Å; Y735-D746 PolarHBondContact OH-OD2 3.27Å; Y735-L781 HydrophobicContact CD1-CD2 4.18Å; Y735-L781 HydrophobicContact CE1-CD2 3.98Å
736	Y	89.6	Confident	89.5	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.008	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	13.9	179	-61.3	-84.5	0	0	0	113	C700 L703 L706 I727 Q731 N734 L781	C700-Y736 HydrophobicContact CB-CD1 4.13Å; L703-Y736 HydrophobicContact CD2-CD1 3.61Å; L703-Y736 HydrophobicContact CD2-CD2 4.25Å; L703-Y736 HydrophobicContact CD2-CE1 3.73Å; L703-Y736 HydrophobicContact CD2-CE2 4.35Å; L703-Y736 HydrophobicContact CD2-CG 3.89Å; L703-Y736 HydrophobicContact CG-CD1 4.41Å; L706-Y736 HydrophobicContact CD1-CE1 4.34Å; L706-Y736 WeakPolarHBondContact CD1-OH 3.39Å; I727-Y736 HydrophobicContact CB-CD2 4.21Å; I727-Y736 HydrophobicContact CB-CE2 4.4Å; I727-Y736 HydrophobicContact CG1-CD2 3.79Å; I727-Y736 HydrophobicContact CG1-CE2 3.78Å; I727-Y736 HydrophobicContact CG2-CD2 3.81Å; I727-Y736 HydrophobicContact CG2-CE2 4.47Å; Q731-Y736 HydrophobicContact CB-CE2 4.47Å; Q731-Y736 HydrophobicContact CG-CE2 4.11Å; N734-Y736 VanDerWaalsContact C-N 3.32Å; N734-Y736 PolarHBondContact O-N 2.98Å; Y736-L781 HydrophobicContact CD1-CD2 3.9Å; Y736-L781 HydrophobicContact CE1-CD2 3.68Å; Y736-L781 PolarHBondContact OH-O 3.31Å
737	G	85.3	Confident	89.4	Confident	3 Å²	3	49.7 Å²	49.7	3%	0.031	25%	0.248	C	C	.	.	S	Bend	trans	-63.8	169.3	177.6	0	0	0	0	0	113.2	N734 Y735 T739 V740	N734-G737 PolarHBondContact O-N 3.5Å; N734-G737 VanDerWaalsContact O-N 3.11Å; N734-G737 WeakPolarHBondContact OD1-CA 3.18Å; Y735-G737 VanDerWaalsContact C-N 3.3Å; G737-T739 PolarHBondContact O-N 3.39Å; G737-T739 VanDerWaalsContact O-N 3.13Å; G737-V740 VanDerWaalsContact O-CG1 3.28Å; G737-V740 WeakPolarHBondContact O-CG1 3.37Å; G737-V740 PolarHBondContact O-N 2.82Å
738	R	83.4	Confident	89.3	Confident	233 Å²	233	55 Å²	55	88%	0.879	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.2	-176.9	-64.9	-175	-175.4	-161.6	1.8	114.8
739	T	84.1	Confident	89.3	Confident	89 Å²	89	52.6 Å²	52.6	55%	0.546	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-8.6	-179.9	54.2	0	0	0	0	113.1	G737 L741	G737-T739 PolarHBondContact O-N 3.39Å; G737-T739 VanDerWaalsContact O-N 3.13Å; T739-L741 PolarHBondContact O-N 2.8Å
740	V	86.8	Confident	89.3	Confident	26 Å²	26	49.8 Å²	49.8	16%	0.158	24%	0.244	C	C	.	.			trans	43.4	33.8	-175.3	-69.5	0	0	0	0	112.9	G737 A742 A743 Q744 F777	G737-V740 VanDerWaalsContact O-CG1 3.28Å; G737-V740 WeakPolarHBondContact O-CG1 3.37Å; G737-V740 PolarHBondContact O-N 2.82Å; V740-A742 VanDerWaalsContact C-N 3.34Å; V740-A742 PolarHBondContact O-N 2.91Å; V740-A743 HydrophobicContact CB-CB 4.27Å; V740-A743 WeakPolarHBondContact O-CB 3.37Å; V740-A743 PolarHBondContact O-N 3.43Å; V740-A743 VanDerWaalsContact O-N 3.11Å; V740-Q744 WeakPolarHBondContact O-CG 3.42Å; V740-Q744 PolarHBondContact O-N 3.25Å; V740-F777 HydrophobicContact CB-CZ 4.12Å; V740-F777 HydrophobicContact CG2-CE2 4.41Å; V740-F777 HydrophobicContact CG2-CZ 3.87Å
741	L	87.2	Confident	89.2	Confident	111 Å²	111	50.5 Å²	50.5	58%	0.581	25%	0.247	S	C	*	.	H	α-helix	trans	-64	-39.3	-169.4	-178.2	66.1	0	0	0	111.7	T739 Q744 A745	T739-L741 PolarHBondContact O-N 2.8Å; L741-Q744 PolarHBondContact O-N 2.89Å; L741-A745 WeakPolarHBondContact O-CB 3.2Å; L741-A745 PolarHBondContact O-N 3.5Å
742	A	88.4	Confident	89.2	Confident	19 Å²	19	51.9 Å²	51.9	16%	0.157	26%	0.255	C	S	.	.	H	α-helix	trans	-68.6	-36.8	176.5	0	0	0	0	0	111.7	P732 Y735 V740 Q744 A745 D746 Y869	P732-A742 HydrophobicContact CB-CB 4.14Å; Y735-A742 HydrophobicContact CD2-CB 3.78Å; Y735-A742 HydrophobicContact CE2-CB 4.45Å; V740-A742 VanDerWaalsContact C-N 3.34Å; V740-A742 PolarHBondContact O-N 2.91Å; A742-Q744 VanDerWaalsContact C-N 3.35Å; A742-Q744 PolarHBondContact O-N 3.33Å; A742-A745 PolarHBondContact O-N 3.14Å; A742-D746 PolarHBondContact O-N 2.61Å; A742-Y869 PolarHBondContact O-OH 3.23Å
743	A	90.4	Very high	89.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-36.2	173.6	0	0	0	0	0	112.5	Y735 V740 D746 Q747 F777 L781	Y735-A743 HydrophobicContact CD1-CB 4.12Å; Y735-A743 HydrophobicContact CD2-CB 4.31Å; Y735-A743 HydrophobicContact CE1-CB 3.69Å; Y735-A743 VanDerWaalsContact CE2-CA 3.44Å; Y735-A743 HydrophobicContact CE2-CB 3.91Å; Y735-A743 HydrophobicContact CG-CB 4.42Å; V740-A743 HydrophobicContact CB-CB 4.27Å; V740-A743 WeakPolarHBondContact O-CB 3.37Å; V740-A743 PolarHBondContact O-N 3.43Å; V740-A743 VanDerWaalsContact O-N 3.11Å; A743-D746 WeakPolarHBondContact O-CB 3.33Å; A743-D746 PolarHBondContact O-N 2.99Å; A743-Q747 WeakPolarHBondContact O-CG 3.38Å; A743-Q747 PolarHBondContact O-N 2.93Å; A743-Q747 VanDerWaalsContact O-N 3.16Å; A743-Q747 PolarHBondContact O-NE2 3.09Å; A743-F777 HydrophobicContact CB-CD2 4.46Å; A743-F777 HydrophobicContact CB-CE2 3.69Å; A743-F777 HydrophobicContact CB-CZ 4.28Å; A743-L781 HydrophobicContact CB-CD2 4.3Å
744	Q	91.5	Very high	89.5	Confident	104 Å²	104	42.7 Å²	42.7	49%	0.486	21%	0.21	S	C	.	.	H	α-helix	trans	-67.2	-40.7	172.4	-69.8	177.7	-7.9	0	0	112.2	V740 L741 A742 D746 Q747 R748 F777	V740-Q744 WeakPolarHBondContact O-CG 3.42Å; V740-Q744 PolarHBondContact O-N 3.25Å; L741-Q744 PolarHBondContact O-N 2.89Å; A742-Q744 VanDerWaalsContact C-N 3.35Å; A742-Q744 PolarHBondContact O-N 3.33Å; Q744-D746 VanDerWaalsContact C-N 3.32Å; Q744-D746 PolarHBondContact O-N 3.43Å; Q744-Q747 WeakPolarHBondContact O-CB 3.37Å; Q744-Q747 PolarHBondContact O-N 2.96Å; Q744-Q747 VanDerWaalsContact O-N 3.15Å; Q744-R748 PolarHBondContact O-N 2.98Å; Q744-R748 VanDerWaalsContact O-N 3.13Å; Q744-F777 HydrophobicContact CG-CE2 4.42Å
745	A	90.9	Very high	89.9	Confident	33 Å²	33	42.7 Å²	42.7	27%	0.273	21%	0.207	S	C	.	.	H	α-helix	trans	-62.2	-40.2	174.7	0	0	0	0	0	111.4	L741 A742 Q747 R748 V749 Y869	L741-A745 WeakPolarHBondContact O-CB 3.2Å; L741-A745 PolarHBondContact O-N 3.5Å; A742-A745 PolarHBondContact O-N 3.14Å; A745-Q747 VanDerWaalsContact C-N 3.32Å; A745-Q747 PolarHBondContact O-N 3.36Å; A745-R748 WeakPolarHBondContact O-CB 3.38Å; A745-R748 PolarHBondContact O-N 3.44Å; A745-R748 VanDerWaalsContact O-N 3.13Å; A745-V749 WeakPolarHBondContact O-CG2 3.5Å; A745-V749 PolarHBondContact O-N 3.15Å; A745-Y869 HydrophobicContact CB-CE2 4.12Å; A745-Y869 WeakPolarHBondContact CB-OH 3.28Å
746	D	92.2	Very high	89.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.9	-39.9	171.2	-84.9	8.2	0	0	0	112.5	Y735 A742 A743 Q744 R748 V749 L750 F780 N805 F809 Y869	Y735-D746 HydrophobicContact CE2-CB 4.34Å; Y735-D746 WeakPolarHBondContact CE2-OD2 3.37Å; Y735-D746 VanDerWaalsContact CZ-OD2 3.3Å; Y735-D746 PolarHBondContact OH-OD2 3.27Å; A742-D746 PolarHBondContact O-N 2.61Å; A743-D746 WeakPolarHBondContact O-CB 3.33Å; A743-D746 PolarHBondContact O-N 2.99Å; Q744-D746 VanDerWaalsContact C-N 3.32Å; Q744-D746 PolarHBondContact O-N 3.43Å; D746-R748 VanDerWaalsContact C-N 3.3Å; D746-R748 PolarHBondContact O-N 3.4Å; D746-V749 PolarHBondContact O-N 3Å; D746-L750 WeakPolarHBondContact O-CB 3.31Å; D746-L750 PolarHBondContact O-N 3.48Å; D746-F780 HydrophobicContact CB-CD2 3.97Å; D746-F780 HydrophobicContact CB-CE2 4.15Å; D746-N805 PolarHBondContact OD1-ND2 3.08Å; D746-N805 PolarHBondContact OD2-ND2 2.89Å; D746-F809 HydrophobicContact CB-CE1 4.16Å; D746-F809 HydrophobicContact CB-CZ 3.84Å; D746-F809 VanDerWaalsContact CG-CZ 3.43Å; D746-F809 WeakPolarHBondContact O-CE1 3.38Å; D746-F809 WeakPolarHBondContact OD1-CZ 3.31Å; D746-Y869 WeakPolarHBondContact OD1-CE1 3.29Å; D746-Y869 PolarHBondContact OD1-OH 3.34Å; D746-Y869 VanDerWaalsContact OD1-OH 3.12Å
747	Q	93.7	Very high	89.7	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.028	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-42.1	175.1	-59.1	-44.3	-65.3	0	0	111.2	A743 Q744 A745 V749 L750 E751 T776 F777 F780	A743-Q747 WeakPolarHBondContact O-CG 3.38Å; A743-Q747 PolarHBondContact O-N 2.93Å; A743-Q747 VanDerWaalsContact O-N 3.16Å; A743-Q747 PolarHBondContact O-NE2 3.09Å; Q744-Q747 WeakPolarHBondContact O-CB 3.37Å; Q744-Q747 PolarHBondContact O-N 2.96Å; Q744-Q747 VanDerWaalsContact O-N 3.15Å; A745-Q747 VanDerWaalsContact C-N 3.32Å; A745-Q747 PolarHBondContact O-N 3.36Å; Q747-V749 PolarHBondContact O-N 2.99Å; Q747-L750 WeakPolarHBondContact O-CB 3.15Å; Q747-L750 PolarHBondContact O-N 3.39Å; Q747-E751 PolarHBondContact O-N 3.26Å; Q747-T776 VanDerWaalsContact OE1-C 3.22Å; Q747-T776 VanDerWaalsContact OE1-CB 3.31Å; Q747-T776 PolarHBondContact OE1-OG1 2.83Å; Q747-F777 HydrophobicContact CG-CB 4.3Å; Q747-F777 HydrophobicContact CG-CD2 3.85Å; Q747-F777 VanDerWaalsContact OE1-N 3.12Å; Q747-F780 VanDerWaalsContact NE2-CD2 3.34Å
748	R	91.9	Very high	89.9	Confident	114 Å²	114	48.3 Å²	48.3	43%	0.43	23%	0.232	S	C	.	.	H	α-helix	trans	-63.9	-41.2	176.5	-172.7	68.6	-171.5	111.5	24.5	112.1	Q744 A745 D746 L750 E751 D752	Q744-R748 PolarHBondContact O-N 2.98Å; Q744-R748 VanDerWaalsContact O-N 3.13Å; A745-R748 WeakPolarHBondContact O-CB 3.38Å; A745-R748 PolarHBondContact O-N 3.44Å; A745-R748 VanDerWaalsContact O-N 3.13Å; D746-R748 VanDerWaalsContact C-N 3.3Å; D746-R748 PolarHBondContact O-N 3.4Å; R748-L750 VanDerWaalsContact C-N 3.32Å; R748-L750 PolarHBondContact O-N 3.02Å; R748-E751 IonicContact CZ-OE2 3.17Å; R748-E751 IonicContact NH1-OE2 2.99Å; R748-E751 PolarHBondContact NH1-OE2 3.48Å; R748-E751 PolarHBondContact O-N 3.44Å; R748-D752 IonicContact CZ-OD1 2.95Å; R748-D752 IonicContact NH1-OD1 2.99Å; R748-D752 PolarHBondContact NH1-OD1 3.29Å; R748-D752 VanDerWaalsContact NH1-OD1 3.17Å; R748-D752 IonicContact NH2-OD1 3.86Å; R748-D752 PolarHBondContact NH2-OD1 3.44Å; R748-D752 IonicContact NH2-OD2 3.41Å; R748-D752 PolarHBondContact O-N 3.49Å; R748-D752 VanDerWaalsContact O-N 3.14Å
749	V	91.1	Very high	90.4	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.03	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-43.7	174.9	178.8	0	0	0	0	110.3	A745 D746 Q747 D752 L753 F809 Y866 Y869	A745-V749 WeakPolarHBondContact O-CG2 3.5Å; A745-V749 PolarHBondContact O-N 3.15Å; D746-V749 PolarHBondContact O-N 3Å; Q747-V749 PolarHBondContact O-N 2.99Å; V749-D752 PolarHBondContact O-N 3.19Å; V749-L753 HydrophobicContact CG1-CD1 4.1Å; V749-L753 HydrophobicContact CG1-CG 4.46Å; V749-L753 VanDerWaalsContact O-CG 3.31Å; V749-L753 WeakPolarHBondContact O-CG 3.49Å; V749-L753 PolarHBondContact O-N 3.32Å; V749-F809 HydrophobicContact CB-CE1 3.75Å; V749-F809 HydrophobicContact CB-CZ 4.23Å; V749-F809 HydrophobicContact CG1-CD1 4.18Å; V749-F809 HydrophobicContact CG1-CE1 3.7Å; V749-F809 HydrophobicContact CG1-CZ 4.13Å; V749-Y866 HydrophobicContact CB-CD1 4.36Å; V749-Y866 HydrophobicContact CB-CE1 3.93Å; V749-Y866 HydrophobicContact CG1-CD1 3.82Å; V749-Y866 HydrophobicContact CG1-CE1 3.81Å; V749-Y866 HydrophobicContact CG1-CG 4.31Å; V749-Y866 HydrophobicContact CG2-CD1 3.76Å; V749-Y866 HydrophobicContact CG2-CE1 3.31Å; V749-Y869 HydrophobicContact CG2-CD1 4Å; V749-Y869 HydrophobicContact CG2-CE1 3.79Å
750	L	92.8	Very high	90.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-45.2	177.4	-179.7	64.1	0	0	0	111.5	D746 Q747 R748 D752 L753 V754 L772 T776 F780 F809 A812	D746-L750 WeakPolarHBondContact O-CB 3.31Å; D746-L750 PolarHBondContact O-N 3.48Å; Q747-L750 WeakPolarHBondContact O-CB 3.15Å; Q747-L750 PolarHBondContact O-N 3.39Å; R748-L750 VanDerWaalsContact C-N 3.32Å; R748-L750 PolarHBondContact O-N 3.02Å; L750-D752 VanDerWaalsContact C-N 3.32Å; L750-D752 PolarHBondContact O-N 3.15Å; L750-L753 PolarHBondContact O-N 3.2Å; L750-V754 HydrophobicContact CD1-CG2 4.18Å; L750-V754 HydrophobicContact CG-CG2 4.27Å; L750-V754 WeakPolarHBondContact O-CG2 3.29Å; L750-V754 PolarHBondContact O-N 2.99Å; L750-L772 HydrophobicContact CD2-CD2 4.09Å; L750-L772 HydrophobicContact CG-CD2 4.21Å; L750-T776 HydrophobicContact CD2-CG2 3.63Å; L750-F780 HydrophobicContact CB-CE2 4.45Å; L750-F780 HydrophobicContact CB-CZ 4.41Å; L750-F780 HydrophobicContact CD1-CZ 4.37Å; L750-F780 HydrophobicContact CD2-CE1 4.41Å; L750-F780 HydrophobicContact CD2-CE2 4.36Å; L750-F780 HydrophobicContact CD2-CZ 3.81Å; L750-F780 HydrophobicContact CG-CZ 4.43Å; L750-F809 HydrophobicContact CB-CD1 4.26Å; L750-F809 HydrophobicContact CB-CE1 4.43Å; L750-A812 HydrophobicContact CD1-CB 3.94Å; L750-A812 HydrophobicContact CD2-CB 4.13Å
751	E	92.1	Very high	91.2	Very high	22 Å²	22	41.4 Å²	41.4	10%	0.103	21%	0.206	C	C	.	.	H	α-helix	trans	-55.6	-46	176.1	-73.5	-168.5	131.4	0	0	112.2	Q747 R748 L753 V754 Q755 R766	Q747-E751 PolarHBondContact O-N 3.26Å; R748-E751 IonicContact CZ-OE2 3.17Å; R748-E751 IonicContact NH1-OE2 2.99Å; R748-E751 PolarHBondContact NH1-OE2 3.48Å; R748-E751 PolarHBondContact O-N 3.44Å; E751-L753 VanDerWaalsContact C-N 3.35Å; E751-L753 PolarHBondContact O-N 3.48Å; E751-V754 PolarHBondContact O-N 2.67Å; E751-Q755 PolarHBondContact O-N 2.8Å; E751-R766 IonicContact OE1-CZ 2.73Å; E751-R766 IonicContact OE1-NH2 3.16Å; E751-R766 PolarHBondContact OE1-NH2 2.94Å; E751-R766 IonicContact OE2-NH2 3.74Å
752	D	91.4	Very high	91.6	Very high	35 Å²	35	38.2 Å²	38.2	19%	0.187	19%	0.186	C	C	.	.	H	α-helix	trans	-64.9	-39.1	178.6	-75.6	-4.5	0	0	0	111.5	R748 V749 L750 Q755 E756 Y866	R748-D752 IonicContact CZ-OD1 2.95Å; R748-D752 IonicContact NH1-OD1 2.99Å; R748-D752 PolarHBondContact NH1-OD1 3.29Å; R748-D752 VanDerWaalsContact NH1-OD1 3.17Å; R748-D752 IonicContact NH2-OD1 3.86Å; R748-D752 PolarHBondContact NH2-OD1 3.44Å; R748-D752 IonicContact NH2-OD2 3.41Å; R748-D752 PolarHBondContact O-N 3.49Å; R748-D752 VanDerWaalsContact O-N 3.14Å; V749-D752 PolarHBondContact O-N 3.19Å; L750-D752 VanDerWaalsContact C-N 3.32Å; L750-D752 PolarHBondContact O-N 3.15Å; D752-Q755 PolarHBondContact O-N 3.31Å; D752-E756 PolarHBondContact O-N 2.82Å; D752-Y866 HydrophobicContact CB-CE2 4.41Å; D752-Y866 PolarHBondContact OD2-OH 2.72Å
753	L	90.1	Very high	91.9	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-37.9	174.7	-71.1	173.5	0	0	0	112.3	V749 L750 E751 E756 K757 F809 L861	V749-L753 HydrophobicContact CG1-CD1 4.1Å; V749-L753 HydrophobicContact CG1-CG 4.46Å; V749-L753 VanDerWaalsContact O-CG 3.31Å; V749-L753 WeakPolarHBondContact O-CG 3.49Å; V749-L753 PolarHBondContact O-N 3.32Å; L750-L753 PolarHBondContact O-N 3.2Å; E751-L753 VanDerWaalsContact C-N 3.35Å; E751-L753 PolarHBondContact O-N 3.48Å; L753-E756 PolarHBondContact O-N 3.11Å; L753-K757 WeakPolarHBondContact O-CB 3.42Å; L753-K757 WeakPolarHBondContact O-CG 3.37Å; L753-K757 PolarHBondContact O-N 2.88Å; L753-F809 HydrophobicContact CD1-CB 3.99Å; L753-F809 HydrophobicContact CD1-CD1 3.95Å; L753-F809 HydrophobicContact CD1-CG 4.21Å; L753-L861 HydrophobicContact CD1-CD2 4.24Å; L753-L861 HydrophobicContact CD2-CD2 3.59Å
754	V	92	Very high	92.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-67.3	-42.2	176	177.3	0	0	0	0	109.8	L750 E751 E756 V758 V761 L772 L813 L816	L750-V754 HydrophobicContact CD1-CG2 4.18Å; L750-V754 HydrophobicContact CG-CG2 4.27Å; L750-V754 WeakPolarHBondContact O-CG2 3.29Å; L750-V754 PolarHBondContact O-N 2.99Å; E751-V754 PolarHBondContact O-N 2.67Å; V754-E756 VanDerWaalsContact C-N 3.33Å; V754-E756 PolarHBondContact O-N 3.35Å; V754-V758 CarbonylContact O-C 3.07Å; V754-V758 WeakPolarHBondContact O-CA 3.45Å; V754-V758 PolarHBondContact O-N 3.43Å; V754-V761 HydrophobicContact CG1-CG1 4.46Å; V754-L772 HydrophobicContact CG2-CD2 3.85Å; V754-L813 HydrophobicContact CG2-CD1 4.14Å; V754-L816 HydrophobicContact CG1-CD1 4.5Å; V754-L816 HydrophobicContact CG2-CD1 3.65Å
755	Q	92.6	Very high	92.3	Very high	92 Å²	92	36.9 Å²	36.9	43%	0.43	19%	0.187	S	C	.	.	H	α-helix	trans	-58.9	-42.2	174.1	-177.7	177.3	-1.2	0	0	112.1	E751 D752 P759 Y762	E751-Q755 PolarHBondContact O-N 2.8Å; D752-Q755 PolarHBondContact O-N 3.31Å; Q755-P759 WeakPolarHBondContact O-CB 3.21Å; Q755-Y762 HydrophobicContact CB-CD1 3.87Å; Q755-Y762 HydrophobicContact CB-CD2 3.91Å; Q755-Y762 HydrophobicContact CB-CE1 4.03Å; Q755-Y762 HydrophobicContact CB-CE2 4.09Å; Q755-Y762 HydrophobicContact CB-CG 3.8Å; Q755-Y762 HydrophobicContact CG-CD1 3.72Å; Q755-Y762 HydrophobicContact CG-CE1 3.73Å; Q755-Y762 HydrophobicContact CG-CG 4.18Å
756	E	88.7	Confident	92.4	Very high	82 Å²	82	40.2 Å²	40.2	38%	0.383	19%	0.193	S	C	.	.	H	α-helix	trans	-74.5	-46.9	-179.5	-168.4	-164.3	144.4	0	0	112.6	D752 L753 V754 I863	D752-E756 PolarHBondContact O-N 2.82Å; L753-E756 PolarHBondContact O-N 3.11Å; V754-E756 VanDerWaalsContact C-N 3.33Å; V754-E756 PolarHBondContact O-N 3.35Å; E756-I863 WeakPolarHBondContact OE2-CD1 3.47Å
757	K	86.1	Confident	92.5	Very high	39 Å²	39	48.9 Å²	48.9	17%	0.17	23%	0.227	C	C	.	.	H	α-helix	trans	-98.7	-24.7	-166.1	-57.5	-57.9	-167.3	-164.9	0	114.2	L753 P759 L813 L857 S860	L753-K757 WeakPolarHBondContact O-CB 3.42Å; L753-K757 WeakPolarHBondContact O-CG 3.37Å; L753-K757 PolarHBondContact O-N 2.88Å; K757-P759 VanDerWaalsContact C-CD 3.48Å; K757-L813 HydrophobicContact CB-CD1 4.16Å; K757-L813 HydrophobicContact CB-CD2 3.86Å; K757-L813 HydrophobicContact CB-CG 4.47Å; K757-L813 HydrophobicContact CG-CD2 3.88Å; K757-L857 HydrophobicContact CB-CD2 4.13Å; K757-L857 WeakPolarHBondContact CE-O 3.41Å; K757-S860 PolarHBondContact NZ-O 3.02Å; K757-S860 PolarHBondContact NZ-OG 3.41Å; K757-S860 VanDerWaalsContact NZ-OG 3.09Å
758	V	90.7	Very high	92.5	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	24%	0.236	C	C	.	.			trans	-135.5	58.8	178.3	-157.5	0	0	0	0	109.9	V754 K760 V761 Y762 L813 K817 E820	V754-V758 CarbonylContact O-C 3.07Å; V754-V758 WeakPolarHBondContact O-CA 3.45Å; V754-V758 PolarHBondContact O-N 3.43Å; V758-K760 PolarHBondContact O-N 3.35Å; V758-K760 VanDerWaalsContact O-N 3.11Å; V758-V761 HydrophobicContact CB-CB 4.36Å; V758-V761 HydrophobicContact CG1-CB 3.78Å; V758-V761 HydrophobicContact CG1-CG2 3.48Å; V758-V761 VanDerWaalsContact CG1-CG2 3.48Å; V758-V761 PolarHBondContact O-N 2.83Å; V758-V761 VanDerWaalsContact O-N 3.08Å; V758-Y762 PolarHBondContact O-N 3.11Å; V758-Y762 VanDerWaalsContact O-N 3.13Å; V758-L813 HydrophobicContact CG2-CD1 3.79Å; V758-K817 HydrophobicContact CG2-CB 4.15Å; V758-E820 HydrophobicContact CG1-CG 4.33Å
759	P	94.1	Very high	92.5	Very high	72 Å²	72	52.4 Å²	52.4	47%	0.468	25%	0.25	S	S	.	.	H	α-helix	trans	-60.8	-27.7	-170.2	22.9	-34.7	0	0	0	113.7	Q755 K757 Y762 A763	Q755-P759 WeakPolarHBondContact O-CB 3.21Å; K757-P759 VanDerWaalsContact C-CD 3.48Å; P759-Y762 PolarHBondContact O-N 2.85Å; P759-A763 WeakPolarHBondContact O-CB 3.23Å; P759-A763 PolarHBondContact O-N 3.33Å
760	K	94.2	Very high	92.5	Very high	130 Å²	130	52.4 Å²	52.4	57%	0.565	25%	0.25	S	S	*	.	H	α-helix	trans	-64.6	-46.4	176.5	-64.1	-177.2	-174.7	169.1	0	111.4	V758 A763 H764 E820 L824	V758-K760 PolarHBondContact O-N 3.35Å; V758-K760 VanDerWaalsContact O-N 3.11Å; K760-A763 PolarHBondContact O-N 2.88Å; K760-H764 WeakPolarHBondContact O-CB 3.37Å; K760-H764 PolarHBondContact O-N 3.33Å; K760-E820 WeakPolarHBondContact CD-OE1 3.35Å; K760-L824 HydrophobicContact CB-CD1 4.18Å; K760-L824 HydrophobicContact CB-CD2 4.3Å; K760-L824 HydrophobicContact CD-CD1 4.28Å
761	V	93.8	Very high	92.4	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-44.9	175.6	171.4	0	0	0	0	110	V754 V758 A763 H764 L765 E820 I823	V754-V761 HydrophobicContact CG1-CG1 4.46Å; V758-V761 HydrophobicContact CB-CB 4.36Å; V758-V761 HydrophobicContact CG1-CB 3.78Å; V758-V761 HydrophobicContact CG1-CG2 3.48Å; V758-V761 VanDerWaalsContact CG1-CG2 3.48Å; V758-V761 PolarHBondContact O-N 2.83Å; V758-V761 VanDerWaalsContact O-N 3.08Å; V761-A763 PolarHBondContact O-N 3.41Å; V761-H764 PolarHBondContact O-N 2.96Å; V761-L765 HydrophobicContact CG1-CD1 3.81Å; V761-L765 HydrophobicContact CG1-CG 4.29Å; V761-L765 WeakPolarHBondContact O-CG 3.35Å; V761-L765 PolarHBondContact O-N 2.72Å; V761-E820 HydrophobicContact CG2-CB 4.01Å; V761-E820 HydrophobicContact CG2-CG 3.76Å; V761-I823 HydrophobicContact CG1-CD1 4.23Å; V761-I823 HydrophobicContact CG1-CG2 4.09Å; V761-I823 HydrophobicContact CG2-CD1 4.46Å; V761-I823 HydrophobicContact CG2-CG2 4.36Å
762	Y	94.4	Very high	92.4	Very high	44 Å²	44	54.9 Å²	54.9	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-57.3	-49.6	176.6	-176.9	-103.7	0	0	0	112.5	Q755 V758 P759 H764 L765 R766	Q755-Y762 HydrophobicContact CB-CD1 3.87Å; Q755-Y762 HydrophobicContact CB-CD2 3.91Å; Q755-Y762 HydrophobicContact CB-CE1 4.03Å; Q755-Y762 HydrophobicContact CB-CE2 4.09Å; Q755-Y762 HydrophobicContact CB-CG 3.8Å; Q755-Y762 HydrophobicContact CG-CD1 3.72Å; Q755-Y762 HydrophobicContact CG-CE1 3.73Å; Q755-Y762 HydrophobicContact CG-CG 4.18Å; V758-Y762 PolarHBondContact O-N 3.11Å; V758-Y762 VanDerWaalsContact O-N 3.13Å; P759-Y762 PolarHBondContact O-N 2.85Å; Y762-H764 VanDerWaalsContact C-N 3.29Å; Y762-H764 PolarHBondContact O-N 2.7Å; Y762-L765 PolarHBondContact O-N 3.4Å; Y762-R766 HydrophobicContact CD1-CG 4.33Å; Y762-R766 HydrophobicContact CE1-CG 3.92Å; Y762-R766 HydrophobicContact CE2-CG 4.22Å; Y762-R766 WeakPolarHBondContact O-CG 3.47Å; Y762-R766 PolarHBondContact O-N 3.31Å; Y762-R766 PolarHBondContact OH-NE 2.81Å; Y762-R766 PolarHBondContact OH-NH2 3.34Å
763	A	95.1	Very high	92.5	Very high	59 Å²	59	54.5 Å²	54.5	49%	0.488	26%	0.264	S	S	.	.	H	α-helix	trans	-62.3	-37.6	178.9	0	0	0	0	0	112	P759 K760 V761 R766 Y767	P759-A763 WeakPolarHBondContact O-CB 3.23Å; P759-A763 PolarHBondContact O-N 3.33Å; K760-A763 PolarHBondContact O-N 2.88Å; V761-A763 PolarHBondContact O-N 3.41Å; A763-R766 PolarHBondContact O-N 3.46Å; A763-Y767 WeakPolarHBondContact O-CB 3.47Å; A763-Y767 PolarHBondContact O-N 3.45Å
764	H	95.5	Very high	92.5	Very high	29 Å²	29	59 Å²	59	13%	0.134	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-44.9	177.1	-163.9	80.3	0	0	0	112.1	K760 V761 Y762 R766 Y767 Y768 I823 L824 C826	K760-H764 WeakPolarHBondContact O-CB 3.37Å; K760-H764 PolarHBondContact O-N 3.33Å; V761-H764 PolarHBondContact O-N 2.96Å; Y762-H764 VanDerWaalsContact C-N 3.29Å; Y762-H764 PolarHBondContact O-N 2.7Å; H764-R766 VanDerWaalsContact C-N 3.34Å; H764-R766 PolarHBondContact O-N 3.47Å; H764-Y767 PolarHBondContact O-N 3.48Å; H764-Y768 AromaticContact CE1-CE2 3.4Å; H764-Y768 WeakPolarHBondContact CE1-CE2 3.21Å; H764-Y768 AromaticContact ND1-CE2 3.79Å; H764-Y768 AromaticContact NE2-CD2 3.9Å; H764-Y768 AromaticContact NE2-CE2 3.52Å; H764-Y768 VanDerWaalsContact O-CD2 3.31Å; H764-Y768 WeakPolarHBondContact O-CD2 3.25Å; H764-Y768 PolarHBondContact O-N 2.92Å; H764-Y768 VanDerWaalsContact O-N 3.13Å; H764-I823 PolarHBondContact CD2-O 2.91Å; H764-I823 PolarHBondContact NE2-O 2.9Å; H764-I823 VanDerWaalsContact NE2-O 3.08Å; H764-L824 HydrophobicContact CB-CD2 3.79Å; H764-L824 PolarHBondContact CE1-O 2.86Å; H764-C826 PolarHBondContact CE1-O 3.42Å; H764-C826 PolarHBondContact NE2-O 3Å
765	L	93.8	Very high	92.5	Very high	7 Å²	7	59.7 Å²	59.7	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-59.7	-44.9	174.7	-70	168	0	0	0	111.2	V761 Y762 Y767 Y768 D769 V770 L772 L832 L836	V761-L765 HydrophobicContact CG1-CD1 3.81Å; V761-L765 HydrophobicContact CG1-CG 4.29Å; V761-L765 WeakPolarHBondContact O-CG 3.35Å; V761-L765 PolarHBondContact O-N 2.72Å; Y762-L765 PolarHBondContact O-N 3.4Å; L765-Y767 PolarHBondContact O-N 3.07Å; L765-Y768 CarbonylContact O-C 3.57Å; L765-Y768 PolarHBondContact O-N 3.32Å; L765-D769 PolarHBondContact O-N 3.33Å; L765-V770 HydrophobicContact CD2-CB 4.07Å; L765-V770 HydrophobicContact CD2-CG1 3.98Å; L765-V770 PolarHBondContact O-N 3.33Å; L765-L772 HydrophobicContact CD1-CD1 4.47Å; L765-L832 HydrophobicContact CD2-CD1 4.26Å; L765-L832 HydrophobicContact CD2-CD2 3.71Å; L765-L832 HydrophobicContact CD2-CG 4.1Å; L765-L836 HydrophobicContact CD2-CD1 3.73Å
766	R	94	Very high	92.5	Very high	104 Å²	104	55.4 Å²	55.4	39%	0.392	28%	0.275	S	S	.	.	H	α-helix	trans	-65.7	-36	176	-70.8	-66.3	-175.7	-152.3	-9.8	112.9	E751 Y762 A763 H764 Y768 D769	E751-R766 IonicContact OE1-CZ 2.73Å; E751-R766 IonicContact OE1-NH2 3.16Å; E751-R766 PolarHBondContact OE1-NH2 2.94Å; E751-R766 IonicContact OE2-NH2 3.74Å; Y762-R766 HydrophobicContact CD1-CG 4.33Å; Y762-R766 HydrophobicContact CE1-CG 3.92Å; Y762-R766 HydrophobicContact CE2-CG 4.22Å; Y762-R766 WeakPolarHBondContact O-CG 3.47Å; Y762-R766 PolarHBondContact O-N 3.31Å; Y762-R766 PolarHBondContact OH-NE 2.81Å; Y762-R766 PolarHBondContact OH-NH2 3.34Å; A763-R766 PolarHBondContact O-N 3.46Å; H764-R766 VanDerWaalsContact C-N 3.34Å; H764-R766 PolarHBondContact O-N 3.47Å; R766-Y768 VanDerWaalsContact C-N 3.33Å; R766-Y768 PolarHBondContact O-N 2.95Å; R766-D769 PolarHBondContact O-N 2.82Å
767	Y	94.1	Very high	92.7	Very high	182 Å²	182	54.3 Å²	54.3	71%	0.714	27%	0.269	S	S	*	.	H	α-helix	trans	-64.3	-37.8	177.1	179.8	-96.8	0	0	0	112.4	A763 H764 L765	A763-Y767 WeakPolarHBondContact O-CB 3.47Å; A763-Y767 PolarHBondContact O-N 3.45Å; H764-Y767 PolarHBondContact O-N 3.48Å; L765-Y767 PolarHBondContact O-N 3.07Å
768	Y	93.2	Very high	93	Very high	56 Å²	56	55 Å²	55	22%	0.22	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	6.3	175.8	-69.4	-73.4	0	0	0	114.2	H764 L765 R766 V770 K827 L832	H764-Y768 AromaticContact CE1-CE2 3.4Å; H764-Y768 WeakPolarHBondContact CE1-CE2 3.21Å; H764-Y768 AromaticContact ND1-CE2 3.79Å; H764-Y768 AromaticContact NE2-CD2 3.9Å; H764-Y768 AromaticContact NE2-CE2 3.52Å; H764-Y768 VanDerWaalsContact O-CD2 3.31Å; H764-Y768 WeakPolarHBondContact O-CD2 3.25Å; H764-Y768 PolarHBondContact O-N 2.92Å; H764-Y768 VanDerWaalsContact O-N 3.13Å; L765-Y768 CarbonylContact O-C 3.57Å; L765-Y768 PolarHBondContact O-N 3.32Å; R766-Y768 VanDerWaalsContact C-N 3.33Å; R766-Y768 PolarHBondContact O-N 2.95Å; Y768-V770 VanDerWaalsContact C-N 3.26Å; Y768-V770 PolarHBondContact O-N 3.47Å; Y768-K827 WeakPolarHBondContact CE1-O 3.35Å; Y768-K827 WeakPolarHBondContact OH-CA 3.32Å; Y768-K827 PolarHBondContact OH-O 3.45Å; Y768-L832 HydrophobicContact CD2-CD2 4.28Å
769	D	91.9	Very high	93.1	Very high	138 Å²	138	55.1 Å²	55.1	74%	0.738	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	40.9	-177.9	-158.4	33	0	0	0	113.7	L765 R766	L765-D769 PolarHBondContact O-N 3.33Å; R766-D769 PolarHBondContact O-N 2.82Å
770	V	91.8	Very high	93.1	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.03	25%	0.252	C	S	.	.			trans	-97.2	114.2	178.2	176.8	0	0	0	0	109.6	L765 Y768 L772 F775 L832 L836	L765-V770 HydrophobicContact CD2-CB 4.07Å; L765-V770 HydrophobicContact CD2-CG1 3.98Å; L765-V770 PolarHBondContact O-N 3.33Å; Y768-V770 VanDerWaalsContact C-N 3.26Å; Y768-V770 PolarHBondContact O-N 3.47Å; V770-L772 PolarHBondContact O-N 2.9Å; V770-F775 HydrophobicContact CG1-CE2 3.84Å; V770-F775 HydrophobicContact CG1-CZ 4.36Å; V770-L832 HydrophobicContact CB-CD2 4.22Å; V770-L832 HydrophobicContact CG2-CD2 3.92Å; V770-L832 HydrophobicContact CG2-CG 4.32Å; V770-L836 HydrophobicContact CG1-CD1 3.99Å
771	D	91.7	Very high	93	Very high	67 Å²	67	46 Å²	46	36%	0.358	23%	0.228	S	C	.	.			trans	-76.7	121.3	173.6	-177.2	5	0	0	0	110.7	S773 V774	D771-S773 PolarHBondContact O-N 3.45Å; D771-S773 WeakPolarHBondContact OD1-CB 3.35Å; D771-S773 PolarHBondContact OD1-N 3.35Å; D771-S773 PolarHBondContact OD1-OG 3.41Å; D771-V774 HydrophobicContact CB-CG2 4.14Å; D771-V774 PolarHBondContact O-N 2.88Å
772	L	91.7	Very high	93	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-32.3	179.1	-176.8	62.4	0	0	0	111.7	L750 V754 L765 V770 V774 F775 T776 L816	L750-L772 HydrophobicContact CD2-CD2 4.09Å; L750-L772 HydrophobicContact CG-CD2 4.21Å; V754-L772 HydrophobicContact CG2-CD2 3.85Å; L765-L772 HydrophobicContact CD1-CD1 4.47Å; V770-L772 PolarHBondContact O-N 2.9Å; L772-V774 PolarHBondContact O-N 3.48Å; L772-V774 VanDerWaalsContact O-N 3.12Å; L772-F775 PolarHBondContact O-N 2.87Å; L772-T776 HydrophobicContact CD1-CG2 3.73Å; L772-T776 HydrophobicContact CD2-CG2 4.31Å; L772-T776 HydrophobicContact CG-CG2 3.71Å; L772-T776 PolarHBondContact O-N 3.18Å; L772-T776 VanDerWaalsContact O-N 3.11Å; L772-T776 PolarHBondContact O-OG1 3.49Å; L772-L816 HydrophobicContact CD1-CD1 4.24Å; L772-L816 HydrophobicContact CD1-CD2 4.22Å; L772-L816 HydrophobicContact CD2-CD1 3.88Å
773	S	92.4	Very high	93.1	Very high	26 Å²	26	43.9 Å²	43.9	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-58.4	-28.9	-176.5	-47.2	0	0	0	0	112.4	D771 F775 F777	D771-S773 PolarHBondContact O-N 3.45Å; D771-S773 WeakPolarHBondContact OD1-CB 3.35Å; D771-S773 PolarHBondContact OD1-N 3.35Å; D771-S773 PolarHBondContact OD1-OG 3.41Å; S773-F775 PolarHBondContact O-N 3.26Å; S773-F777 WeakPolarHBondContact O-CB 3.27Å; S773-F777 PolarHBondContact O-N 2.97Å; S773-F777 VanDerWaalsContact O-N 3.12Å
774	V	91.4	Very high	93	Very high	97 Å²	97	41.1 Å²	41.1	59%	0.588	20%	0.197	S	C	*	.	H	α-helix	trans	-58.8	-31.4	177.7	178.2	0	0	0	0	111.9	D771 L772	D771-V774 HydrophobicContact CB-CG2 4.14Å; D771-V774 PolarHBondContact O-N 2.88Å; L772-V774 PolarHBondContact O-N 3.48Å; L772-V774 VanDerWaalsContact O-N 3.12Å
775	F	91.3	Very high	92.8	Very high	15 Å²	15	40 Å²	40	7%	0.066	19%	0.192	C	C	.	.	H	α-helix	trans	-99.4	-49.3	-179.3	-46.3	-84.2	0	0	0	111.2	V770 L772 S773 F777 N778 W779 H833 L836 S837	V770-F775 HydrophobicContact CG1-CE2 3.84Å; V770-F775 HydrophobicContact CG1-CZ 4.36Å; L772-F775 PolarHBondContact O-N 2.87Å; S773-F775 PolarHBondContact O-N 3.26Å; F775-F777 VanDerWaalsContact C-N 3.3Å; F775-F777 PolarHBondContact O-N 3.41Å; F775-N778 PolarHBondContact O-N 3.35Å; F775-W779 HydrophobicContact CB-CZ2 4.32Å; F775-W779 PolarHBondContact O-NE1 3.22Å; F775-H833 AromaticContact CE1-ND1 3.98Å; F775-H833 HydrophobicContact CZ-CB 4.2Å; F775-H833 AromaticContact CZ-CE1 3.81Å; F775-H833 AromaticContact CZ-CG 3.8Å; F775-H833 AromaticContact CZ-ND1 3.29Å; F775-H833 VanDerWaalsContact CZ-ND1 3.29Å; F775-H833 WeakPolarHBondContact CZ-ND1 3.37Å; F775-L836 HydrophobicContact CD1-CB 4.01Å; F775-L836 HydrophobicContact CD2-CB 4.07Å; F775-L836 HydrophobicContact CD2-CD1 4.03Å; F775-L836 HydrophobicContact CE1-CB 3.93Å; F775-L836 HydrophobicContact CE2-CB 4Å; F775-L836 HydrophobicContact CE2-CD1 3.62Å; F775-L836 HydrophobicContact CE2-CG 4.49Å; F775-L836 HydrophobicContact CG-CB 4.07Å; F775-L836 HydrophobicContact CZ-CB 3.9Å; F775-L836 HydrophobicContact CZ-CD1 4.07Å; F775-S837 WeakPolarHBondContact CE1-OG 3.33Å
776	T	92.4	Very high	92.5	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-74.5	-19.5	-169.6	51.5	0	0	0	0	113.4	Q747 L750 L772 N778 W779 F780	Q747-T776 VanDerWaalsContact OE1-C 3.22Å; Q747-T776 VanDerWaalsContact OE1-CB 3.31Å; Q747-T776 PolarHBondContact OE1-OG1 2.83Å; L750-T776 HydrophobicContact CD2-CG2 3.63Å; L772-T776 HydrophobicContact CD1-CG2 3.73Å; L772-T776 HydrophobicContact CD2-CG2 4.31Å; L772-T776 HydrophobicContact CG-CG2 3.71Å; L772-T776 PolarHBondContact O-N 3.18Å; L772-T776 VanDerWaalsContact O-N 3.11Å; L772-T776 PolarHBondContact O-OG1 3.49Å; T776-N778 VanDerWaalsContact C-N 3.35Å; T776-N778 PolarHBondContact O-N 3.38Å; T776-W779 HydrophobicContact CG2-CD2 4.09Å; T776-W779 HydrophobicContact CG2-CE3 3.67Å; T776-W779 HydrophobicContact CG2-CH2 4.16Å; T776-W779 HydrophobicContact CG2-CZ3 3.73Å; T776-W779 WeakPolarHBondContact O-CB 3.39Å; T776-W779 PolarHBondContact O-N 3.28Å; T776-F780 PolarHBondContact O-N 2.98Å; T776-F780 VanDerWaalsContact O-N 3.08Å
777	F	92.9	Very high	92.2	Very high	59 Å²	59	39.2 Å²	39.2	26%	0.259	20%	0.195	S	C	.	.	H	α-helix	trans	-60	-45.5	175.5	-173.7	-100.7	0	0	0	111.8	V740 A743 Q744 Q747 S773 F775 F780 L781	V740-F777 HydrophobicContact CB-CZ 4.12Å; V740-F777 HydrophobicContact CG2-CE2 4.41Å; V740-F777 HydrophobicContact CG2-CZ 3.87Å; A743-F777 HydrophobicContact CB-CD2 4.46Å; A743-F777 HydrophobicContact CB-CE2 3.69Å; A743-F777 HydrophobicContact CB-CZ 4.28Å; Q744-F777 HydrophobicContact CG-CE2 4.42Å; Q747-F777 HydrophobicContact CG-CB 4.3Å; Q747-F777 HydrophobicContact CG-CD2 3.85Å; Q747-F777 VanDerWaalsContact OE1-N 3.12Å; S773-F777 WeakPolarHBondContact O-CB 3.27Å; S773-F777 PolarHBondContact O-N 2.97Å; S773-F777 VanDerWaalsContact O-N 3.12Å; F775-F777 VanDerWaalsContact C-N 3.3Å; F775-F777 PolarHBondContact O-N 3.41Å; F777-F780 PolarHBondContact O-N 3.44Å; F777-L781 HydrophobicContact CD1-CD1 3.72Å; F777-L781 HydrophobicContact CD1-CG 4.47Å; F777-L781 HydrophobicContact CE1-CD1 3.22Å; F777-L781 HydrophobicContact CE1-CG 4.17Å; F777-L781 HydrophobicContact CZ-CD1 3.69Å; F777-L781 HydrophobicContact CZ-CG 4.33Å; F777-L781 WeakPolarHBondContact O-CG 3.08Å; F777-L781 PolarHBondContact O-N 3.26Å; F777-L781 VanDerWaalsContact O-N 3.12Å
778	N	91.6	Very high	92	Very high	54 Å²	54	31 Å²	31	29%	0.289	16%	0.163	S	C	.	.	H	α-helix	trans	-70.2	-33.1	176.4	179.3	-104.7	0	0	0	112.4	F775 T776 F780 T782 N787	F775-N778 PolarHBondContact O-N 3.35Å; T776-N778 VanDerWaalsContact C-N 3.35Å; T776-N778 PolarHBondContact O-N 3.38Å; N778-F780 VanDerWaalsContact C-N 3.26Å; N778-F780 PolarHBondContact O-N 3.14Å; N778-T782 PolarHBondContact O-N 2.88Å; N778-T782 VanDerWaalsContact O-N 3.1Å; N778-T782 PolarHBondContact O-OG1 3.17Å; N778-N787 PolarHBondContact OD1-ND2 3.47Å; N778-N787 VanDerWaalsContact OD1-ND2 3.11Å; N778-N787 PolarHBondContact OD1-OD1 3.08Å; N778-N787 VanDerWaalsContact OD1-OD1 3.07Å
779	W	93.5	Very high	91.8	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-59.4	-42.1	176.5	-60.5	8	0	0	0	110.6	F775 T776 I783 F784 N787 F788 A812 I839	F775-W779 HydrophobicContact CB-CZ2 4.32Å; F775-W779 PolarHBondContact O-NE1 3.22Å; T776-W779 HydrophobicContact CG2-CD2 4.09Å; T776-W779 HydrophobicContact CG2-CE3 3.67Å; T776-W779 HydrophobicContact CG2-CH2 4.16Å; T776-W779 HydrophobicContact CG2-CZ3 3.73Å; T776-W779 WeakPolarHBondContact O-CB 3.39Å; T776-W779 PolarHBondContact O-N 3.28Å; W779-I783 CarbonylContact O-C 3.56Å; W779-I783 WeakPolarHBondContact O-CA 3.13Å; W779-I783 PolarHBondContact O-N 2.73Å; W779-F784 HydrophobicContact CB-CD1 3.84Å; W779-F784 HydrophobicContact CB-CE1 3.84Å; W779-F784 HydrophobicContact CB-CZ 4.45Å; W779-F784 HydrophobicContact CD2-CD1 4.32Å; W779-F784 HydrophobicContact CD2-CE1 4.07Å; W779-F784 HydrophobicContact CE3-CD1 4.29Å; W779-F784 AromaticContact CE3-CE1 3.62Å; W779-F784 HydrophobicContact CE3-CE1 3.62Å; W779-F784 HydrophobicContact CG-CD1 4.17Å; W779-F784 HydrophobicContact CG-CE1 4.21Å; W779-F784 PolarHBondContact O-N 2.92Å; W779-N787 WeakPolarHBondContact CA-OD1 3.5Å; W779-N787 HydrophobicContact CG-CB 4.29Å; W779-F788 HydrophobicContact CD2-CE2 4.32Å; W779-F788 HydrophobicContact CE3-CE2 4.39Å; W779-A812 HydrophobicContact CE3-CB 4.25Å; W779-A812 HydrophobicContact CZ3-CB 4.36Å; W779-I839 HydrophobicContact CH2-CG2 3.38Å; W779-I839 HydrophobicContact CZ2-CG2 3.26Å
780	F	94.5	Very high	91.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-77.2	-45.1	-177.2	-72.7	8.7	0	0	0	112.1	D746 Q747 L750 T776 F777 N778 T782 I783 F784 L808 F809 A812	D746-F780 HydrophobicContact CB-CD2 3.97Å; D746-F780 HydrophobicContact CB-CE2 4.15Å; Q747-F780 VanDerWaalsContact NE2-CD2 3.34Å; L750-F780 HydrophobicContact CB-CE2 4.45Å; L750-F780 HydrophobicContact CB-CZ 4.41Å; L750-F780 HydrophobicContact CD1-CZ 4.37Å; L750-F780 HydrophobicContact CD2-CE1 4.41Å; L750-F780 HydrophobicContact CD2-CE2 4.36Å; L750-F780 HydrophobicContact CD2-CZ 3.81Å; L750-F780 HydrophobicContact CG-CZ 4.43Å; T776-F780 PolarHBondContact O-N 2.98Å; T776-F780 VanDerWaalsContact O-N 3.08Å; F777-F780 PolarHBondContact O-N 3.44Å; N778-F780 VanDerWaalsContact C-N 3.26Å; N778-F780 PolarHBondContact O-N 3.14Å; F780-T782 PolarHBondContact O-N 2.99Å; F780-I783 PolarHBondContact O-N 3.3Å; F780-F784 HydrophobicContact CD1-CZ 4.46Å; F780-F784 HydrophobicContact CE1-CZ 4.27Å; F780-L808 HydrophobicContact CB-CD1 3.87Å; F780-L808 HydrophobicContact CD1-CB 3.82Å; F780-L808 HydrophobicContact CD1-CD1 4.21Å; F780-L808 HydrophobicContact CD2-CB 4.46Å; F780-L808 HydrophobicContact CD2-CD1 4.46Å; F780-L808 HydrophobicContact CE1-CB 3.74Å; F780-L808 HydrophobicContact CE2-CB 4.42Å; F780-L808 HydrophobicContact CG-CB 4.18Å; F780-L808 HydrophobicContact CG-CD1 3.95Å; F780-L808 HydrophobicContact CZ-CB 4.07Å; F780-F809 AromaticContact CE2-CD1 3.99Å; F780-F809 HydrophobicContact CE2-CD1 3.99Å; F780-F809 AromaticContact CE2-CE1 3.79Å; F780-F809 HydrophobicContact CE2-CE1 3.79Å; F780-F809 HydrophobicContact CE2-CZ 4.3Å; F780-F809 HydrophobicContact CZ-CD1 4.05Å; F780-F809 HydrophobicContact CZ-CE1 4.32Å; F780-A812 HydrophobicContact CE1-CB 3.72Å; F780-A812 HydrophobicContact CZ-CB 4.09Å
781	L	92.5	Very high	91.1	Very high	11 Å²	11	28.3 Å²	28.3	6%	0.058	15%	0.15	C	C	.	.	H	α-helix	trans	-59.7	-30	178.1	-77.4	-179.2	0	0	0	113.8	Y735 Y736 A743 F777	Y735-L781 HydrophobicContact CD1-CD2 4.18Å; Y735-L781 HydrophobicContact CE1-CD2 3.98Å; Y736-L781 HydrophobicContact CD1-CD2 3.9Å; Y736-L781 HydrophobicContact CE1-CD2 3.68Å; Y736-L781 PolarHBondContact OH-O 3.31Å; A743-L781 HydrophobicContact CB-CD2 4.3Å; F777-L781 HydrophobicContact CD1-CD1 3.72Å; F777-L781 HydrophobicContact CD1-CG 4.47Å; F777-L781 HydrophobicContact CE1-CD1 3.22Å; F777-L781 HydrophobicContact CE1-CG 4.17Å; F777-L781 HydrophobicContact CZ-CD1 3.69Å; F777-L781 HydrophobicContact CZ-CG 4.33Å; F777-L781 WeakPolarHBondContact O-CG 3.08Å; F777-L781 PolarHBondContact O-N 3.26Å; F777-L781 VanDerWaalsContact O-N 3.12Å
782	T	94.1	Very high	91	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	3.4	-178.5	65.4	0	0	0	0	113.4	R705 N778 F780 F784 V785	R705-T782 HydrophobicContact CB-CG2 4.24Å; R705-T782 HydrophobicContact CG-CG2 4.04Å; N778-T782 PolarHBondContact O-N 2.88Å; N778-T782 VanDerWaalsContact O-N 3.1Å; N778-T782 PolarHBondContact O-OG1 3.17Å; F780-T782 PolarHBondContact O-N 2.99Å; T782-F784 PolarHBondContact O-N 3.03Å; T782-V785 WeakPolarHBondContact O-CB 3.33Å; T782-V785 WeakPolarHBondContact O-CG2 3.18Å; T782-V785 PolarHBondContact O-N 3.2Å
783	I	95.4	Very high	91	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	49.8	-174.2	-46.6	173.1	0	0	0	110	L706 I726 W779 F780 V785 I796 W797 F800 L808	L706-I783 HydrophobicContact CD2-CB 4.34Å; L706-I783 HydrophobicContact CD2-CD1 3.74Å; L706-I783 HydrophobicContact CD2-CG1 3.8Å; I726-I783 HydrophobicContact CG2-CD1 4.01Å; W779-I783 CarbonylContact O-C 3.56Å; W779-I783 WeakPolarHBondContact O-CA 3.13Å; W779-I783 PolarHBondContact O-N 2.73Å; F780-I783 PolarHBondContact O-N 3.3Å; I783-V785 VanDerWaalsContact C-N 3.26Å; I783-V785 PolarHBondContact O-N 3.39Å; I783-V785 VanDerWaalsContact O-N 3.16Å; I783-I796 HydrophobicContact CG2-CG2 4.36Å; I783-W797 HydrophobicContact CB-CZ2 4.42Å; I783-W797 HydrophobicContact CD1-CZ2 4.01Å; I783-W797 HydrophobicContact CG2-CG 4.25Å; I783-W797 PolarHBondContact O-NE1 3.38Å; I783-F800 HydrophobicContact CD1-CD1 3.68Å; I783-F800 HydrophobicContact CD1-CE1 3.45Å; I783-F800 VanDerWaalsContact CD1-CE1 3.45Å; I783-F800 HydrophobicContact CD1-CE2 4.35Å; I783-F800 HydrophobicContact CD1-CG 4.24Å; I783-F800 HydrophobicContact CD1-CZ 3.83Å; I783-F800 HydrophobicContact CG2-CB 4.36Å; I783-F800 HydrophobicContact CG2-CD1 4.49Å; I783-F800 HydrophobicContact CG2-CD2 4.47Å; I783-F800 HydrophobicContact CG2-CG 4.17Å; I783-L808 HydrophobicContact CB-CD2 4.47Å; I783-L808 HydrophobicContact CG1-CD2 4.49Å; I783-L808 HydrophobicContact CG2-CD2 3.96Å
784	F	94.1	Very high	91	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	5.2	175.6	-58.5	-90.2	0	0	0	117.6	W779 F780 T782 D786 N787 F788 I796 L808 F811 A812	W779-F784 HydrophobicContact CB-CD1 3.84Å; W779-F784 HydrophobicContact CB-CE1 3.84Å; W779-F784 HydrophobicContact CB-CZ 4.45Å; W779-F784 HydrophobicContact CD2-CD1 4.32Å; W779-F784 HydrophobicContact CD2-CE1 4.07Å; W779-F784 HydrophobicContact CE3-CD1 4.29Å; W779-F784 AromaticContact CE3-CE1 3.62Å; W779-F784 HydrophobicContact CE3-CE1 3.62Å; W779-F784 HydrophobicContact CG-CD1 4.17Å; W779-F784 HydrophobicContact CG-CE1 4.21Å; W779-F784 PolarHBondContact O-N 2.92Å; F780-F784 HydrophobicContact CD1-CZ 4.46Å; F780-F784 HydrophobicContact CE1-CZ 4.27Å; T782-F784 PolarHBondContact O-N 3.03Å; F784-D786 VanDerWaalsContact C-N 3.28Å; F784-D786 PolarHBondContact O-N 3.17Å; F784-N787 PolarHBondContact O-N 3.41Å; F784-F788 HydrophobicContact CB-CB 4.24Å; F784-F788 HydrophobicContact CB-CD2 3.96Å; F784-F788 HydrophobicContact CB-CG 4.19Å; F784-F788 AromaticContact CD1-CD2 3.49Å; F784-F788 HydrophobicContact CD1-CD2 3.49Å; F784-F788 VanDerWaalsContact CD1-CD2 3.49Å; F784-F788 AromaticContact CD1-CE2 3.36Å; F784-F788 HydrophobicContact CD1-CE2 3.36Å; F784-F788 HydrophobicContact CD1-CG 4.22Å; F784-F788 AromaticContact CD1-CZ 3.93Å; F784-F788 HydrophobicContact CD1-CZ 3.93Å; F784-F788 HydrophobicContact CE1-CD2 4.41Å; F784-F788 AromaticContact CE1-CE2 3.85Å; F784-F788 HydrophobicContact CE1-CE2 3.85Å; F784-F788 HydrophobicContact CE1-CZ 4.09Å; F784-F788 HydrophobicContact CG-CD2 4.19Å; F784-F788 HydrophobicContact CG-CE2 4.43Å; F784-F788 PolarHBondContact O-N 3.01Å; F784-I796 HydrophobicContact CB-CD1 4.15Å; F784-I796 HydrophobicContact CD1-CD1 4.5Å; F784-I796 HydrophobicContact CD2-CD1 3.86Å; F784-I796 HydrophobicContact CD2-CG2 3.86Å; F784-I796 HydrophobicContact CE2-CD1 4.35Å; F784-I796 HydrophobicContact CE2-CG2 4.18Å; F784-I796 HydrophobicContact CG-CD1 3.93Å; F784-L808 HydrophobicContact CD2-CD2 4.3Å; F784-L808 HydrophobicContact CE2-CD2 3.87Å; F784-F811 HydrophobicContact CE2-CB 4.15Å; F784-F811 HydrophobicContact CZ-CB 4.02Å; F784-A812 HydrophobicContact CZ-CB 4.16Å
785	V	90.9	Very high	91	Very high	6 Å²	6	20.6 Å²	20.6	4%	0.036	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-36.1	-172.4	172.9	0	0	0	0	113.8	L666 R705 V709 T782 I783 Y793 W797	L666-V785 HydrophobicContact CD2-CG1 3.71Å; R705-V785 HydrophobicContact CB-CB 4.41Å; R705-V785 HydrophobicContact CB-CG1 4.25Å; V709-V785 HydrophobicContact CB-CG2 4.5Å; V709-V785 HydrophobicContact CG2-CB 4.34Å; V709-V785 HydrophobicContact CG2-CG1 3.69Å; V709-V785 HydrophobicContact CG2-CG2 3.61Å; T782-V785 WeakPolarHBondContact O-CB 3.33Å; T782-V785 WeakPolarHBondContact O-CG2 3.18Å; T782-V785 PolarHBondContact O-N 3.2Å; I783-V785 VanDerWaalsContact C-N 3.26Å; I783-V785 PolarHBondContact O-N 3.39Å; I783-V785 VanDerWaalsContact O-N 3.16Å; V785-Y793 HydrophobicContact CB-CD2 4.49Å; V785-Y793 HydrophobicContact CB-CE1 4.45Å; V785-Y793 HydrophobicContact CG1-CE1 4.19Å; V785-Y793 HydrophobicContact CG1-CE2 4.34Å; V785-Y793 HydrophobicContact CG2-CD2 3.81Å; V785-Y793 HydrophobicContact CG2-CE2 3.97Å; V785-Y793 HydrophobicContact CG2-CG 4.22Å; V785-Y793 VanDerWaalsContact O-CE1 3.26Å; V785-Y793 WeakPolarHBondContact O-CE1 3.31Å; V785-W797 HydrophobicContact CG2-CZ2 4.42Å
786	D	86.4	Confident	91	Very high	63 Å²	63	19.9 Å²	19.9	34%	0.337	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-16.6	-175.7	-70.6	-9.1	0	0	0	113.8	R705 F784	R705-D786 VanDerWaalsContact CD-OD1 3.26Å; R705-D786 WeakPolarHBondContact CD-OD1 3.32Å; R705-D786 IonicContact CZ-OD1 3.94Å; R705-D786 IonicContact CZ-OD2 3.75Å; R705-D786 IonicContact NE-OD1 3.78Å; R705-D786 IonicContact NE-OD2 2.84Å; R705-D786 PolarHBondContact NE-OD2 3.5Å; R705-D786 IonicContact NH1-OD1 2.67Å; R705-D786 PolarHBondContact NH1-OD1 2.87Å; R705-D786 IonicContact NH1-OD2 3.55Å; R705-D786 PolarHBondContact NH1-OD2 2.96Å; R705-D786 VanDerWaalsContact NH1-OD2 3.07Å; R705-D786 IonicContact NH2-OD2 2.79Å; F784-D786 VanDerWaalsContact C-N 3.28Å; F784-D786 PolarHBondContact O-N 3.17Å
787	N	87.8	Confident	91.1	Very high	31 Å²	31	19.9 Å²	19.9	17%	0.166	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-22.2	-168.8	-44.9	102.4	0	0	0	112	N778 W779 F784 G840	N778-N787 PolarHBondContact OD1-ND2 3.47Å; N778-N787 VanDerWaalsContact OD1-ND2 3.11Å; N778-N787 PolarHBondContact OD1-OD1 3.08Å; N778-N787 VanDerWaalsContact OD1-OD1 3.07Å; W779-N787 WeakPolarHBondContact CA-OD1 3.5Å; W779-N787 HydrophobicContact CG-CB 4.29Å; F784-N787 PolarHBondContact O-N 3.41Å; N787-G840 CarbonylContact O-C 3.34Å; N787-G840 WeakPolarHBondContact O-CA 3.34Å
788	F	90.8	Very high	91.1	Very high	9 Å²	9	17.1 Å²	17.1	4%	0.039	9%	0.088	C	C	.	.	S	Bend	trans	-118.1	154.8	-178.1	-77.1	-119.1	0	0	0	110.1	W779 F784 T792 Y793 A815 L843 L849	W779-F788 HydrophobicContact CD2-CE2 4.32Å; W779-F788 HydrophobicContact CE3-CE2 4.39Å; F784-F788 HydrophobicContact CB-CB 4.24Å; F784-F788 HydrophobicContact CB-CD2 3.96Å; F784-F788 HydrophobicContact CB-CG 4.19Å; F784-F788 AromaticContact CD1-CD2 3.49Å; F784-F788 HydrophobicContact CD1-CD2 3.49Å; F784-F788 VanDerWaalsContact CD1-CD2 3.49Å; F784-F788 AromaticContact CD1-CE2 3.36Å; F784-F788 HydrophobicContact CD1-CE2 3.36Å; F784-F788 HydrophobicContact CD1-CG 4.22Å; F784-F788 AromaticContact CD1-CZ 3.93Å; F784-F788 HydrophobicContact CD1-CZ 3.93Å; F784-F788 HydrophobicContact CE1-CD2 4.41Å; F784-F788 AromaticContact CE1-CE2 3.85Å; F784-F788 HydrophobicContact CE1-CE2 3.85Å; F784-F788 HydrophobicContact CE1-CZ 4.09Å; F784-F788 HydrophobicContact CG-CD2 4.19Å; F784-F788 HydrophobicContact CG-CE2 4.43Å; F784-F788 PolarHBondContact O-N 3.01Å; F788-T792 HydrophobicContact CD1-CG2 3.82Å; F788-Y793 VanDerWaalsContact O-CD1 3.28Å; F788-Y793 WeakPolarHBondContact O-CD1 3.34Å; F788-A815 HydrophobicContact CE1-CB 4.24Å; F788-A815 HydrophobicContact CZ-CB 3.78Å; F788-L843 HydrophobicContact CD1-CB 4.16Å; F788-L843 HydrophobicContact CD1-CD1 4.44Å; F788-L843 HydrophobicContact CE1-CB 3.99Å; F788-L843 HydrophobicContact CE1-CD1 3.5Å; F788-L843 VanDerWaalsContact CE1-CD1 3.5Å; F788-L843 HydrophobicContact CE1-CG 4.39Å; F788-L843 HydrophobicContact CZ-CD1 3.84Å; F788-L849 HydrophobicContact CE1-CD2 4.32Å
789	P	88.3	Confident	91.1	Very high	25 Å²	25	14.6 Å²	14.6	16%	0.162	8%	0.075	C	C	.	.			trans	-64.3	151.1	172.9	27.2	-35.4	0	0	0	110.6	Q791 T792 Y793 G840	P789-Q791 PolarHBondContact O-N 3.45Å; P789-T792 WeakPolarHBondContact O-CA 3.22Å; P789-T792 PolarHBondContact O-N 2.89Å; P789-Y793 WeakPolarHBondContact O-CD1 3.28Å; P789-Y793 PolarHBondContact O-N 3.11Å; P789-G840 WeakPolarHBondContact CD-O 3.01Å
790	H	87.5	Confident	91.1	Very high	32 Å²	32	14.4 Å²	14.4	15%	0.148	7%	0.074	C	C	.	.	H	α-helix	trans	-60.1	-33	-175.5	66.7	-96.7	0	0	0	113.7	D528 F532 T792 Y793 L794	D528-H790 IonicContact OD2-CE1 2.82Å; D528-H790 IonicContact OD2-NE2 2.93Å; D528-H790 PolarHBondContact OD2-NE2 3.07Å; F532-H790 HydrophobicContact CD2-CB 4.28Å; F532-H790 AromaticContact CD2-CD2 3.91Å; F532-H790 AromaticContact CD2-CG 3.79Å; F532-H790 AromaticContact CD2-ND1 3.89Å; F532-H790 HydrophobicContact CE1-CB 4.4Å; F532-H790 HydrophobicContact CE2-CB 3.91Å; F532-H790 AromaticContact CE2-CG 3.92Å; F532-H790 AromaticContact CG-ND1 3.8Å; F532-H790 HydrophobicContact CZ-CB 3.98Å; H790-T792 PolarHBondContact O-N 2.84Å; H790-T792 VanDerWaalsContact O-N 3.16Å; H790-Y793 VanDerWaalsContact CA-CD1 3.5Å; H790-Y793 HydrophobicContact CB-CD1 4.36Å; H790-Y793 HydrophobicContact CB-CE1 3.57Å; H790-Y793 HydrophobicContact CB-CE2 4.34Å; H790-Y793 WeakPolarHBondContact CB-OH 3.19Å; H790-L794 HydrophobicContact CB-CD1 4.38Å; H790-L794 WeakPolarHBondContact O-CB 3.39Å; H790-L794 WeakPolarHBondContact O-CD1 3.44Å; H790-L794 WeakPolarHBondContact O-CG 3.42Å; H790-L794 PolarHBondContact O-N 2.91Å; H790-L794 VanDerWaalsContact O-N 3.1Å
791	Q	83	Confident	91.1	Very high	87 Å²	87	14.5 Å²	14.5	41%	0.407	7%	0.074	S	C	.	.	H	α-helix	trans	-63.3	-22.6	175.1	-57.3	89	-11.7	0	0	112.6	P789 N795	P789-Q791 PolarHBondContact O-N 3.45Å; Q791-N795 PolarHBondContact O-OD1 3.35Å; Q791-N795 VanDerWaalsContact O-OD1 3.06Å
792	T	88.6	Confident	91	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-96.4	-51.2	179.8	-57.7	0	0	0	0	111.6	F788 P789 H790 L794 N795 I796 L843 L849	F788-T792 HydrophobicContact CD1-CG2 3.82Å; P789-T792 WeakPolarHBondContact O-CA 3.22Å; P789-T792 PolarHBondContact O-N 2.89Å; H790-T792 PolarHBondContact O-N 2.84Å; H790-T792 VanDerWaalsContact O-N 3.16Å; T792-L794 VanDerWaalsContact C-N 3.29Å; T792-L794 PolarHBondContact O-N 3.13Å; T792-N795 PolarHBondContact O-N 3Å; T792-N795 VanDerWaalsContact O-N 3.15Å; T792-I796 HydrophobicContact CG2-CD1 4.28Å; T792-I796 WeakPolarHBondContact O-CG1 3.08Å; T792-I796 PolarHBondContact O-N 3.49Å; T792-I796 VanDerWaalsContact O-N 3.08Å; T792-L843 WeakPolarHBondContact CB-O 3.49Å; T792-L843 WeakPolarHBondContact CG2-O 3.37Å; T792-L843 PolarHBondContact OG1-O 2.95Å; T792-L849 HydrophobicContact CG2-CD2 3.74Å
793	Y	92.5	Very high	90.8	Very high	4 Å²	4	16 Å²	16	2%	0.016	8%	0.082	C	C	.	.	H	α-helix	trans	-65.7	-32.3	-178.1	72.6	-115.6	0	0	0	112.1	F532 V709 V785 F788 P789 H790 N795 I796 W797	F532-Y793 VanDerWaalsContact CZ-OH 3.24Å; F532-Y793 WeakPolarHBondContact CZ-OH 3.27Å; V709-Y793 HydrophobicContact CG1-CE2 4.26Å; V709-Y793 HydrophobicContact CG2-CE2 3.87Å; V785-Y793 HydrophobicContact CB-CD2 4.49Å; V785-Y793 HydrophobicContact CB-CE1 4.45Å; V785-Y793 HydrophobicContact CG1-CE1 4.19Å; V785-Y793 HydrophobicContact CG1-CE2 4.34Å; V785-Y793 HydrophobicContact CG2-CD2 3.81Å; V785-Y793 HydrophobicContact CG2-CE2 3.97Å; V785-Y793 HydrophobicContact CG2-CG 4.22Å; V785-Y793 VanDerWaalsContact O-CE1 3.26Å; V785-Y793 WeakPolarHBondContact O-CE1 3.31Å; F788-Y793 VanDerWaalsContact O-CD1 3.28Å; F788-Y793 WeakPolarHBondContact O-CD1 3.34Å; P789-Y793 WeakPolarHBondContact O-CD1 3.28Å; P789-Y793 PolarHBondContact O-N 3.11Å; H790-Y793 VanDerWaalsContact CA-CD1 3.5Å; H790-Y793 HydrophobicContact CB-CD1 4.36Å; H790-Y793 HydrophobicContact CB-CE1 3.57Å; H790-Y793 HydrophobicContact CB-CE2 4.34Å; H790-Y793 WeakPolarHBondContact CB-OH 3.19Å; Y793-N795 PolarHBondContact O-N 3.31Å; Y793-I796 CarbonylContact O-C 3.49Å; Y793-I796 WeakPolarHBondContact O-CA 3.43Å; Y793-I796 WeakPolarHBondContact O-CB 3.25Å; Y793-I796 PolarHBondContact O-N 2.89Å; Y793-I796 VanDerWaalsContact O-N 3.07Å; Y793-W797 VanDerWaalsContact O-CD1 3.23Å; Y793-W797 PolarHBondContact O-N 2.94Å
794	L	92.4	Very high	90.5	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-63	-32.7	176.9	-70.5	173.9	0	0	0	111.9	L530 R612 W616 V709 Y713 H790 T792 W797 D798	L530-L794 HydrophobicContact CD1-CD1 3.65Å; R612-L794 PolarHBondContact NH2-O 3.48Å; W616-L794 HydrophobicContact CH2-CD2 3.81Å; W616-L794 HydrophobicContact CZ2-CD2 4.43Å; V709-L794 HydrophobicContact CG1-CD2 3.82Å; Y713-L794 HydrophobicContact CE2-CD1 4.15Å; Y713-L794 HydrophobicContact CE2-CD2 3.82Å; H790-L794 HydrophobicContact CB-CD1 4.38Å; H790-L794 WeakPolarHBondContact O-CB 3.39Å; H790-L794 WeakPolarHBondContact O-CD1 3.44Å; H790-L794 WeakPolarHBondContact O-CG 3.42Å; H790-L794 PolarHBondContact O-N 2.91Å; H790-L794 VanDerWaalsContact O-N 3.1Å; T792-L794 VanDerWaalsContact C-N 3.29Å; T792-L794 PolarHBondContact O-N 3.13Å; L794-W797 WeakPolarHBondContact O-CB 3.3Å; L794-W797 PolarHBondContact O-N 2.97Å; L794-D798 PolarHBondContact O-N 3.09Å; L794-D798 VanDerWaalsContact O-N 3.13Å
795	N	90.7	Very high	90.4	Very high	28 Å²	28	17 Å²	17	15%	0.15	9%	0.088	C	C	.	.	H	α-helix	trans	-77.6	-30	174.6	-72.8	56.7	0	0	0	112.5	R612 Q791 T792 Y793 W797 D798 C799 Y846	R612-N795 PolarHBondContact NH2-OD1 3.18Å; Q791-N795 PolarHBondContact O-OD1 3.35Å; Q791-N795 VanDerWaalsContact O-OD1 3.06Å; T792-N795 PolarHBondContact O-N 3Å; T792-N795 VanDerWaalsContact O-N 3.15Å; Y793-N795 PolarHBondContact O-N 3.31Å; N795-W797 VanDerWaalsContact C-N 3.32Å; N795-D798 PolarHBondContact O-N 3.39Å; N795-C799 PolarHBondContact O-N 3.21Å; N795-Y846 HydrophobicContact CB-CD1 3.92Å; N795-Y846 HydrophobicContact CB-CD2 3.27Å; N795-Y846 HydrophobicContact CB-CE1 4.05Å; N795-Y846 HydrophobicContact CB-CE2 3.42Å; N795-Y846 VanDerWaalsContact CB-CE2 3.42Å; N795-Y846 HydrophobicContact CB-CG 3.54Å; N795-Y846 WeakPolarHBondContact ND2-CD1 3.46Å
796	I	92	Very high	90.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64	-42.2	168.9	-63.2	173.4	0	0	0	109.8	I783 F784 T792 Y793 D798 C799 F800 I807 F811 L849	I783-I796 HydrophobicContact CG2-CG2 4.36Å; F784-I796 HydrophobicContact CB-CD1 4.15Å; F784-I796 HydrophobicContact CD1-CD1 4.5Å; F784-I796 HydrophobicContact CD2-CD1 3.86Å; F784-I796 HydrophobicContact CD2-CG2 3.86Å; F784-I796 HydrophobicContact CE2-CD1 4.35Å; F784-I796 HydrophobicContact CE2-CG2 4.18Å; F784-I796 HydrophobicContact CG-CD1 3.93Å; T792-I796 HydrophobicContact CG2-CD1 4.28Å; T792-I796 WeakPolarHBondContact O-CG1 3.08Å; T792-I796 PolarHBondContact O-N 3.49Å; T792-I796 VanDerWaalsContact O-N 3.08Å; Y793-I796 CarbonylContact O-C 3.49Å; Y793-I796 WeakPolarHBondContact O-CA 3.43Å; Y793-I796 WeakPolarHBondContact O-CB 3.25Å; Y793-I796 PolarHBondContact O-N 2.89Å; Y793-I796 VanDerWaalsContact O-N 3.07Å; I796-D798 PolarHBondContact O-N 3.38Å; I796-C799 PolarHBondContact O-N 2.96Å; I796-F800 WeakPolarHBondContact O-CB 3.4Å; I796-F800 PolarHBondContact O-N 3.36Å; I796-I807 HydrophobicContact CG2-CG2 4.09Å; I796-F811 HydrophobicContact CB-CD2 4.22Å; I796-F811 HydrophobicContact CB-CE2 4.32Å; I796-F811 HydrophobicContact CD1-CB 4.08Å; I796-F811 HydrophobicContact CD1-CD1 4.16Å; I796-F811 HydrophobicContact CD1-CD2 4.45Å; I796-F811 HydrophobicContact CD1-CG 3.99Å; I796-F811 HydrophobicContact CG1-CB 4.4Å; I796-F811 HydrophobicContact CG1-CD1 3.89Å; I796-F811 HydrophobicContact CG1-CD2 3.86Å; I796-F811 HydrophobicContact CG1-CE1 4.09Å; I796-F811 HydrophobicContact CG1-CE2 4.04Å; I796-F811 HydrophobicContact CG1-CG 3.79Å; I796-F811 HydrophobicContact CG1-CZ 4.17Å; I796-F811 HydrophobicContact CG2-CD2 3.69Å; I796-F811 HydrophobicContact CG2-CE2 4.13Å; I796-F811 HydrophobicContact CG2-CG 4.24Å; I796-L849 HydrophobicContact CD1-CD2 4.32Å
797	W	94.4	Very high	90.5	Very high	1 Å²	1	17.4 Å²	17.4	0%	0.004	9%	0.087	C	C	.	.	H	α-helix	trans	-58.2	-44.2	175.2	-91.1	65.9	0	0	0	112.5	W616 L706 V709 I726 I783 V785 Y793 L794 N795 C799 F800 L801	W616-W797 HydrophobicContact CH2-CB 3.94Å; W616-W797 HydrophobicContact CH2-CD2 4.21Å; W616-W797 AromaticContact CH2-CE3 3.84Å; W616-W797 HydrophobicContact CH2-CE3 3.84Å; W616-W797 HydrophobicContact CH2-CG 4.29Å; W616-W797 HydrophobicContact CZ2-CB 3.6Å; W616-W797 HydrophobicContact CZ2-CE3 4.35Å; W616-W797 HydrophobicContact CZ2-CG 4.41Å; W616-W797 AromaticContact CZ3-CE3 3.99Å; W616-W797 HydrophobicContact CZ3-CE3 3.99Å; W616-W797 HydrophobicContact CZ3-CZ3 4.47Å; L706-W797 HydrophobicContact CB-CH2 4.14Å; L706-W797 HydrophobicContact CB-CZ2 4.33Å; L706-W797 HydrophobicContact CD2-CH2 4.26Å; L706-W797 HydrophobicContact CD2-CZ2 3.7Å; L706-W797 WeakPolarHBondContact O-CH2 3.37Å; V709-W797 HydrophobicContact CB-CH2 4.21Å; V709-W797 HydrophobicContact CB-CZ2 4.02Å; V709-W797 HydrophobicContact CG1-CD2 3.9Å; V709-W797 HydrophobicContact CG1-CE3 4.1Å; V709-W797 HydrophobicContact CG1-CG 4.48Å; V709-W797 HydrophobicContact CG1-CH2 4.19Å; V709-W797 HydrophobicContact CG1-CZ2 3.99Å; V709-W797 HydrophobicContact CG1-CZ3 4.23Å; I726-W797 HydrophobicContact CD1-CH2 3.51Å; I726-W797 HydrophobicContact CD1-CZ2 4.48Å; I726-W797 HydrophobicContact CD1-CZ3 3.56Å; I783-W797 HydrophobicContact CB-CZ2 4.42Å; I783-W797 HydrophobicContact CD1-CZ2 4.01Å; I783-W797 HydrophobicContact CG2-CG 4.25Å; I783-W797 PolarHBondContact O-NE1 3.38Å; V785-W797 HydrophobicContact CG2-CZ2 4.42Å; Y793-W797 VanDerWaalsContact O-CD1 3.23Å; Y793-W797 PolarHBondContact O-N 2.94Å; L794-W797 WeakPolarHBondContact O-CB 3.3Å; L794-W797 PolarHBondContact O-N 2.97Å; N795-W797 VanDerWaalsContact C-N 3.32Å; W797-C799 VanDerWaalsContact C-N 3.27Å; W797-C799 PolarHBondContact O-N 3.29Å; W797-F800 PolarHBondContact O-N 3.09Å; W797-F800 VanDerWaalsContact O-N 3.12Å; W797-L801 HydrophobicContact CE3-CD1 4.33Å; W797-L801 WeakPolarHBondContact O-CG 3.39Å; W797-L801 PolarHBondContact O-N 3.34Å
798	D	92.6	Very high	90.7	Very high	1 Å²	1	16 Å²	16	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-52.8	-47.3	175.3	-60.9	-29.2	0	0	0	111.6	I603 V607 R612 W616 L794 N795 I796	I603-D798 VanDerWaalsContact CG2-C 3.49Å; I603-D798 HydrophobicContact CG2-CB 3.99Å; I603-D798 VanDerWaalsContact CG2-O 3.28Å; I603-D798 WeakPolarHBondContact CG2-O 3.45Å; V607-D798 WeakPolarHBondContact CB-OD2 3.2Å; V607-D798 HydrophobicContact CG2-CB 3.67Å; V607-D798 VanDerWaalsContact CG2-CG 3.41Å; V607-D798 WeakPolarHBondContact CG2-OD2 3.07Å; V607-D798 PolarHBondContact N-OD2 3.23Å; R612-D798 IonicContact CZ-OD1 3.86Å; R612-D798 IonicContact CZ-OD2 3.88Å; R612-D798 IonicContact NE-OD1 3.94Å; R612-D798 PolarHBondContact NE-OD1 3.41Å; R612-D798 IonicContact NE-OD2 3.86Å; R612-D798 PolarHBondContact NE-OD2 3.49Å; R612-D798 IonicContact NH2-OD1 3.39Å; R612-D798 IonicContact NH2-OD2 3.73Å; R612-D798 PolarHBondContact NH2-OD2 3.06Å; W616-D798 PolarHBondContact NE1-OD1 2.91Å; L794-D798 PolarHBondContact O-N 3.09Å; L794-D798 VanDerWaalsContact O-N 3.13Å; N795-D798 PolarHBondContact O-N 3.39Å; I796-D798 PolarHBondContact O-N 3.38Å
799	C	91.5	Very high	90.8	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.014	8%	0.077	C	C	.	.	H	α-helix	trans	-70.2	-40.1	178.3	-67.4	0	0	0	0	112.1	I603 N795 I796 W797 L802 E803 I807 F811 Y846	I603-C799 HydrophobicContact CG2-CB 4.49Å; N795-C799 PolarHBondContact O-N 3.21Å; I796-C799 PolarHBondContact O-N 2.96Å; W797-C799 VanDerWaalsContact C-N 3.27Å; W797-C799 PolarHBondContact O-N 3.29Å; C799-L802 PolarHBondContact O-N 3.39Å; C799-E803 PolarHBondContact O-N 3.33Å; C799-I807 HydrophobicContact CB-CD1 4.04Å; C799-I807 HydrophobicContact CB-CG1 4.18Å; C799-I807 HydrophobicContact CB-CG2 3.96Å; C799-F811 HydrophobicContact CB-CE2 4.19Å; C799-Y846 PolarHBondContact SG-OH 2.93Å
800	F	94.1	Very high	90.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.6	-44	-177.9	176.4	-92.1	0	0	0	111.6	I726 L730 Q731 I783 I796 W797 L802 G804 I807 L808	I726-F800 HydrophobicContact CG1-CE1 4.13Å; I726-F800 HydrophobicContact CG2-CE1 4.02Å; I726-F800 HydrophobicContact CG2-CZ 4.31Å; L730-F800 HydrophobicContact CB-CE1 3.88Å; L730-F800 HydrophobicContact CB-CZ 3.79Å; L730-F800 HydrophobicContact CD1-CD1 4.2Å; L730-F800 HydrophobicContact CD1-CE1 3.73Å; L730-F800 HydrophobicContact CD1-CZ 4.49Å; L730-F800 HydrophobicContact CG-CE1 4.39Å; Q731-F800 HydrophobicContact CG-CZ 4.12Å; I783-F800 HydrophobicContact CD1-CD1 3.68Å; I783-F800 HydrophobicContact CD1-CE1 3.45Å; I783-F800 VanDerWaalsContact CD1-CE1 3.45Å; I783-F800 HydrophobicContact CD1-CE2 4.35Å; I783-F800 HydrophobicContact CD1-CG 4.24Å; I783-F800 HydrophobicContact CD1-CZ 3.83Å; I783-F800 HydrophobicContact CG2-CB 4.36Å; I783-F800 HydrophobicContact CG2-CD1 4.49Å; I783-F800 HydrophobicContact CG2-CD2 4.47Å; I783-F800 HydrophobicContact CG2-CG 4.17Å; I796-F800 WeakPolarHBondContact O-CB 3.4Å; I796-F800 PolarHBondContact O-N 3.36Å; W797-F800 PolarHBondContact O-N 3.09Å; W797-F800 VanDerWaalsContact O-N 3.12Å; F800-L802 PolarHBondContact O-N 3.36Å; F800-G804 VanDerWaalsContact O-CA 3.29Å; F800-G804 WeakPolarHBondContact O-CA 3.42Å; F800-G804 PolarHBondContact O-N 2.95Å; F800-I807 HydrophobicContact CB-CB 4.48Å; F800-I807 HydrophobicContact CB-CG2 4.19Å; F800-L808 HydrophobicContact CD2-CD2 3.87Å; F800-L808 HydrophobicContact CD2-CG 4.18Å; F800-L808 HydrophobicContact CE2-CD1 4.4Å; F800-L808 HydrophobicContact CE2-CD2 4.18Å; F800-L808 HydrophobicContact CE2-CG 4.16Å
801	L	93.7	Very high	91.1	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-63.8	-22.2	178.8	-69	174.3	0	0	0	113.1	W616 L619 I620 W623 I726 L730 W797	W616-L801 HydrophobicContact CB-CD1 4.02Å; W616-L801 HydrophobicContact CD2-CD1 3.59Å; W616-L801 HydrophobicContact CE3-CD1 4.25Å; W616-L801 HydrophobicContact CG-CD1 3.47Å; W616-L801 VanDerWaalsContact CG-CD1 3.47Å; L619-L801 HydrophobicContact CD1-CB 3.99Å; I620-L801 HydrophobicContact CG1-CD2 4.42Å; W623-L801 PolarHBondContact NE1-O 3.3Å; I726-L801 HydrophobicContact CD1-CD2 4.44Å; I726-L801 HydrophobicContact CG1-CD2 4.22Å; L730-L801 HydrophobicContact CD1-CD2 3.85Å; W797-L801 HydrophobicContact CE3-CD1 4.33Å; W797-L801 WeakPolarHBondContact O-CG 3.39Å; W797-L801 PolarHBondContact O-N 3.34Å
802	L	90.9	Very high	91.5	Very high	14 Å²	14	11 Å²	11	7%	0.073	5%	0.052	C	C	.	.	H	α-helix	trans	-92.8	-48.9	175.4	-179.4	72.4	0	0	0	113.1	P595 L599 K600 I603 L619 C799 F800	P595-L802 HydrophobicContact CB-CD1 3.98Å; P595-L802 HydrophobicContact CG-CD1 4.22Å; L599-L802 HydrophobicContact CD2-CD1 4.17Å; K600-L802 VanDerWaalsContact CA-CD2 3.49Å; K600-L802 HydrophobicContact CB-CD2 3.79Å; K600-L802 HydrophobicContact CG-CD2 4.05Å; I603-L802 HydrophobicContact CB-CD2 4.44Å; I603-L802 HydrophobicContact CD1-CB 4.11Å; I603-L802 HydrophobicContact CD1-CD2 4.02Å; I603-L802 HydrophobicContact CD1-CG 4.44Å; L619-L802 HydrophobicContact CD1-CB 4.42Å; L619-L802 HydrophobicContact CD2-CD1 3.75Å; C799-L802 PolarHBondContact O-N 3.39Å; F800-L802 PolarHBondContact O-N 3.36Å
803	E	88.9	Confident	91.6	Very high	30 Å²	30	11.1 Å²	11.1	14%	0.14	5%	0.052	C	C	.	.	H	α-helix	trans	-101.9	-10.4	-168.5	-69.5	-167.3	-117	0	0	114.4	K600 R604 C799 I807 R810	K600-E803 WeakPolarHBondContact CE-OE1 3.49Å; K600-E803 WeakPolarHBondContact CE-OE2 3.11Å; K600-E803 VanDerWaalsContact NZ-CD 3.33Å; K600-E803 IonicContact NZ-OE1 2.81Å; K600-E803 IonicContact NZ-OE2 3.61Å; K600-E803 PolarHBondContact NZ-OE2 3.43Å; R604-E803 IonicContact CZ-OE1 3.96Å; R604-E803 IonicContact CZ-OE2 3.73Å; R604-E803 IonicContact NE-OE1 3.09Å; R604-E803 PolarHBondContact NE-OE1 2.95Å; R604-E803 VanDerWaalsContact NH2-CD 3.31Å; R604-E803 IonicContact NH2-OE1 3.59Å; R604-E803 PolarHBondContact NH2-OE1 3.34Å; R604-E803 IonicContact NH2-OE2 2.8Å; R604-E803 PolarHBondContact NH2-OE2 3.12Å; C799-E803 PolarHBondContact O-N 3.33Å; E803-I807 HydrophobicContact CB-CD1 3.76Å; E803-I807 HydrophobicContact CB-CG1 3.59Å; E803-I807 HydrophobicContact CG-CD1 4.23Å; E803-R810 IonicContact OE1-NH1 3.43Å; E803-R810 IonicContact OE2-CZ 3.2Å; E803-R810 IonicContact OE2-NH1 2.78Å; E803-R810 PolarHBondContact OE2-NH1 3.3Å; E803-R810 IonicContact OE2-NH2 3.81Å
804	G	89.8	Confident	91.4	Very high	6 Å²	6	11 Å²	11	6%	0.062	5%	0.052	C	C	.	.			trans	74	-158.9	178.5	0	0	0	0	0	115.3	F800 K806 I807	F800-G804 VanDerWaalsContact O-CA 3.29Å; F800-G804 WeakPolarHBondContact O-CA 3.42Å; F800-G804 PolarHBondContact O-N 2.95Å; G804-K806 PolarHBondContact O-N 2.88Å; G804-I807 WeakPolarHBondContact O-CB 3.48Å; G804-I807 WeakPolarHBondContact O-CG1 3.26Å; G804-I807 PolarHBondContact O-N 3.39Å; G804-I807 VanDerWaalsContact O-N 3.08Å
805	N	91.2	Very high	91.4	Very high	14 Å²	14	10.9 Å²	10.9	8%	0.075	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-30.1	-169.8	-168	23.7	0	0	0	115.2	L730 Q731 P732 D746 I807 L808	L730-N805 PolarHBondContact O-N 2.96Å; Q731-N805 PolarHBondContact OE1-OD1 3.42Å; P732-N805 WeakPolarHBondContact CD-ND2 3.35Å; P732-N805 WeakPolarHBondContact CG-ND2 3.46Å; D746-N805 PolarHBondContact OD1-ND2 3.08Å; D746-N805 PolarHBondContact OD2-ND2 2.89Å; N805-I807 PolarHBondContact O-N 3.08Å; N805-L808 WeakPolarHBondContact O-CB 3.42Å; N805-L808 PolarHBondContact O-N 3.46Å; N805-L808 WeakPolarHBondContact OD1-CD1 3.27Å
806	K	89.5	Confident	91.4	Very high	75 Å²	75	9.5 Å²	9.5	33%	0.326	4%	0.044	S	C	.	.	H	α-helix	trans	-49.1	-33.9	177.3	-72.2	162.2	-178.6	154	0	112.7	G804 L808 R810 L870	G804-K806 PolarHBondContact O-N 2.88Å; K806-L808 VanDerWaalsContact C-N 3.32Å; K806-L808 PolarHBondContact O-N 3.13Å; K806-R810 WeakPolarHBondContact O-CG 3.47Å; K806-R810 PolarHBondContact O-N 3.44Å; K806-L870 VanDerWaalsContact CE-C 3.48Å; K806-L870 WeakPolarHBondContact CE-O 3.49Å; K806-L870 HydrophobicContact CG-CB 4.32Å; K806-L870 HydrophobicContact CG-CD1 4.39Å; K806-L870 HydrophobicContact CG-CD2 4.19Å; K806-L870 PolarHBondContact NZ-O 3.45Å; K806-L870 PolarHBondContact NZ-OXT 3.14Å
807	I	90.9	Very high	91.3	Very high	4 Å²	4	13.1 Å²	13.1	2%	0.021	6%	0.06	C	C	.	.	H	α-helix	trans	-62.6	-34.8	-179.8	-67.6	-55.6	0	0	0	113	I796 C799 F800 E803 G804 N805 F809 R810 F811	I796-I807 HydrophobicContact CG2-CG2 4.09Å; C799-I807 HydrophobicContact CB-CD1 4.04Å; C799-I807 HydrophobicContact CB-CG1 4.18Å; C799-I807 HydrophobicContact CB-CG2 3.96Å; F800-I807 HydrophobicContact CB-CB 4.48Å; F800-I807 HydrophobicContact CB-CG2 4.19Å; E803-I807 HydrophobicContact CB-CD1 3.76Å; E803-I807 HydrophobicContact CB-CG1 3.59Å; E803-I807 HydrophobicContact CG-CD1 4.23Å; G804-I807 WeakPolarHBondContact O-CB 3.48Å; G804-I807 WeakPolarHBondContact O-CG1 3.26Å; G804-I807 PolarHBondContact O-N 3.39Å; G804-I807 VanDerWaalsContact O-N 3.08Å; N805-I807 PolarHBondContact O-N 3.08Å; I807-F809 PolarHBondContact O-N 3.41Å; I807-R810 PolarHBondContact O-N 3.24Å; I807-F811 HydrophobicContact CG2-CD2 3.38Å; I807-F811 HydrophobicContact CG2-CE2 3.5Å; I807-F811 VanDerWaalsContact CG2-CE2 3.5Å; I807-F811 WeakPolarHBondContact O-CD2 3.23Å; I807-F811 PolarHBondContact O-N 2.9Å
808	L	92.6	Very high	91	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-61.5	-46.9	-178.7	-58.6	-167.4	0	0	0	111.6	F780 I783 F784 F800 N805 K806 R810 F811 A812	F780-L808 HydrophobicContact CB-CD1 3.87Å; F780-L808 HydrophobicContact CD1-CB 3.82Å; F780-L808 HydrophobicContact CD1-CD1 4.21Å; F780-L808 HydrophobicContact CD2-CB 4.46Å; F780-L808 HydrophobicContact CD2-CD1 4.46Å; F780-L808 HydrophobicContact CE1-CB 3.74Å; F780-L808 HydrophobicContact CE2-CB 4.42Å; F780-L808 HydrophobicContact CG-CB 4.18Å; F780-L808 HydrophobicContact CG-CD1 3.95Å; F780-L808 HydrophobicContact CZ-CB 4.07Å; I783-L808 HydrophobicContact CB-CD2 4.47Å; I783-L808 HydrophobicContact CG1-CD2 4.49Å; I783-L808 HydrophobicContact CG2-CD2 3.96Å; F784-L808 HydrophobicContact CD2-CD2 4.3Å; F784-L808 HydrophobicContact CE2-CD2 3.87Å; F800-L808 HydrophobicContact CD2-CD2 3.87Å; F800-L808 HydrophobicContact CD2-CG 4.18Å; F800-L808 HydrophobicContact CE2-CD1 4.4Å; F800-L808 HydrophobicContact CE2-CD2 4.18Å; F800-L808 HydrophobicContact CE2-CG 4.16Å; N805-L808 WeakPolarHBondContact O-CB 3.42Å; N805-L808 PolarHBondContact O-N 3.46Å; N805-L808 WeakPolarHBondContact OD1-CD1 3.27Å; K806-L808 VanDerWaalsContact C-N 3.32Å; K806-L808 PolarHBondContact O-N 3.13Å; L808-R810 VanDerWaalsContact C-N 3.34Å; L808-R810 PolarHBondContact O-N 3.08Å; L808-F811 PolarHBondContact O-N 3.43Å; L808-A812 WeakPolarHBondContact O-CB 3.32Å; L808-A812 PolarHBondContact O-N 3.33Å
809	F	93.1	Very high	90.8	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.009	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-42.2	175.3	-57.9	-79.6	0	0	0	112.5	D746 V749 L750 L753 F780 I807 F811 L813 L870	D746-F809 HydrophobicContact CB-CE1 4.16Å; D746-F809 HydrophobicContact CB-CZ 3.84Å; D746-F809 VanDerWaalsContact CG-CZ 3.43Å; D746-F809 WeakPolarHBondContact O-CE1 3.38Å; D746-F809 WeakPolarHBondContact OD1-CZ 3.31Å; V749-F809 HydrophobicContact CB-CE1 3.75Å; V749-F809 HydrophobicContact CB-CZ 4.23Å; V749-F809 HydrophobicContact CG1-CD1 4.18Å; V749-F809 HydrophobicContact CG1-CE1 3.7Å; V749-F809 HydrophobicContact CG1-CZ 4.13Å; L750-F809 HydrophobicContact CB-CD1 4.26Å; L750-F809 HydrophobicContact CB-CE1 4.43Å; L753-F809 HydrophobicContact CD1-CB 3.99Å; L753-F809 HydrophobicContact CD1-CD1 3.95Å; L753-F809 HydrophobicContact CD1-CG 4.21Å; F780-F809 AromaticContact CE2-CD1 3.99Å; F780-F809 HydrophobicContact CE2-CD1 3.99Å; F780-F809 AromaticContact CE2-CE1 3.79Å; F780-F809 HydrophobicContact CE2-CE1 3.79Å; F780-F809 HydrophobicContact CE2-CZ 4.3Å; F780-F809 HydrophobicContact CZ-CD1 4.05Å; F780-F809 HydrophobicContact CZ-CE1 4.32Å; I807-F809 PolarHBondContact O-N 3.41Å; F809-F811 PolarHBondContact O-N 2.9Å; F809-L813 WeakPolarHBondContact O-CB 3.28Å; F809-L813 PolarHBondContact O-N 3.49Å; F809-L870 HydrophobicContact CD2-CD2 4.14Å; F809-L870 HydrophobicContact CE2-CD2 3.57Å; F809-L870 HydrophobicContact CZ-CD2 4.27Å
810	R	89.8	Confident	90.8	Very high	39 Å²	39	19.9 Å²	19.9	15%	0.147	9%	0.091	C	C	.	.	H	α-helix	trans	-62	-47.1	-178.8	-59.2	-161.2	177.4	142.8	2.7	111.2	R604 E803 K806 I807 L808 A814 G853 L858	R604-R810 VanDerWaalsContact NH2-NH1 3.13Å; E803-R810 IonicContact OE1-NH1 3.43Å; E803-R810 IonicContact OE2-CZ 3.2Å; E803-R810 IonicContact OE2-NH1 2.78Å; E803-R810 PolarHBondContact OE2-NH1 3.3Å; E803-R810 IonicContact OE2-NH2 3.81Å; K806-R810 WeakPolarHBondContact O-CG 3.47Å; K806-R810 PolarHBondContact O-N 3.44Å; I807-R810 PolarHBondContact O-N 3.24Å; L808-R810 VanDerWaalsContact C-N 3.34Å; L808-R810 PolarHBondContact O-N 3.08Å; R810-A814 VanDerWaalsContact O-CB 3.23Å; R810-A814 WeakPolarHBondContact O-CB 3.37Å; R810-A814 PolarHBondContact O-N 3.11Å; R810-G853 WeakPolarHBondContact CD-O 3.42Å; R810-L858 HydrophobicContact CB-CD1 3.75Å; R810-L858 HydrophobicContact CG-CD1 3.65Å; R810-L858 HydrophobicContact CG-CD2 4.3Å; R810-L858 HydrophobicContact CG-CG 4.43Å
811	F	90.5	Very high	90.6	Very high	9 Å²	9	26.7 Å²	26.7	4%	0.039	12%	0.123	C	C	.	.	H	α-helix	trans	-74.1	-37.9	-177.5	-79	-67.9	0	0	0	112.7	F784 I796 C799 I807 L808 F809 A814 A815 Y846 L849 A850	F784-F811 HydrophobicContact CE2-CB 4.15Å; F784-F811 HydrophobicContact CZ-CB 4.02Å; I796-F811 HydrophobicContact CB-CD2 4.22Å; I796-F811 HydrophobicContact CB-CE2 4.32Å; I796-F811 HydrophobicContact CD1-CB 4.08Å; I796-F811 HydrophobicContact CD1-CD1 4.16Å; I796-F811 HydrophobicContact CD1-CD2 4.45Å; I796-F811 HydrophobicContact CD1-CG 3.99Å; I796-F811 HydrophobicContact CG1-CB 4.4Å; I796-F811 HydrophobicContact CG1-CD1 3.89Å; I796-F811 HydrophobicContact CG1-CD2 3.86Å; I796-F811 HydrophobicContact CG1-CE1 4.09Å; I796-F811 HydrophobicContact CG1-CE2 4.04Å; I796-F811 HydrophobicContact CG1-CG 3.79Å; I796-F811 HydrophobicContact CG1-CZ 4.17Å; I796-F811 HydrophobicContact CG2-CD2 3.69Å; I796-F811 HydrophobicContact CG2-CE2 4.13Å; I796-F811 HydrophobicContact CG2-CG 4.24Å; C799-F811 HydrophobicContact CB-CE2 4.19Å; I807-F811 HydrophobicContact CG2-CD2 3.38Å; I807-F811 HydrophobicContact CG2-CE2 3.5Å; I807-F811 VanDerWaalsContact CG2-CE2 3.5Å; I807-F811 WeakPolarHBondContact O-CD2 3.23Å; I807-F811 PolarHBondContact O-N 2.9Å; L808-F811 PolarHBondContact O-N 3.43Å; F809-F811 PolarHBondContact O-N 2.9Å; F811-A814 PolarHBondContact O-N 3.4Å; F811-A815 WeakPolarHBondContact O-CB 3.42Å; F811-A815 PolarHBondContact O-N 2.84Å; F811-Y846 HydrophobicContact CE1-CD2 4.28Å; F811-Y846 AromaticContact CE1-CE2 3.81Å; F811-Y846 HydrophobicContact CE1-CE2 3.81Å; F811-Y846 HydrophobicContact CZ-CD2 4.48Å; F811-Y846 AromaticContact CZ-CE2 3.6Å; F811-Y846 HydrophobicContact CZ-CE2 3.6Å; F811-L849 HydrophobicContact CD1-CD2 3.46Å; F811-L849 VanDerWaalsContact CD1-CD2 3.46Å; F811-L849 HydrophobicContact CD1-CG 3.59Å; F811-L849 HydrophobicContact CE1-CD2 3.94Å; F811-L849 HydrophobicContact CE1-CG 3.97Å; F811-L849 HydrophobicContact CG-CD2 4.5Å; F811-A850 HydrophobicContact CE1-CB 4.42Å
812	A	92.1	Very high	90.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.5	-45.5	172.9	0	0	0	0	0	111.8	L750 W779 F780 F784 L808 A814 A815 L816	L750-A812 HydrophobicContact CD1-CB 3.94Å; L750-A812 HydrophobicContact CD2-CB 4.13Å; W779-A812 HydrophobicContact CE3-CB 4.25Å; W779-A812 HydrophobicContact CZ3-CB 4.36Å; F780-A812 HydrophobicContact CE1-CB 3.72Å; F780-A812 HydrophobicContact CZ-CB 4.09Å; F784-A812 HydrophobicContact CZ-CB 4.16Å; L808-A812 WeakPolarHBondContact O-CB 3.32Å; L808-A812 PolarHBondContact O-N 3.33Å; A812-A814 VanDerWaalsContact C-N 3.34Å; A812-A814 PolarHBondContact O-N 2.97Å; A812-A815 PolarHBondContact O-N 3.23Å; A812-L816 WeakPolarHBondContact O-CG 3.37Å; A812-L816 PolarHBondContact O-N 3.47Å
813	L	90.8	Very high	90.6	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-40.7	177.1	-170.7	65.1	0	0	0	111.9	V754 K757 V758 F809 L816 K817 L857 L858	V754-L813 HydrophobicContact CG2-CD1 4.14Å; K757-L813 HydrophobicContact CB-CD1 4.16Å; K757-L813 HydrophobicContact CB-CD2 3.86Å; K757-L813 HydrophobicContact CB-CG 4.47Å; K757-L813 HydrophobicContact CG-CD2 3.88Å; V758-L813 HydrophobicContact CG2-CD1 3.79Å; F809-L813 WeakPolarHBondContact O-CB 3.28Å; F809-L813 PolarHBondContact O-N 3.49Å; L813-L816 PolarHBondContact O-N 3.25Å; L813-K817 VanDerWaalsContact O-CB 3.31Å; L813-K817 WeakPolarHBondContact O-CB 3.33Å; L813-K817 PolarHBondContact O-N 3.02Å; L813-L857 HydrophobicContact CD2-CD2 3.87Å; L813-L857 HydrophobicContact CG-CD2 4.19Å; L813-L858 HydrophobicContact CD2-CD1 4.43Å
814	A	89.2	Confident	90.7	Very high	1 Å²	1	30 Å²	30	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-64.1	-40.4	176.5	0	0	0	0	0	112.3	R810 F811 A812 K817 L818 L849 V852	R810-A814 VanDerWaalsContact O-CB 3.23Å; R810-A814 WeakPolarHBondContact O-CB 3.37Å; R810-A814 PolarHBondContact O-N 3.11Å; F811-A814 PolarHBondContact O-N 3.4Å; A812-A814 VanDerWaalsContact C-N 3.34Å; A812-A814 PolarHBondContact O-N 2.97Å; A814-K817 PolarHBondContact O-N 3.34Å; A814-L818 WeakPolarHBondContact O-CB 3.32Å; A814-L818 WeakPolarHBondContact O-CG 3.44Å; A814-L818 PolarHBondContact O-N 3.13Å; A814-L849 HydrophobicContact CB-CD1 3.75Å; A814-L849 HydrophobicContact CB-CG 4.31Å; A814-L849 WeakPolarHBondContact CB-O 3.32Å; A814-V852 HydrophobicContact CB-CB 4.04Å; A814-V852 HydrophobicContact CB-CG1 3.85Å
815	A	90.7	Very high	90.9	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62	-47.5	176.8	0	0	0	0	0	111.6	F788 F811 A812 K817 L818 R819 L843 L849	F788-A815 HydrophobicContact CE1-CB 4.24Å; F788-A815 HydrophobicContact CZ-CB 3.78Å; F811-A815 WeakPolarHBondContact O-CB 3.42Å; F811-A815 PolarHBondContact O-N 2.84Å; A812-A815 PolarHBondContact O-N 3.23Å; A815-K817 VanDerWaalsContact C-N 3.35Å; A815-K817 PolarHBondContact O-N 3.39Å; A815-L818 PolarHBondContact O-N 3.32Å; A815-R819 PolarHBondContact O-N 2.99Å; A815-L843 HydrophobicContact CB-CD1 3.6Å; A815-L849 HydrophobicContact CB-CD1 4.19Å
816	L	91.5	Very high	90.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-41.1	177.1	-67.9	171.9	0	0	0	111.9	V754 L772 A812 L813 R819 E820 I823 L836 I839	V754-L816 HydrophobicContact CG1-CD1 4.5Å; V754-L816 HydrophobicContact CG2-CD1 3.65Å; L772-L816 HydrophobicContact CD1-CD1 4.24Å; L772-L816 HydrophobicContact CD1-CD2 4.22Å; L772-L816 HydrophobicContact CD2-CD1 3.88Å; A812-L816 WeakPolarHBondContact O-CG 3.37Å; A812-L816 PolarHBondContact O-N 3.47Å; L813-L816 PolarHBondContact O-N 3.25Å; L816-R819 CarbonylContact O-C 3.51Å; L816-R819 PolarHBondContact O-N 3.37Å; L816-E820 PolarHBondContact O-N 3.07Å; L816-E820 VanDerWaalsContact O-N 3.08Å; L816-I823 HydrophobicContact CD2-CD1 4.02Å; L816-L836 HydrophobicContact CD2-CD2 4.15Å; L816-I839 HydrophobicContact CD2-CD1 4.08Å
817	K	89.3	Confident	91	Very high	76 Å²	76	37.9 Å²	37.9	33%	0.33	19%	0.186	S	C	.	.	H	α-helix	trans	-67.6	-41.2	178.9	179.3	163.6	178.7	159	0	112.9	V758 L813 A814 A815 R819 E820 V852 L857	V758-K817 HydrophobicContact CG2-CB 4.15Å; L813-K817 VanDerWaalsContact O-CB 3.31Å; L813-K817 WeakPolarHBondContact O-CB 3.33Å; L813-K817 PolarHBondContact O-N 3.02Å; A814-K817 PolarHBondContact O-N 3.34Å; A815-K817 VanDerWaalsContact C-N 3.35Å; A815-K817 PolarHBondContact O-N 3.39Å; K817-R819 PolarHBondContact O-N 3.5Å; K817-E820 WeakPolarHBondContact O-CB 3.34Å; K817-E820 PolarHBondContact O-N 3.49Å; K817-V852 HydrophobicContact CB-CG1 4.17Å; K817-V852 HydrophobicContact CD-CG1 3.95Å; K817-V852 HydrophobicContact CG-CG1 4.14Å; K817-L857 HydrophobicContact CD-CD1 3.85Å; K817-L857 HydrophobicContact CD-CD2 3.68Å; K817-L857 HydrophobicContact CD-CG 4.44Å
818	L	88.7	Confident	90.9	Very high	59 Å²	59	40.4 Å²	40.4	31%	0.309	20%	0.204	S	C	.	.	H	α-helix	trans	-63.9	-26.7	178.4	-80.2	173.6	0	0	0	112.8	A814 A815 L843 K848 L849 V852	A814-L818 WeakPolarHBondContact O-CB 3.32Å; A814-L818 WeakPolarHBondContact O-CG 3.44Å; A814-L818 PolarHBondContact O-N 3.13Å; A815-L818 PolarHBondContact O-N 3.32Å; L818-L843 HydrophobicContact CB-CD2 4.44Å; L818-L843 HydrophobicContact CD1-CD2 4.2Å; L818-K848 HydrophobicContact CD1-CB 4.48Å; L818-L849 HydrophobicContact CD1-CB 4.29Å; L818-L849 HydrophobicContact CD1-CD1 3.75Å; L818-V852 HydrophobicContact CD2-CG2 3.79Å; L818-V852 HydrophobicContact CG-CG2 4.1Å
819	R	88.9	Confident	90.7	Very high	52 Å²	52	43 Å²	43	20%	0.196	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	15.5	-178.7	-59.2	-63.5	179.5	-152	0.1	113.2	A815 L816 K817 E821 E822 I823 F835 I839 Q842 L843	A815-R819 PolarHBondContact O-N 2.99Å; L816-R819 CarbonylContact O-C 3.51Å; L816-R819 PolarHBondContact O-N 3.37Å; K817-R819 PolarHBondContact O-N 3.5Å; R819-E821 VanDerWaalsContact C-N 3.32Å; R819-E821 PolarHBondContact O-N 3.33Å; R819-E822 WeakPolarHBondContact CD-OE1 3.4Å; R819-E822 IonicContact CZ-OE1 3.39Å; R819-E822 IonicContact NE-OE1 3.46Å; R819-E822 IonicContact NH1-OE1 3.83Å; R819-E822 PolarHBondContact NH1-OE1 2.89Å; R819-E822 PolarHBondContact O-N 2.89Å; R819-E822 VanDerWaalsContact O-N 3.12Å; R819-I823 HydrophobicContact CB-CD1 4.39Å; R819-I823 VanDerWaalsContact O-CG1 3.32Å; R819-I823 WeakPolarHBondContact O-CG1 3.21Å; R819-I823 PolarHBondContact O-N 3.45Å; R819-F835 HydrophobicContact CB-CE1 4.09Å; R819-F835 HydrophobicContact CB-CZ 4.1Å; R819-F835 HydrophobicContact CG-CZ 4.41Å; R819-I839 HydrophobicContact CB-CD1 4.12Å; R819-I839 HydrophobicContact CB-CG1 4.26Å; R819-I839 HydrophobicContact CG-CD1 4.26Å; R819-I839 HydrophobicContact CG-CG1 3.93Å; R819-Q842 PolarHBondContact NH2-O 3.14Å; R819-L843 HydrophobicContact CG-CD2 4.45Å
820	E	90.9	Very high	90.6	Very high	34 Å²	34	45.4 Å²	45.4	16%	0.159	25%	0.246	C	C	.	.	H	α-helix	trans	-53.4	-47.3	-177.2	170.7	167.8	-166.7	0	0	112.1	V758 K760 V761 L816 K817 E822 I823 L824	V758-E820 HydrophobicContact CG1-CG 4.33Å; K760-E820 WeakPolarHBondContact CD-OE1 3.35Å; V761-E820 HydrophobicContact CG2-CB 4.01Å; V761-E820 HydrophobicContact CG2-CG 3.76Å; L816-E820 PolarHBondContact O-N 3.07Å; L816-E820 VanDerWaalsContact O-N 3.08Å; K817-E820 WeakPolarHBondContact O-CB 3.34Å; K817-E820 PolarHBondContact O-N 3.49Å; E820-E822 PolarHBondContact O-N 3Å; E820-I823 PolarHBondContact O-N 3.35Å; E820-L824 HydrophobicContact CG-CD1 3.91Å; E820-L824 WeakPolarHBondContact O-CB 3.31Å; E820-L824 VanDerWaalsContact O-CG 3.23Å; E820-L824 WeakPolarHBondContact O-CG 3.41Å; E820-L824 PolarHBondContact O-N 3.03Å
821	E	90.8	Very high	90.6	Very high	143 Å²	143	45.5 Å²	45.5	67%	0.668	26%	0.255	S	S	*	.	H	α-helix	trans	-62.7	-39.7	179.7	-62.7	-65.1	156.2	0	0	112.6	R819 L824 A825	R819-E821 VanDerWaalsContact C-N 3.32Å; R819-E821 PolarHBondContact O-N 3.33Å; E821-L824 PolarHBondContact O-N 2.93Å; E821-A825 WeakPolarHBondContact O-CB 3.36Å; E821-A825 PolarHBondContact O-N 3.46Å
822	E	90.7	Very high	90.6	Very high	66 Å²	66	45 Å²	45	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-71.8	-37.7	-179.9	-62.4	171.9	-128.9	0	0	111.3	R819 E820 A825 C826 F835	R819-E822 WeakPolarHBondContact CD-OE1 3.4Å; R819-E822 IonicContact CZ-OE1 3.39Å; R819-E822 IonicContact NE-OE1 3.46Å; R819-E822 IonicContact NH1-OE1 3.83Å; R819-E822 PolarHBondContact NH1-OE1 2.89Å; R819-E822 PolarHBondContact O-N 2.89Å; R819-E822 VanDerWaalsContact O-N 3.12Å; E820-E822 PolarHBondContact O-N 3Å; E822-A825 PolarHBondContact O-N 3.26Å; E822-C826 PolarHBondContact O-N 2.91Å; E822-C826 PolarHBondContact O-SG 3.26Å; E822-F835 HydrophobicContact CB-CE1 4.11Å; E822-F835 HydrophobicContact CB-CE2 3.83Å; E822-F835 HydrophobicContact CB-CZ 3.42Å; E822-F835 VanDerWaalsContact CB-CZ 3.42Å; E822-F835 HydrophobicContact CG-CZ 4.32Å; E822-F835 VanDerWaalsContact OE2-CE2 3.27Å; E822-F835 WeakPolarHBondContact OE2-CE2 3.43Å; E822-F835 VanDerWaalsContact OE2-CZ 3.28Å; E822-F835 WeakPolarHBondContact OE2-CZ 3.36Å
823	I	91.9	Very high	90.5	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-47.2	173.2	-68.8	168.4	0	0	0	110.3	V761 H764 L816 R819 E820 A825 C826 L832 F835 L836 I839	V761-I823 HydrophobicContact CG1-CD1 4.23Å; V761-I823 HydrophobicContact CG1-CG2 4.09Å; V761-I823 HydrophobicContact CG2-CD1 4.46Å; V761-I823 HydrophobicContact CG2-CG2 4.36Å; H764-I823 PolarHBondContact CD2-O 2.91Å; H764-I823 PolarHBondContact NE2-O 2.9Å; H764-I823 VanDerWaalsContact NE2-O 3.08Å; L816-I823 HydrophobicContact CD2-CD1 4.02Å; R819-I823 HydrophobicContact CB-CD1 4.39Å; R819-I823 VanDerWaalsContact O-CG1 3.32Å; R819-I823 WeakPolarHBondContact O-CG1 3.21Å; R819-I823 PolarHBondContact O-N 3.45Å; E820-I823 PolarHBondContact O-N 3.35Å; I823-A825 VanDerWaalsContact C-N 3.26Å; I823-A825 PolarHBondContact O-N 2.95Å; I823-C826 WeakPolarHBondContact O-CB 3.42Å; I823-C826 PolarHBondContact O-N 3.47Å; I823-C826 VanDerWaalsContact O-N 3.14Å; I823-L832 HydrophobicContact CG2-CD1 3.77Å; I823-F835 HydrophobicContact CG1-CD1 3.91Å; I823-F835 HydrophobicContact CG1-CE1 3.61Å; I823-L836 HydrophobicContact CD1-CD2 4.25Å; I823-L836 HydrophobicContact CG1-CD2 4.46Å; I823-I839 HydrophobicContact CD1-CD1 4.29Å
824	L	92.5	Very high	90.4	Very high	50 Å²	50	51.2 Å²	51.2	26%	0.262	29%	0.29	S	S	.	.	H	α-helix	trans	-67.4	-27.9	178.9	-67.5	174.1	0	0	0	112.5	K760 H764 E820 E821 C826	K760-L824 HydrophobicContact CB-CD1 4.18Å; K760-L824 HydrophobicContact CB-CD2 4.3Å; K760-L824 HydrophobicContact CD-CD1 4.28Å; H764-L824 HydrophobicContact CB-CD2 3.79Å; H764-L824 PolarHBondContact CE1-O 2.86Å; E820-L824 HydrophobicContact CG-CD1 3.91Å; E820-L824 WeakPolarHBondContact O-CB 3.31Å; E820-L824 VanDerWaalsContact O-CG 3.23Å; E820-L824 WeakPolarHBondContact O-CG 3.41Å; E820-L824 PolarHBondContact O-N 3.03Å; E821-L824 PolarHBondContact O-N 2.93Å; L824-C826 VanDerWaalsContact C-N 3.27Å; L824-C826 PolarHBondContact O-N 3.33Å
825	A	93.4	Very high	90.5	Very high	68 Å²	68	53.1 Å²	53.1	56%	0.562	30%	0.298	S	S	*	.	H	α-helix	trans	-70.2	-21.4	174.1	0	0	0	0	0	113.2	E821 E822 I823 K827	E821-A825 WeakPolarHBondContact O-CB 3.36Å; E821-A825 PolarHBondContact O-N 3.46Å; E822-A825 PolarHBondContact O-N 3.26Å; I823-A825 VanDerWaalsContact C-N 3.26Å; I823-A825 PolarHBondContact O-N 2.95Å; A825-K827 PolarHBondContact O-N 2.96Å
826	C	91	Very high	90.4	Very high	18 Å²	18	53.1 Å²	53.1	12%	0.122	30%	0.298	C	S	.	.			trans	-72	115.5	176.2	-65.9	0	0	0	0	110.7	H764 E822 I823 L824 A831 L832	H764-C826 PolarHBondContact CE1-O 3.42Å; H764-C826 PolarHBondContact NE2-O 3Å; E822-C826 PolarHBondContact O-N 2.91Å; E822-C826 PolarHBondContact O-SG 3.26Å; I823-C826 WeakPolarHBondContact O-CB 3.42Å; I823-C826 PolarHBondContact O-N 3.47Å; I823-C826 VanDerWaalsContact O-N 3.14Å; L824-C826 VanDerWaalsContact C-N 3.27Å; L824-C826 PolarHBondContact O-N 3.33Å; C826-A831 HydrophobicContact CB-CB 4.32Å; C826-L832 HydrophobicContact CB-CB 4.27Å; C826-L832 HydrophobicContact CB-CD1 4.34Å
827	K	91.1	Very high	90.2	Very high	174 Å²	174	56.4 Å²	56.4	76%	0.757	32%	0.321	S	S	*	.			trans	-101.5	12.5	-174.7	-58.8	-177.8	-175.6	177.3	0	114.8	Y768 A825	Y768-K827 WeakPolarHBondContact CE1-O 3.35Å; Y768-K827 WeakPolarHBondContact OH-CA 3.32Å; Y768-K827 PolarHBondContact OH-O 3.45Å; A825-K827 PolarHBondContact O-N 2.96Å
828	S	89.4	Confident	90	Very high	57 Å²	57	58.1 Å²	58.1	40%	0.399	33%	0.329	S	S	.	.	S	Bend	trans	-146.2	151.5	177.8	72	0	0	0	0	111	G830 A831 L832	S828-G830 VanDerWaalsContact C-N 3.31Å; S828-G830 PolarHBondContact O-N 2.88Å; S828-A831 PolarHBondContact O-N 3.39Å; S828-A831 WeakPolarHBondContact OG-CB 3.43Å; S828-A831 PolarHBondContact OG-N 2.81Å; S828-A831 VanDerWaalsContact OG-N 3.14Å; S828-L832 WeakPolarHBondContact O-CB 3.47Å; S828-L832 PolarHBondContact O-N 3.25Å
829	C	89.3	Confident	89.9	Confident	54 Å²	54	55.5 Å²	55.5	37%	0.365	32%	0.315	S	S	.	.	H	α-helix	trans	-54.1	-47.9	175.3	178.9	0	0	0	0	111	A831 L832 H833	C829-A831 PolarHBondContact O-N 2.91Å; C829-L832 PolarHBondContact O-N 3.47Å; C829-H833 PolarHBondContact O-CD2 2.88Å; C829-H833 VanDerWaalsContact O-CD2 3.31Å; C829-H833 PolarHBondContact O-N 3.26Å; C829-H833 VanDerWaalsContact SG-CD2 3.57Å
830	G	89.7	Confident	89.5	Confident	52 Å²	52	53.1 Å²	53.1	54%	0.536	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-39.7	178.7	0	0	0	0	0	114.3	S828 L832 S834	S828-G830 VanDerWaalsContact C-N 3.31Å; S828-G830 PolarHBondContact O-N 2.88Å; G830-L832 VanDerWaalsContact C-N 3.33Å; G830-S834 WeakPolarHBondContact O-CB 3.44Å; G830-S834 PolarHBondContact O-N 3.32Å
831	A	90.5	Very high	89	Confident	41 Å²	41	57.2 Å²	57.2	34%	0.339	33%	0.325	S	S	.	.	H	α-helix	trans	-65.2	-40.3	175.4	0	0	0	0	0	111.2	C826 S828 C829 S834 F835	C826-A831 HydrophobicContact CB-CB 4.32Å; S828-A831 PolarHBondContact O-N 3.39Å; S828-A831 WeakPolarHBondContact OG-CB 3.43Å; S828-A831 PolarHBondContact OG-N 2.81Å; S828-A831 VanDerWaalsContact OG-N 3.14Å; C829-A831 PolarHBondContact O-N 2.91Å; A831-S834 PolarHBondContact O-N 3.47Å; A831-F835 VanDerWaalsContact O-CB 3.31Å; A831-F835 WeakPolarHBondContact O-CB 3.37Å; A831-F835 PolarHBondContact O-N 2.91Å
832	L	90	Very high	88.1	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-44.8	177.9	-172.9	52.6	0	0	0	111.8	L765 Y768 V770 I823 C826 S828 C829 G830 S834 F835 L836	L765-L832 HydrophobicContact CD2-CD1 4.26Å; L765-L832 HydrophobicContact CD2-CD2 3.71Å; L765-L832 HydrophobicContact CD2-CG 4.1Å; Y768-L832 HydrophobicContact CD2-CD2 4.28Å; V770-L832 HydrophobicContact CB-CD2 4.22Å; V770-L832 HydrophobicContact CG2-CD2 3.92Å; V770-L832 HydrophobicContact CG2-CG 4.32Å; I823-L832 HydrophobicContact CG2-CD1 3.77Å; C826-L832 HydrophobicContact CB-CB 4.27Å; C826-L832 HydrophobicContact CB-CD1 4.34Å; S828-L832 WeakPolarHBondContact O-CB 3.47Å; S828-L832 PolarHBondContact O-N 3.25Å; C829-L832 PolarHBondContact O-N 3.47Å; G830-L832 VanDerWaalsContact C-N 3.33Å; L832-S834 PolarHBondContact O-N 2.93Å; L832-F835 PolarHBondContact O-N 2.91Å; L832-L836 HydrophobicContact CD1-CD1 3.97Å; L832-L836 HydrophobicContact CD1-CG 4.06Å; L832-L836 HydrophobicContact CG-CD1 3.98Å; L832-L836 HydrophobicContact CG-CG 4.49Å; L832-L836 WeakPolarHBondContact O-CB 3.33Å; L832-L836 VanDerWaalsContact O-CG 3.27Å; L832-L836 WeakPolarHBondContact O-CG 3.45Å; L832-L836 PolarHBondContact O-N 3.47Å
833	H	90.5	Very high	87.6	Confident	63 Å²	63	53.3 Å²	53.3	29%	0.292	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-45.5	173.3	-89.2	-95.6	0	0	0	112.3	F775 C829 S837	F775-H833 AromaticContact CE1-ND1 3.98Å; F775-H833 HydrophobicContact CZ-CB 4.2Å; F775-H833 AromaticContact CZ-CE1 3.81Å; F775-H833 AromaticContact CZ-CG 3.8Å; F775-H833 AromaticContact CZ-ND1 3.29Å; F775-H833 VanDerWaalsContact CZ-ND1 3.29Å; F775-H833 WeakPolarHBondContact CZ-ND1 3.37Å; C829-H833 PolarHBondContact O-CD2 2.88Å; C829-H833 VanDerWaalsContact O-CD2 3.31Å; C829-H833 PolarHBondContact O-N 3.26Å; C829-H833 VanDerWaalsContact SG-CD2 3.57Å; H833-S837 WeakPolarHBondContact O-CB 3.39Å; H833-S837 PolarHBondContact O-N 3.48Å; H833-S837 PolarHBondContact O-OG 3.44Å
834	S	89.3	Confident	86.6	Confident	68 Å²	68	57.1 Å²	57.1	48%	0.476	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-43.3	178.5	-175	0	0	0	0	111.7	G830 A831 L832 K838	G830-S834 WeakPolarHBondContact O-CB 3.44Å; G830-S834 PolarHBondContact O-N 3.32Å; A831-S834 PolarHBondContact O-N 3.47Å; L832-S834 PolarHBondContact O-N 2.93Å; S834-K838 PolarHBondContact O-N 3.1Å
835	F	89.7	Confident	85.7	Confident	40 Å²	40	58.2 Å²	58.2	18%	0.175	34%	0.339	C	S	.	.	H	α-helix	trans	-67.1	-49.2	178.6	-176.5	-96	0	0	0	112.2	R819 E822 I823 A831 L832 S837 K838 I839	R819-F835 HydrophobicContact CB-CE1 4.09Å; R819-F835 HydrophobicContact CB-CZ 4.1Å; R819-F835 HydrophobicContact CG-CZ 4.41Å; E822-F835 HydrophobicContact CB-CE1 4.11Å; E822-F835 HydrophobicContact CB-CE2 3.83Å; E822-F835 HydrophobicContact CB-CZ 3.42Å; E822-F835 VanDerWaalsContact CB-CZ 3.42Å; E822-F835 HydrophobicContact CG-CZ 4.32Å; E822-F835 VanDerWaalsContact OE2-CE2 3.27Å; E822-F835 WeakPolarHBondContact OE2-CE2 3.43Å; E822-F835 VanDerWaalsContact OE2-CZ 3.28Å; E822-F835 WeakPolarHBondContact OE2-CZ 3.36Å; I823-F835 HydrophobicContact CG1-CD1 3.91Å; I823-F835 HydrophobicContact CG1-CE1 3.61Å; A831-F835 VanDerWaalsContact O-CB 3.31Å; A831-F835 WeakPolarHBondContact O-CB 3.37Å; A831-F835 PolarHBondContact O-N 2.91Å; L832-F835 PolarHBondContact O-N 2.91Å; F835-S837 VanDerWaalsContact C-N 3.27Å; F835-S837 PolarHBondContact O-N 2.95Å; F835-K838 CarbonylContact O-C 3.47Å; F835-K838 PolarHBondContact O-N 3.46Å; F835-I839 HydrophobicContact CE1-CD1 4.42Å; F835-I839 HydrophobicContact CE1-CG1 4.24Å; F835-I839 PolarHBondContact O-N 3.36Å
836	L	88.7	Confident	85	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-33.9	179.4	-71	171.8	0	0	0	112.5	L765 V770 F775 L816 I823 L832 K838 I839	L765-L836 HydrophobicContact CD2-CD1 3.73Å; V770-L836 HydrophobicContact CG1-CD1 3.99Å; F775-L836 HydrophobicContact CD1-CB 4.01Å; F775-L836 HydrophobicContact CD2-CB 4.07Å; F775-L836 HydrophobicContact CD2-CD1 4.03Å; F775-L836 HydrophobicContact CE1-CB 3.93Å; F775-L836 HydrophobicContact CE2-CB 4Å; F775-L836 HydrophobicContact CE2-CD1 3.62Å; F775-L836 HydrophobicContact CE2-CG 4.49Å; F775-L836 HydrophobicContact CG-CB 4.07Å; F775-L836 HydrophobicContact CZ-CB 3.9Å; F775-L836 HydrophobicContact CZ-CD1 4.07Å; L816-L836 HydrophobicContact CD2-CD2 4.15Å; I823-L836 HydrophobicContact CD1-CD2 4.25Å; I823-L836 HydrophobicContact CG1-CD2 4.46Å; L832-L836 HydrophobicContact CD1-CD1 3.97Å; L832-L836 HydrophobicContact CD1-CG 4.06Å; L832-L836 HydrophobicContact CG-CD1 3.98Å; L832-L836 HydrophobicContact CG-CG 4.49Å; L832-L836 WeakPolarHBondContact O-CB 3.33Å; L832-L836 VanDerWaalsContact O-CG 3.27Å; L832-L836 WeakPolarHBondContact O-CG 3.45Å; L832-L836 PolarHBondContact O-N 3.47Å; L836-K838 PolarHBondContact O-N 3.2Å; L836-I839 HydrophobicContact CD2-CD1 4.32Å; L836-I839 WeakPolarHBondContact O-CG2 3.36Å; L836-I839 PolarHBondContact O-N 3Å
837	S	87.4	Confident	84.3	Confident	70 Å²	70	61.6 Å²	61.6	49%	0.49	34%	0.339	S	S	.	.	H	α-helix	trans	-63.1	-29.7	174.9	-58.2	0	0	0	0	112.7	F775 H833 F835	F775-S837 WeakPolarHBondContact CE1-OG 3.33Å; H833-S837 WeakPolarHBondContact O-CB 3.39Å; H833-S837 PolarHBondContact O-N 3.48Å; H833-S837 PolarHBondContact O-OG 3.44Å; F835-S837 VanDerWaalsContact C-N 3.27Å; F835-S837 PolarHBondContact O-N 2.95Å
838	K	86	Confident	83.6	Confident	112 Å²	112	59 Å²	59	49%	0.487	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	7.7	-176.2	-62	-173.2	179.3	-171.3	0	114	S834 F835 L836 G840 E841	S834-K838 PolarHBondContact O-N 3.1Å; F835-K838 CarbonylContact O-C 3.47Å; F835-K838 PolarHBondContact O-N 3.46Å; L836-K838 PolarHBondContact O-N 3.2Å; K838-G840 PolarHBondContact O-N 3.04Å; K838-E841 WeakPolarHBondContact O-CB 3.48Å; K838-E841 PolarHBondContact O-N 2.99Å
839	I	85.7	Confident	83.1	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.021	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-36	-171.9	-166.7	175.4	0	0	0	112.7	W779 L816 R819 I823 F835 L836 L843	W779-I839 HydrophobicContact CH2-CG2 3.38Å; W779-I839 HydrophobicContact CZ2-CG2 3.26Å; L816-I839 HydrophobicContact CD2-CD1 4.08Å; R819-I839 HydrophobicContact CB-CD1 4.12Å; R819-I839 HydrophobicContact CB-CG1 4.26Å; R819-I839 HydrophobicContact CG-CD1 4.26Å; R819-I839 HydrophobicContact CG-CG1 3.93Å; I823-I839 HydrophobicContact CD1-CD1 4.29Å; F835-I839 HydrophobicContact CE1-CD1 4.42Å; F835-I839 HydrophobicContact CE1-CG1 4.24Å; F835-I839 PolarHBondContact O-N 3.36Å; L836-I839 HydrophobicContact CD2-CD1 4.32Å; L836-I839 WeakPolarHBondContact O-CG2 3.36Å; L836-I839 PolarHBondContact O-N 3Å; I839-L843 WeakPolarHBondContact O-CG 3.36Å
840	G	80.7	Confident	82.3	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.01	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-28.8	-178.8	0	0	0	0	0	113.7	N787 P789 K838 Q842 L843	N787-G840 CarbonylContact O-C 3.34Å; N787-G840 WeakPolarHBondContact O-CA 3.34Å; P789-G840 WeakPolarHBondContact CD-O 3.01Å; K838-G840 PolarHBondContact O-N 3.04Å; G840-Q842 PolarHBondContact O-N 3.5Å; G840-Q842 VanDerWaalsContact O-N 3.1Å; G840-L843 PolarHBondContact O-N 3.32Å
841	E	80	Confident	81.6	Confident	121 Å²	121	58.8 Å²	58.8	57%	0.565	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.9	-178.6	-65.4	179.3	-179.2	0	0	112.6	K838	K838-E841 WeakPolarHBondContact O-CB 3.48Å; K838-E841 PolarHBondContact O-N 2.99Å
842	Q	73.6	Confident	80.6	Confident	117 Å²	117	58.5 Å²	58.5	55%	0.547	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	0.8	-178.5	-59.3	-175.3	4.1	0	0	113.9	R819 G840 C844	R819-Q842 PolarHBondContact NH2-O 3.14Å; G840-Q842 PolarHBondContact O-N 3.5Å; G840-Q842 VanDerWaalsContact O-N 3.1Å; Q842-C844 PolarHBondContact O-N 2.9Å
843	L	79.5	Confident	79.1	Confident	9 Å²	9	58.6 Å²	58.6	5%	0.047	30%	0.3	C	S	.	.			trans	-96.1	64.5	-178	-71.1	173.7	0	0	0	111.1	F788 T792 A815 L818 R819 I839 G840	F788-L843 HydrophobicContact CD1-CB 4.16Å; F788-L843 HydrophobicContact CD1-CD1 4.44Å; F788-L843 HydrophobicContact CE1-CB 3.99Å; F788-L843 HydrophobicContact CE1-CD1 3.5Å; F788-L843 VanDerWaalsContact CE1-CD1 3.5Å; F788-L843 HydrophobicContact CE1-CG 4.39Å; F788-L843 HydrophobicContact CZ-CD1 3.84Å; T792-L843 WeakPolarHBondContact CB-O 3.49Å; T792-L843 WeakPolarHBondContact CG2-O 3.37Å; T792-L843 PolarHBondContact OG1-O 2.95Å; A815-L843 HydrophobicContact CB-CD1 3.6Å; L818-L843 HydrophobicContact CB-CD2 4.44Å; L818-L843 HydrophobicContact CD1-CD2 4.2Å; R819-L843 HydrophobicContact CG-CD2 4.45Å; I839-L843 WeakPolarHBondContact O-CG 3.36Å; G840-L843 PolarHBondContact O-N 3.32Å
844	C	70.6	Confident	77.5	Confident	81 Å²	81	57.7 Å²	57.7	55%	0.547	31%	0.307	S	S	.	.			trans	-82.5	-13.8	178.5	-50.5	0	0	0	0	114.1	Q842 Y846	Q842-C844 PolarHBondContact O-N 2.9Å; C844-Y846 PolarHBondContact O-N 3.34Å
845	D	74.1	Confident	75.7	Confident	72 Å²	72	55.8 Å²	55.8	39%	0.385	30%	0.298	S	S	.	.			trans	-94.5	84.4	-176.1	-168.3	-13.5	0	0	0	111.5	K847 K848 L849	D845-K847 PolarHBondContact O-N 3.36Å; D845-K847 PolarHBondContact OD1-N 2.98Å; D845-K848 HydrophobicContact CB-CB 4.44Å; D845-K848 HydrophobicContact CB-CD 4.32Å; D845-K848 PolarHBondContact O-N 3.44Å; D845-K848 PolarHBondContact OD1-N 3.2Å; D845-K848 WeakPolarHBondContact OD2-CD 3.49Å; D845-K848 WeakPolarHBondContact OD2-CE 3.41Å; D845-K848 WeakPolarHBondContact OD2-CG 3.44Å; D845-K848 IonicContact OD2-NZ 2.64Å; D845-K848 PolarHBondContact OD2-NZ 2.92Å; D845-L849 PolarHBondContact O-N 3.43Å
846	Y	78	Confident	73.7	Confident	15 Å²	15	63.3 Å²	63.3	6%	0.059	33%	0.331	C	S	.	.	H	α-helix	trans	-55.3	-35.4	176.9	170.6	-100.6	0	0	0	112.8	R604 N795 C799 F811 C844 K848 L849 A850	R604-Y846 WeakPolarHBondContact O-CE1 3.36Å; R604-Y846 PolarHBondContact O-OH 2.93Å; N795-Y846 HydrophobicContact CB-CD1 3.92Å; N795-Y846 HydrophobicContact CB-CD2 3.27Å; N795-Y846 HydrophobicContact CB-CE1 4.05Å; N795-Y846 HydrophobicContact CB-CE2 3.42Å; N795-Y846 VanDerWaalsContact CB-CE2 3.42Å; N795-Y846 HydrophobicContact CB-CG 3.54Å; N795-Y846 WeakPolarHBondContact ND2-CD1 3.46Å; C799-Y846 PolarHBondContact SG-OH 2.93Å; F811-Y846 HydrophobicContact CE1-CD2 4.28Å; F811-Y846 AromaticContact CE1-CE2 3.81Å; F811-Y846 HydrophobicContact CE1-CE2 3.81Å; F811-Y846 HydrophobicContact CZ-CD2 4.48Å; F811-Y846 AromaticContact CZ-CE2 3.6Å; F811-Y846 HydrophobicContact CZ-CE2 3.6Å; C844-Y846 PolarHBondContact O-N 3.34Å; Y846-K848 PolarHBondContact O-N 3Å; Y846-L849 PolarHBondContact O-N 3Å; Y846-A850 HydrophobicContact CD1-CB 4.43Å; Y846-A850 HydrophobicContact CE1-CB 3.93Å; Y846-A850 HydrophobicContact CE2-CB 4.05Å; Y846-A850 VanDerWaalsContact O-CB 3.26Å; Y846-A850 WeakPolarHBondContact O-CB 3.44Å; Y846-A850 PolarHBondContact O-N 2.8Å
847	K	77.7	Confident	71.8	Confident	142 Å²	142	65 Å²	65	62%	0.617	34%	0.339	S	S	*	.	H	α-helix	trans	-64.9	-43.3	-176.9	-71.5	-173.3	178.1	-177	0	111.5	D845 L849 Q851	D845-K847 PolarHBondContact O-N 3.36Å; D845-K847 PolarHBondContact OD1-N 2.98Å; K847-L849 VanDerWaalsContact C-N 3.34Å; K847-Q851 VanDerWaalsContact O-CB 3.32Å; K847-Q851 WeakPolarHBondContact O-CB 3.42Å; K847-Q851 WeakPolarHBondContact O-CG 3.32Å; K847-Q851 PolarHBondContact O-N 3.29Å
848	K	76.4	Confident	69.7	Low	120 Å²	120	62.2 Å²	62.2	52%	0.522	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-43.2	173.8	-72.8	178.8	-172.6	163.2	0	111.3	L818 D845 Y846 Q851 V852	L818-K848 HydrophobicContact CD1-CB 4.48Å; D845-K848 HydrophobicContact CB-CB 4.44Å; D845-K848 HydrophobicContact CB-CD 4.32Å; D845-K848 PolarHBondContact O-N 3.44Å; D845-K848 PolarHBondContact OD1-N 3.2Å; D845-K848 WeakPolarHBondContact OD2-CD 3.49Å; D845-K848 WeakPolarHBondContact OD2-CE 3.41Å; D845-K848 WeakPolarHBondContact OD2-CG 3.44Å; D845-K848 IonicContact OD2-NZ 2.64Å; D845-K848 PolarHBondContact OD2-NZ 2.92Å; Y846-K848 PolarHBondContact O-N 3Å; K848-Q851 PolarHBondContact O-N 3.36Å; K848-V852 WeakPolarHBondContact O-CG2 3.11Å; K848-V852 PolarHBondContact O-N 3.06Å
849	L	77.2	Confident	67.6	Low	1 Å²	1	64.1 Å²	64.1	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-45	179.4	-167.4	71.5	0	0	0	111.8	F788 T792 I796 F811 A814 A815 L818 D845 Y846 K847 V852 G853	F788-L849 HydrophobicContact CE1-CD2 4.32Å; T792-L849 HydrophobicContact CG2-CD2 3.74Å; I796-L849 HydrophobicContact CD1-CD2 4.32Å; F811-L849 HydrophobicContact CD1-CD2 3.46Å; F811-L849 VanDerWaalsContact CD1-CD2 3.46Å; F811-L849 HydrophobicContact CD1-CG 3.59Å; F811-L849 HydrophobicContact CE1-CD2 3.94Å; F811-L849 HydrophobicContact CE1-CG 3.97Å; F811-L849 HydrophobicContact CG-CD2 4.5Å; A814-L849 HydrophobicContact CB-CD1 3.75Å; A814-L849 HydrophobicContact CB-CG 4.31Å; A814-L849 WeakPolarHBondContact CB-O 3.32Å; A815-L849 HydrophobicContact CB-CD1 4.19Å; L818-L849 HydrophobicContact CD1-CB 4.29Å; L818-L849 HydrophobicContact CD1-CD1 3.75Å; D845-L849 PolarHBondContact O-N 3.43Å; Y846-L849 PolarHBondContact O-N 3Å; K847-L849 VanDerWaalsContact C-N 3.34Å; L849-V852 PolarHBondContact O-N 3.4Å; L849-G853 PolarHBondContact O-N 3.26Å
850	A	73.7	Confident	65.4	Low	20 Å²	20	66.1 Å²	66.1	17%	0.165	35%	0.347	C	S	.	.	H	α-helix	trans	-69.1	-34.1	176.4	0	0	0	0	0	112.7	F811 Y846 G854	F811-A850 HydrophobicContact CE1-CB 4.42Å; Y846-A850 HydrophobicContact CD1-CB 4.43Å; Y846-A850 HydrophobicContact CE1-CB 3.93Å; Y846-A850 HydrophobicContact CE2-CB 4.05Å; Y846-A850 VanDerWaalsContact O-CB 3.26Å; Y846-A850 WeakPolarHBondContact O-CB 3.44Å; Y846-A850 PolarHBondContact O-N 2.8Å; A850-G854 VanDerWaalsContact O-CA 3.28Å; A850-G854 WeakPolarHBondContact O-CA 3.45Å; A850-G854 PolarHBondContact O-N 3.31Å
851	Q	75.1	Confident	63.6	Low	138 Å²	138	68 Å²	68	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-67.9	-39.9	173.5	-77.8	173.1	10.8	0	0	112.1	K847 K848 G855	K847-Q851 VanDerWaalsContact O-CB 3.32Å; K847-Q851 WeakPolarHBondContact O-CB 3.42Å; K847-Q851 WeakPolarHBondContact O-CG 3.32Å; K847-Q851 PolarHBondContact O-N 3.29Å; K848-Q851 PolarHBondContact O-N 3.36Å; Q851-G855 VanDerWaalsContact O-CA 3.22Å; Q851-G855 WeakPolarHBondContact O-CA 3.3Å; Q851-G855 PolarHBondContact O-N 2.76Å
852	V	69.7	Low	61.7	Low	34 Å²	34	66 Å²	66	21%	0.206	36%	0.356	C	S	.	.	H	α-helix	trans	-72.6	-41.3	176.8	175.9	0	0	0	0	111	A814 K817 L818 K848 L849	A814-V852 HydrophobicContact CB-CB 4.04Å; A814-V852 HydrophobicContact CB-CG1 3.85Å; K817-V852 HydrophobicContact CB-CG1 4.17Å; K817-V852 HydrophobicContact CD-CG1 3.95Å; K817-V852 HydrophobicContact CG-CG1 4.14Å; L818-V852 HydrophobicContact CD2-CG2 3.79Å; L818-V852 HydrophobicContact CG-CG2 4.1Å; K848-V852 WeakPolarHBondContact O-CG2 3.11Å; K848-V852 PolarHBondContact O-N 3.06Å; L849-V852 PolarHBondContact O-N 3.4Å
853	G	57.1	Low	60.3	Low	3 Å²	3	62.7 Å²	62.7	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-75.8	-30.8	178.8	0	0	0	0	0	114.1	R810 L849 L858	R810-G853 WeakPolarHBondContact CD-O 3.42Å; L849-G853 PolarHBondContact O-N 3.26Å; G853-L858 WeakPolarHBondContact O-CD1 3.48Å
854	G	56.6	Low	58.6	Low	44 Å²	44	66.7 Å²	66.7	45%	0.454	37%	0.368	S	S	.	.	H	α-helix	trans	-94	-22.7	178.6	0	0	0	0	0	113.9	A850	A850-G854 VanDerWaalsContact O-CA 3.28Å; A850-G854 WeakPolarHBondContact O-CA 3.45Å; A850-G854 PolarHBondContact O-N 3.31Å
855	G	53.6	Low	57.5	Low	27 Å²	27	70.4 Å²	70.4	28%	0.278	38%	0.377	S	S	.	.	S	Bend	trans	-68.6	-176.1	-178.9	0	0	0	0	0	113.9	Q851 L857 L858	Q851-G855 VanDerWaalsContact O-CA 3.22Å; Q851-G855 WeakPolarHBondContact O-CA 3.3Å; Q851-G855 PolarHBondContact O-N 2.76Å; G855-L857 PolarHBondContact O-N 2.92Å; G855-L858 PolarHBondContact O-N 3.46Å; G855-L858 VanDerWaalsContact O-N 3.11Å
856	K	47.5	Very low	56.2	Low	199 Å²	199	68.8 Å²	68.8	87%	0.865	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-13.5	-176.2	-76.1	-178.7	175.8	177.8	0	116.3	L858	K856-L858 PolarHBondContact O-N 3.39Å
857	L	47.1	Very low	54.7	Low	34 Å²	34	77.7 Å²	77.7	18%	0.178	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.7	173.2	-120.1	84.4	0	0	0	113.7	K757 L813 K817 G855	K757-L857 HydrophobicContact CB-CD2 4.13Å; K757-L857 WeakPolarHBondContact CE-O 3.41Å; L813-L857 HydrophobicContact CD2-CD2 3.87Å; L813-L857 HydrophobicContact CG-CD2 4.19Å; K817-L857 HydrophobicContact CD-CD1 3.85Å; K817-L857 HydrophobicContact CD-CD2 3.68Å; K817-L857 HydrophobicContact CD-CG 4.44Å; G855-L857 PolarHBondContact O-N 2.92Å
858	L	44.9	Very low	53.3	Low	13 Å²	13	77.1 Å²	77.1	7%	0.068	41%	0.408	C	S	.	.	S	Bend	trans	-124.5	0.5	-165.2	-80.9	149.1	0	0	0	116.3	R810 L813 G853 G855 K856 S860 L861	R810-L858 HydrophobicContact CB-CD1 3.75Å; R810-L858 HydrophobicContact CG-CD1 3.65Å; R810-L858 HydrophobicContact CG-CD2 4.3Å; R810-L858 HydrophobicContact CG-CG 4.43Å; L813-L858 HydrophobicContact CD2-CD1 4.43Å; G853-L858 WeakPolarHBondContact O-CD1 3.48Å; G855-L858 PolarHBondContact O-N 3.46Å; G855-L858 VanDerWaalsContact O-N 3.11Å; K856-L858 PolarHBondContact O-N 3.39Å; L858-S860 PolarHBondContact O-N 3.34Å; L858-S860 VanDerWaalsContact O-N 3.07Å; L858-L861 HydrophobicContact CD2-CD1 4.17Å; L858-L861 HydrophobicContact CD2-CD2 4.1Å; L858-L861 HydrophobicContact CD2-CG 3.89Å; L858-L861 PolarHBondContact O-N 3.27Å
859	I	40.7	Very low	51.8	Low	152 Å²	152	75.3 Å²	75.3	78%	0.779	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-16.4	166.6	-62.3	176.7	0	0	0	110.6
860	S	40.1	Very low	50.1	Low	46 Å²	46	78 Å²	78	32%	0.322	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	59.3	175.5	88.5	0	0	0	0	113.7	K757 L858 S862	K757-S860 PolarHBondContact NZ-O 3.02Å; K757-S860 PolarHBondContact NZ-OG 3.41Å; K757-S860 VanDerWaalsContact NZ-OG 3.09Å; L858-S860 PolarHBondContact O-N 3.34Å; L858-S860 VanDerWaalsContact O-N 3.07Å; S860-S862 PolarHBondContact O-N 3Å; S860-S862 PolarHBondContact O-OG 3.46Å
861	L	43.6	Very low	48.9	Very low	39 Å²	39	80.9 Å²	80.9	20%	0.204	43%	0.425	C	S	.	.			trans	-66.9	54.7	145.1	-74.8	168	0	0	0	109	L753 L858 I863 L870	L753-L861 HydrophobicContact CD1-CD2 4.24Å; L753-L861 HydrophobicContact CD2-CD2 3.59Å; L858-L861 HydrophobicContact CD2-CD1 4.17Å; L858-L861 HydrophobicContact CD2-CD2 4.1Å; L858-L861 HydrophobicContact CD2-CG 3.89Å; L858-L861 PolarHBondContact O-N 3.27Å; L861-I863 PolarHBondContact O-N 3.45Å; L861-L870 HydrophobicContact CD1-CD1 4.24Å
862	S	38.2	Very low	47.5	Very low	80 Å²	80	77.8 Å²	77.8	56%	0.559	41%	0.413	S	S	*	.			trans	-83.4	9.9	-173	49.1	0	0	0	0	112.5	S860 P864	S860-S862 PolarHBondContact O-N 3Å; S860-S862 PolarHBondContact O-OG 3.46Å; S862-P864 VanDerWaalsContact O-CD 3.25Å; S862-P864 WeakPolarHBondContact O-CD 3.09Å
863	I	44.7	Very low	46.3	Very low	48 Å²	48	80.3 Å²	80.3	25%	0.246	43%	0.425	C	S	.	.			trans	-78.7	113.9	174.5	-59	172.9	0	0	0	107.9	E756 L861 H865 Y866 R867	E756-I863 WeakPolarHBondContact OE2-CD1 3.47Å; L861-I863 PolarHBondContact O-N 3.45Å; I863-H865 VanDerWaalsContact C-N 3.26Å; I863-H865 HydrophobicContact CG2-CB 4.21Å; I863-H865 PolarHBondContact O-N 3Å; I863-Y866 HydrophobicContact CB-CD2 3.73Å; I863-Y866 HydrophobicContact CD1-CD2 3.7Å; I863-Y866 HydrophobicContact CD1-CE2 3.93Å; I863-Y866 HydrophobicContact CG1-CD2 4.32Å; I863-Y866 HydrophobicContact CG2-CD2 3.48Å; I863-Y866 VanDerWaalsContact CG2-CD2 3.48Å; I863-Y866 HydrophobicContact CG2-CE2 4.07Å; I863-Y866 HydrophobicContact CG2-CG 4.32Å; I863-Y866 PolarHBondContact O-N 3.28Å; I863-Y866 VanDerWaalsContact O-N 3.16Å; I863-R867 PolarHBondContact O-N 3.1Å
864	P	44.7	Very low	45.6	Very low	92 Å²	92	84.8 Å²	84.8	60%	0.597	45%	0.448	S	S	*	.	H	α-helix	trans	-60	-36.6	-177.2	-21.6	32.8	0	0	0	112.6	S862 Y866 R867 T868	S862-P864 VanDerWaalsContact O-CD 3.25Å; S862-P864 WeakPolarHBondContact O-CD 3.09Å; P864-Y866 VanDerWaalsContact C-N 3.26Å; P864-Y866 PolarHBondContact O-N 3.38Å; P864-R867 PolarHBondContact O-N 3.21Å; P864-T868 PolarHBondContact O-OG1 3.46Å
865	H	46.7	Very low	45	Very low	159 Å²	159	87.4 Å²	87.4	74%	0.736	45%	0.448	S	S	*	.	H	α-helix	trans	-62.7	-33.3	-179.7	-80.1	66.3	0	0	0	112.4	I863	I863-H865 VanDerWaalsContact C-N 3.26Å; I863-H865 HydrophobicContact CG2-CB 4.21Å; I863-H865 PolarHBondContact O-N 3Å
866	Y	47.4	Very low	44.4	Very low	38 Å²	38	91.4 Å²	91.4	15%	0.149	46%	0.459	C	S	.	.	H	α-helix	trans	-85.5	-24.3	179.1	-69.2	-57.5	0	0	0	113.3	V749 D752 I863 P864 T868 Y869 L870	V749-Y866 HydrophobicContact CB-CD1 4.36Å; V749-Y866 HydrophobicContact CB-CE1 3.93Å; V749-Y866 HydrophobicContact CG1-CD1 3.82Å; V749-Y866 HydrophobicContact CG1-CE1 3.81Å; V749-Y866 HydrophobicContact CG1-CG 4.31Å; V749-Y866 HydrophobicContact CG2-CD1 3.76Å; V749-Y866 HydrophobicContact CG2-CE1 3.31Å; D752-Y866 HydrophobicContact CB-CE2 4.41Å; D752-Y866 PolarHBondContact OD2-OH 2.72Å; I863-Y866 HydrophobicContact CB-CD2 3.73Å; I863-Y866 HydrophobicContact CD1-CD2 3.7Å; I863-Y866 HydrophobicContact CD1-CE2 3.93Å; I863-Y866 HydrophobicContact CG1-CD2 4.32Å; I863-Y866 HydrophobicContact CG2-CD2 3.48Å; I863-Y866 VanDerWaalsContact CG2-CD2 3.48Å; I863-Y866 HydrophobicContact CG2-CE2 4.07Å; I863-Y866 HydrophobicContact CG2-CG 4.32Å; I863-Y866 PolarHBondContact O-N 3.28Å; I863-Y866 VanDerWaalsContact O-N 3.16Å; P864-Y866 VanDerWaalsContact C-N 3.26Å; P864-Y866 PolarHBondContact O-N 3.38Å; Y866-T868 PolarHBondContact O-N 3.11Å; Y866-Y869 HydrophobicContact CD1-CD1 4.49Å; Y866-Y869 PolarHBondContact O-N 3.47Å; Y866-Y869 VanDerWaalsContact O-N 3.09Å; Y866-L870 WeakPolarHBondContact O-CB 3.05Å; Y866-L870 PolarHBondContact O-N 3.09Å
867	R	46.8	Very low	44.2	Very low	202 Å²	202	83.7 Å²	83.7	76%	0.762	43%	0.43	S	S	*	.	H	α-helix	trans	-62.9	-26.3	171.1	-116.5	-173.6	-171.9	-173.2	1.9	113.1	I863 P864	I863-R867 PolarHBondContact O-N 3.1Å; P864-R867 PolarHBondContact O-N 3.21Å
868	T	48.1	Very low	43.9	Very low	130 Å²	130	87.5 Å²	87.5	80%	0.798	45%	0.449	S	S	*	.	H	α-helix	trans	-83.1	-26.1	174.8	-36.4	0	0	0	0	111.7	P864 Y866	P864-T868 PolarHBondContact O-OG1 3.46Å; Y866-T868 PolarHBondContact O-N 3.11Å
869	Y	44.5	Very low	43.9	Very low	83 Å²	83	93.8 Å²	93.8	33%	0.325	48%	0.481	S	S	.	.	H	α-helix	trans	-84.5	-38.4	179.3	-178.7	-99.6	0	0	0	113.1	A742 A745 D746 V749 Y866	A742-Y869 PolarHBondContact O-OH 3.23Å; A745-Y869 HydrophobicContact CB-CE2 4.12Å; A745-Y869 WeakPolarHBondContact CB-OH 3.28Å; D746-Y869 WeakPolarHBondContact OD1-CE1 3.29Å; D746-Y869 PolarHBondContact OD1-OH 3.34Å; D746-Y869 VanDerWaalsContact OD1-OH 3.12Å; V749-Y869 HydrophobicContact CG2-CD1 4Å; V749-Y869 HydrophobicContact CG2-CE1 3.79Å; Y866-Y869 HydrophobicContact CD1-CD1 4.49Å; Y866-Y869 PolarHBondContact O-N 3.47Å; Y866-Y869 VanDerWaalsContact O-N 3.09Å
870	L	40.8	Very low	44.1	Very low	56 Å²	56	88.5 Å²	88.5	29%	0.293	45%	0.454	S	S	.	.			trans	-97.2	0	-179.7	-70.2	174.3	0	0	0	113.2	K806 F809 L861 Y866	K806-L870 VanDerWaalsContact CE-C 3.48Å; K806-L870 WeakPolarHBondContact CE-O 3.49Å; K806-L870 HydrophobicContact CG-CB 4.32Å; K806-L870 HydrophobicContact CG-CD1 4.39Å; K806-L870 HydrophobicContact CG-CD2 4.19Å; K806-L870 PolarHBondContact NZ-O 3.45Å; K806-L870 PolarHBondContact NZ-OXT 3.14Å; F809-L870 HydrophobicContact CD2-CD2 4.14Å; F809-L870 HydrophobicContact CE2-CD2 3.57Å; F809-L870 HydrophobicContact CZ-CD2 4.27Å; L861-L870 HydrophobicContact CD1-CD1 4.24Å; Y866-L870 WeakPolarHBondContact O-CB 3.05Å; Y866-L870 PolarHBondContact O-N 3.09Å

Retrieved 870 of 870 residues in 446.1 ms (Link to these results)

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