A0A3Q0KRG3_SCHMA Loading...

Rho-GAP domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KRG3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 835 aa.

						>A0A3Q0KRG3_SCHMA|A0A3Q0KRG3
MTTSDDIRSRMLHRANRLVNGIKNEEAWHLIGLFQQTHPNTFLQICHHTLASFLELTHDYFDDQRWPLISRLILITNQKSSENRRGRSRAGVNVTMNTNQNKNNIHEIFQSPIGSPLFMSNYQIDKLSCSSPVVSNVKLFNNEQVKNKTKPSRKRILKQLLPSMFPVPNNSSNNNNMNNNNNNNNNGSKPSRVDLMTPTKKSDQSNSKTKLFFKQQVQPLFCKSGSNETIRQLTCPFILRLNSSKIDGNLQQMKSKWRNDYTGYCIRYCNVDSTICATLIDYITSNPKLCQTEGLFRIPGNALRIRELWLKLSHHFQNPYLRIPQPDPDVTDENLSPYPIIDHTEIYEILQSYTPHDISSLILRCLSTCTEFQRVHQVLNFDSTTVDSPIYSHHDQTTTNTNNPYSYNDGEYQQTGGLIPLEAGNLLFLATELQYKLKSTSSSSSSTTTLNNVSDNEDIDHKLSDSQYDDWMYILCQSRQLLAYRIVLQLLLPTPERYLLMSLLRLFKQIDDLSVTSKMTAECLSRCTAFAVFGAPLKIKKSHNSITITNRHHNHRRLKGDINSDNNVYTFESYTNSITKRIDTLTNLIKMAHQLEDLPAIIYNTVRSRLRTHLGNSPIPRTASRLQCKSTTEKCNIESQYCLVDDRSMILKELTNVNHVQPEQLESVIQKRAKYQNDSDELIQSHPMNEMHSLSNSNRSNHIHRTKSTSNATSKNSLQQLKSNESRNDQLNNLHKTTKITTNTNTTTNNTPIDSFHLWKRYKPGTIRQELKSSIFNNTSFINSKTDTYDERFIKMTNHCVVVPHSTPSSHYHYHHKTLIKSRSSSLLEESHIFN
					

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(Predicted Aligned Error values between residue pairs)

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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	30.9	Very low	47.1	Very low	237 Å²	237	81.2 Å²	81.2	100%	1.167	43%	0.429	S	S	*	.				0	129.5	0	-81.2	-174.7	139.5	0	0	107.2	T3	M1-T3 PolarHBondContact O-N 3.44Å
2	T	41.2	Very low	47.8	Very low	44 Å²	44	80.5 Å²	80.5	27%	0.27	43%	0.425	S	S	.	.			trans	-67.6	119.8	161.7	40.1	0	0	0	0	106.4	E422	T2-E422 PolarHBondContact OG1-OE1 3.21Å
3	T	43.4	Very low	48.7	Very low	85 Å²	85	82.8 Å²	82.8	52%	0.521	43%	0.432	S	S	.	.			trans	-63	156	173	51.1	0	0	0	0	108.7	M1 D5 D6 I7	M1-T3 PolarHBondContact O-N 3.44Å; T3-D5 PolarHBondContact O-N 3.49Å; T3-D6 WeakPolarHBondContact O-CB 3.08Å; T3-D6 PolarHBondContact O-N 3.39Å; T3-D6 PolarHBondContact OG1-N 3.09Å; T3-I7 PolarHBondContact O-N 3.41Å
4	S	42.4	Very low	49.1	Very low	81 Å²	81	83.3 Å²	83.3	57%	0.566	43%	0.425	S	S	*	.	H	α-helix	trans	-50.6	-30.2	171.5	52.2	0	0	0	0	111.8	R8	S4-R8 VanDerWaalsContact O-CB 3.3Å; S4-R8 WeakPolarHBondContact O-CB 2.91Å; S4-R8 PolarHBondContact O-N 3.44Å; S4-R8 VanDerWaalsContact O-N 3.11Å
5	D	46.5	Very low	49.3	Very low	90 Å²	90	78.4 Å²	78.4	48%	0.481	40%	0.402	S	S	.	.	H	α-helix	trans	-71.1	-29.9	176.1	-64.5	-33.4	0	0	0	114.1	T3 S9	T3-D5 PolarHBondContact O-N 3.49Å; D5-S9 VanDerWaalsContact O-CB 3.28Å; D5-S9 WeakPolarHBondContact O-CB 3.27Å; D5-S9 PolarHBondContact O-N 3.43Å; D5-S9 PolarHBondContact O-OG 3.41Å
6	D	54.5	Low	49.5	Very low	39 Å²	39	79.9 Å²	79.9	21%	0.209	41%	0.411	C	S	.	.	H	α-helix	trans	-75.1	-39.3	179.5	-163.7	6.3	0	0	0	111.1	T3 S9 R10	T3-D6 WeakPolarHBondContact O-CB 3.08Å; T3-D6 PolarHBondContact O-N 3.39Å; T3-D6 PolarHBondContact OG1-N 3.09Å; D6-S9 PolarHBondContact O-N 3.37Å; D6-R10 WeakPolarHBondContact O-CB 3.38Å; D6-R10 WeakPolarHBondContact O-CG 3.41Å; D6-R10 PolarHBondContact O-N 3.07Å; D6-R10 IonicContact OD1-CZ 3.64Å; D6-R10 IonicContact OD1-NE 3.73Å; D6-R10 PolarHBondContact OD1-NE 3.26Å; D6-R10 IonicContact OD1-NH2 2.8Å; D6-R10 PolarHBondContact OD1-NH2 2.82Å; D6-R10 IonicContact OD2-CZ 2.9Å; D6-R10 IonicContact OD2-NE 3.43Å; D6-R10 IonicContact OD2-NH2 3.67Å; D6-R10 PolarHBondContact OD2-NH2 2.79Å
7	I	50.6	Low	49.8	Very low	48 Å²	48	86.1 Å²	86.1	25%	0.246	43%	0.428	C	S	.	.	H	α-helix	trans	-63.9	-47.8	171	-61.9	158.1	0	0	0	109.6	T3 S9 R10 M11 E422	T3-I7 PolarHBondContact O-N 3.41Å; I7-S9 VanDerWaalsContact C-N 3.31Å; I7-S9 PolarHBondContact O-N 3.48Å; I7-R10 PolarHBondContact O-N 3.01Å; I7-M11 HydrophobicContact CG2-CG 4.18Å; I7-M11 HydrophobicContact CG2-SD 3.85Å; I7-M11 WeakPolarHBondContact O-CB 3.12Å; I7-M11 VanDerWaalsContact O-CG 3.22Å; I7-M11 WeakPolarHBondContact O-CG 3.32Å; I7-M11 PolarHBondContact O-N 3.21Å; I7-E422 HydrophobicContact CD1-CG 3.62Å; I7-E422 HydrophobicContact CG1-CG 4.24Å
8	R	49.1	Very low	49.9	Very low	113 Å²	113	86.1 Å²	86.1	43%	0.426	43%	0.43	S	S	.	.	H	α-helix	trans	-54.4	-47.7	176.2	-179.2	-178.1	-178.6	170	3.1	111.4	S4 M11 L12	S4-R8 VanDerWaalsContact O-CB 3.3Å; S4-R8 WeakPolarHBondContact O-CB 2.91Å; S4-R8 PolarHBondContact O-N 3.44Å; S4-R8 VanDerWaalsContact O-N 3.11Å; R8-M11 PolarHBondContact O-N 2.8Å; R8-L12 HydrophobicContact CG-CD1 3.83Å; R8-L12 HydrophobicContact CG-CG 4.43Å; R8-L12 VanDerWaalsContact O-CB 3.28Å; R8-L12 WeakPolarHBondContact O-CB 3.43Å; R8-L12 WeakPolarHBondContact O-CG 3.41Å; R8-L12 PolarHBondContact O-N 2.72Å
9	S	53.6	Low	49.8	Very low	69 Å²	69	82.5 Å²	82.5	48%	0.483	41%	0.413	S	S	.	.	H	α-helix	trans	-64.2	-42.4	-179.9	-60.1	0	0	0	0	112.1	D5 D6 I7 H13	D5-S9 VanDerWaalsContact O-CB 3.28Å; D5-S9 WeakPolarHBondContact O-CB 3.27Å; D5-S9 PolarHBondContact O-N 3.43Å; D5-S9 PolarHBondContact O-OG 3.41Å; D6-S9 PolarHBondContact O-N 3.37Å; I7-S9 VanDerWaalsContact C-N 3.31Å; I7-S9 PolarHBondContact O-N 3.48Å; S9-H13 WeakPolarHBondContact O-CB 3.25Å; S9-H13 PolarHBondContact O-N 3.18Å
10	R	54.8	Low	49.8	Very low	66 Å²	66	84.4 Å²	84.4	25%	0.249	42%	0.424	C	S	.	.	H	α-helix	trans	-68	-39.4	177.7	-69.4	169.9	-162.1	-152.4	9.2	112.6	D6 I7 R14	D6-R10 WeakPolarHBondContact O-CB 3.38Å; D6-R10 WeakPolarHBondContact O-CG 3.41Å; D6-R10 PolarHBondContact O-N 3.07Å; D6-R10 IonicContact OD1-CZ 3.64Å; D6-R10 IonicContact OD1-NE 3.73Å; D6-R10 PolarHBondContact OD1-NE 3.26Å; D6-R10 IonicContact OD1-NH2 2.8Å; D6-R10 PolarHBondContact OD1-NH2 2.82Å; D6-R10 IonicContact OD2-CZ 2.9Å; D6-R10 IonicContact OD2-NE 3.43Å; D6-R10 IonicContact OD2-NH2 3.67Å; D6-R10 PolarHBondContact OD2-NH2 2.79Å; I7-R10 PolarHBondContact O-N 3.01Å; R10-R14 WeakPolarHBondContact O-CB 3.21Å; R10-R14 WeakPolarHBondContact O-CG 3.24Å; R10-R14 PolarHBondContact O-N 2.95Å
11	M	51.3	Low	49.7	Very low	21 Å²	21	81.7 Å²	81.7	10%	0.103	42%	0.417	C	S	.	.	H	α-helix	trans	-69.7	-43.4	176.9	-67.7	-168.9	77.4	0	0	111.4	I7 R8 H13 R14 A15 F34 L490 L491	I7-M11 HydrophobicContact CG2-CG 4.18Å; I7-M11 HydrophobicContact CG2-SD 3.85Å; I7-M11 WeakPolarHBondContact O-CB 3.12Å; I7-M11 VanDerWaalsContact O-CG 3.22Å; I7-M11 WeakPolarHBondContact O-CG 3.32Å; I7-M11 PolarHBondContact O-N 3.21Å; R8-M11 PolarHBondContact O-N 2.8Å; M11-H13 PolarHBondContact O-N 3.16Å; M11-R14 PolarHBondContact O-N 3.36Å; M11-A15 WeakPolarHBondContact O-CB 3.43Å; M11-A15 PolarHBondContact O-N 3.46Å; M11-F34 HydrophobicContact CE-CD1 3.45Å; M11-F34 VanDerWaalsContact CE-CD1 3.45Å; M11-F34 HydrophobicContact CE-CD2 3.71Å; M11-F34 HydrophobicContact CE-CE1 3.14Å; M11-F34 HydrophobicContact CE-CE2 3.42Å; M11-F34 VanDerWaalsContact CE-CE2 3.42Å; M11-F34 HydrophobicContact CE-CG 3.74Å; M11-F34 HydrophobicContact CE-CZ 3.14Å; M11-F34 HydrophobicContact SD-CD1 3.51Å; M11-F34 VanDerWaalsContact SD-CD1 3.51Å; M11-F34 HydrophobicContact SD-CE1 3.6Å; M11-F34 HydrophobicContact SD-CG 4.08Å; M11-F34 HydrophobicContact SD-CZ 4.24Å; M11-L490 HydrophobicContact CE-CB 4.36Å; M11-L491 HydrophobicContact CE-CD2 3.47Å; M11-L491 VanDerWaalsContact CE-CD2 3.47Å; M11-L491 HydrophobicContact CE-CG 3.83Å; M11-L491 HydrophobicContact CG-CD2 4.18Å; M11-L491 HydrophobicContact SD-CD2 3.39Å; M11-L491 WeakPolarHBondContact SD-CD2 3.49Å; M11-L491 HydrophobicContact SD-CG 4.39Å
12	L	55.9	Low	50.4	Low	73 Å²	73	76.4 Å²	76.4	38%	0.382	39%	0.393	S	S	.	.	H	α-helix	trans	-60.6	-44	172.5	-74.6	171.5	0	0	0	111.2	R8 R14 A15 N16 I31	R8-L12 HydrophobicContact CG-CD1 3.83Å; R8-L12 HydrophobicContact CG-CG 4.43Å; R8-L12 VanDerWaalsContact O-CB 3.28Å; R8-L12 WeakPolarHBondContact O-CB 3.43Å; R8-L12 WeakPolarHBondContact O-CG 3.41Å; R8-L12 PolarHBondContact O-N 2.72Å; L12-R14 PolarHBondContact O-N 2.9Å; L12-A15 PolarHBondContact O-N 2.94Å; L12-N16 WeakPolarHBondContact O-CB 2.98Å; L12-N16 PolarHBondContact O-N 2.73Å; L12-I31 HydrophobicContact CD2-CG2 4.31Å
13	H	58.6	Low	50.8	Low	111 Å²	111	80.3 Å²	80.3	51%	0.514	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-40.7	177.9	-169.7	-32.9	0	0	0	112	S9 M11 R17	S9-H13 WeakPolarHBondContact O-CB 3.25Å; S9-H13 PolarHBondContact O-N 3.18Å; M11-H13 PolarHBondContact O-N 3.16Å; H13-R17 PolarHBondContact O-N 3.02Å; H13-R17 VanDerWaalsContact O-N 3.14Å
14	R	55.3	Low	51	Low	89 Å²	89	79.8 Å²	79.8	34%	0.336	40%	0.4	S	S	.	.	H	α-helix	trans	-70.4	-38.3	176.1	-77.1	-177.7	-178.8	-177.2	2.5	112.2	R10 M11 L12 R17 L18 L491	R10-R14 WeakPolarHBondContact O-CB 3.21Å; R10-R14 WeakPolarHBondContact O-CG 3.24Å; R10-R14 PolarHBondContact O-N 2.95Å; M11-R14 PolarHBondContact O-N 3.36Å; L12-R14 PolarHBondContact O-N 2.9Å; R14-R17 WeakPolarHBondContact O-CB 3.5Å; R14-R17 PolarHBondContact O-N 3.5Å; R14-L18 WeakPolarHBondContact O-CG 3.44Å; R14-L18 PolarHBondContact O-N 2.61Å; R14-L491 PolarHBondContact NH1-O 3.01Å
15	A	51.5	Low	51.3	Low	10 Å²	10	83.6 Å²	83.6	8%	0.083	41%	0.409	C	S	.	.	H	α-helix	trans	-70.1	-36.7	177.8	0	0	0	0	0	111.4	M11 L12 R17 L18 V19 I31	M11-A15 WeakPolarHBondContact O-CB 3.43Å; M11-A15 PolarHBondContact O-N 3.46Å; L12-A15 PolarHBondContact O-N 2.94Å; A15-R17 VanDerWaalsContact C-N 3.26Å; A15-R17 PolarHBondContact O-N 2.54Å; A15-L18 CarbonylContact O-C 3.38Å; A15-L18 WeakPolarHBondContact O-CA 3.33Å; A15-L18 WeakPolarHBondContact O-CB 3.38Å; A15-L18 PolarHBondContact O-N 2.94Å; A15-V19 VanDerWaalsContact O-CG2 3.32Å; A15-V19 WeakPolarHBondContact O-CG2 3.09Å; A15-V19 PolarHBondContact O-N 3.15Å; A15-I31 HydrophobicContact CB-CD1 3.71Å; A15-I31 HydrophobicContact CB-CG1 3.26Å
16	N	53	Low	51.3	Low	102 Å²	102	82.7 Å²	82.7	55%	0.545	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-35.3	170.4	-154.1	7.4	0	0	0	111.5	L12	L12-N16 WeakPolarHBondContact O-CB 2.98Å; L12-N16 PolarHBondContact O-N 2.73Å
17	R	54.7	Low	50.9	Low	185 Å²	185	81.1 Å²	81.1	70%	0.698	39%	0.394	S	S	*	.	H	α-helix	trans	-69.1	-30.6	170.1	-76.5	-177	164.7	178.5	-1.9	113.7	H13 R14 A15	H13-R17 PolarHBondContact O-N 3.02Å; H13-R17 VanDerWaalsContact O-N 3.14Å; R14-R17 WeakPolarHBondContact O-CB 3.5Å; R14-R17 PolarHBondContact O-N 3.5Å; A15-R17 VanDerWaalsContact C-N 3.26Å; A15-R17 PolarHBondContact O-N 2.54Å
18	L	50.4	Low	50.6	Low	86 Å²	86	86.4 Å²	86.4	45%	0.45	41%	0.411	S	S	.	.	H	α-helix	trans	-79	-29.3	176.2	-71.1	167.8	0	0	0	112.7	R14 A15 N20 G21 A27 L490	R14-L18 WeakPolarHBondContact O-CG 3.44Å; R14-L18 PolarHBondContact O-N 2.61Å; A15-L18 CarbonylContact O-C 3.38Å; A15-L18 WeakPolarHBondContact O-CA 3.33Å; A15-L18 WeakPolarHBondContact O-CB 3.38Å; A15-L18 PolarHBondContact O-N 2.94Å; L18-N20 PolarHBondContact O-N 3.12Å; L18-G21 PolarHBondContact O-N 3.27Å; L18-A27 HydrophobicContact CB-CB 4.16Å; L18-L490 HydrophobicContact CD1-CD2 3.94Å
19	V	49	Very low	50.7	Low	18 Å²	18	87.7 Å²	87.7	11%	0.109	42%	0.422	C	S	.	.	H	α-helix	trans	-64.3	-22.6	172.9	169.5	0	0	0	0	112.3	A15 G21 N24 A27 W28 I31	A15-V19 VanDerWaalsContact O-CG2 3.32Å; A15-V19 WeakPolarHBondContact O-CG2 3.09Å; A15-V19 PolarHBondContact O-N 3.15Å; V19-G21 PolarHBondContact O-N 3.38Å; V19-N24 PolarHBondContact O-OD1 3.45Å; V19-A27 HydrophobicContact CB-CB 4.48Å; V19-A27 HydrophobicContact CG2-CB 3.68Å; V19-W28 HydrophobicContact CG1-CZ2 4.21Å; V19-I31 HydrophobicContact CG2-CD1 3.2Å
20	N	48.8	Very low	50.5	Low	121 Å²	121	85.7 Å²	85.7	65%	0.647	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	1.3	172.5	-66.9	-16.1	0	0	0	113.3	L18	L18-N20 PolarHBondContact O-N 3.12Å
21	G	49.2	Very low	50.2	Low	27 Å²	27	83.9 Å²	83.9	28%	0.278	40%	0.4	S	S	.	.	S	Bend	trans	-80.4	-165.7	179.3	0	0	0	0	0	114.4	L18 V19 K23 N24	L18-G21 PolarHBondContact O-N 3.27Å; V19-G21 PolarHBondContact O-N 3.38Å; G21-K23 VanDerWaalsContact C-N 3.28Å; G21-N24 PolarHBondContact O-OD1 2.89Å
22	I	44.1	Very low	50.1	Low	126 Å²	126	85.3 Å²	85.3	65%	0.646	42%	0.421	S	S	*	.	S	Bend	trans	-92.2	2.4	174.2	-53.8	169.3	0	0	0	110.1	K254	I22-K254 HydrophobicContact CD1-CB 3.95Å; I22-K254 HydrophobicContact CD1-CD 3.94Å; I22-K254 HydrophobicContact CD1-CG 4Å; I22-K254 HydrophobicContact CG1-CD 3.81Å; I22-K254 HydrophobicContact CG1-CG 4.29Å
23	K	51.4	Low	49.8	Very low	126 Å²	126	82.5 Å²	82.5	55%	0.548	41%	0.406	S	S	.	.			trans	-119.6	47	-169.9	-71.5	167	152.1	-105.3	0	110.9	G21 E25 E26 A27	G21-K23 VanDerWaalsContact C-N 3.28Å; K23-E25 VanDerWaalsContact C-N 3.32Å; K23-E25 PolarHBondContact O-N 3.29Å; K23-E26 HydrophobicContact CB-CB 4.4Å; K23-E26 IonicContact NZ-OE2 3.91Å; K23-E26 PolarHBondContact NZ-OE2 3.03Å; K23-E26 PolarHBondContact O-N 3.16Å; K23-A27 PolarHBondContact O-N 2.82Å
24	N	46.7	Very low	49.4	Very low	75 Å²	75	78.8 Å²	78.8	40%	0.401	39%	0.388	S	S	.	.	H	α-helix	trans	-62.2	-39.5	-169.2	-64.6	-1.7	0	0	0	112	V19 G21 A27 W28	V19-N24 PolarHBondContact O-OD1 3.45Å; G21-N24 PolarHBondContact O-OD1 2.89Å; N24-A27 PolarHBondContact O-N 3Å; N24-W28 PolarHBondContact O-N 3.13Å
25	E	48.7	Very low	49.1	Very low	160 Å²	160	80.9 Å²	80.9	75%	0.748	40%	0.402	S	S	*	.	H	α-helix	trans	-69.3	-40.8	-179.3	-63.8	-178.1	169	0	0	112.8	K23 A27 W28 H29	K23-E25 VanDerWaalsContact C-N 3.32Å; K23-E25 PolarHBondContact O-N 3.29Å; E25-A27 VanDerWaalsContact C-N 3.34Å; E25-W28 PolarHBondContact O-N 3.28Å; E25-H29 PolarHBondContact O-N 3.31Å; E25-H29 VanDerWaalsContact O-N 3.1Å; E25-H29 PolarHBondContact O-ND1 2.85Å
26	E	46.5	Very low	48.9	Very low	71 Å²	71	87.3 Å²	87.3	33%	0.332	43%	0.43	S	S	.	.	H	α-helix	trans	-63.4	-42.9	175.2	-168.5	176.6	-168.7	0	0	109.7	K23 L30	K23-E26 HydrophobicContact CB-CB 4.4Å; K23-E26 IonicContact NZ-OE2 3.91Å; K23-E26 PolarHBondContact NZ-OE2 3.03Å; K23-E26 PolarHBondContact O-N 3.16Å; E26-L30 HydrophobicContact CG-CD1 3.86Å; E26-L30 VanDerWaalsContact O-CB 3.26Å; E26-L30 WeakPolarHBondContact O-CB 3.41Å; E26-L30 WeakPolarHBondContact O-CD1 3.39Å; E26-L30 WeakPolarHBondContact O-CG 3.49Å; E26-L30 PolarHBondContact O-N 3.24Å
27	A	46	Very low	48.7	Very low	7 Å²	7	88 Å²	88	6%	0.058	44%	0.438	C	S	.	.	H	α-helix	trans	-66	-42.1	178.6	0	0	0	0	0	112.9	L18 V19 K23 N24 E25 L30 I31	L18-A27 HydrophobicContact CB-CB 4.16Å; V19-A27 HydrophobicContact CB-CB 4.48Å; V19-A27 HydrophobicContact CG2-CB 3.68Å; K23-A27 PolarHBondContact O-N 2.82Å; N24-A27 PolarHBondContact O-N 3Å; E25-A27 VanDerWaalsContact C-N 3.34Å; A27-L30 CarbonylContact O-C 3.51Å; A27-L30 PolarHBondContact O-N 2.79Å; A27-I31 WeakPolarHBondContact O-CB 3.43Å; A27-I31 WeakPolarHBondContact O-CD1 3.25Å; A27-I31 WeakPolarHBondContact O-CG1 3.39Å; A27-I31 PolarHBondContact O-N 3.13Å
28	W	44.7	Very low	48.7	Very low	159 Å²	159	85.4 Å²	85.4	60%	0.602	43%	0.434	S	S	*	.	H	α-helix	trans	-66.8	-39.7	177.4	-82	110.5	0	0	0	113.2	V19 N24 E25 L30 I31 G32	V19-W28 HydrophobicContact CG1-CZ2 4.21Å; N24-W28 PolarHBondContact O-N 3.13Å; E25-W28 PolarHBondContact O-N 3.28Å; W28-L30 VanDerWaalsContact C-N 3.32Å; W28-L30 PolarHBondContact O-N 2.95Å; W28-I31 PolarHBondContact O-N 3.16Å; W28-G32 PolarHBondContact O-N 2.91Å; W28-G32 VanDerWaalsContact O-N 3.12Å
29	H	51.1	Low	48.8	Very low	140 Å²	140	82.9 Å²	82.9	65%	0.648	42%	0.422	S	S	*	.	H	α-helix	trans	-64.3	-38.7	172.7	-76.6	76.5	0	0	0	111.5	E25 I31 L33	E25-H29 PolarHBondContact O-N 3.31Å; E25-H29 VanDerWaalsContact O-N 3.1Å; E25-H29 PolarHBondContact O-ND1 2.85Å; H29-I31 VanDerWaalsContact C-N 3.32Å; H29-I31 PolarHBondContact O-N 2.67Å; H29-L33 WeakPolarHBondContact O-CD1 3.22Å; H29-L33 PolarHBondContact O-N 3.23Å
30	L	50.1	Low	49	Very low	27 Å²	27	87 Å²	87	14%	0.141	44%	0.444	C	S	.	.	H	α-helix	trans	-73.4	-17.5	175.4	-64.9	171.7	0	0	0	113.7	E26 A27 W28 L33 F34 I486 L490	E26-L30 HydrophobicContact CG-CD1 3.86Å; E26-L30 VanDerWaalsContact O-CB 3.26Å; E26-L30 WeakPolarHBondContact O-CB 3.41Å; E26-L30 WeakPolarHBondContact O-CD1 3.39Å; E26-L30 WeakPolarHBondContact O-CG 3.49Å; E26-L30 PolarHBondContact O-N 3.24Å; A27-L30 CarbonylContact O-C 3.51Å; A27-L30 PolarHBondContact O-N 2.79Å; W28-L30 VanDerWaalsContact C-N 3.32Å; W28-L30 PolarHBondContact O-N 2.95Å; L30-L33 HydrophobicContact CB-CD1 4.45Å; L30-L33 HydrophobicContact CD2-CD1 3.42Å; L30-L33 VanDerWaalsContact CD2-CD1 3.42Å; L30-L33 HydrophobicContact CG-CD1 4.34Å; L30-L33 WeakPolarHBondContact O-CB 3.47Å; L30-F34 WeakPolarHBondContact O-CD2 3.5Å; L30-I486 HydrophobicContact CD2-CG1 4.31Å; L30-I486 HydrophobicContact CD2-CG2 4.27Å; L30-L490 HydrophobicContact CB-CD1 3.98Å; L30-L490 HydrophobicContact CB-CD2 4.44Å; L30-L490 HydrophobicContact CD1-CD1 4.18Å; L30-L490 HydrophobicContact CD1-CD2 4.11Å; L30-L490 HydrophobicContact CD1-CG 4.49Å; L30-L490 HydrophobicContact CD2-CD1 3.86Å; L30-L490 HydrophobicContact CG-CD1 4.2Å
31	I	48.4	Very low	49.5	Very low	27 Å²	27	82.7 Å²	82.7	14%	0.138	42%	0.422	C	S	.	.	H	α-helix	trans	-82.6	-40	173.6	-76.1	163.8	0	0	0	112.1	L12 A15 V19 A27 W28 H29 L33	L12-I31 HydrophobicContact CD2-CG2 4.31Å; A15-I31 HydrophobicContact CB-CD1 3.71Å; A15-I31 HydrophobicContact CB-CG1 3.26Å; V19-I31 HydrophobicContact CG2-CD1 3.2Å; A27-I31 WeakPolarHBondContact O-CB 3.43Å; A27-I31 WeakPolarHBondContact O-CD1 3.25Å; A27-I31 WeakPolarHBondContact O-CG1 3.39Å; A27-I31 PolarHBondContact O-N 3.13Å; W28-I31 PolarHBondContact O-N 3.16Å; H29-I31 VanDerWaalsContact C-N 3.32Å; H29-I31 PolarHBondContact O-N 2.67Å; I31-L33 PolarHBondContact O-N 3.34Å
32	G	47.8	Very low	50	Low	51 Å²	51	82.2 Å²	82.2	53%	0.526	41%	0.412	S	S	.	.	H	α-helix	trans	-61.9	-24.1	172.5	0	0	0	0	0	112.9	W28 F34	W28-G32 PolarHBondContact O-N 2.91Å; W28-G32 VanDerWaalsContact O-N 3.12Å; G32-F34 VanDerWaalsContact C-N 3.31Å; G32-F34 PolarHBondContact O-N 2.89Å
33	L	50.7	Low	50.8	Low	14 Å²	14	76.8 Å²	76.8	7%	0.073	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.8	-174.4	-108.5	157.9	0	0	0	116.2	H29 L30 I31 I45	H29-L33 WeakPolarHBondContact O-CD1 3.22Å; H29-L33 PolarHBondContact O-N 3.23Å; L30-L33 HydrophobicContact CB-CD1 4.45Å; L30-L33 HydrophobicContact CD2-CD1 3.42Å; L30-L33 VanDerWaalsContact CD2-CD1 3.42Å; L30-L33 HydrophobicContact CG-CD1 4.34Å; L30-L33 WeakPolarHBondContact O-CB 3.47Å; I31-L33 PolarHBondContact O-N 3.34Å; L33-I45 HydrophobicContact CD1-CG2 4.04Å; L33-I45 HydrophobicContact CD2-CB 3.48Å; L33-I45 VanDerWaalsContact CD2-CB 3.48Å; L33-I45 HydrophobicContact CD2-CD1 3.67Å; L33-I45 HydrophobicContact CD2-CG1 4.16Å; L33-I45 HydrophobicContact CD2-CG2 3.21Å; L33-I45 HydrophobicContact CG-CB 4.27Å; L33-I45 HydrophobicContact CG-CD1 4.3Å; L33-I45 HydrophobicContact CG-CG2 3.47Å; L33-I45 VanDerWaalsContact CG-CG2 3.47Å
34	F	50.4	Low	51.3	Low	34 Å²	34	76.5 Å²	76.5	15%	0.149	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	9.6	-168.3	-79.4	-81.8	0	0	0	115.9	M11 L30 G32 Q36 L490	M11-F34 HydrophobicContact CE-CD1 3.45Å; M11-F34 VanDerWaalsContact CE-CD1 3.45Å; M11-F34 HydrophobicContact CE-CD2 3.71Å; M11-F34 HydrophobicContact CE-CE1 3.14Å; M11-F34 HydrophobicContact CE-CE2 3.42Å; M11-F34 VanDerWaalsContact CE-CE2 3.42Å; M11-F34 HydrophobicContact CE-CG 3.74Å; M11-F34 HydrophobicContact CE-CZ 3.14Å; M11-F34 HydrophobicContact SD-CD1 3.51Å; M11-F34 VanDerWaalsContact SD-CD1 3.51Å; M11-F34 HydrophobicContact SD-CE1 3.6Å; M11-F34 HydrophobicContact SD-CG 4.08Å; M11-F34 HydrophobicContact SD-CZ 4.24Å; L30-F34 WeakPolarHBondContact O-CD2 3.5Å; G32-F34 VanDerWaalsContact C-N 3.31Å; G32-F34 PolarHBondContact O-N 2.89Å; F34-Q36 VanDerWaalsContact C-N 3.33Å; F34-Q36 PolarHBondContact O-N 3.2Å; F34-L490 HydrophobicContact CE2-CD1 3.79Å; F34-L490 HydrophobicContact CZ-CD1 4.43Å
35	Q	47.6	Very low	52	Low	133 Å²	133	74.9 Å²	74.9	62%	0.621	38%	0.376	S	S	*	.	S	Bend	trans	-77	-8.8	-178.5	-73.6	-171.3	-10.2	0	0	115.2
36	Q	47.1	Very low	52.7	Low	144 Å²	144	67.3 Å²	67.3	67%	0.673	34%	0.341	S	S	*	.	S	Bend	trans	-150.3	91.8	-179.2	-64.7	179.8	-2	0	0	111.6	F34 H38	F34-Q36 VanDerWaalsContact C-N 3.33Å; F34-Q36 PolarHBondContact O-N 3.2Å; Q36-H38 VanDerWaalsContact C-N 3.3Å; Q36-H38 PolarHBondContact O-N 3.41Å
37	T	48.6	Very low	53.4	Low	116 Å²	116	66 Å²	66	71%	0.712	34%	0.335	S	S	*	.			trans	-74.7	71.9	-175.8	50.5	0	0	0	0	113.2
38	H	55	Low	54.2	Low	132 Å²	132	69.8 Å²	69.8	61%	0.611	35%	0.351	S	S	*	.			trans	-107	137.3	158.9	-92.6	-70.5	0	0	0	109.8	Q36 N40 T41 F42	Q36-H38 VanDerWaalsContact C-N 3.3Å; Q36-H38 PolarHBondContact O-N 3.41Å; H38-N40 PolarHBondContact O-N 3.25Å; H38-T41 WeakPolarHBondContact O-CB 3.32Å; H38-T41 PolarHBondContact O-N 2.91Å; H38-F42 PolarHBondContact O-N 3.12Å; H38-F42 VanDerWaalsContact O-N 3.13Å
39	P	52.8	Low	55.1	Low	32 Å²	32	63.6 Å²	63.6	21%	0.208	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-33.6	179.9	23	-34.4	0	0	0	112.4	L43 L429 F571	P39-L43 VanDerWaalsContact O-CG 3.26Å; P39-L43 WeakPolarHBondContact O-CG 3.43Å; P39-L43 PolarHBondContact O-N 2.99Å; P39-L429 HydrophobicContact CB-CD1 3.59Å; P39-L429 HydrophobicContact CB-CD2 3.93Å; P39-L429 HydrophobicContact CB-CG 4.32Å; P39-F571 HydrophobicContact CG-CE2 4.22Å
40	N	53.1	Low	55.8	Low	104 Å²	104	57.4 Å²	57.4	56%	0.556	30%	0.302	S	S	*	.	H	α-helix	trans	-67.4	-39.2	176.8	-65.5	-28.6	0	0	0	112.1	H38 L43 Q44	H38-N40 PolarHBondContact O-N 3.25Å; N40-L43 PolarHBondContact O-N 3.28Å; N40-Q44 WeakPolarHBondContact O-CB 3.29Å; N40-Q44 VanDerWaalsContact O-CG 3.27Å; N40-Q44 WeakPolarHBondContact O-CG 3.42Å; N40-Q44 PolarHBondContact O-N 2.89Å
41	T	59.6	Low	56.3	Low	32 Å²	32	56.2 Å²	56.2	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-66.2	-43.7	178	-47.7	0	0	0	0	110.9	H38 L43 Q44 I45	H38-T41 WeakPolarHBondContact O-CB 3.32Å; H38-T41 PolarHBondContact O-N 2.91Å; T41-L43 VanDerWaalsContact C-N 3.29Å; T41-L43 PolarHBondContact O-N 2.9Å; T41-Q44 PolarHBondContact O-N 3.42Å; T41-I45 HydrophobicContact CG2-CD1 3.92Å; T41-I45 WeakPolarHBondContact O-CD1 3.4Å; T41-I45 WeakPolarHBondContact O-CG1 3.46Å; T41-I45 PolarHBondContact O-N 3.11Å
42	F	59.5	Low	56.8	Low	16 Å²	16	57.7 Å²	57.7	7%	0.07	31%	0.309	C	S	.	.	H	α-helix	trans	-57.5	-42.6	173.9	173.3	-103.1	0	0	0	112.3	H38 I45 C46 L426 A483 I486 V487	H38-F42 PolarHBondContact O-N 3.12Å; H38-F42 VanDerWaalsContact O-N 3.13Å; F42-I45 PolarHBondContact O-N 3.46Å; F42-C46 VanDerWaalsContact CZ-SG 3.5Å; F42-C46 PolarHBondContact O-N 3.42Å; F42-C46 PolarHBondContact O-SG 2.9Å; F42-L426 HydrophobicContact CD1-CD2 4.39Å; F42-L426 HydrophobicContact CG-CD2 4.37Å; F42-A483 HydrophobicContact CE1-CB 3.91Å; F42-A483 HydrophobicContact CZ-CB 4.02Å; F42-I486 HydrophobicContact CE2-CG2 4.13Å; F42-V487 HydrophobicContact CE1-CG2 4.47Å; F42-V487 HydrophobicContact CE2-CG2 4.33Å; F42-V487 HydrophobicContact CZ-CG2 3.75Å
43	L	61.9	Low	57.5	Low	12 Å²	12	60.4 Å²	60.4	6%	0.063	31%	0.307	C	S	.	.	H	α-helix	trans	-70	-40	178.7	-67.7	179.2	0	0	0	113	P39 N40 T41 I45 C46 H47 L68 L433	P39-L43 VanDerWaalsContact O-CG 3.26Å; P39-L43 WeakPolarHBondContact O-CG 3.43Å; P39-L43 PolarHBondContact O-N 2.99Å; N40-L43 PolarHBondContact O-N 3.28Å; T41-L43 VanDerWaalsContact C-N 3.29Å; T41-L43 PolarHBondContact O-N 2.9Å; L43-I45 VanDerWaalsContact C-N 3.26Å; L43-I45 PolarHBondContact O-N 3.33Å; L43-C46 PolarHBondContact O-N 2.78Å; L43-H47 VanDerWaalsContact O-CB 3.29Å; L43-H47 WeakPolarHBondContact O-CB 3.41Å; L43-H47 PolarHBondContact O-N 2.94Å; L43-L68 HydrophobicContact CB-CD1 4.47Å; L43-L433 HydrophobicContact CD1-CD2 3.61Å; L43-L433 HydrophobicContact CD2-CD1 3.61Å; L43-L433 HydrophobicContact CD2-CD2 3.31Å; L43-L433 HydrophobicContact CD2-CG 3.9Å; L43-L433 HydrophobicContact CG-CD2 4.01Å
44	Q	61.3	Low	57.8	Low	120 Å²	120	60.4 Å²	60.4	56%	0.561	31%	0.307	S	S	*	.	H	α-helix	trans	-58.4	-42	172.6	-78.5	171.1	-24	0	0	110.4	N40 T41 H47 H48	N40-Q44 WeakPolarHBondContact O-CB 3.29Å; N40-Q44 VanDerWaalsContact O-CG 3.27Å; N40-Q44 WeakPolarHBondContact O-CG 3.42Å; N40-Q44 PolarHBondContact O-N 2.89Å; T41-Q44 PolarHBondContact O-N 3.42Å; Q44-H47 WeakPolarHBondContact O-CB 3.15Å; Q44-H47 PolarHBondContact O-N 3.31Å; Q44-H48 WeakPolarHBondContact O-CB 3.34Å; Q44-H48 PolarHBondContact O-N 3.37Å
45	I	60.7	Low	58.2	Low	42 Å²	42	62 Å²	62	22%	0.215	32%	0.315	C	S	.	.	H	α-helix	trans	-75.6	-40.8	-178.4	-55	159.1	0	0	0	111.7	L33 T41 F42 L43 H47 H48 T49	L33-I45 HydrophobicContact CD1-CG2 4.04Å; L33-I45 HydrophobicContact CD2-CB 3.48Å; L33-I45 VanDerWaalsContact CD2-CB 3.48Å; L33-I45 HydrophobicContact CD2-CD1 3.67Å; L33-I45 HydrophobicContact CD2-CG1 4.16Å; L33-I45 HydrophobicContact CD2-CG2 3.21Å; L33-I45 HydrophobicContact CG-CB 4.27Å; L33-I45 HydrophobicContact CG-CD1 4.3Å; L33-I45 HydrophobicContact CG-CG2 3.47Å; L33-I45 VanDerWaalsContact CG-CG2 3.47Å; T41-I45 HydrophobicContact CG2-CD1 3.92Å; T41-I45 WeakPolarHBondContact O-CD1 3.4Å; T41-I45 WeakPolarHBondContact O-CG1 3.46Å; T41-I45 PolarHBondContact O-N 3.11Å; F42-I45 PolarHBondContact O-N 3.46Å; L43-I45 VanDerWaalsContact C-N 3.26Å; L43-I45 PolarHBondContact O-N 3.33Å; I45-H47 PolarHBondContact O-N 2.99Å; I45-H48 PolarHBondContact O-N 3.04Å; I45-H48 VanDerWaalsContact O-N 3.14Å; I45-T49 WeakPolarHBondContact O-CB 3.49Å; I45-T49 PolarHBondContact O-N 2.86Å; I45-T49 PolarHBondContact O-OG1 3.22Å
46	C	63.3	Low	58.6	Low	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-56.3	-38.2	170.8	-69.1	0	0	0	0	111.3	F42 L43 L50 L482	F42-C46 VanDerWaalsContact CZ-SG 3.5Å; F42-C46 PolarHBondContact O-N 3.42Å; F42-C46 PolarHBondContact O-SG 2.9Å; L43-C46 PolarHBondContact O-N 2.78Å; C46-L50 WeakPolarHBondContact O-CB 3.15Å; C46-L50 PolarHBondContact O-N 3.43Å; C46-L482 WeakPolarHBondContact O-CD2 3.34Å
47	H	62.8	Low	58.8	Low	45 Å²	45	54.3 Å²	54.3	21%	0.208	29%	0.285	C	S	.	.	H	α-helix	trans	-69.1	-44.5	175.9	-174.4	62.7	0	0	0	112.1	L43 Q44 I45 L50 A51	L43-H47 VanDerWaalsContact O-CB 3.29Å; L43-H47 WeakPolarHBondContact O-CB 3.41Å; L43-H47 PolarHBondContact O-N 2.94Å; Q44-H47 WeakPolarHBondContact O-CB 3.15Å; Q44-H47 PolarHBondContact O-N 3.31Å; I45-H47 PolarHBondContact O-N 2.99Å; H47-L50 PolarHBondContact O-N 3.23Å; H47-A51 WeakPolarHBondContact O-CB 3.21Å; H47-A51 PolarHBondContact O-N 3.03Å
48	H	62.3	Low	58.8	Low	85 Å²	85	51.5 Å²	51.5	39%	0.394	26%	0.264	S	S	.	.	H	α-helix	trans	-60.8	-47.7	176.9	-173.3	86.3	0	0	0	111.1	Q44 I45 L50 A51 S52 H58	Q44-H48 WeakPolarHBondContact O-CB 3.34Å; Q44-H48 PolarHBondContact O-N 3.37Å; I45-H48 PolarHBondContact O-N 3.04Å; I45-H48 VanDerWaalsContact O-N 3.14Å; H48-L50 VanDerWaalsContact C-N 3.32Å; H48-L50 PolarHBondContact O-N 3.2Å; H48-A51 CarbonylContact O-C 3.51Å; H48-A51 WeakPolarHBondContact O-CB 3.45Å; H48-A51 PolarHBondContact O-N 3.23Å; H48-A51 VanDerWaalsContact O-N 3.11Å; H48-S52 PolarHBondContact O-N 3.34Å; H48-S52 PolarHBondContact O-OG 3.45Å; H48-H58 AromaticContact CE1-CD2 3.67Å; H48-H58 AromaticContact CE1-CE1 3.1Å; H48-H58 PolarHBondContact CE1-CE1 3.43Å; H48-H58 AromaticContact CE1-CG 3.63Å; H48-H58 AromaticContact CE1-ND1 3.29Å; H48-H58 PolarHBondContact CE1-ND1 2.86Å; H48-H58 VanDerWaalsContact CE1-ND1 3.29Å; H48-H58 AromaticContact CE1-NE2 3.35Å; H48-H58 PolarHBondContact CE1-NE2 2.82Å; H48-H58 AromaticContact CG-CE1 3.9Å; H48-H58 AromaticContact ND1-CE1 3.29Å; H48-H58 PolarHBondContact ND1-CE1 3.2Å; H48-H58 VanDerWaalsContact ND1-CE1 3.29Å; H48-H58 AromaticContact ND1-CG 3.91Å; H48-H58 AromaticContact ND1-ND1 3.21Å; H48-H58 PolarHBondContact ND1-ND1 2.78Å; H48-H58 AromaticContact NE2-CE1 3.63Å; H48-H58 AromaticContact NE2-NE2 3.74Å
49	T	63	Low	58.2	Low	30 Å²	30	51.7 Å²	51.7	18%	0.184	27%	0.269	C	S	.	.	H	α-helix	trans	-58	-43.9	174.7	-57.3	0	0	0	0	111.6	I45 S52 F53 L482	I45-T49 WeakPolarHBondContact O-CB 3.49Å; I45-T49 PolarHBondContact O-N 2.86Å; I45-T49 PolarHBondContact O-OG1 3.22Å; T49-S52 PolarHBondContact O-N 2.8Å; T49-F53 HydrophobicContact CG2-CD2 3.68Å; T49-F53 HydrophobicContact CG2-CE2 3.44Å; T49-F53 VanDerWaalsContact CG2-CE2 3.44Å; T49-F53 WeakPolarHBondContact O-CB 3.43Å; T49-F53 WeakPolarHBondContact O-CD2 3.08Å; T49-F53 PolarHBondContact O-N 2.64Å; T49-L482 HydrophobicContact CG2-CD2 4.19Å
50	L	65.1	Low	57.6	Low	9 Å²	9	59.5 Å²	59.5	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-41.4	175.5	-171.4	70.7	0	0	0	111.6	C46 H47 H48 F53 L54 L475 R479 L482	C46-L50 WeakPolarHBondContact O-CB 3.15Å; C46-L50 PolarHBondContact O-N 3.43Å; H47-L50 PolarHBondContact O-N 3.23Å; H48-L50 VanDerWaalsContact C-N 3.32Å; H48-L50 PolarHBondContact O-N 3.2Å; L50-F53 PolarHBondContact O-N 3.36Å; L50-L54 HydrophobicContact CD1-CD1 4.35Å; L50-L54 HydrophobicContact CG-CD1 3.94Å; L50-L54 WeakPolarHBondContact O-CB 3.45Å; L50-L54 VanDerWaalsContact O-CG 3.22Å; L50-L54 WeakPolarHBondContact O-CG 3.27Å; L50-L54 PolarHBondContact O-N 3.36Å; L50-L475 HydrophobicContact CD2-CD1 3.76Å; L50-L475 HydrophobicContact CD2-CG 4.48Å; L50-R479 HydrophobicContact CD2-CB 4.24Å; L50-L482 HydrophobicContact CB-CD2 4.01Å; L50-L482 HydrophobicContact CD1-CD2 4.43Å
51	A	61.2	Low	57.3	Low	3 Å²	3	56.8 Å²	56.8	3%	0.025	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-43.7	176.7	0	0	0	0	0	111.4	H47 H48 L54 E55 L56	H47-A51 WeakPolarHBondContact O-CB 3.21Å; H47-A51 PolarHBondContact O-N 3.03Å; H48-A51 CarbonylContact O-C 3.51Å; H48-A51 WeakPolarHBondContact O-CB 3.45Å; H48-A51 PolarHBondContact O-N 3.23Å; H48-A51 VanDerWaalsContact O-N 3.11Å; A51-L54 CarbonylContact O-C 3.59Å; A51-L54 PolarHBondContact O-N 2.87Å; A51-E55 PolarHBondContact O-N 2.92Å; A51-L56 HydrophobicContact CB-CB 4.18Å; A51-L56 PolarHBondContact O-N 2.85Å
52	S	60	Low	56.5	Low	58 Å²	58	61 Å²	61	41%	0.406	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-43.8	174.3	-51.6	0	0	0	0	111.4	H48 T49 L54 E55 H58	H48-S52 PolarHBondContact O-N 3.34Å; H48-S52 PolarHBondContact O-OG 3.45Å; T49-S52 PolarHBondContact O-N 2.8Å; S52-L54 VanDerWaalsContact C-N 3.25Å; S52-L54 PolarHBondContact O-N 3.47Å; S52-E55 PolarHBondContact O-N 2.78Å; S52-E55 VanDerWaalsContact O-N 3.16Å; S52-H58 PolarHBondContact OG-CE1 3Å; S52-H58 PolarHBondContact OG-NE2 3.42Å
53	F	60.9	Low	55.7	Low	108 Å²	108	67.7 Å²	67.7	47%	0.474	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-30.2	175.6	-84.6	-59.1	0	0	0	113.4	T49 L50 E55 Y603	T49-F53 HydrophobicContact CG2-CD2 3.68Å; T49-F53 HydrophobicContact CG2-CE2 3.44Å; T49-F53 VanDerWaalsContact CG2-CE2 3.44Å; T49-F53 WeakPolarHBondContact O-CB 3.43Å; T49-F53 WeakPolarHBondContact O-CD2 3.08Å; T49-F53 PolarHBondContact O-N 2.64Å; L50-F53 PolarHBondContact O-N 3.36Å; F53-E55 VanDerWaalsContact C-N 3.34Å; F53-Y603 WeakPolarHBondContact O-CD2 3.24Å; F53-Y603 VanDerWaalsContact O-CE2 3.25Å; F53-Y603 WeakPolarHBondContact O-CE2 3.38Å
54	L	58.7	Low	54.6	Low	13 Å²	13	73.6 Å²	73.6	7%	0.068	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	1	178.8	-66.7	174	0	0	0	113.2	L50 A51 S52 L56 L475 V606 L610	L50-L54 HydrophobicContact CD1-CD1 4.35Å; L50-L54 HydrophobicContact CG-CD1 3.94Å; L50-L54 WeakPolarHBondContact O-CB 3.45Å; L50-L54 VanDerWaalsContact O-CG 3.22Å; L50-L54 WeakPolarHBondContact O-CG 3.27Å; L50-L54 PolarHBondContact O-N 3.36Å; A51-L54 CarbonylContact O-C 3.59Å; A51-L54 PolarHBondContact O-N 2.87Å; S52-L54 VanDerWaalsContact C-N 3.25Å; S52-L54 PolarHBondContact O-N 3.47Å; L54-L56 VanDerWaalsContact C-N 3.31Å; L54-L56 HydrophobicContact CB-CD1 3.89Å; L54-L56 HydrophobicContact CB-CG 3.83Å; L54-L56 HydrophobicContact CD1-CD1 4.04Å; L54-L56 PolarHBondContact O-N 3.4Å; L54-L475 HydrophobicContact CD1-CD1 4.05Å; L54-V606 HydrophobicContact CD1-CG1 3.64Å; L54-V606 HydrophobicContact CD2-CB 3.82Å; L54-V606 HydrophobicContact CD2-CG1 3.53Å; L54-V606 HydrophobicContact CG-CG1 4.24Å; L54-L610 HydrophobicContact CD1-CD1 4.45Å; L54-L610 HydrophobicContact CD2-CD1 4.36Å
55	E	58.6	Low	53.6	Low	69 Å²	69	77.5 Å²	77.5	32%	0.322	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	48.8	-173.7	-43.4	169.2	-177.5	0	0	110.8	A51 S52 F53 R607 I619	A51-E55 PolarHBondContact O-N 2.92Å; S52-E55 PolarHBondContact O-N 2.78Å; S52-E55 VanDerWaalsContact O-N 3.16Å; F53-E55 VanDerWaalsContact C-N 3.34Å; E55-R607 VanDerWaalsContact CD-NH1 3.32Å; E55-R607 IonicContact OE1-CZ 2.63Å; E55-R607 IonicContact OE1-NH1 2.73Å; E55-R607 PolarHBondContact OE1-NH1 3.29Å; E55-R607 IonicContact OE1-NH2 3.41Å; E55-R607 PolarHBondContact OE1-NH2 3.45Å; E55-R607 IonicContact OE2-CZ 3.6Å; E55-R607 IonicContact OE2-NH1 2.78Å; E55-R607 IonicContact OE2-NH2 3.63Å; E55-R607 PolarHBondContact OE2-NH2 3.21Å; E55-I619 HydrophobicContact CB-CD1 3.34Å; E55-I619 WeakPolarHBondContact O-CD1 2.89Å
56	L	56.2	Low	52.6	Low	41 Å²	41	80.5 Å²	80.5	22%	0.215	38%	0.383	C	S	.	.			trans	-97.1	130.8	175.7	-65	172.6	0	0	0	109.5	A51 L54 H58 F61	A51-L56 HydrophobicContact CB-CB 4.18Å; A51-L56 PolarHBondContact O-N 2.85Å; L54-L56 VanDerWaalsContact C-N 3.31Å; L54-L56 HydrophobicContact CB-CD1 3.89Å; L54-L56 HydrophobicContact CB-CG 3.83Å; L54-L56 HydrophobicContact CD1-CD1 4.04Å; L54-L56 PolarHBondContact O-N 3.4Å; L56-H58 PolarHBondContact O-N 3.31Å; L56-F61 HydrophobicContact CB-CE2 3.94Å; L56-F61 HydrophobicContact CB-CZ 4.35Å; L56-F61 HydrophobicContact CD1-CZ 4.46Å
57	T	49.7	Very low	51.4	Low	74 Å²	74	83.3 Å²	83.3	45%	0.454	40%	0.401	S	S	.	.			trans	-64.8	113	179.6	47.5	0	0	0	0	110.8	D59 Y60 F61	T57-D59 PolarHBondContact O-N 2.76Å; T57-D59 VanDerWaalsContact O-N 3.08Å; T57-Y60 PolarHBondContact O-N 3.29Å; T57-F61 WeakPolarHBondContact O-CD2 3.46Å; T57-F61 VanDerWaalsContact O-CE2 3.28Å; T57-F61 WeakPolarHBondContact O-CE2 3.39Å
58	H	49.9	Very low	50.1	Low	57 Å²	57	84.6 Å²	84.6	26%	0.264	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-52.5	-31.8	-179.2	-60.5	-60.2	0	0	0	113.4	H48 S52 L56 Y60 F61 D62	H48-H58 AromaticContact CE1-CD2 3.67Å; H48-H58 AromaticContact CE1-CE1 3.1Å; H48-H58 PolarHBondContact CE1-CE1 3.43Å; H48-H58 AromaticContact CE1-CG 3.63Å; H48-H58 AromaticContact CE1-ND1 3.29Å; H48-H58 PolarHBondContact CE1-ND1 2.86Å; H48-H58 VanDerWaalsContact CE1-ND1 3.29Å; H48-H58 AromaticContact CE1-NE2 3.35Å; H48-H58 PolarHBondContact CE1-NE2 2.82Å; H48-H58 AromaticContact CG-CE1 3.9Å; H48-H58 AromaticContact ND1-CE1 3.29Å; H48-H58 PolarHBondContact ND1-CE1 3.2Å; H48-H58 VanDerWaalsContact ND1-CE1 3.29Å; H48-H58 AromaticContact ND1-CG 3.91Å; H48-H58 AromaticContact ND1-ND1 3.21Å; H48-H58 PolarHBondContact ND1-ND1 2.78Å; H48-H58 AromaticContact NE2-CE1 3.63Å; H48-H58 AromaticContact NE2-NE2 3.74Å; S52-H58 PolarHBondContact OG-CE1 3Å; S52-H58 PolarHBondContact OG-NE2 3.42Å; L56-H58 PolarHBondContact O-N 3.31Å; H58-Y60 VanDerWaalsContact C-N 3.26Å; H58-Y60 PolarHBondContact O-N 3.14Å; H58-F61 PolarHBondContact O-N 2.95Å; H58-D62 PolarHBondContact O-N 3.45Å
59	D	41.9	Very low	48.6	Very low	136 Å²	136	84 Å²	84	73%	0.727	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-63.4	-22.9	-175.6	-56.2	-19	0	0	0	114.6	T57 F61	T57-D59 PolarHBondContact O-N 2.76Å; T57-D59 VanDerWaalsContact O-N 3.08Å; D59-F61 VanDerWaalsContact C-N 3.33Å
60	Y	41	Very low	47	Very low	195 Å²	195	83.8 Å²	83.8	77%	0.765	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-83.2	-10.1	173.8	-109.8	-87.8	0	0	0	113.3	T57 H58	T57-Y60 PolarHBondContact O-N 3.29Å; H58-Y60 VanDerWaalsContact C-N 3.26Å; H58-Y60 PolarHBondContact O-N 3.14Å
61	F	45.2	Very low	45.4	Very low	48 Å²	48	91 Å²	91	21%	0.211	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-16.7	-166.5	-60.5	-82.1	0	0	0	114.4	L56 T57 H58 D59 W66	L56-F61 HydrophobicContact CB-CE2 3.94Å; L56-F61 HydrophobicContact CB-CZ 4.35Å; L56-F61 HydrophobicContact CD1-CZ 4.46Å; T57-F61 WeakPolarHBondContact O-CD2 3.46Å; T57-F61 VanDerWaalsContact O-CE2 3.28Å; T57-F61 WeakPolarHBondContact O-CE2 3.39Å; H58-F61 PolarHBondContact O-N 2.95Å; D59-F61 VanDerWaalsContact C-N 3.33Å; F61-W66 HydrophobicContact CE1-CZ3 4.46Å
62	D	44.2	Very low	43.9	Very low	121 Å²	121	94.7 Å²	94.7	65%	0.647	45%	0.453	S	S	*	.	S	Bend	trans	-82	-31.5	-179.9	-79	-26.8	0	0	0	113.3	H58	H58-D62 PolarHBondContact O-N 3.45Å
63	D	42	Very low	42.7	Very low	155 Å²	155	97.4 Å²	97.4	83%	0.829	46%	0.462	S	S	*	.	S	Bend	trans	-90.3	-23.2	-176	-77.9	-20.5	0	0	0	114.6
64	Q	37.9	Very low	41.3	Very low	137 Å²	137	98.5 Å²	98.5	64%	0.64	47%	0.472	S	S	*	.	S	Bend	trans	-113.7	109.3	170.4	-68.2	-174	6.4	0	0	107.7	W66	Q64-W66 PolarHBondContact O-N 3.4Å
65	R	40.4	Very low	40.1	Very low	201 Å²	201	104.1 Å²	104.1	76%	0.758	50%	0.501	S	S	*	.			trans	-55.7	74.2	168.1	-66.9	-179.2	177	-172.7	0	110.5	P67	R65-P67 WeakPolarHBondContact O-CA 3.25Å
66	W	39.9	Very low	38.8	Very low	105 Å²	105	106.3 Å²	106.3	40%	0.398	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	135.4	175.8	-130.2	55.8	0	0	0	107.9	F61 Q64 L68 W471 M472 L475	F61-W66 HydrophobicContact CE1-CZ3 4.46Å; Q64-W66 PolarHBondContact O-N 3.4Å; W66-L68 VanDerWaalsContact C-N 3.29Å; W66-L68 PolarHBondContact O-N 3.1Å; W66-W471 AromaticContact CH2-CH2 3.05Å; W66-W471 HydrophobicContact CH2-CH2 3.05Å; W66-W471 HydrophobicContact CH2-CZ2 4.16Å; W66-W471 AromaticContact CH2-CZ3 3.47Å; W66-W471 HydrophobicContact CH2-CZ3 3.47Å; W66-W471 VanDerWaalsContact CH2-CZ3 3.47Å; W66-W471 AromaticContact CZ2-CH2 3.78Å; W66-W471 HydrophobicContact CZ2-CH2 3.78Å; W66-W471 AromaticContact CZ3-CH2 3.58Å; W66-W471 HydrophobicContact CZ3-CH2 3.58Å; W66-W471 AromaticContact CZ3-CZ3 3.63Å; W66-W471 HydrophobicContact CZ3-CZ3 3.63Å; W66-M472 HydrophobicContact CD2-CE 4.46Å; W66-M472 HydrophobicContact CE3-CE 4.07Å; W66-M472 HydrophobicContact CE3-SD 4.36Å; W66-M472 HydrophobicContact CH2-CE 4.08Å; W66-M472 HydrophobicContact CZ2-CE 4.31Å; W66-M472 HydrophobicContact CZ3-CE 3.87Å; W66-M472 HydrophobicContact CZ3-SD 4.18Å; W66-L475 HydrophobicContact CZ3-CD2 4.08Å
67	P	38.2	Very low	37.6	Very low	60 Å²	60	110.9 Å²	110.9	39%	0.39	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn		-71.1	84.8	-116.4	-18.4	29.2	0	0	0	112.4	R65 I69 S70	R65-P67 WeakPolarHBondContact O-CA 3.25Å; P67-I69 WeakPolarHBondContact CB-O 3.44Å; P67-S70 VanDerWaalsContact C-N 3.31Å; P67-S70 WeakPolarHBondContact O-CA 3.49Å; P67-S70 WeakPolarHBondContact O-CB 3.13Å; P67-S70 PolarHBondContact O-N 2.94Å; P67-S70 VanDerWaalsContact O-N 3.09Å; P67-S70 PolarHBondContact O-OG 2.89Å
68	L	34.9	Very low	36.8	Very low	72 Å²	72	115.5 Å²	115.5	38%	0.377	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	-4.9	150	-73.9	173.2	0	0	0	111	L43 W66 S70	L43-L68 HydrophobicContact CB-CD1 4.47Å; W66-L68 VanDerWaalsContact C-N 3.29Å; W66-L68 PolarHBondContact O-N 3.1Å; L68-S70 VanDerWaalsContact C-N 3.34Å
69	I	31.7	Very low	35.9	Very low	71 Å²	71	122.7 Å²	122.7	36%	0.364	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.9	64.6	139.3	-47.6	170.7	0	0	0	107.4	P67 R71 I73	P67-I69 WeakPolarHBondContact CB-O 3.44Å; I69-R71 PolarHBondContact O-N 3.43Å; I69-I73 HydrophobicContact CG2-CB 4.25Å; I69-I73 HydrophobicContact CG2-CG1 4.43Å
70	S	30	Very low	35.3	Very low	26 Å²	26	121 Å²	121	18%	0.182	59%	0.59	C	S	.	*	S	Bend	trans	-66.3	79.6	166	13	0	0	0	0	107.8	P67 L68 L72	P67-S70 VanDerWaalsContact C-N 3.31Å; P67-S70 WeakPolarHBondContact O-CA 3.49Å; P67-S70 WeakPolarHBondContact O-CB 3.13Å; P67-S70 PolarHBondContact O-N 2.94Å; P67-S70 VanDerWaalsContact O-N 3.09Å; P67-S70 PolarHBondContact O-OG 2.89Å; L68-S70 VanDerWaalsContact C-N 3.34Å; S70-L72 VanDerWaalsContact O-CD1 3.24Å; S70-L72 WeakPolarHBondContact O-CD1 3.37Å; S70-L72 WeakPolarHBondContact O-CG 3.48Å; S70-L72 PolarHBondContact O-N 3.21Å
71	R	31.6	Very low	34.8	Very low	162 Å²	162	116.3 Å²	116.3	61%	0.611	59%	0.585	S	S	*	*	S	Bend	trans	53	5.7	174.9	-70.6	176	164.2	142.3	-7.2	116.6	I69 I73 L74 I75	I69-R71 PolarHBondContact O-N 3.43Å; R71-I73 VanDerWaalsContact C-N 3.27Å; R71-I73 PolarHBondContact O-N 2.66Å; R71-L74 PolarHBondContact O-N 3.05Å; R71-L74 VanDerWaalsContact O-N 3.12Å; R71-I75 HydrophobicContact CB-CD1 4.39Å
72	L	30	Very low	34.1	Very low	80 Å²	80	122.4 Å²	122.4	42%	0.419	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	-10.9	-171	-82.1	132.8	0	0	0	115.2	S70 K436	S70-L72 VanDerWaalsContact O-CD1 3.24Å; S70-L72 WeakPolarHBondContact O-CD1 3.37Å; S70-L72 WeakPolarHBondContact O-CG 3.48Å; S70-L72 PolarHBondContact O-N 3.21Å; L72-K436 HydrophobicContact CD1-CB 4Å; L72-K436 HydrophobicContact CD1-CD 3.24Å; L72-K436 HydrophobicContact CD1-CG 3.55Å; L72-K436 HydrophobicContact CD2-CD 4.28Å; L72-K436 HydrophobicContact CD2-CG 4.22Å; L72-K436 HydrophobicContact CG-CD 4.32Å; L72-K436 HydrophobicContact CG-CG 4.31Å
73	I	33.7	Very low	33.6	Very low	115 Å²	115	124.4 Å²	124.4	59%	0.59	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	-3.3	173.8	-60.9	175.7	0	0	0	110.8	I69 R71	I69-I73 HydrophobicContact CG2-CB 4.25Å; I69-I73 HydrophobicContact CG2-CG1 4.43Å; R71-I73 VanDerWaalsContact C-N 3.27Å; R71-I73 PolarHBondContact O-N 2.66Å
74	L	31	Very low	33.1	Very low	130 Å²	130	128.5 Å²	128.5	68%	0.681	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-1.9	-178.1	-119	86.3	0	0	0	115.7	R71	R71-L74 PolarHBondContact O-N 3.05Å; R71-L74 VanDerWaalsContact O-N 3.12Å
75	I	34.1	Very low	32.9	Very low	132 Å²	132	134.1 Å²	134.1	68%	0.677	64%	0.644	S	S	*	*	S	Bend	trans	-117.1	-1.1	-179.7	-55.1	178	0	0	0	113.1	R71	R71-I75 HydrophobicContact CB-CD1 4.39Å
76	T	30.9	Very low	32.5	Very low	114 Å²	114	128 Å²	128	70%	0.699	64%	0.643	S	S	*	*	S	Bend	trans	-107.1	9.1	177.8	49.4	0	0	0	0	115.2
77	N	31.1	Very low	32.2	Very low	137 Å²	137	135 Å²	135	73%	0.733	67%	0.67	S	S	*	*	S	Bend	trans	-130.2	6.1	175.9	-88.6	-21.1	0	0	0	115.8	K79	N77-K79 VanDerWaalsContact C-N 3.3Å; N77-K79 PolarHBondContact O-N 3.03Å
78	Q	33.6	Very low	31.9	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	69%	0.693	S	S	*	*			trans	-94	61.5	170.9	-71	-168.2	0.1	0	0	111.3
79	K	30.7	Very low	31.8	Very low	209 Å²	209	146.1 Å²	146.1	91%	0.909	72%	0.718	S	S	*	*	S	Bend	trans	-146.5	49.8	166.1	-113.1	-170.2	-173.9	-177.6	0	109.4	N77	N77-K79 VanDerWaalsContact C-N 3.3Å; N77-K79 PolarHBondContact O-N 3.03Å
80	S	29.5	Very low	31.9	Very low	101 Å²	101	147.8 Å²	147.8	71%	0.706	74%	0.742	S	S	*	*	S	Bend	trans	-169.2	138.4	164.7	-166.9	0	0	0	0	109.4
81	S	30.5	Very low	32	Very low	96 Å²	96	149.6 Å²	149.6	67%	0.671	77%	0.765	S	S	*	*			trans	58.5	94.5	165.2	61.1	0	0	0	0	118.4
82	E	31	Very low	32	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.822	77%	0.774	S	S	*	*				172	99.1	117.3	-97.6	157.8	161.9	0	0	110.8
83	N	33.1	Very low	32	Very low	162 Å²	162	151 Å²	151	87%	0.866	79%	0.79	S	S	*	*				177.5	104.9	114.2	-89.9	-37.1	0	0	0	110.6	R85	N83-R85 PolarHBondContact O-N 3.37Å
84	R	31.5	Very low	32	Very low	242 Å²	242	151.4 Å²	151.4	91%	0.913	80%	0.797	S	S	*	*			trans	-56.7	120	156.6	-74.2	175	170.1	179.3	-2.6	108.4
85	R	34.1	Very low	31.7	Very low	255 Å²	255	151 Å²	151	96%	0.962	80%	0.8	S	S	*	*			trans	168.9	126.2	132.9	-94.9	167	-177.4	-158.4	2.1	110.4	N83	N83-R85 PolarHBondContact O-N 3.37Å
86	G	31.7	Very low	31.6	Very low	71 Å²	71	153.1 Å²	153.1	73%	0.732	81%	0.81	S	S	*	*			trans	132.3	75.4	166.8	0	0	0	0	0	113.7
87	R	32.3	Very low	31.4	Very low	254 Å²	254	154.6 Å²	154.6	96%	0.958	81%	0.813	S	S	*	*				48.7	113.9	119.4	-87.3	179.5	170.1	173.2	-3.6	113.9
88	S	33.1	Very low	31.4	Very low	126 Å²	126	153.7 Å²	153.7	88%	0.881	81%	0.812	S	S	*	*				-159.9	153	72.6	-165.2	0	0	0	0	112.7
89	R	32.5	Very low	31.1	Very low	239 Å²	239	152.7 Å²	152.7	90%	0.902	81%	0.813	S	S	*	*			trans	-86.4	165.1	-168.6	-86.7	175.2	158	178.5	-6.5	113.5
90	A	34.4	Very low	31.2	Very low	105 Å²	105	151.3 Å²	151.3	87%	0.868	81%	0.809	S	S	*	*			trans	84.6	124.4	156.5	0	0	0	0	0	114.6
91	G	31.7	Very low	31.2	Very low	64 Å²	64	153.7 Å²	153.7	66%	0.66	81%	0.814	S	S	*	*			cis	152.9	158.5	8.7	0	0	0	0	0	107.7
92	V	32.4	Very low	31.1	Very low	134 Å²	134	157.3 Å²	157.3	81%	0.812	82%	0.818	S	S	*	*			trans	77.2	133.3	163.2	-170	0	0	0	0	114.8
93	N	29.9	Very low	31.2	Very low	138 Å²	138	156.7 Å²	156.7	74%	0.738	82%	0.82	S	S	*	*			cis	-173.9	169.2	-22.1	-97.3	-19.3	0	0	0	104.9
94	V	32.7	Very low	31	Very low	123 Å²	123	156.7 Å²	156.7	75%	0.745	82%	0.82	S	S	*	*			trans	91.1	90.4	150	-158.1	0	0	0	0	119
95	T	24.5	Very low	31	Very low	123 Å²	123	153 Å²	153	76%	0.755	82%	0.817	S	S	*	*				7.8	134	125.3	14.6	0	0	0	0	120.3
96	M	33	Very low	30.8	Very low	176 Å²	176	148.5 Å²	148.5	87%	0.867	81%	0.807	S	S	*	*				-175.3	113.6	125.1	-93.1	-52.8	179.8	0	0	111.9
97	N	26.8	Very low	30.7	Very low	145 Å²	145	153.1 Å²	153.1	78%	0.775	81%	0.809	S	S	*	*			trans	27	150.6	141.4	-107.3	-14.6	0	0	0	126
98	T	31.3	Very low	30.5	Very low	117 Å²	117	147.1 Å²	147.1	72%	0.718	80%	0.795	S	S	*	*			trans	89.3	99.6	146.9	42.7	0	0	0	0	122.3
99	N	27.4	Very low	30.4	Very low	150 Å²	150	149.8 Å²	149.8	80%	0.802	79%	0.791	S	S	*	*				50.5	130	125	-80.3	-12.4	0	0	0	123
100	Q	31.5	Very low	30.3	Very low	180 Å²	180	146.9 Å²	146.9	84%	0.841	79%	0.787	S	S	*	*			trans	76.8	108.6	160.1	-52.8	-165.6	6.9	0	0	118.1
101	N	30.5	Very low	30	Very low	151 Å²	151	146.7 Å²	146.7	81%	0.807	78%	0.78	S	S	*	*				-178.2	155.4	104.8	-126.4	-32.4	0	0	0	114.1
102	K	28.6	Very low	29.9	Very low	173 Å²	173	149.7 Å²	149.7	75%	0.752	79%	0.787	S	S	*	*			trans	-56.2	155.8	179.8	-64.8	159.5	174.7	170	0	114.3
103	N	32.7	Very low	29.9	Very low	163 Å²	163	151.1 Å²	151.1	87%	0.872	79%	0.789	S	S	*	*			trans	-157	108.9	136.2	-89.7	-25.2	0	0	0	111.9
104	N	28.4	Very low	29.8	Very low	161 Å²	161	147.7 Å²	147.7	86%	0.861	79%	0.787	S	S	*	*			trans	-77.3	128.4	165.8	-80.1	-25.9	0	0	0	109
105	I	32	Very low	29.7	Very low	166 Å²	166	147.7 Å²	147.7	85%	0.851	79%	0.792	S	S	*	*			trans	-96.5	110.6	170.5	-61.7	175.4	0	0	0	108.3
106	H	29.4	Very low	29.9	Very low	160 Å²	160	146.9 Å²	146.9	74%	0.741	79%	0.789	S	S	*	*			trans	-89.1	114.7	175.3	-140.7	-72.2	0	0	0	107.6	I108	H106-I108 PolarHBondContact O-N 3.09Å
107	E	29.9	Very low	29.5	Very low	167 Å²	167	145.7 Å²	145.7	78%	0.78	79%	0.785	S	S	*	*			trans	-71.3	100.4	169.2	-84.1	-176.5	159.1	0	0	109.2
108	I	28.4	Very low	29.6	Very low	129 Å²	129	148.6 Å²	148.6	66%	0.662	79%	0.791	S	S	*	*			trans	-90.6	108.6	171.4	-64.9	169.4	0	0	0	107.2	H106 Q110	H106-I108 PolarHBondContact O-N 3.09Å; I108-Q110 HydrophobicContact CG2-CG 4.22Å
109	F	29.9	Very low	29.3	Very low	181 Å²	181	150.4 Å²	150.4	79%	0.794	79%	0.794	S	S	*	*			trans	-91	102.4	163.4	-88.7	-84.1	0	0	0	109.3	S111	F109-S111 PolarHBondContact O-N 3.44Å
110	Q	30	Very low	29.4	Very low	178 Å²	178	148.5 Å²	148.5	83%	0.832	79%	0.792	S	S	*	*			trans	-71.4	114.5	165.1	-84.7	166.2	-18.2	0	0	109.7	I108	I108-Q110 HydrophobicContact CG2-CG 4.22Å
111	S	28.7	Very low	29.1	Very low	101 Å²	101	146 Å²	146	71%	0.706	78%	0.784	S	S	*	*			trans	-82.1	134	162.6	28.7	0	0	0	0	109.7	F109 I113	F109-S111 PolarHBondContact O-N 3.44Å; S111-I113 PolarHBondContact O-N 3.48Å
112	P	30	Very low	29.1	Very low	127 Å²	127	150 Å²	150	83%	0.825	79%	0.789	S	S	*	*			trans	-88.2	106	177.7	32	-28.1	0	0	0	110.2
113	I	32.5	Very low	29.1	Very low	164 Å²	164	149 Å²	149	84%	0.841	79%	0.787	S	S	*	*			trans	-121.2	106.6	160.5	-66.9	172.2	0	0	0	107.7	S111	S111-I113 PolarHBondContact O-N 3.48Å
114	G	27.9	Very low	28.9	Very low	67 Å²	67	146.9 Å²	146.9	69%	0.691	78%	0.775	S	S	*	*			trans	73.8	105.9	147.6	0	0	0	0	0	119.5
115	S	29.3	Very low	29	Very low	123 Å²	123	144.6 Å²	144.6	86%	0.86	76%	0.763	S	S	*	*				158.9	154.9	116.5	-71	0	0	0	0	112.3
116	P	29.1	Very low	28.8	Very low	106 Å²	106	145 Å²	145	69%	0.688	76%	0.758	S	S	*	*			trans	-101.2	174.5	-149.4	40.7	-34.6	0	0	0	114
117	L	25.9	Very low	29	Very low	151 Å²	151	145.1 Å²	145.1	79%	0.791	76%	0.764	S	S	*	*			trans	72.5	112.6	166.2	-56.4	165.1	0	0	0	115.3
118	F	28.4	Very low	28.9	Very low	206 Å²	206	141.7 Å²	141.7	90%	0.904	76%	0.758	S	S	*	*				-177.3	131.1	104.6	-104.6	-83	0	0	0	110
119	M	24.2	Very low	28.7	Very low	155 Å²	155	141.1 Å²	141.1	76%	0.764	76%	0.764	S	S	*	*			trans	-71	146.2	174.6	-68.8	-174.2	65.2	0	0	112.1
120	S	29.5	Very low	28.7	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	76%	0.763	S	S	*	*			trans	170	103.4	134.4	38.1	0	0	0	0	108.1
121	N	25.2	Very low	28.6	Very low	129 Å²	129	134.5 Å²	134.5	69%	0.69	76%	0.76	S	S	*	*				69.4	98.3	94.3	-77.1	-7.5	0	0	0	114.4
122	Y	30.4	Very low	28.9	Very low	233 Å²	233	135.2 Å²	135.2	91%	0.914	76%	0.763	S	S	*	*			trans	-157.8	83.4	142.4	-98.6	-79.4	0	0	0	105.9
123	Q	28.6	Very low	28.9	Very low	152 Å²	152	135.2 Å²	135.2	71%	0.71	76%	0.76	S	S	*	*				51.4	107.7	90.4	-87.4	-164.2	-22.2	0	0	114
124	I	28.7	Very low	28.8	Very low	119 Å²	119	133.4 Å²	133.4	61%	0.61	76%	0.756	S	S	*	*				103.1	128.9	110.3	-74.7	173	0	0	0	108
125	D	30.1	Very low	29	Very low	113 Å²	113	134.4 Å²	134.4	60%	0.604	75%	0.752	S	S	*	*			cis	-152.8	129.2	43.1	-105.7	-44.5	0	0	0	109.1
126	K	29.1	Very low	29	Very low	174 Å²	174	135.8 Å²	135.8	76%	0.757	75%	0.75	S	S	*	*				69.3	113.4	100.8	-72.4	-168.7	-163.5	108.3	0	116.2
127	L	33.3	Very low	29.3	Very low	164 Å²	164	136.8 Å²	136.8	86%	0.859	75%	0.754	S	S	*	*				-179.3	93	118.5	-86.1	148.6	0	0	0	105.9
128	S	26.7	Very low	29.5	Very low	94 Å²	94	138.5 Å²	138.5	66%	0.657	76%	0.755	S	S	*	*				56.6	126.4	90.5	66	0	0	0	0	111.5
129	C	25.1	Very low	29.3	Very low	117 Å²	117	135.3 Å²	135.3	79%	0.791	75%	0.747	S	S	*	*			cis	-170.2	164.3	29.5	-96.1	0	0	0	0	103.8
130	S	30.5	Very low	29.8	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	75%	0.752	S	S	*	*			cis	-177.4	133.8	16.2	23.8	0	0	0	0	105.8
131	S	26.5	Very low	29.6	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	75%	0.748	S	S	*	*			trans	-68.9	-151.1	166.7	-43.4	0	0	0	0	111.4
132	P	36.2	Very low	29.8	Very low	116 Å²	116	138.3 Å²	138.3	75%	0.753	75%	0.748	S	S	*	*				-124.1	-163.2	-54.6	25.1	-4	0	0	0	108.6
133	V	29.4	Very low	29.8	Very low	126 Å²	126	133.7 Å²	133.7	76%	0.764	74%	0.735	S	S	*	*			trans	169.7	112.3	136	150.9	0	0	0	0	113
134	V	30.4	Very low	29.9	Very low	127 Å²	127	134.1 Å²	134.1	77%	0.77	74%	0.737	S	S	*	*				74.9	135	128.9	-176.8	0	0	0	0	117.8
135	S	32.6	Very low	30.2	Very low	87 Å²	87	134.4 Å²	134.4	61%	0.608	74%	0.744	S	S	*	*			cis	-169	148.4	30.2	21.7	0	0	0	0	111.9
136	N	28.8	Very low	30.2	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	75%	0.753	S	S	*	*			trans	60.9	130.6	136.3	-52.9	-21.4	0	0	0	118.5
137	V	34.8	Very low	30.3	Very low	127 Å²	127	137.5 Å²	137.5	77%	0.77	76%	0.76	S	S	*	*				-165	125.4	67.1	163.9	0	0	0	0	111.7
138	K	31.7	Very low	30.1	Very low	188 Å²	188	139.2 Å²	139.2	82%	0.817	76%	0.76	S	S	*	*			trans	55.6	111.4	142.9	-65.3	176.7	178.9	177.8	0	123.1
139	L	24.5	Very low	30.4	Very low	138 Å²	138	141.9 Å²	141.9	72%	0.723	77%	0.773	S	S	*	*			trans	-48.3	147.1	141.1	-87.4	81.5	0	0	0	113.1
140	F	33	Very low	30.9	Very low	202 Å²	202	145.7 Å²	145.7	89%	0.886	78%	0.776	S	S	*	*			trans	-139.6	113.7	132.8	-101.6	-80.8	0	0	0	110.1
141	N	25.8	Very low	31	Very low	123 Å²	123	146.4 Å²	146.4	66%	0.658	78%	0.778	S	S	*	*			trans	-66.9	152.7	158.3	-78.1	-26.5	0	0	0	109.9
142	N	30.7	Very low	31.2	Very low	131 Å²	131	146 Å²	146	70%	0.701	78%	0.775	S	S	*	*				166.4	116.2	129.3	-93.9	8.1	0	0	0	107.3
143	E	29	Very low	31	Very low	137 Å²	137	151.7 Å²	151.7	64%	0.64	78%	0.782	S	S	*	*				121.7	145.1	59.9	-109	-169.7	167.9	0	0	107.3
144	Q	31.3	Very low	31.2	Very low	161 Å²	161	155.5 Å²	155.5	75%	0.752	79%	0.788	S	S	*	*			trans	71.9	137.1	151.7	-65.7	179.5	46.5	0	0	116.9
145	V	34.7	Very low	31.1	Very low	125 Å²	125	160.4 Å²	160.4	76%	0.758	79%	0.793	S	S	*	*			cis	-150.9	145.9	24.3	179.1	0	0	0	0	110.4
146	K	29.2	Very low	31	Very low	184 Å²	184	163.3 Å²	163.3	80%	0.8	80%	0.8	S	S	*	*			trans	-50.6	148.1	169.7	-63.2	158.2	176.9	168.7	0	113.5
147	N	32.8	Very low	31.1	Very low	167 Å²	167	161.5 Å²	161.5	89%	0.893	79%	0.789	S	S	*	*				-164.7	136.3	121.4	-93.9	-22.8	0	0	0	113.7
148	K	28.6	Very low	30.9	Very low	200 Å²	200	165.9 Å²	165.9	87%	0.87	80%	0.798	S	S	*	*			trans	-76.2	140.1	-175.6	-66.2	166.2	172.8	173.2	0	110.9
149	T	33.2	Very low	30.9	Very low	150 Å²	150	163.8 Å²	163.8	92%	0.92	79%	0.791	S	S	*	*			trans	-150.4	141	140.7	16.5	0	0	0	0	111.2
150	K	34.9	Very low	31.1	Very low	198 Å²	198	164.7 Å²	164.7	86%	0.861	80%	0.796	S	S	*	*			trans	-72.2	169.8	-164.8	-94.9	175.9	179.1	177.5	0	114.7
151	P	32.8	Very low	30.9	Very low	125 Å²	125	162.8 Å²	162.8	81%	0.812	79%	0.794	S	S	*	*			trans	-85.4	140.7	-152.6	34.8	-32.6	0	0	0	112.1
152	S	31.8	Very low	31.2	Very low	102 Å²	102	162.3 Å²	162.3	71%	0.713	80%	0.798	S	S	*	*			trans	-146	135.1	174.9	54	0	0	0	0	112.2
153	R	32	Very low	31.2	Very low	236 Å²	236	160.3 Å²	160.3	89%	0.891	79%	0.794	S	S	*	*			trans	81.1	89.9	153.2	-66.8	171.8	177.4	-172.3	-0.9	118.4	R155	R153-R155 PolarHBondContact O-N 2.86Å
154	K	31.7	Very low	31.1	Very low	205 Å²	205	162.6 Å²	162.6	89%	0.891	81%	0.807	S	S	*	*			trans	-30.9	121	130.1	-64.6	174.1	177.6	175.9	0	111.4
155	R	29.8	Very low	31.1	Very low	230 Å²	230	163.7 Å²	163.7	87%	0.868	81%	0.81	S	S	*	*			trans	155.7	153.9	143.4	-93.7	176.1	173.6	161.3	-0.9	109	R153	R153-R155 PolarHBondContact O-N 2.86Å
156	I	30.8	Very low	30.9	Very low	148 Å²	148	163 Å²	163	76%	0.759	81%	0.808	S	S	*	*			trans	83.4	101.8	173	-45.6	153	0	0	0	110.2
157	L	30.3	Very low	31.1	Very low	114 Å²	114	160.5 Å²	160.5	60%	0.597	81%	0.808	S	S	*	*				-158.7	86.4	50.3	-152.4	113.1	0	0	0	109.2	Q159 L160	L157-Q159 WeakPolarHBondContact CD2-O 3.38Å; L157-Q159 HydrophobicContact CG-CB 4.2Å; L157-Q159 PolarHBondContact O-N 3.25Å; L157-L160 HydrophobicContact CD2-CB 4.49Å; L157-L160 HydrophobicContact CD2-CD1 4.03Å; L157-L160 HydrophobicContact CD2-CG 4.38Å
158	K	30.8	Very low	31.2	Very low	220 Å²	220	158.1 Å²	158.1	96%	0.957	80%	0.801	S	S	*	*	S	Bend	trans	-80.2	35	160.6	-124.9	-177.4	-173.6	-175.5	0	110
159	Q	30.4	Very low	31.4	Very low	144 Å²	144	156.3 Å²	156.3	67%	0.673	80%	0.801	S	S	*	*			trans	-138.1	75.7	-169.4	-70.7	179.2	-33.2	0	0	108.9	L157	L157-Q159 WeakPolarHBondContact CD2-O 3.38Å; L157-Q159 HydrophobicContact CG-CB 4.2Å; L157-Q159 PolarHBondContact O-N 3.25Å
160	L	29.6	Very low	31.4	Very low	156 Å²	156	157 Å²	157	82%	0.817	80%	0.799	S	S	*	*	S	Bend	trans	-163.6	33.2	152.6	-101.5	167.3	0	0	0	110.4	L157	L157-L160 HydrophobicContact CD2-CB 4.49Å; L157-L160 HydrophobicContact CD2-CD1 4.03Å; L157-L160 HydrophobicContact CD2-CG 4.38Å
161	L	28.6	Very low	31.2	Very low	163 Å²	163	153.3 Å²	153.3	85%	0.853	80%	0.798	S	S	*	*			trans	-110.7	108.3	157.1	-75.6	167.9	0	0	0	106.1	S163	L161-S163 VanDerWaalsContact C-N 3.31Å; L161-S163 PolarHBondContact O-N 2.6Å; L161-S163 VanDerWaalsContact O-N 3.09Å
162	P	32.7	Very low	31.3	Very low	113 Å²	113	152.8 Å²	152.8	73%	0.734	80%	0.797	S	S	*	*			trans	-70.9	100.6	154.3	-10.7	27.7	0	0	0	106.5
163	S	29.7	Very low	31.4	Very low	89 Å²	89	154.6 Å²	154.6	62%	0.622	80%	0.799	S	S	*	*			trans	-40.8	143.5	155.1	49.1	0	0	0	0	111.2	L161 F165	L161-S163 VanDerWaalsContact C-N 3.31Å; L161-S163 PolarHBondContact O-N 2.6Å; L161-S163 VanDerWaalsContact O-N 3.09Å; S163-F165 PolarHBondContact O-N 2.75Å
164	M	27	Very low	31.4	Very low	184 Å²	184	149.3 Å²	149.3	91%	0.906	79%	0.789	S	S	*	*			trans	-18.6	123.3	159.7	-69.7	172.9	48.9	0	0	114.1
165	F	30.9	Very low	31.5	Very low	184 Å²	184	146.8 Å²	146.8	81%	0.807	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-103	146.5	158.4	-82.3	-83.2	0	0	0	110.2	S163	S163-F165 PolarHBondContact O-N 2.75Å
166	P	31.2	Very low	31.7	Very low	110 Å²	110	143.2 Å²	143.2	71%	0.714	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-84.1	151.2	-158.9	-0.2	19.9	0	0	0	112
167	V	33.2	Very low	31.9	Very low	133 Å²	133	143.8 Å²	143.8	81%	0.806	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.2	126.7	166.4	178.5	0	0	0	0	108.7	N169	V167-N169 PolarHBondContact O-N 2.93Å
168	P	35.2	Very low	32.1	Very low	117 Å²	117	144.2 Å²	144.2	76%	0.76	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-76.5	122.9	173.8	28.8	-29.2	0	0	0	109.9
169	N	32.3	Very low	32.3	Very low	162 Å²	162	139.5 Å²	139.5	87%	0.866	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-76.6	133.2	168.8	-114.8	-3.3	0	0	0	109.1	V167 S171	V167-N169 PolarHBondContact O-N 2.93Å; N169-S171 PolarHBondContact O-N 2.98Å
170	N	34	Very low	32.6	Very low	165 Å²	165	138.5 Å²	138.5	88%	0.882	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-56.2	127.9	174.7	-86.9	-14.9	0	0	0	111.5
171	S	31.3	Very low	33	Very low	120 Å²	120	137.2 Å²	137.2	84%	0.839	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-70.2	123.7	165.3	54.5	0	0	0	0	110.3	N169	N169-S171 PolarHBondContact O-N 2.98Å
172	S	33.9	Very low	33.4	Very low	113 Å²	113	135.3 Å²	135.3	79%	0.79	76%	0.756	S	S	*	*			trans	-123.5	123	143.9	80.8	0	0	0	0	107.2
173	N	33.6	Very low	33.7	Very low	140 Å²	140	135.8 Å²	135.8	75%	0.749	75%	0.753	S	S	*	*			trans	-152.5	119.5	161.4	-123.8	2.6	0	0	0	109.4
174	N	32.5	Very low	34.2	Very low	126 Å²	126	137.4 Å²	137.4	67%	0.674	76%	0.755	S	S	*	*			trans	66.5	107.8	148.5	-59.6	-14.7	0	0	0	119.3
175	N	33	Very low	34.8	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	74%	0.742	S	S	*	*				177	113.6	104.2	-85.1	-20.2	0	0	0	110.5
176	N	34.4	Very low	35.1	Very low	156 Å²	156	133 Å²	133	83%	0.834	74%	0.743	S	S	*	*				176	128.3	122.5	-103.1	-20.9	0	0	0	112.1
177	M	35.5	Very low	35.2	Very low	159 Å²	159	130.7 Å²	130.7	78%	0.783	74%	0.74	S	S	*	*			trans	9.4	133.5	136.1	-68.4	-76	-174	0	0	115.3
178	N	34.9	Very low	35.5	Very low	123 Å²	123	130.1 Å²	130.1	66%	0.658	74%	0.742	S	S	*	*			cis	-177.4	148.8	43.6	-145.7	-6	0	0	0	109.6
179	N	34.6	Very low	35.4	Very low	122 Å²	122	134.4 Å²	134.4	65%	0.652	75%	0.748	S	S	*	*			trans	63.9	118.7	146.5	-77.6	-12.2	0	0	0	124.4
180	N	36.6	Very low	35.6	Very low	122 Å²	122	131.8 Å²	131.8	65%	0.652	74%	0.74	S	S	*	*				95	104.7	124.5	-72.1	-5	0	0	0	121
181	N	37.2	Very low	35.7	Very low	129 Å²	129	129.5 Å²	129.5	69%	0.69	74%	0.737	S	S	*	*				93.4	117.7	120	-75.7	-3.1	0	0	0	120.5
182	N	36.8	Very low	35.6	Very low	123 Å²	123	135 Å²	135	66%	0.658	74%	0.739	S	S	*	*			trans	99.2	102.4	132.5	-70.3	-2.9	0	0	0	119.4
183	N	39.8	Very low	35.5	Very low	124 Å²	124	134.4 Å²	134.4	66%	0.663	73%	0.731	S	S	*	*				95.2	112.6	116	-73.6	-1.2	0	0	0	120
184	N	39.7	Very low	35.3	Very low	123 Å²	123	134.5 Å²	134.5	66%	0.658	73%	0.731	S	S	*	*				106.1	104.9	123.4	-71.5	-0.5	0	0	0	119.2
185	N	39.2	Very low	35.1	Very low	120 Å²	120	135.9 Å²	135.9	64%	0.642	74%	0.738	S	S	*	*				102.4	112.8	117.7	-71	-7.1	0	0	0	119.8
186	N	39.2	Very low	35.1	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	74%	0.744	S	S	*	*			trans	69.9	129.8	137.2	-54.7	-14.2	0	0	0	117.1
187	G	33.3	Very low	35	Very low	63 Å²	63	136.1 Å²	136.1	65%	0.649	74%	0.74	S	S	*	*			cis	163.7	143.5	5.4	0	0	0	0	0	108.6
188	S	38.1	Very low	34.9	Very low	121 Å²	121	133.7 Å²	133.7	85%	0.846	74%	0.736	S	S	*	*			trans	62.8	95	153.1	28.8	0	0	0	0	121.6
189	K	34.1	Very low	34.8	Very low	206 Å²	206	134.1 Å²	134.1	90%	0.896	74%	0.744	S	S	*	*				40.2	160.9	103.7	-110.1	-174	-173	175.5	0	120.9
190	P	37.1	Very low	34.7	Very low	108 Å²	108	137.7 Å²	137.7	70%	0.701	75%	0.753	S	S	*	*				-131.6	175.2	-96.2	43	-25.9	0	0	0	114.7
191	S	34.5	Very low	34.4	Very low	116 Å²	116	141.7 Å²	141.7	81%	0.811	77%	0.765	S	S	*	*			trans	161	121.9	147.5	47.4	0	0	0	0	109.9
192	R	29.8	Very low	34.1	Very low	235 Å²	235	141 Å²	141	89%	0.887	77%	0.77	S	S	*	*				82.8	121.3	76.5	-143.7	-155	168.8	153.6	-3.3	113.4
193	V	30.7	Very low	33.8	Very low	101 Å²	101	143.5 Å²	143.5	61%	0.612	78%	0.783	S	S	*	*			trans	98.5	119.3	148.9	-162.9	0	0	0	0	119.5
194	D	31.1	Very low	33.5	Very low	142 Å²	142	146.4 Å²	146.4	76%	0.759	79%	0.793	S	S	*	*			trans	69.1	110.7	146	-60.4	-12.9	0	0	0	124.9
195	L	28.1	Very low	33.1	Very low	155 Å²	155	146.4 Å²	146.4	81%	0.812	80%	0.803	S	S	*	*				56.1	99.7	112.7	-156.2	76.4	0	0	0	118.5
196	M	33	Very low	32.6	Very low	189 Å²	189	147.6 Å²	147.6	93%	0.931	81%	0.809	S	S	*	*				-167.4	157.9	128.2	-106.8	-162.5	168.6	0	0	112.8
197	T	31	Very low	32.2	Very low	123 Å²	123	145.7 Å²	145.7	76%	0.755	81%	0.808	S	S	*	*			trans	-105.2	-167.3	-145.3	-23.5	0	0	0	0	112
198	P	34.3	Very low	31.9	Very low	108 Å²	108	151.9 Å²	151.9	70%	0.701	82%	0.817	S	S	*	*				-119.5	172.1	-109.9	41.5	-24.6	0	0	0	115.4
199	T	32.9	Very low	31.4	Very low	133 Å²	133	152.8 Å²	152.8	82%	0.816	82%	0.817	S	S	*	*			trans	-153.5	121.1	151.1	30.2	0	0	0	0	114.6
200	K	32.1	Very low	31.1	Very low	197 Å²	197	152.3 Å²	152.3	86%	0.857	82%	0.815	S	S	*	*			trans	65.3	96.2	142	-64.3	-177.9	177.6	178.7	0	120.6
201	K	30.4	Very low	30.6	Very low	206 Å²	206	154.1 Å²	154.1	90%	0.896	82%	0.818	S	S	*	*			trans	-147	130.5	141.5	-75.9	-166.6	178.8	175.4	0	112.2
202	S	31.3	Very low	30.4	Very low	113 Å²	113	158.6 Å²	158.6	79%	0.79	82%	0.823	S	S	*	*			trans	51.5	106.5	151.7	65.7	0	0	0	0	120.8
203	D	30.4	Very low	30.4	Very low	176 Å²	176	157.4 Å²	157.4	94%	0.941	83%	0.825	S	S	*	*			trans	-85.4	104.7	162.2	-71.6	-46.1	0	0	0	110.9
204	Q	32.6	Very low	30.4	Very low	185 Å²	185	162 Å²	162	86%	0.864	84%	0.837	S	S	*	*			trans	-113	117.3	157.7	-98	-178.4	-0.3	0	0	108.1	N206	Q204-N206 PolarHBondContact O-N 2.85Å
205	S	31.1	Very low	30.4	Very low	124 Å²	124	163 Å²	163	87%	0.867	84%	0.837	S	S	*	*			trans	-66.5	122.9	-173.5	50.9	0	0	0	0	113
206	N	28.8	Very low	30.4	Very low	144 Å²	144	163.1 Å²	163.1	77%	0.77	83%	0.834	S	S	*	*			trans	-70	134.7	167.2	-76.9	-60.5	0	0	0	112.1	Q204	Q204-N206 PolarHBondContact O-N 2.85Å
207	S	30.9	Very low	30.4	Very low	114 Å²	114	158.7 Å²	158.7	80%	0.797	82%	0.817	S	S	*	*			trans	-138.3	101.4	147.3	63.6	0	0	0	0	109.7	T209	S207-T209 PolarHBondContact O-N 3.09Å
208	K	26.7	Very low	30.3	Very low	193 Å²	193	157.2 Å²	157.2	84%	0.839	80%	0.801	S	S	*	*			trans	-76	108.4	177.2	-74.3	173.2	175.6	173.2	0	110.3
209	T	27.7	Very low	30.1	Very low	141 Å²	141	153.9 Å²	153.9	87%	0.865	78%	0.779	S	S	*	*			trans	-149	62.2	158.1	15.4	0	0	0	0	108.7	S207	S207-T209 PolarHBondContact O-N 3.09Å
210	K	27.8	Very low	30.3	Very low	196 Å²	196	152.8 Å²	152.8	85%	0.852	77%	0.768	S	S	*	*			trans	-126.5	108	166.1	-84.4	-177.3	176.6	-179.6	0	105.8
211	L	28.2	Very low	30.1	Very low	146 Å²	146	151.5 Å²	151.5	76%	0.764	76%	0.763	S	S	*	*			trans	158.5	91.6	156.6	-89.3	151.3	0	0	0	108.7
212	F	29.2	Very low	29.9	Very low	209 Å²	209	145.5 Å²	145.5	92%	0.917	75%	0.746	S	S	*	*	S	Bend	trans	-161.2	-6.7	152.9	-96.5	-65.3	0	0	0	113.8
213	F	30.7	Very low	29.8	Very low	211 Å²	211	149.4 Å²	149.4	93%	0.925	75%	0.748	S	S	*	*	S	Bend	trans	-122.6	35.5	174.8	-92.5	-81.5	0	0	0	113.7
214	K	30	Very low	29.7	Very low	196 Å²	196	147.3 Å²	147.3	85%	0.852	75%	0.748	S	S	*	*			trans	-103.4	47.9	176.5	-135.8	-176.3	-172.7	-170.3	0	110.8
215	Q	31.3	Very low	29.4	Very low	163 Å²	163	141.9 Å²	141.9	76%	0.762	74%	0.741	S	S	*	*	S	Bend	trans	-97.9	117.7	163	-133.8	172.2	16.6	0	0	106.2	V217	Q215-V217 PolarHBondContact O-N 2.81Å
216	Q	28.5	Very low	29.3	Very low	159 Å²	159	141.5 Å²	141.5	74%	0.743	74%	0.738	S	S	*	*			trans	-52.4	110.8	-178.1	-78.7	168.5	-39.2	0	0	110.1	Q218	Q216-Q218 PolarHBondContact O-N 3.22Å
217	V	32.8	Very low	29.1	Very low	95 Å²	95	142 Å²	142	58%	0.576	74%	0.742	S	S	*	*			trans	-75.8	74.3	164.5	-172.8	0	0	0	0	106.4	Q215	Q215-V217 PolarHBondContact O-N 2.81Å
218	Q	28.8	Very low	29	Very low	93 Å²	93	145.3 Å²	145.3	44%	0.435	74%	0.744	S	S	.	*			trans	-92.3	127.3	163.8	-87	-166.6	-19.3	0	0	108	Q216 R364	Q216-Q218 PolarHBondContact O-N 3.22Å; Q218-R364 PolarHBondContact O-NH2 3.41Å
219	P	29.7	Very low	29	Very low	37 Å²	37	141.6 Å²	141.6	24%	0.24	74%	0.738	C	S	.	*			trans	-59.7	145.6	165.5	25.4	-29.3	0	0	0	108.1	F221 C222	P219-F221 PolarHBondContact O-N 3.48Å; P219-C222 HydrophobicContact CG-CB 3.78Å; P219-C222 PolarHBondContact O-N 3.13Å
220	L	36.3	Very low	28.9	Very low	110 Å²	110	141.8 Å²	141.8	58%	0.576	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-7.3	-179.7	-80.8	161.5	0	0	0	113.3
221	F	29.4	Very low	28.7	Very low	171 Å²	171	144.1 Å²	144.1	75%	0.75	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	56.9	177.5	-59.8	-78.8	0	0	0	112.6	P219	P219-F221 PolarHBondContact O-N 3.48Å
222	C	26.6	Very low	28.5	Very low	79 Å²	79	145.2 Å²	145.2	53%	0.534	74%	0.737	S	S	.	*			trans	-146.6	78.5	162.3	-80.4	0	0	0	0	111	P219	P219-C222 HydrophobicContact CG-CB 3.78Å; P219-C222 PolarHBondContact O-N 3.13Å
223	K	28.3	Very low	28.2	Very low	195 Å²	195	143.9 Å²	143.9	85%	0.848	74%	0.738	S	S	*	*			trans	-115.5	98.2	153.9	-86.8	-177.3	176	178.1	0	107.9
224	S	27.3	Very low	27.8	Very low	133 Å²	133	139 Å²	139	93%	0.93	73%	0.726	S	S	*	*			trans	-104.3	128.6	161.1	-177.5	0	0	0	0	107.7
225	G	26.5	Very low	27.6	Very low	70 Å²	70	134.8 Å²	134.8	72%	0.722	72%	0.72	S	S	*	*			trans	117.5	65.7	163.1	0	0	0	0	0	116.5
226	S	30.2	Very low	27.3	Very low	116 Å²	116	131.9 Å²	131.9	81%	0.811	72%	0.715	S	S	*	*				175.2	116.4	123.8	60.9	0	0	0	0	110.1	E228	S226-E228 PolarHBondContact O-N 2.83Å
227	N	25	Very low	27.2	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	72%	0.715	S	S	*	*			trans	-10.3	112.7	163.6	-56	-21.4	0	0	0	115.8
228	E	28.1	Very low	26.7	Very low	182 Å²	182	135.6 Å²	135.6	85%	0.85	73%	0.728	S	S	*	*			trans	178	114.7	131	-97.6	161.1	-173	0	0	111	S226	S226-E228 PolarHBondContact O-N 2.83Å
229	T	26.8	Very low	26.7	Very low	115 Å²	115	137.4 Å²	137.4	71%	0.706	74%	0.739	S	S	*	*			trans	51.9	105.1	143.8	44.4	0	0	0	0	121.9
230	I	24.5	Very low	26.4	Very low	146 Å²	146	146.2 Å²	146.2	75%	0.749	77%	0.768	S	S	*	*				70.8	101.8	123.7	-55.1	159.3	0	0	0	117.3
231	R	23.7	Very low	26	Very low	245 Å²	245	148.3 Å²	148.3	93%	0.925	78%	0.779	S	S	*	*				-158.7	110.6	106.4	-98.2	179.7	-167.4	-129	1.9	109.6
232	Q	23.8	Very low	25.8	Very low	169 Å²	169	146.8 Å²	146.8	79%	0.79	78%	0.779	S	S	*	*			trans	-59.9	132.6	171.9	-71.4	162.5	-41.9	0	0	111
233	L	24.1	Very low	25.8	Very low	180 Å²	180	148.7 Å²	148.7	94%	0.942	79%	0.793	S	S	*	*			trans	-129.8	70.1	140.5	-94.7	160.5	0	0	0	107.2
234	T	23	Very low	25.7	Very low	109 Å²	109	144 Å²	144	67%	0.669	78%	0.784	S	S	*	*			trans	-62.7	120.5	156.1	13.7	0	0	0	0	108.2
235	C	24.7	Very low	25.7	Very low	107 Å²	107	147.1 Å²	147.1	72%	0.723	78%	0.781	S	S	*	*			trans	-123.9	109.3	155.7	-129.4	0	0	0	0	109
236	P	24.5	Very low	26	Very low	102 Å²	102	151.2 Å²	151.2	66%	0.662	79%	0.785	S	S	*	*			trans	-91.2	124.4	179.2	34	-26.5	0	0	0	109.4
237	F	26.7	Very low	26	Very low	168 Å²	168	154.1 Å²	154.1	74%	0.737	79%	0.791	S	S	*	*			trans	-137.9	86.9	162.1	-76.9	-73.7	0	0	0	110.7	L239	F237-L239 HydrophobicContact CD1-CD1 4.39Å; F237-L239 HydrophobicContact CD1-CG 4.45Å; F237-L239 PolarHBondContact O-N 2.95Å
238	I	23.8	Very low	26.4	Very low	165 Å²	165	149.8 Å²	149.8	85%	0.846	78%	0.783	S	S	*	*			trans	-73.5	98.8	152.6	-61.7	172.8	0	0	0	105.5
239	L	27.6	Very low	26.7	Very low	130 Å²	130	147.5 Å²	147.5	68%	0.681	78%	0.777	S	S	*	*			trans	-110.9	90.2	165.4	-77.7	175	0	0	0	109.8	F237 L241	F237-L239 HydrophobicContact CD1-CD1 4.39Å; F237-L239 HydrophobicContact CD1-CG 4.45Å; F237-L239 PolarHBondContact O-N 2.95Å; L239-L241 PolarHBondContact O-N 2.81Å; L239-L241 VanDerWaalsContact O-N 3.08Å
240	R	23	Very low	27.1	Very low	222 Å²	222	149.7 Å²	149.7	84%	0.838	78%	0.784	S	S	*	*			trans	-54.4	94.9	156.1	-170.7	-176.5	-156.7	157.4	4.6	108.3
241	L	28.3	Very low	27.5	Very low	154 Å²	154	151 Å²	151	81%	0.806	79%	0.787	S	S	*	*			trans	-112	112.6	171.1	-84.1	161.4	0	0	0	109.5	L239	L239-L241 PolarHBondContact O-N 2.81Å; L239-L241 VanDerWaalsContact O-N 3.08Å
242	N	24.8	Very low	28	Very low	140 Å²	140	147.9 Å²	147.9	75%	0.749	78%	0.783	S	S	*	*			trans	-62.7	137.5	-175.5	-73.6	-34.7	0	0	0	112	S244	N242-S244 PolarHBondContact O-N 2.9Å
243	S	26.4	Very low	28.3	Very low	119 Å²	119	147.3 Å²	147.3	83%	0.832	78%	0.782	S	S	*	*			trans	-42.7	113.4	156.1	154.2	0	0	0	0	111.6
244	S	26.8	Very low	28.8	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	76%	0.759	S	S	*	*			trans	-178.8	137.4	133.2	54.6	0	0	0	0	110.9	N242	N242-S244 PolarHBondContact O-N 2.9Å
245	K	28.2	Very low	29.4	Very low	198 Å²	198	144 Å²	144	86%	0.861	77%	0.765	S	S	*	*			trans	70.8	76	162.3	-57.8	177	178.7	-178.3	0	118.3
246	I	32.4	Very low	29.8	Very low	157 Å²	157	145.8 Å²	145.8	81%	0.805	76%	0.76	S	S	*	*			trans	-142.5	64.8	148.8	-47.9	177.5	0	0	0	109.1
247	D	29.9	Very low	30.2	Very low	176 Å²	176	150 Å²	150	94%	0.941	76%	0.763	S	S	*	*			trans	-94	119.4	159.9	-85.4	-38.2	0	0	0	107.3
248	G	34.4	Very low	30.6	Very low	65 Å²	65	150.8 Å²	150.8	67%	0.67	76%	0.761	S	S	*	*	S	Bend	trans	152.4	-39.7	171.9	0	0	0	0	0	115.8
249	N	33.4	Very low	31.2	Very low	135 Å²	135	149.3 Å²	149.3	72%	0.722	76%	0.755	S	S	*	*	S	Bend	trans	-101.7	0.7	-166.8	-73.8	-14.2	0	0	0	115.9	Q251	N249-Q251 VanDerWaalsContact C-N 3.29Å; N249-Q251 PolarHBondContact O-N 3.19Å
250	L	34.9	Very low	31.6	Very low	161 Å²	161	148.2 Å²	148.2	84%	0.843	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-7.7	-174.7	-143	76.8	0	0	0	114.5
251	Q	33.4	Very low	32.3	Very low	173 Å²	173	141.2 Å²	141.2	81%	0.808	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-16.6	-176.1	-69.6	-172.2	2.8	0	0	114.7	N249	N249-Q251 VanDerWaalsContact C-N 3.29Å; N249-Q251 PolarHBondContact O-N 3.19Å
252	Q	33.4	Very low	32.8	Very low	179 Å²	179	138 Å²	138	84%	0.836	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-86.7	-11.9	-179.3	-96.5	-178.6	3.8	0	0	115.2	K254	Q252-K254 PolarHBondContact O-N 2.94Å; Q252-K254 VanDerWaalsContact O-N 3.15Å
253	M	31.5	Very low	33.2	Very low	157 Å²	157	132.2 Å²	132.2	77%	0.773	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-79.9	13.3	-178.3	-80	-152.6	158.9	0	0	115.4	S255	M253-S255 PolarHBondContact O-N 2.83Å
254	K	34.5	Very low	33.7	Very low	109 Å²	109	132.4 Å²	132.4	47%	0.474	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-84.1	1	-170.2	-90.3	-179.3	174.4	-175.1	0	116	I22 Q252	I22-K254 HydrophobicContact CD1-CB 3.95Å; I22-K254 HydrophobicContact CD1-CD 3.94Å; I22-K254 HydrophobicContact CD1-CG 4Å; I22-K254 HydrophobicContact CG1-CD 3.81Å; I22-K254 HydrophobicContact CG1-CG 4.29Å; Q252-K254 PolarHBondContact O-N 2.94Å; Q252-K254 VanDerWaalsContact O-N 3.15Å
255	S	34.2	Very low	34.3	Very low	112 Å²	112	129.2 Å²	129.2	78%	0.783	65%	0.645	S	S	*	*	S	Bend	trans	-126.8	-3.3	-172.8	59.7	0	0	0	0	117.7	M253	M253-S255 PolarHBondContact O-N 2.83Å
256	K	33.1	Very low	35	Very low	143 Å²	143	123.2 Å²	123.2	62%	0.622	62%	0.621	S	S	*	*			trans	-104	9.4	-169.6	-117.8	-176.7	-179.5	-171.3	0	117.4	R258 N259	K256-R258 PolarHBondContact O-N 3.24Å; K256-N259 PolarHBondContact O-N 3.21Å
257	W	34.2	Very low	35.3	Very low	191 Å²	191	120.9 Å²	120.9	72%	0.723	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-4.1	-171.9	-65.2	92.6	0	0	0	117.6	Y261	W257-Y261 WeakPolarHBondContact O-CD2 3.33Å
258	R	33.7	Very low	36	Very low	185 Å²	185	119 Å²	119	70%	0.698	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-15.3	-175.7	-121.5	-178.7	-168.3	-137.8	-1	114.9	K256	K256-R258 PolarHBondContact O-N 3.24Å
259	N	36.7	Very low	36.9	Very low	133 Å²	133	117.1 Å²	117.1	71%	0.711	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.1	-12.8	-170.9	-71.8	-4.1	0	0	0	115.9	K256	K256-N259 PolarHBondContact O-N 3.21Å
260	D	37	Very low	38.3	Very low	108 Å²	108	112.7 Å²	112.7	58%	0.578	54%	0.536	S	S	*	.	S	Bend	trans	-95.2	10.6	-179.4	-66.6	-23.6	0	0	0	114.4	G263 Y264	D260-G263 PolarHBondContact O-N 3.1Å; D260-Y264 PolarHBondContact O-N 3.26Å; D260-Y264 VanDerWaalsContact O-N 3.16Å
261	Y	36.7	Very low	39.7	Very low	75 Å²	75	106.7 Å²	106.7	29%	0.294	51%	0.506	S	S	.	.	H	α-helix	trans	-70.9	-34.3	-171.1	-117.5	-92.6	0	0	0	114.2	W257 G263 Y264 C265 T494 Y498	W257-Y261 WeakPolarHBondContact O-CD2 3.33Å; Y261-G263 VanDerWaalsContact C-N 3.31Å; Y261-Y264 PolarHBondContact O-N 2.84Å; Y261-C265 PolarHBondContact O-N 3.43Å; Y261-C265 PolarHBondContact O-SG 2.67Å; Y261-T494 HydrophobicContact CE1-CG2 4.36Å; Y261-T494 WeakPolarHBondContact OH-CG2 3.37Å; Y261-Y498 HydrophobicContact CD1-CD2 4.05Å; Y261-Y498 HydrophobicContact CD1-CE2 4.29Å; Y261-Y498 AromaticContact CE1-CD2 3.93Å; Y261-Y498 HydrophobicContact CE1-CD2 3.93Å; Y261-Y498 HydrophobicContact CE1-CG 4.39Å
262	T	39.1	Very low	41.3	Very low	85 Å²	85	99.2 Å²	99.2	52%	0.521	47%	0.471	S	S	.	.	H	α-helix	trans	-62.8	-42	174.1	43.4	0	0	0	0	110.3	Y264 C265 I266	T262-Y264 PolarHBondContact O-N 3.14Å; T262-C265 PolarHBondContact O-N 3.45Å; T262-I266 VanDerWaalsContact O-CD1 3.32Å; T262-I266 WeakPolarHBondContact O-CD1 3.19Å; T262-I266 WeakPolarHBondContact O-CG1 3.39Å; T262-I266 PolarHBondContact O-N 3.18Å
263	G	33.8	Very low	42.9	Very low	19 Å²	19	91.3 Å²	91.3	20%	0.196	44%	0.436	C	S	.	.	H	α-helix	trans	-63.1	-38.9	174.3	0	0	0	0	0	113	D260 Y261 I266 R267	D260-G263 PolarHBondContact O-N 3.1Å; Y261-G263 VanDerWaalsContact C-N 3.31Å; G263-I266 PolarHBondContact O-N 3.06Å; G263-R267 WeakPolarHBondContact O-CB 3.49Å; G263-R267 WeakPolarHBondContact O-CD 3.35Å; G263-R267 WeakPolarHBondContact O-CG 3.42Å; G263-R267 PolarHBondContact O-N 3.48Å
264	Y	37.1	Very low	44.5	Very low	124 Å²	124	84.8 Å²	84.8	49%	0.486	41%	0.405	S	S	.	.	H	α-helix	trans	-72.3	-35.9	179.8	-161.5	-92.8	0	0	0	113.1	D260 Y261 T262 R267 Y268	D260-Y264 PolarHBondContact O-N 3.26Å; D260-Y264 VanDerWaalsContact O-N 3.16Å; Y261-Y264 PolarHBondContact O-N 2.84Å; T262-Y264 PolarHBondContact O-N 3.14Å; Y264-R267 PolarHBondContact O-N 3.26Å; Y264-Y268 HydrophobicContact CD2-CD2 4.37Å; Y264-Y268 HydrophobicContact CD2-CE2 4.35Å; Y264-Y268 HydrophobicContact CE1-CD2 4.34Å; Y264-Y268 HydrophobicContact CE2-CD2 4.11Å; Y264-Y268 AromaticContact CE2-CE2 3.98Å; Y264-Y268 HydrophobicContact CE2-CE2 3.98Å
265	C	38.5	Very low	46.2	Very low	28 Å²	28	79.7 Å²	79.7	19%	0.189	38%	0.383	C	S	.	.	H	α-helix	trans	-66	-44.8	172.9	-62.4	0	0	0	0	110.3	Y261 T262 R267 Y268 C269	Y261-C265 PolarHBondContact O-N 3.43Å; Y261-C265 PolarHBondContact O-SG 2.67Å; T262-C265 PolarHBondContact O-N 3.45Å; C265-R267 VanDerWaalsContact C-N 3.29Å; C265-R267 PolarHBondContact O-N 3.42Å; C265-Y268 PolarHBondContact O-N 2.86Å; C265-C269 WeakPolarHBondContact O-CB 3.36Å; C265-C269 PolarHBondContact O-N 3.39Å; C265-C269 PolarHBondContact O-SG 3Å
266	I	42.6	Very low	48.1	Very low	72 Å²	72	74.4 Å²	74.4	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-36.9	176.1	-65.4	162.4	0	0	0	111.9	T262 G263 Y268 P339	T262-I266 VanDerWaalsContact O-CD1 3.32Å; T262-I266 WeakPolarHBondContact O-CD1 3.19Å; T262-I266 WeakPolarHBondContact O-CG1 3.39Å; T262-I266 PolarHBondContact O-N 3.18Å; G263-I266 PolarHBondContact O-N 3.06Å; I266-Y268 PolarHBondContact O-N 2.93Å; I266-P339 WeakPolarHBondContact CG2-O 3.24Å
267	R	38.1	Very low	49.9	Very low	109 Å²	109	68.6 Å²	68.6	41%	0.411	33%	0.325	S	S	.	.	H	α-helix	trans	-69.6	-24.1	-176	-77.9	171.9	-149	-136.6	3.5	115.2	G263 Y264 C265 Y338	G263-R267 WeakPolarHBondContact O-CB 3.49Å; G263-R267 WeakPolarHBondContact O-CD 3.35Å; G263-R267 WeakPolarHBondContact O-CG 3.42Å; G263-R267 PolarHBondContact O-N 3.48Å; Y264-R267 PolarHBondContact O-N 3.26Å; C265-R267 VanDerWaalsContact C-N 3.29Å; C265-R267 PolarHBondContact O-N 3.42Å; R267-Y338 HydrophobicContact CG-CD1 4.36Å; R267-Y338 HydrophobicContact CG-CE1 4.26Å; R267-Y338 PolarHBondContact NH2-OH 2.92Å
268	Y	45.5	Very low	51.6	Low	135 Å²	135	61.2 Å²	61.2	53%	0.529	30%	0.301	S	S	.	.	H	α-helix	trans	-145.7	19.8	-167.2	-60.1	-74.9	0	0	0	114.7	Y264 C265 I266 F372	Y264-Y268 HydrophobicContact CD2-CD2 4.37Å; Y264-Y268 HydrophobicContact CD2-CE2 4.35Å; Y264-Y268 HydrophobicContact CE1-CD2 4.34Å; Y264-Y268 HydrophobicContact CE2-CD2 4.11Å; Y264-Y268 AromaticContact CE2-CE2 3.98Å; Y264-Y268 HydrophobicContact CE2-CE2 3.98Å; C265-Y268 PolarHBondContact O-N 2.86Å; I266-Y268 PolarHBondContact O-N 2.93Å; Y268-F372 WeakPolarHBondContact O-CE1 2.9Å; Y268-F372 WeakPolarHBondContact O-CZ 3.19Å
269	C	52.7	Low	53.5	Low	26 Å²	26	52.5 Å²	52.5	18%	0.176	27%	0.268	C	S	.	.			trans	-110.6	146.4	-178.5	-77.7	0	0	0	0	112.7	C265 S273	C265-C269 WeakPolarHBondContact O-CB 3.36Å; C265-C269 PolarHBondContact O-N 3.39Å; C265-C269 PolarHBondContact O-SG 3Å; C269-S273 WeakPolarHBondContact CB-OG 3.45Å
270	N	62.6	Low	55.3	Low	42 Å²	42	46.1 Å²	46.1	23%	0.225	23%	0.234	C	C	.	.			trans	-64.1	151.5	170	-173	-3.2	0	0	0	108.1	D272 S273 T274 F372	N270-D272 PolarHBondContact O-N 3.21Å; N270-D272 VanDerWaalsContact O-N 3.13Å; N270-S273 PolarHBondContact N-OG 2.94Å; N270-S273 PolarHBondContact O-N 3.49Å; N270-S273 PolarHBondContact O-OG 3.42Å; N270-T274 PolarHBondContact O-N 3.35Å; N270-T274 VanDerWaalsContact O-N 3.09Å; N270-T274 PolarHBondContact O-OG1 3.47Å; N270-F372 HydrophobicContact CB-CD2 4.21Å; N270-F372 HydrophobicContact CB-CE2 3.83Å
271	V	65	Low	57	Low	36 Å²	36	44.4 Å²	44.4	22%	0.218	22%	0.224	C	C	.	.	H	α-helix	trans	-49.6	-40.3	171.7	178.6	0	0	0	0	110.2	S273 T274 I275 I349	V271-S273 PolarHBondContact O-N 3.46Å; V271-T274 PolarHBondContact O-N 3.25Å; V271-I275 HydrophobicContact CG1-CD1 3.78Å; V271-I275 HydrophobicContact CG1-CG1 4.3Å; V271-I275 VanDerWaalsContact O-CG1 3.28Å; V271-I275 WeakPolarHBondContact O-CG1 3.25Å; V271-I275 PolarHBondContact O-N 3.27Å; V271-I349 HydrophobicContact CG1-CD1 3.77Å
272	D	67.8	Low	58.6	Low	15 Å²	15	41.8 Å²	41.8	8%	0.08	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-38.9	176.1	-73.7	-32.2	0	0	0	114	N270 C276 C365 T368	N270-D272 PolarHBondContact O-N 3.21Å; N270-D272 VanDerWaalsContact O-N 3.13Å; D272-C276 VanDerWaalsContact O-CB 3.28Å; D272-C276 WeakPolarHBondContact O-CB 3.36Å; D272-C276 PolarHBondContact O-N 3.02Å; D272-C365 HydrophobicContact CB-CB 4.23Å; D272-C365 WeakPolarHBondContact O-CB 3.49Å; D272-T368 WeakPolarHBondContact CB-OG1 3.5Å; D272-T368 VanDerWaalsContact OD2-CB 3.25Å; D272-T368 WeakPolarHBondContact OD2-CB 2.99Å; D272-T368 PolarHBondContact OD2-OG1 3.36Å
273	S	65.8	Low	60.3	Low	14 Å²	14	38 Å²	38	10%	0.098	19%	0.191	C	C	.	.	H	α-helix	trans	-75.8	-30.1	177.9	51	0	0	0	0	112	C269 N270 V271 A277 C369	C269-S273 WeakPolarHBondContact CB-OG 3.45Å; N270-S273 PolarHBondContact N-OG 2.94Å; N270-S273 PolarHBondContact O-N 3.49Å; N270-S273 PolarHBondContact O-OG 3.42Å; V271-S273 PolarHBondContact O-N 3.46Å; S273-A277 VanDerWaalsContact O-CB 3.25Å; S273-A277 WeakPolarHBondContact O-CB 3.4Å; S273-A277 PolarHBondContact O-N 3.36Å; S273-C369 VanDerWaalsContact CB-SG 3.58Å
274	T	65.7	Low	62.2	Low	20 Å²	20	39.1 Å²	39.1	12%	0.123	19%	0.194	C	C	.	.	H	α-helix	trans	-67.5	-44.1	170	-55.7	0	0	0	0	111.4	N270 V271 A277 T278 I341 I346	N270-T274 PolarHBondContact O-N 3.35Å; N270-T274 VanDerWaalsContact O-N 3.09Å; N270-T274 PolarHBondContact O-OG1 3.47Å; V271-T274 PolarHBondContact O-N 3.25Å; T274-A277 PolarHBondContact O-N 3.18Å; T274-T278 HydrophobicContact CG2-CG2 4.4Å; T274-T278 WeakPolarHBondContact O-CB 3.23Å; T274-T278 VanDerWaalsContact O-CG2 3.24Å; T274-T278 WeakPolarHBondContact O-CG2 3.34Å; T274-T278 PolarHBondContact O-N 2.88Å; T274-T278 PolarHBondContact O-OG1 2.82Å; T274-I341 HydrophobicContact CG2-CD1 3.91Å; T274-I346 HydrophobicContact CG2-CD1 4.45Å
275	I	71.2	Confident	63.8	Low	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-47.1	173.4	-68.2	167.8	0	0	0	109.8	V271 A277 T278 L279 I346 I349 L361	V271-I275 HydrophobicContact CG1-CD1 3.78Å; V271-I275 HydrophobicContact CG1-CG1 4.3Å; V271-I275 VanDerWaalsContact O-CG1 3.28Å; V271-I275 WeakPolarHBondContact O-CG1 3.25Å; V271-I275 PolarHBondContact O-N 3.27Å; I275-A277 PolarHBondContact O-N 2.9Å; I275-T278 WeakPolarHBondContact CA-OG1 3.46Å; I275-T278 PolarHBondContact O-N 3.49Å; I275-T278 PolarHBondContact O-OG1 3.2Å; I275-L279 HydrophobicContact CG2-CD1 3.69Å; I275-L279 HydrophobicContact CG2-CG 4.19Å; I275-L279 WeakPolarHBondContact O-CB 3.36Å; I275-L279 WeakPolarHBondContact O-CG 3.08Å; I275-L279 PolarHBondContact O-N 2.66Å; I275-I346 HydrophobicContact CG1-CG1 4.34Å; I275-I346 HydrophobicContact CG1-CG2 4.37Å; I275-I349 HydrophobicContact CD1-CB 4.34Å; I275-I349 HydrophobicContact CD1-CD1 3.79Å; I275-I349 HydrophobicContact CD1-CG2 3.88Å; I275-L361 HydrophobicContact CG2-CD2 4.47Å
276	C	73.6	Confident	65.3	Low	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.2	-44.8	179.6	-165.7	0	0	0	0	112	D272 I280 C365 L499	D272-C276 VanDerWaalsContact O-CB 3.28Å; D272-C276 WeakPolarHBondContact O-CB 3.36Å; D272-C276 PolarHBondContact O-N 3.02Å; C276-I280 WeakPolarHBondContact O-CB 3.38Å; C276-I280 WeakPolarHBondContact O-CD1 3.18Å; C276-I280 WeakPolarHBondContact O-CG1 3.29Å; C276-I280 PolarHBondContact O-N 2.85Å; C276-C365 HydrophobicContact CB-CB 3.86Å; C276-L499 HydrophobicContact CB-CD1 4.06Å; C276-L499 HydrophobicContact CB-CD2 4.4Å
277	A	69.8	Low	66.6	Low	22 Å²	22	39.3 Å²	39.3	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-46.9	178.4	0	0	0	0	0	111.6	S273 T274 I275 L279 I280 D281 L499	S273-A277 VanDerWaalsContact O-CB 3.25Å; S273-A277 WeakPolarHBondContact O-CB 3.4Å; S273-A277 PolarHBondContact O-N 3.36Å; T274-A277 PolarHBondContact O-N 3.18Å; I275-A277 PolarHBondContact O-N 2.9Å; A277-L279 PolarHBondContact O-N 3.22Å; A277-I280 PolarHBondContact O-N 3.27Å; A277-D281 WeakPolarHBondContact O-CB 3.33Å; A277-D281 VanDerWaalsContact O-CG 3.32Å; A277-D281 PolarHBondContact O-N 2.9Å; A277-L499 HydrophobicContact CB-CD1 4.22Å
278	T	69.7	Low	68.1	Low	36 Å²	36	41.8 Å²	41.8	22%	0.221	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-39.1	178.6	52.9	0	0	0	0	112.5	T274 I275 Y282	T274-T278 HydrophobicContact CG2-CG2 4.4Å; T274-T278 WeakPolarHBondContact O-CB 3.23Å; T274-T278 VanDerWaalsContact O-CG2 3.24Å; T274-T278 WeakPolarHBondContact O-CG2 3.34Å; T274-T278 PolarHBondContact O-N 2.88Å; T274-T278 PolarHBondContact O-OG1 2.82Å; I275-T278 WeakPolarHBondContact CA-OG1 3.46Å; I275-T278 PolarHBondContact O-N 3.49Å; I275-T278 PolarHBondContact O-OG1 3.2Å; T278-Y282 VanDerWaalsContact O-CB 3.25Å; T278-Y282 WeakPolarHBondContact O-CB 3.18Å; T278-Y282 PolarHBondContact O-N 2.93Å
279	L	73.7	Confident	69.1	Low	1 Å²	1	36 Å²	36	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-65	-45	173.6	-71.4	175.2	0	0	0	111.9	I275 A277 Y282 I283 L312 L361 I362	I275-L279 HydrophobicContact CG2-CD1 3.69Å; I275-L279 HydrophobicContact CG2-CG 4.19Å; I275-L279 WeakPolarHBondContact O-CB 3.36Å; I275-L279 WeakPolarHBondContact O-CG 3.08Å; I275-L279 PolarHBondContact O-N 2.66Å; A277-L279 PolarHBondContact O-N 3.22Å; L279-Y282 PolarHBondContact O-N 3.45Å; L279-I283 WeakPolarHBondContact O-CG1 3.32Å; L279-I283 PolarHBondContact O-N 2.96Å; L279-L312 HydrophobicContact CD2-CD1 3.67Å; L279-L312 HydrophobicContact CD2-CD2 4.23Å; L279-L312 HydrophobicContact CD2-CG 4.46Å; L279-L361 HydrophobicContact CD1-CD2 3.74Å; L279-L361 HydrophobicContact CD1-CG 3.99Å; L279-I362 HydrophobicContact CB-CG1 4.35Å; L279-I362 HydrophobicContact CD1-CG1 3.97Å
280	I	75.3	Confident	69.9	Low	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-45.8	177.3	-70.8	165	0	0	0	110.5	C276 A277 Y282 I283 T284 L499 L503 L506	C276-I280 WeakPolarHBondContact O-CB 3.38Å; C276-I280 WeakPolarHBondContact O-CD1 3.18Å; C276-I280 WeakPolarHBondContact O-CG1 3.29Å; C276-I280 PolarHBondContact O-N 2.85Å; A277-I280 PolarHBondContact O-N 3.27Å; I280-Y282 VanDerWaalsContact C-N 3.34Å; I280-Y282 PolarHBondContact O-N 2.85Å; I280-I283 PolarHBondContact O-N 3.49Å; I280-T284 VanDerWaalsContact O-CB 3.32Å; I280-T284 WeakPolarHBondContact O-CB 3.46Å; I280-T284 PolarHBondContact O-N 3.42Å; I280-T284 PolarHBondContact O-OG1 3.38Å; I280-L499 HydrophobicContact CD1-CD1 3.85Å; I280-L503 HydrophobicContact CD1-CB 4.2Å; I280-L503 HydrophobicContact CD1-CD1 4.02Å; I280-L503 HydrophobicContact CG1-CD1 4.47Å; I280-L506 HydrophobicContact CG1-CD2 4.12Å; I280-L506 HydrophobicContact CG2-CB 4.28Å; I280-L506 HydrophobicContact CG2-CD2 4.32Å
281	D	73.6	Confident	70.2	Confident	71 Å²	71	37.3 Å²	37.3	38%	0.38	21%	0.208	S	C	.	.	H	α-helix	trans	-64.3	-39.9	179.1	-75.2	-18.4	0	0	0	111.5	A277 T284 S285	A277-D281 WeakPolarHBondContact O-CB 3.33Å; A277-D281 VanDerWaalsContact O-CG 3.32Å; A277-D281 PolarHBondContact O-N 2.9Å; D281-T284 PolarHBondContact O-N 3.25Å; D281-S285 WeakPolarHBondContact O-CB 3.24Å; D281-S285 PolarHBondContact O-N 3.27Å; D281-S285 PolarHBondContact O-OG 3.47Å
282	Y	69.9	Low	70.4	Confident	21 Å²	21	36 Å²	36	8%	0.082	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-44.1	175.3	-179.8	-99	0	0	0	112	T278 L279 I280 S285 N286 L289 K311 L312 H315	T278-Y282 VanDerWaalsContact O-CB 3.25Å; T278-Y282 WeakPolarHBondContact O-CB 3.18Å; T278-Y282 PolarHBondContact O-N 2.93Å; L279-Y282 PolarHBondContact O-N 3.45Å; I280-Y282 VanDerWaalsContact C-N 3.34Å; I280-Y282 PolarHBondContact O-N 2.85Å; Y282-S285 PolarHBondContact O-N 3.42Å; Y282-N286 WeakPolarHBondContact CE2-ND2 3.41Å; Y282-N286 PolarHBondContact O-N 3.45Å; Y282-N286 PolarHBondContact O-ND2 3.37Å; Y282-L289 HydrophobicContact CD1-CD1 3.73Å; Y282-L289 HydrophobicContact CE1-CD1 3.5Å; Y282-L289 VanDerWaalsContact CE1-CD1 3.5Å; Y282-K311 VanDerWaalsContact OH-C 3.31Å; Y282-K311 PolarHBondContact OH-O 3.25Å; Y282-L312 HydrophobicContact CD1-CD1 3.65Å; Y282-L312 HydrophobicContact CD1-CG 4.15Å; Y282-L312 HydrophobicContact CE1-CB 3.87Å; Y282-L312 HydrophobicContact CE1-CD1 3.75Å; Y282-L312 HydrophobicContact CE1-CG 3.97Å; Y282-L312 PolarHBondContact OH-N 3.48Å; Y282-H315 HydrophobicContact CD2-CB 4.31Å; Y282-H315 AromaticContact CD2-CD2 3.9Å; Y282-H315 AromaticContact CD2-CE1 3.9Å; Y282-H315 AromaticContact CD2-CG 3.75Å; Y282-H315 AromaticContact CD2-ND1 3.75Å; Y282-H315 AromaticContact CD2-NE2 3.97Å; Y282-H315 HydrophobicContact CE2-CB 3.58Å; Y282-H315 AromaticContact CE2-CD2 3.52Å; Y282-H315 AromaticContact CE2-CG 3.39Å; Y282-H315 AromaticContact CE2-ND1 3.89Å
283	I	73.8	Confident	70.3	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-44.2	178.6	-62.4	164.8	0	0	0	110.6	L279 I280 S285 N286 L289 I362 L506	L279-I283 WeakPolarHBondContact O-CG1 3.32Å; L279-I283 PolarHBondContact O-N 2.96Å; I280-I283 PolarHBondContact O-N 3.49Å; I283-S285 VanDerWaalsContact C-N 3.32Å; I283-S285 PolarHBondContact O-N 3.4Å; I283-N286 CarbonylContact O-C 3.52Å; I283-N286 PolarHBondContact O-N 3.35Å; I283-L289 HydrophobicContact CB-CD1 4.4Å; I283-L289 HydrophobicContact CG1-CD1 4.2Å; I283-L289 HydrophobicContact CG2-CB 3.93Å; I283-I362 HydrophobicContact CD1-CD1 3.72Å; I283-L506 HydrophobicContact CB-CD1 3.96Å; I283-L506 HydrophobicContact CB-CD2 4.46Å; I283-L506 HydrophobicContact CD1-CD2 4.36Å; I283-L506 HydrophobicContact CG2-CD1 3.35Å; I283-L506 HydrophobicContact CG2-CD2 4.44Å
284	T	74.8	Confident	70.2	Confident	44 Å²	44	38.2 Å²	38.2	27%	0.27	21%	0.21	S	C	.	.	H	α-helix	trans	-64.5	-36.4	178.5	-53.3	0	0	0	0	111.9	I280 D281 N286	I280-T284 VanDerWaalsContact O-CB 3.32Å; I280-T284 WeakPolarHBondContact O-CB 3.46Å; I280-T284 PolarHBondContact O-N 3.42Å; I280-T284 PolarHBondContact O-OG1 3.38Å; D281-T284 PolarHBondContact O-N 3.25Å; T284-N286 VanDerWaalsContact C-N 3.27Å; T284-N286 PolarHBondContact O-N 3.35Å
285	S	70.6	Confident	70.4	Confident	84 Å²	84	38 Å²	38	59%	0.587	21%	0.208	S	C	*	.	H	α-helix	trans	-74.2	-17	179.2	-61.2	0	0	0	0	113.5	D281 Y282 I283 P287	D281-S285 WeakPolarHBondContact O-CB 3.24Å; D281-S285 PolarHBondContact O-N 3.27Å; D281-S285 PolarHBondContact O-OG 3.47Å; Y282-S285 PolarHBondContact O-N 3.42Å; I283-S285 VanDerWaalsContact C-N 3.32Å; I283-S285 PolarHBondContact O-N 3.4Å; S285-P287 WeakPolarHBondContact O-CD 3.44Å
286	N	70	Confident	70.3	Confident	60 Å²	60	38.5 Å²	38.5	32%	0.321	21%	0.21	S	C	.	.			trans	-120.6	85.3	-177.3	-72.2	-75.7	0	0	0	109.9	Y282 I283 T284 K288 L289	Y282-N286 WeakPolarHBondContact CE2-ND2 3.41Å; Y282-N286 PolarHBondContact O-N 3.45Å; Y282-N286 PolarHBondContact O-ND2 3.37Å; I283-N286 CarbonylContact O-C 3.52Å; I283-N286 PolarHBondContact O-N 3.35Å; T284-N286 VanDerWaalsContact C-N 3.27Å; T284-N286 PolarHBondContact O-N 3.35Å; N286-K288 PolarHBondContact O-N 2.97Å; N286-L289 HydrophobicContact CB-CD1 3.59Å; N286-L289 HydrophobicContact CB-CG 3.99Å; N286-L289 VanDerWaalsContact O-CB 3.27Å; N286-L289 WeakPolarHBondContact O-CB 3.44Å; N286-L289 PolarHBondContact O-N 3.13Å
287	P	69.1	Low	69.8	Low	84 Å²	84	46.2 Å²	46.2	55%	0.545	24%	0.239	S	C	.	.	H	α-helix	trans	-61.1	-19.8	-172.3	23.8	-34.8	0	0	0	114.1	S285 L289 C290	S285-P287 WeakPolarHBondContact O-CD 3.44Å; P287-L289 PolarHBondContact O-N 3.34Å; P287-C290 PolarHBondContact O-N 2.9Å
288	K	69.3	Low	69	Low	161 Å²	161	52.8 Å²	52.8	70%	0.7	27%	0.269	S	S	*	.	H	α-helix	trans	-60.8	-28.1	171.8	-64.9	-177.2	-179.8	178.7	0	112.5	N286 Q291	N286-K288 PolarHBondContact O-N 2.97Å; K288-Q291 PolarHBondContact O-N 2.98Å
289	L	67	Low	68.1	Low	13 Å²	13	56.7 Å²	56.7	7%	0.068	30%	0.295	C	S	.	.	H	α-helix	trans	-70.9	-37.5	177.1	-69.1	170.8	0	0	0	111.7	Y282 I283 N286 P287 Q291 T292 L308	Y282-L289 HydrophobicContact CD1-CD1 3.73Å; Y282-L289 HydrophobicContact CE1-CD1 3.5Å; Y282-L289 VanDerWaalsContact CE1-CD1 3.5Å; I283-L289 HydrophobicContact CB-CD1 4.4Å; I283-L289 HydrophobicContact CG1-CD1 4.2Å; I283-L289 HydrophobicContact CG2-CB 3.93Å; N286-L289 HydrophobicContact CB-CD1 3.59Å; N286-L289 HydrophobicContact CB-CG 3.99Å; N286-L289 VanDerWaalsContact O-CB 3.27Å; N286-L289 WeakPolarHBondContact O-CB 3.44Å; N286-L289 PolarHBondContact O-N 3.13Å; P287-L289 PolarHBondContact O-N 3.34Å; L289-Q291 PolarHBondContact O-N 3.12Å; L289-T292 WeakPolarHBondContact O-CB 3.49Å; L289-T292 WeakPolarHBondContact O-CG2 3.19Å; L289-T292 PolarHBondContact O-N 3.26Å; L289-T292 VanDerWaalsContact O-N 3.14Å; L289-T292 PolarHBondContact O-OG1 2.96Å; L289-L308 HydrophobicContact CD2-CB 3.75Å; L289-L308 HydrophobicContact CD2-CD1 3.69Å; L289-L308 HydrophobicContact CD2-CD2 3.21Å; L289-L308 HydrophobicContact CD2-CG 3.63Å; L289-L308 HydrophobicContact CG-CD2 4.31Å
290	C	70.1	Confident	67.4	Low	2 Å²	2	57.1 Å²	57.1	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-67.7	-17.2	178.4	-57	0	0	0	0	113.1	P287 T292 I510 L513	P287-C290 PolarHBondContact O-N 2.9Å; C290-T292 VanDerWaalsContact C-N 3.34Å; C290-I510 HydrophobicContact CB-CG1 4.17Å; C290-L513 HydrophobicContact CB-CD1 3.6Å
291	Q	68.8	Low	66.8	Low	93 Å²	93	59.9 Å²	59.9	44%	0.435	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-1.6	176.4	-62.9	175.8	-5.4	0	0	113.5	K288 L289 E293 L513	K288-Q291 PolarHBondContact O-N 2.98Å; L289-Q291 PolarHBondContact O-N 3.12Å; Q291-E293 PolarHBondContact O-N 2.89Å; Q291-L513 HydrophobicContact CG-CD1 3.92Å; Q291-L513 HydrophobicContact CG-CD2 4.41Å
292	T	68.4	Low	66.3	Low	9 Å²	9	58.8 Å²	58.8	6%	0.055	32%	0.316	C	S	.	.	S	Bend	trans	-77.6	125.7	-172.1	59.6	0	0	0	0	110.6	L289 C290 G294 L308	L289-T292 WeakPolarHBondContact O-CB 3.49Å; L289-T292 WeakPolarHBondContact O-CG2 3.19Å; L289-T292 PolarHBondContact O-N 3.26Å; L289-T292 VanDerWaalsContact O-N 3.14Å; L289-T292 PolarHBondContact O-OG1 2.96Å; C290-T292 VanDerWaalsContact C-N 3.34Å; T292-G294 PolarHBondContact O-N 3.09Å; T292-L308 HydrophobicContact CG2-CD1 3.31Å; T292-L308 HydrophobicContact CG2-CG 4.44Å
293	E	65.4	Low	66	Low	70 Å²	70	63.6 Å²	63.6	33%	0.327	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	120.3	-174.8	-173.9	-178.9	168.5	0	0	110.8	Q291 G300 N301 S517 K518	Q291-E293 PolarHBondContact O-N 2.89Å; E293-G300 WeakPolarHBondContact O-CA 3.28Å; E293-N301 PolarHBondContact O-N 2.88Å; E293-S517 WeakPolarHBondContact CA-O 3.31Å; E293-K518 HydrophobicContact CG-CB 4.38Å; E293-K518 HydrophobicContact CG-CD 4.02Å; E293-K518 HydrophobicContact CG-CG 4.17Å; E293-K518 VanDerWaalsContact OE1-CD 3.24Å; E293-K518 WeakPolarHBondContact OE1-CD 3.42Å; E293-K518 WeakPolarHBondContact OE1-CE 3.22Å; E293-K518 IonicContact OE1-NZ 2.67Å; E293-K518 PolarHBondContact OE1-NZ 3.44Å; E293-K518 IonicContact OE2-NZ 3.72Å
294	G	64	Low	65.4	Low	6 Å²	6	69.3 Å²	69.3	6%	0.062	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	39.1	173.7	0	0	0	0	0	114.1	T292 F296 R297 S517	T292-G294 PolarHBondContact O-N 3.09Å; G294-F296 VanDerWaalsContact C-N 3.27Å; G294-F296 PolarHBondContact O-N 2.84Å; G294-R297 CarbonylContact O-C 3.48Å; G294-R297 PolarHBondContact O-N 2.92Å; G294-S517 PolarHBondContact N-O 3.05Å
295	L	70.6	Confident	64.9	Low	14 Å²	14	67.9 Å²	67.9	7%	0.073	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-50.1	177.9	-174.8	63	0	0	0	112.1	S359 I510 M519	L295-S359 VanDerWaalsContact C-OG 3.29Å; L295-S359 PolarHBondContact O-OG 2.86Å; L295-I510 HydrophobicContact CD2-CD1 4.37Å; L295-M519 HydrophobicContact CB-SD 4.05Å; L295-M519 PolarHBondContact N-SD 2.92Å; L295-M519 VanDerWaalsContact N-SD 3.42Å
296	F	69.2	Low	64.6	Low	14 Å²	14	70.7 Å²	70.7	6%	0.061	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	22.1	175.5	-53.1	-105.7	0	0	0	114.4	G294 S359 I362 F507 I510 M519 L524 C527 T528	G294-F296 VanDerWaalsContact C-N 3.27Å; G294-F296 PolarHBondContact O-N 2.84Å; F296-S359 WeakPolarHBondContact CA-OG 3.41Å; F296-S359 WeakPolarHBondContact CD1-OG 3.24Å; F296-S359 WeakPolarHBondContact CG-OG 3.39Å; F296-I362 HydrophobicContact CE1-CD1 4.41Å; F296-I362 HydrophobicContact CE1-CG2 4.27Å; F296-I362 HydrophobicContact CZ-CD1 4.27Å; F296-F507 HydrophobicContact CE1-CE1 4.23Å; F296-F507 HydrophobicContact CE2-CE1 4.11Å; F296-F507 AromaticContact CZ-CE1 3.77Å; F296-F507 HydrophobicContact CZ-CE1 3.77Å; F296-I510 HydrophobicContact CE2-CD1 3.81Å; F296-M519 HydrophobicContact CB-CE 3.45Å; F296-M519 VanDerWaalsContact CB-CE 3.45Å; F296-M519 HydrophobicContact CB-SD 4.37Å; F296-M519 HydrophobicContact CD2-CE 3.72Å; F296-M519 HydrophobicContact CD2-SD 4.06Å; F296-M519 HydrophobicContact CG-CE 4Å; F296-M519 PolarHBondContact N-SD 3.41Å; F296-M519 VanDerWaalsContact N-SD 3.42Å; F296-L524 HydrophobicContact CD2-CD2 3.77Å; F296-L524 HydrophobicContact CE2-CD2 4.14Å; F296-L524 HydrophobicContact CG-CD2 4.4Å; F296-C527 HydrophobicContact CB-CB 4.29Å; F296-C527 PolarHBondContact O-SG 2.93Å; F296-T528 HydrophobicContact CD1-CG2 4.34Å
297	R	63	Low	64.3	Low	162 Å²	162	73 Å²	73	61%	0.611	36%	0.361	S	S	*	.	S	Bend	trans	-122.4	129	177.3	-170.7	176	-178.7	177.5	0.6	109.4	G294 P299 G300	G294-R297 CarbonylContact O-C 3.48Å; G294-R297 PolarHBondContact O-N 2.92Å; R297-P299 CarbonylContact O-C 3.27Å; R297-G300 PolarHBondContact O-N 3.24Å
298	I	53.8	Low	64	Low	159 Å²	159	69.9 Å²	69.9	82%	0.815	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	123.5	165.6	-57.7	173.1	0	0	0	106.9
299	P	50.9	Low	63.9	Low	118 Å²	118	63.2 Å²	63.2	77%	0.766	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	cis	-107.7	97.9	4.3	34.9	-18.8	0	0	0	110.7	R297	R297-P299 CarbonylContact O-C 3.27Å
300	G	57.6	Low	63.9	Low	10 Å²	10	67.3 Å²	67.3	10%	0.103	33%	0.331	C	S	.	.	S	Bend	trans	-58.3	168.9	163.9	0	0	0	0	0	110.3	E293 R297 A302	E293-G300 WeakPolarHBondContact O-CA 3.28Å; R297-G300 PolarHBondContact O-N 3.24Å; G300-A302 VanDerWaalsContact C-N 3.34Å; G300-A302 PolarHBondContact O-N 2.96Å
301	N	63.7	Low	63.7	Low	58 Å²	58	72.8 Å²	72.8	31%	0.31	36%	0.355	S	S	.	.			trans	-61.8	95.6	-178.5	-176.1	-27	0	0	0	110.2	E293 L303 R304 I305	E293-N301 PolarHBondContact O-N 2.88Å; N301-L303 PolarHBondContact O-N 2.86Å; N301-L303 VanDerWaalsContact O-N 3.16Å; N301-L303 PolarHBondContact OD1-N 3.01Å; N301-R304 HydrophobicContact CB-CB 4.1Å; N301-R304 HydrophobicContact CB-CG 4.22Å; N301-R304 WeakPolarHBondContact O-CB 3.23Å; N301-R304 PolarHBondContact O-N 2.88Å; N301-R304 PolarHBondContact OD1-N 2.73Å; N301-I305 WeakPolarHBondContact O-CG1 3.28Å; N301-I305 PolarHBondContact O-N 3.03Å
302	A	62.6	Low	63.6	Low	49 Å²	49	68.5 Å²	68.5	41%	0.405	34%	0.335	S	S	.	.	H	α-helix	trans	-58.8	-33.6	-170.3	0	0	0	0	0	112.2	G300 I305 R306 H356	G300-A302 VanDerWaalsContact C-N 3.34Å; G300-A302 PolarHBondContact O-N 2.96Å; A302-I305 PolarHBondContact O-N 3.33Å; A302-R306 VanDerWaalsContact O-CB 3.27Å; A302-R306 WeakPolarHBondContact O-CB 3.48Å; A302-R306 PolarHBondContact O-N 3.3Å; A302-H356 PolarHBondContact O-CE1 2.89Å; A302-H356 PolarHBondContact O-ND1 3.03Å
303	L	63.4	Low	63.5	Low	122 Å²	122	69 Å²	69	64%	0.639	34%	0.339	S	S	*	.	H	α-helix	trans	-65.7	-47.5	175.4	-67.5	173.6	0	0	0	111.2	N301 R306 E307	N301-L303 PolarHBondContact O-N 2.86Å; N301-L303 VanDerWaalsContact O-N 3.16Å; N301-L303 PolarHBondContact OD1-N 3.01Å; L303-R306 PolarHBondContact O-N 3.4Å; L303-E307 WeakPolarHBondContact O-CG 3.11Å; L303-E307 PolarHBondContact O-N 3.07Å
304	R	61	Low	63.4	Low	124 Å²	124	70.7 Å²	70.7	47%	0.468	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-48.8	174.5	-71.9	-177.4	179.9	175.4	0.9	110.4	N301 R306 E307 L308	N301-R304 HydrophobicContact CB-CB 4.1Å; N301-R304 HydrophobicContact CB-CG 4.22Å; N301-R304 WeakPolarHBondContact O-CB 3.23Å; N301-R304 PolarHBondContact O-N 2.88Å; N301-R304 PolarHBondContact OD1-N 2.73Å; R304-R306 PolarHBondContact O-N 3.13Å; R304-E307 PolarHBondContact O-N 2.99Å; R304-E307 VanDerWaalsContact O-N 3.12Å; R304-L308 WeakPolarHBondContact O-CD1 3.44Å; R304-L308 WeakPolarHBondContact O-CG 3.26Å; R304-L308 PolarHBondContact O-N 3.01Å
305	I	63.8	Low	63.4	Low	13 Å²	13	74.5 Å²	74.5	7%	0.067	36%	0.363	C	S	.	.	H	α-helix	trans	-56.4	-41.1	178.6	-63.6	168.4	0	0	0	111.2	N301 A302 L308 W309 P355 I358	N301-I305 WeakPolarHBondContact O-CG1 3.28Å; N301-I305 PolarHBondContact O-N 3.03Å; A302-I305 PolarHBondContact O-N 3.33Å; I305-L308 PolarHBondContact O-N 3.15Å; I305-W309 WeakPolarHBondContact O-CB 3.41Å; I305-W309 PolarHBondContact O-N 2.99Å; I305-P355 VanDerWaalsContact CG2-O 3.25Å; I305-P355 WeakPolarHBondContact CG2-O 3.47Å; I305-I358 HydrophobicContact CG2-CD1 4.49Å
306	R	64.2	Low	63	Low	143 Å²	143	74.8 Å²	74.8	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-66.8	-43.2	175.5	-175.4	178.4	179.1	176.6	0.5	113.3	A302 L303 R304 L308 W309 L310 P355	A302-R306 VanDerWaalsContact O-CB 3.27Å; A302-R306 WeakPolarHBondContact O-CB 3.48Å; A302-R306 PolarHBondContact O-N 3.3Å; L303-R306 PolarHBondContact O-N 3.4Å; R304-R306 PolarHBondContact O-N 3.13Å; R306-L308 VanDerWaalsContact C-N 3.25Å; R306-L308 PolarHBondContact O-N 3.22Å; R306-W309 WeakPolarHBondContact O-CB 2.95Å; R306-W309 PolarHBondContact O-N 2.92Å; R306-L310 WeakPolarHBondContact O-CG 3.26Å; R306-L310 PolarHBondContact O-N 3.01Å; R306-P355 HydrophobicContact CB-CB 4.37Å; R306-P355 HydrophobicContact CG-CB 4.21Å
307	E	64.2	Low	62.5	Low	110 Å²	110	78.7 Å²	78.7	51%	0.514	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-36.1	174.7	-74.6	176.4	-175.8	0	0	112	L303 R304 L310 K311	L303-E307 WeakPolarHBondContact O-CG 3.11Å; L303-E307 PolarHBondContact O-N 3.07Å; R304-E307 PolarHBondContact O-N 2.99Å; R304-E307 VanDerWaalsContact O-N 3.12Å; E307-L310 PolarHBondContact O-N 3.46Å; E307-K311 WeakPolarHBondContact O-CG 3.39Å; E307-K311 PolarHBondContact O-N 2.91Å; E307-K311 VanDerWaalsContact O-N 3.11Å
308	L	63.1	Low	62.1	Low	17 Å²	17	75.1 Å²	75.1	9%	0.089	38%	0.375	C	S	.	.	H	α-helix	trans	-71.5	-39.7	177.3	-61.9	164.4	0	0	0	111.5	L289 T292 R304 I305 R306 L310 K311 L312	L289-L308 HydrophobicContact CD2-CB 3.75Å; L289-L308 HydrophobicContact CD2-CD1 3.69Å; L289-L308 HydrophobicContact CD2-CD2 3.21Å; L289-L308 HydrophobicContact CD2-CG 3.63Å; L289-L308 HydrophobicContact CG-CD2 4.31Å; T292-L308 HydrophobicContact CG2-CD1 3.31Å; T292-L308 HydrophobicContact CG2-CG 4.44Å; R304-L308 WeakPolarHBondContact O-CD1 3.44Å; R304-L308 WeakPolarHBondContact O-CG 3.26Å; R304-L308 PolarHBondContact O-N 3.01Å; I305-L308 PolarHBondContact O-N 3.15Å; R306-L308 VanDerWaalsContact C-N 3.25Å; R306-L308 PolarHBondContact O-N 3.22Å; L308-L310 VanDerWaalsContact C-N 3.3Å; L308-L310 PolarHBondContact O-N 3.17Å; L308-K311 WeakPolarHBondContact O-CB 3.4Å; L308-K311 PolarHBondContact O-N 3.24Å; L308-L312 WeakPolarHBondContact O-CB 3Å; L308-L312 PolarHBondContact O-N 3.07Å
309	W	66.8	Low	61.9	Low	21 Å²	21	71.2 Å²	71.2	8%	0.08	36%	0.359	C	S	.	.	H	α-helix	trans	-58	-43.4	171.9	-176.5	-99.2	0	0	0	112.1	I305 R306 K311 L312 S313 L350 Y353 P355 I358	I305-W309 WeakPolarHBondContact O-CB 3.41Å; I305-W309 PolarHBondContact O-N 2.99Å; R306-W309 WeakPolarHBondContact O-CB 2.95Å; R306-W309 PolarHBondContact O-N 2.92Å; W309-K311 VanDerWaalsContact C-N 3.32Å; W309-K311 PolarHBondContact O-N 3.45Å; W309-L312 WeakPolarHBondContact O-CB 3.4Å; W309-L312 PolarHBondContact O-N 2.77Å; W309-S313 WeakPolarHBondContact O-CB 3.47Å; W309-S313 PolarHBondContact O-N 3.22Å; W309-S313 PolarHBondContact O-OG 2.82Å; W309-L350 HydrophobicContact CH2-CB 4.45Å; W309-L350 HydrophobicContact CH2-CD2 3.84Å; W309-L350 WeakPolarHBondContact CZ2-O 3.49Å; W309-L350 HydrophobicContact CZ3-CD2 4.12Å; W309-Y353 WeakPolarHBondContact CZ2-O 3.28Å; W309-P355 HydrophobicContact CB-CB 3.65Å; W309-P355 VanDerWaalsContact CD2-CA 3.49Å; W309-P355 HydrophobicContact CD2-CB 4.13Å; W309-P355 VanDerWaalsContact CG-CA 3.42Å; W309-P355 HydrophobicContact CG-CB 3.49Å; W309-P355 VanDerWaalsContact CG-CB 3.49Å; W309-P355 HydrophobicContact CG-CG 4Å; W309-I358 HydrophobicContact CE3-CD1 3.86Å; W309-I358 HydrophobicContact CE3-CG1 3.36Å; W309-I358 HydrophobicContact CZ3-CG1 3.6Å
310	L	66.5	Low	61.6	Low	100 Å²	100	75.7 Å²	75.7	52%	0.524	36%	0.363	S	S	.	.	H	α-helix	trans	-64.9	-35.6	176.6	-70.2	169.1	0	0	0	112.3	R306 E307 L308 S313 H314	R306-L310 WeakPolarHBondContact O-CG 3.26Å; R306-L310 PolarHBondContact O-N 3.01Å; E307-L310 PolarHBondContact O-N 3.46Å; L308-L310 VanDerWaalsContact C-N 3.3Å; L308-L310 PolarHBondContact O-N 3.17Å; L310-S313 WeakPolarHBondContact CA-OG 3.39Å; L310-S313 PolarHBondContact O-OG 2.81Å; L310-H314 WeakPolarHBondContact O-CB 3.38Å; L310-H314 PolarHBondContact O-N 3.45Å
311	K	67.2	Low	60.8	Low	116 Å²	116	82 Å²	82	50%	0.504	39%	0.393	S	S	.	.	H	α-helix	trans	-68.9	-35.8	173	-72.9	171.6	-178.5	168.2	0	112.4	Y282 E307 L308 W309 H315	Y282-K311 VanDerWaalsContact OH-C 3.31Å; Y282-K311 PolarHBondContact OH-O 3.25Å; E307-K311 WeakPolarHBondContact O-CG 3.39Å; E307-K311 PolarHBondContact O-N 2.91Å; E307-K311 VanDerWaalsContact O-N 3.11Å; L308-K311 WeakPolarHBondContact O-CB 3.4Å; L308-K311 PolarHBondContact O-N 3.24Å; W309-K311 VanDerWaalsContact C-N 3.32Å; W309-K311 PolarHBondContact O-N 3.45Å; K311-H315 WeakPolarHBondContact O-CB 3.5Å; K311-H315 PolarHBondContact O-N 2.76Å
312	L	66.4	Low	59.6	Low	4 Å²	4	90.1 Å²	90.1	2%	0.021	42%	0.42	C	S	.	.	H	α-helix	trans	-70.7	-46.7	177.5	-172.3	145.3	0	0	0	110.4	L279 Y282 L308 W309 H314 H315 F316 L350	L279-L312 HydrophobicContact CD2-CD1 3.67Å; L279-L312 HydrophobicContact CD2-CD2 4.23Å; L279-L312 HydrophobicContact CD2-CG 4.46Å; Y282-L312 HydrophobicContact CD1-CD1 3.65Å; Y282-L312 HydrophobicContact CD1-CG 4.15Å; Y282-L312 HydrophobicContact CE1-CB 3.87Å; Y282-L312 HydrophobicContact CE1-CD1 3.75Å; Y282-L312 HydrophobicContact CE1-CG 3.97Å; Y282-L312 PolarHBondContact OH-N 3.48Å; L308-L312 WeakPolarHBondContact O-CB 3Å; L308-L312 PolarHBondContact O-N 3.07Å; W309-L312 WeakPolarHBondContact O-CB 3.4Å; W309-L312 PolarHBondContact O-N 2.77Å; L312-H314 VanDerWaalsContact C-N 3.3Å; L312-H314 PolarHBondContact O-N 2.84Å; L312-H315 WeakPolarHBondContact O-CB 3.4Å; L312-H315 PolarHBondContact O-N 3.26Å; L312-F316 HydrophobicContact CD2-CD2 3.68Å; L312-F316 HydrophobicContact CD2-CE2 3.55Å; L312-F316 HydrophobicContact CG-CD2 4.1Å; L312-F316 HydrophobicContact CG-CE2 3.82Å; L312-F316 WeakPolarHBondContact O-CD2 3.34Å; L312-F316 PolarHBondContact O-N 3.41Å; L312-L350 HydrophobicContact CD2-CD1 3.78Å; L312-L350 HydrophobicContact CD2-CD2 3.88Å; L312-L350 HydrophobicContact CD2-CG 4.47Å
313	S	66	Low	58.3	Low	20 Å²	20	94 Å²	94	14%	0.14	43%	0.432	C	S	.	.	H	α-helix	trans	-60	-41.4	174.3	67.2	0	0	0	0	111.4	W309 L310 H315 F316 Q317	W309-S313 WeakPolarHBondContact O-CB 3.47Å; W309-S313 PolarHBondContact O-N 3.22Å; W309-S313 PolarHBondContact O-OG 2.82Å; L310-S313 WeakPolarHBondContact CA-OG 3.39Å; L310-S313 PolarHBondContact O-OG 2.81Å; S313-H315 VanDerWaalsContact C-N 3.32Å; S313-H315 PolarHBondContact O-N 3.17Å; S313-F316 PolarHBondContact O-N 3.11Å; S313-Q317 WeakPolarHBondContact O-CB 3.39Å; S313-Q317 VanDerWaalsContact O-CG 3.25Å; S313-Q317 WeakPolarHBondContact O-CG 3.36Å; S313-Q317 PolarHBondContact O-N 3.47Å
314	H	64.3	Low	57.2	Low	105 Å²	105	92.6 Å²	92.6	49%	0.486	43%	0.43	S	S	.	.	H	α-helix	trans	-67.8	-31.5	175.2	-170.8	-60.5	0	0	0	112.6	L310 L312 Q317 N318	L310-H314 WeakPolarHBondContact O-CB 3.38Å; L310-H314 PolarHBondContact O-N 3.45Å; L312-H314 VanDerWaalsContact C-N 3.3Å; L312-H314 PolarHBondContact O-N 2.84Å; H314-Q317 PolarHBondContact O-N 3.35Å; H314-N318 PolarHBondContact CE1-ND2 3.05Å; H314-N318 PolarHBondContact O-N 3.09Å
315	H	62.9	Low	55.9	Low	86 Å²	86	95 Å²	95	40%	0.398	45%	0.447	S	S	.	.	H	α-helix	trans	-68.2	-39.9	174.6	-177.1	-85.6	0	0	0	111.7	Y282 K311 L312 S313 N318	Y282-H315 HydrophobicContact CD2-CB 4.31Å; Y282-H315 AromaticContact CD2-CD2 3.9Å; Y282-H315 AromaticContact CD2-CE1 3.9Å; Y282-H315 AromaticContact CD2-CG 3.75Å; Y282-H315 AromaticContact CD2-ND1 3.75Å; Y282-H315 AromaticContact CD2-NE2 3.97Å; Y282-H315 HydrophobicContact CE2-CB 3.58Å; Y282-H315 AromaticContact CE2-CD2 3.52Å; Y282-H315 AromaticContact CE2-CG 3.39Å; Y282-H315 AromaticContact CE2-ND1 3.89Å; K311-H315 WeakPolarHBondContact O-CB 3.5Å; K311-H315 PolarHBondContact O-N 2.76Å; L312-H315 WeakPolarHBondContact O-CB 3.4Å; L312-H315 PolarHBondContact O-N 3.26Å; S313-H315 VanDerWaalsContact C-N 3.32Å; S313-H315 PolarHBondContact O-N 3.17Å; H315-N318 PolarHBondContact O-N 2.95Å
316	F	61.6	Low	54.7	Low	20 Å²	20	99.7 Å²	99.7	9%	0.088	48%	0.478	C	S	.	.	H	α-helix	trans	-74	-25.8	174.4	-73.9	-73.8	0	0	0	113.3	L312 S313 I346 Y347 L350	L312-F316 HydrophobicContact CD2-CD2 3.68Å; L312-F316 HydrophobicContact CD2-CE2 3.55Å; L312-F316 HydrophobicContact CG-CD2 4.1Å; L312-F316 HydrophobicContact CG-CE2 3.82Å; L312-F316 WeakPolarHBondContact O-CD2 3.34Å; L312-F316 PolarHBondContact O-N 3.41Å; S313-F316 PolarHBondContact O-N 3.11Å; F316-I346 HydrophobicContact CD1-CG2 4Å; F316-I346 HydrophobicContact CE1-CG2 3.75Å; F316-I346 HydrophobicContact CZ-CG2 4.17Å; F316-Y347 HydrophobicContact CB-CD2 4.33Å; F316-L350 HydrophobicContact CB-CD1 4.43Å; F316-L350 HydrophobicContact CD2-CD1 3.31Å; F316-L350 HydrophobicContact CE2-CD1 3.58Å; F316-L350 HydrophobicContact CG-CD1 3.85Å; F316-L350 HydrophobicContact CZ-CD1 4.28Å
317	Q	58.5	Low	53.5	Low	95 Å²	95	98.2 Å²	98.2	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-74.3	-20.7	173.2	-76.6	171.2	-11.9	0	0	114.1	S313 H314 P319 Y347	S313-Q317 WeakPolarHBondContact O-CB 3.39Å; S313-Q317 VanDerWaalsContact O-CG 3.25Å; S313-Q317 WeakPolarHBondContact O-CG 3.36Å; S313-Q317 PolarHBondContact O-N 3.47Å; H314-Q317 PolarHBondContact O-N 3.35Å; Q317-P319 VanDerWaalsContact O-CD 3.23Å; Q317-P319 WeakPolarHBondContact O-CD 3.27Å; Q317-Y347 HydrophobicContact CG-CD2 3.93Å; Q317-Y347 HydrophobicContact CG-CE2 3.46Å; Q317-Y347 VanDerWaalsContact CG-CE2 3.46Å; Q317-Y347 VanDerWaalsContact NE2-CE2 3.34Å; Q317-Y347 VanDerWaalsContact NE2-CZ 3.3Å; Q317-Y347 PolarHBondContact NE2-OH 2.93Å
318	N	54.4	Low	52.6	Low	88 Å²	88	98.1 Å²	98.1	47%	0.471	49%	0.49	S	S	.	.			trans	-111.4	91.4	-177.3	-81.1	4.6	0	0	0	111.8	H314 H315 Y320	H314-N318 PolarHBondContact CE1-ND2 3.05Å; H314-N318 PolarHBondContact O-N 3.09Å; H315-N318 PolarHBondContact O-N 2.95Å; N318-Y320 PolarHBondContact O-N 3.22Å
319	P	51.4	Low	51.5	Low	76 Å²	76	104 Å²	104	49%	0.494	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	7.1	-172.6	27	-35.3	0	0	0	116	Q317 L321	Q317-P319 VanDerWaalsContact O-CD 3.23Å; Q317-P319 WeakPolarHBondContact O-CD 3.27Å; P319-L321 PolarHBondContact O-N 3.49Å
320	Y	44.7	Very low	50.2	Low	212 Å²	212	108 Å²	108	83%	0.831	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	4.9	-164.9	-71.2	-76.4	0	0	0	116.7	N318	N318-Y320 PolarHBondContact O-N 3.22Å
321	L	40.1	Very low	48.8	Very low	142 Å²	142	109 Å²	109	74%	0.743	56%	0.558	S	S	*	*	S	Bend	trans	-120	88.9	-177.1	-88	139.5	0	0	0	112	P319	P319-L321 PolarHBondContact O-N 3.49Å
322	R	39	Very low	47.4	Very low	230 Å²	230	108.8 Å²	108.8	87%	0.868	56%	0.563	S	S	*	*			trans	85	64.4	166.7	-52.6	-173.7	-175.6	171.8	4.4	117.3	P324	R322-P324 WeakPolarHBondContact O-CD 3.42Å
323	I	35.7	Very low	46.1	Very low	129 Å²	129	117.6 Å²	117.6	66%	0.662	60%	0.604	S	S	*	*			trans	-70	119.6	145.4	-59.3	167.9	0	0	0	106.1	Q325	I323-Q325 PolarHBondContact O-N 3.23Å
324	P	38.8	Very low	44.8	Very low	94 Å²	94	123.9 Å²	123.9	61%	0.61	64%	0.636	S	S	*	*			trans	-61	110.8	163.2	-9.8	24.8	0	0	0	106.1	R322	R322-P324 WeakPolarHBondContact O-CD 3.42Å
325	Q	33.6	Very low	43.5	Very low	174 Å²	174	123.1 Å²	123.1	81%	0.813	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-55.4	128.3	170.8	-101.3	-170.7	-28.2	0	0	107.5	I323 D327	I323-Q325 PolarHBondContact O-N 3.23Å; Q325-D327 PolarHBondContact O-N 3.31Å
326	P	40.2	Very low	42	Very low	111 Å²	111	123.5 Å²	123.5	72%	0.721	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-57.2	130.3	166.6	23.5	-29.4	0	0	0	107.5
327	D	37.7	Very low	40.9	Very low	112 Å²	112	128.7 Å²	128.7	60%	0.599	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-51.8	125	172.4	-89.9	-31.6	0	0	0	107.6	Q325 D329	Q325-D327 PolarHBondContact O-N 3.31Å; D327-D329 PolarHBondContact O-N 2.84Å
328	P	44.9	Very low	39.8	Very low	109 Å²	109	129 Å²	129	71%	0.708	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-6.2	-176.1	25.3	-33.5	0	0	0	113.7
329	D	41.2	Very low	39	Very low	141 Å²	141	128.9 Å²	128.9	75%	0.754	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	8.7	-171.5	-64.2	-25.1	0	0	0	114.4	D327 T331	D327-D329 PolarHBondContact O-N 2.84Å; D329-T331 PolarHBondContact O-N 2.72Å
330	V	39.3	Very low	38.6	Very low	104 Å²	104	132.2 Å²	132.2	63%	0.63	70%	0.697	S	S	*	*			trans	-101.6	68.6	173.9	-166.5	0	0	0	0	109.7	D332	V330-D332 PolarHBondContact O-N 2.95Å
331	T	36.6	Very low	39	Very low	121 Å²	121	123.8 Å²	123.8	74%	0.742	67%	0.666	S	S	*	*			trans	-76.2	46.6	172.2	52.5	0	0	0	0	112	D329 E333	D329-T331 PolarHBondContact O-N 2.72Å; T331-E333 PolarHBondContact O-N 2.95Å
332	D	38.4	Very low	39.6	Very low	112 Å²	112	120.9 Å²	120.9	60%	0.599	65%	0.651	S	S	*	*			trans	-91.2	91.8	165.8	-97.1	-27.2	0	0	0	108	V330 N334 L335	V330-D332 PolarHBondContact O-N 2.95Å; D332-N334 PolarHBondContact O-N 3.16Å; D332-L335 HydrophobicContact CB-CD1 4.03Å; D332-L335 PolarHBondContact O-N 2.88Å
333	E	39.2	Very low	40.4	Very low	189 Å²	189	114.5 Å²	114.5	88%	0.883	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	14.8	178.5	-63.6	-170.8	150.3	0	0	114.6	T331	T331-E333 PolarHBondContact O-N 2.95Å
334	N	39.1	Very low	41.3	Very low	152 Å²	152	111.7 Å²	111.7	81%	0.813	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.6	9.6	-176.9	-73.3	-43.2	0	0	0	114.5	D332	D332-N334 PolarHBondContact O-N 3.16Å
335	L	36.5	Very low	42.3	Very low	89 Å²	89	111.8 Å²	111.8	47%	0.466	61%	0.612	S	S	.	*	S	Bend	trans	-92.9	102	169.8	-76.3	110.1	0	0	0	110.8	D332 Y338	D332-L335 HydrophobicContact CB-CD1 4.03Å; D332-L335 PolarHBondContact O-N 2.88Å; L335-Y338 WeakPolarHBondContact CD2-OH 3.41Å
336	S	32.4	Very low	43.6	Very low	94 Å²	94	103.6 Å²	103.6	66%	0.657	57%	0.574	S	S	*	*			trans	-42.5	145.2	171.3	62.2	0	0	0	0	112.9	Y338	S336-Y338 PolarHBondContact O-N 3.24Å
337	P	36.5	Very low	44.5	Very low	128 Å²	128	101.3 Å²	101.3	83%	0.831	55%	0.551	S	S	*	*			trans	-62.6	122.5	-174.4	27.3	-32.9	0	0	0	110.4
338	Y	35.5	Very low	45.6	Very low	103 Å²	103	102.3 Å²	102.3	40%	0.404	55%	0.553	S	S	.	*			trans	-56	147.9	179	-66.3	-91.5	0	0	0	112.2	R267 L335 S336 I340	R267-Y338 HydrophobicContact CG-CD1 4.36Å; R267-Y338 HydrophobicContact CG-CE1 4.26Å; R267-Y338 PolarHBondContact NH2-OH 2.92Å; L335-Y338 WeakPolarHBondContact CD2-OH 3.41Å; S336-Y338 PolarHBondContact O-N 3.24Å; Y338-I340 PolarHBondContact O-N 3.41Å
339	P	38.9	Very low	46.5	Very low	85 Å²	85	98.9 Å²	98.9	55%	0.552	53%	0.528	S	S	*	.			trans	-69.4	90.9	160.8	29.9	-29.6	0	0	0	107.2	I266 I341	I266-P339 WeakPolarHBondContact CG2-O 3.24Å; P339-I341 VanDerWaalsContact C-N 3.35Å; P339-I341 PolarHBondContact O-N 3.32Å
340	I	43.6	Very low	47.5	Very low	145 Å²	145	92.4 Å²	92.4	74%	0.744	49%	0.493	S	S	*	.			trans	-67.5	100.9	164	-60	169.7	0	0	0	104.4	Y338 D342	Y338-I340 PolarHBondContact O-N 3.41Å; I340-D342 PolarHBondContact O-N 3.03Å
341	I	51.6	Low	48.6	Very low	35 Å²	35	94 Å²	94	18%	0.179	49%	0.493	C	S	.	.			trans	-62.4	109.4	166.4	-64.5	169.4	0	0	0	105.1	T274 P339 H343 I346	T274-I341 HydrophobicContact CG2-CD1 3.91Å; P339-I341 VanDerWaalsContact C-N 3.35Å; P339-I341 PolarHBondContact O-N 3.32Å; I341-H343 PolarHBondContact O-N 3.43Å; I341-I346 HydrophobicContact CG2-CD1 4.1Å; I341-I346 HydrophobicContact CG2-CG1 4.04Å
342	D	53.7	Low	49.8	Very low	82 Å²	82	92.4 Å²	92.4	44%	0.439	49%	0.487	S	S	.	.			trans	-67	130	-178.8	-163.4	5.6	0	0	0	107.8	I340 T344 E345	I340-D342 PolarHBondContact O-N 3.03Å; D342-T344 VanDerWaalsContact CB-OG1 3.23Å; D342-T344 WeakPolarHBondContact CB-OG1 3.42Å; D342-T344 PolarHBondContact O-N 2.91Å; D342-T344 PolarHBondContact OD2-OG1 3.43Å; D342-E345 WeakPolarHBondContact O-CB 3.36Å; D342-E345 PolarHBondContact O-N 2.69Å
343	H	55.1	Low	50.8	Low	95 Å²	95	88.9 Å²	88.9	44%	0.44	47%	0.466	S	S	.	.	H	α-helix	trans	-58.8	-17.4	-179.5	-72	-67.8	0	0	0	111.8	I341 I346 Y347	I341-H343 PolarHBondContact O-N 3.43Å; H343-I346 PolarHBondContact O-N 3.23Å; H343-Y347 WeakPolarHBondContact O-CB 3.48Å; H343-Y347 PolarHBondContact O-N 3.45Å
344	T	55.5	Low	51.6	Low	70 Å²	70	83.8 Å²	83.8	43%	0.429	45%	0.448	S	S	.	.	H	α-helix	trans	-61.1	-43.6	169.1	59.5	0	0	0	0	112.6	D342 I346 Y347 E348	D342-T344 VanDerWaalsContact CB-OG1 3.23Å; D342-T344 WeakPolarHBondContact CB-OG1 3.42Å; D342-T344 PolarHBondContact O-N 2.91Å; D342-T344 PolarHBondContact OD2-OG1 3.43Å; T344-I346 VanDerWaalsContact C-N 3.34Å; T344-I346 PolarHBondContact O-N 3.25Å; T344-Y347 CarbonylContact O-C 3.58Å; T344-Y347 WeakPolarHBondContact O-CB 3.22Å; T344-Y347 PolarHBondContact O-N 2.87Å; T344-Y347 VanDerWaalsContact O-N 3.14Å; T344-E348 WeakPolarHBondContact O-CG 3.32Å; T344-E348 PolarHBondContact O-N 3.4Å
345	E	59.1	Low	52.5	Low	96 Å²	96	78.3 Å²	78.3	45%	0.449	42%	0.421	S	S	.	.	H	α-helix	trans	-64.7	-39.8	177.1	-66	-176.3	172.9	0	0	111.2	D342 Y347 E348 I349	D342-E345 WeakPolarHBondContact O-CB 3.36Å; D342-E345 PolarHBondContact O-N 2.69Å; E345-Y347 VanDerWaalsContact C-N 3.32Å; E345-E348 PolarHBondContact O-N 3.32Å; E345-I349 VanDerWaalsContact O-CG1 3.27Å; E345-I349 WeakPolarHBondContact O-CG1 3.25Å; E345-I349 PolarHBondContact O-N 2.94Å
346	I	60.9	Low	53.5	Low	3 Å²	3	78.6 Å²	78.6	2%	0.015	42%	0.42	C	S	.	.	H	α-helix	trans	-65.1	-40.6	174.4	-62.1	174.6	0	0	0	110.1	T274 I275 F316 I341 H343 T344 I349 L350	T274-I346 HydrophobicContact CG2-CD1 4.45Å; I275-I346 HydrophobicContact CG1-CG1 4.34Å; I275-I346 HydrophobicContact CG1-CG2 4.37Å; F316-I346 HydrophobicContact CD1-CG2 4Å; F316-I346 HydrophobicContact CE1-CG2 3.75Å; F316-I346 HydrophobicContact CZ-CG2 4.17Å; I341-I346 HydrophobicContact CG2-CD1 4.1Å; I341-I346 HydrophobicContact CG2-CG1 4.04Å; H343-I346 PolarHBondContact O-N 3.23Å; T344-I346 VanDerWaalsContact C-N 3.34Å; T344-I346 PolarHBondContact O-N 3.25Å; I346-I349 PolarHBondContact O-N 2.84Å; I346-L350 HydrophobicContact CG2-CD1 3.94Å; I346-L350 HydrophobicContact CG2-CG 4.41Å; I346-L350 WeakPolarHBondContact O-CB 3.09Å; I346-L350 WeakPolarHBondContact O-CG 3.29Å; I346-L350 PolarHBondContact O-N 2.71Å
347	Y	59.5	Low	55	Low	63 Å²	63	75.9 Å²	75.9	25%	0.247	40%	0.397	C	S	.	.	H	α-helix	trans	-66.4	-40.5	177	179.2	-93	0	0	0	112.5	F316 Q317 H343 T344 E345 L350 Q351	F316-Y347 HydrophobicContact CB-CD2 4.33Å; Q317-Y347 HydrophobicContact CG-CD2 3.93Å; Q317-Y347 HydrophobicContact CG-CE2 3.46Å; Q317-Y347 VanDerWaalsContact CG-CE2 3.46Å; Q317-Y347 VanDerWaalsContact NE2-CE2 3.34Å; Q317-Y347 VanDerWaalsContact NE2-CZ 3.3Å; Q317-Y347 PolarHBondContact NE2-OH 2.93Å; H343-Y347 WeakPolarHBondContact O-CB 3.48Å; H343-Y347 PolarHBondContact O-N 3.45Å; T344-Y347 CarbonylContact O-C 3.58Å; T344-Y347 WeakPolarHBondContact O-CB 3.22Å; T344-Y347 PolarHBondContact O-N 2.87Å; T344-Y347 VanDerWaalsContact O-N 3.14Å; E345-Y347 VanDerWaalsContact C-N 3.32Å; Y347-L350 PolarHBondContact O-N 2.89Å; Y347-Q351 WeakPolarHBondContact O-CB 3.36Å; Y347-Q351 PolarHBondContact O-N 2.9Å
348	E	60.4	Low	56.5	Low	133 Å²	133	70.1 Å²	70.1	62%	0.621	36%	0.36	S	S	*	.	H	α-helix	trans	-63	-42.1	174.3	-74.8	-173.4	173.6	0	0	111.7	T344 E345 Q351 S352	T344-E348 WeakPolarHBondContact O-CG 3.32Å; T344-E348 PolarHBondContact O-N 3.4Å; E345-E348 PolarHBondContact O-N 3.32Å; E348-Q351 PolarHBondContact O-N 2.94Å; E348-S352 PolarHBondContact O-N 3.05Å
349	I	62.7	Low	58.2	Low	36 Å²	36	65.9 Å²	65.9	19%	0.185	35%	0.345	C	S	.	.	H	α-helix	trans	-65.1	-44.5	174.6	-66.3	165.9	0	0	0	110	V271 I275 E345 I346 Q351 S352 Y353	V271-I349 HydrophobicContact CG1-CD1 3.77Å; I275-I349 HydrophobicContact CD1-CB 4.34Å; I275-I349 HydrophobicContact CD1-CD1 3.79Å; I275-I349 HydrophobicContact CD1-CG2 3.88Å; E345-I349 VanDerWaalsContact O-CG1 3.27Å; E345-I349 WeakPolarHBondContact O-CG1 3.25Å; E345-I349 PolarHBondContact O-N 2.94Å; I346-I349 PolarHBondContact O-N 2.84Å; I349-Q351 VanDerWaalsContact C-N 3.3Å; I349-Q351 PolarHBondContact O-N 3.1Å; I349-S352 WeakPolarHBondContact O-CB 3.48Å; I349-S352 PolarHBondContact O-N 2.69Å; I349-S352 VanDerWaalsContact O-N 3.12Å; I349-S352 PolarHBondContact O-OG 3.1Å; I349-Y353 HydrophobicContact CG2-CE2 4.22Å; I349-Y353 WeakPolarHBondContact O-CD2 3.44Å
350	L	63	Low	59.6	Low	6 Å²	6	64 Å²	64	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-59.2	-41.3	174.9	-74	166.8	0	0	0	111.3	W309 L312 F316 I346 Y347 S352 Y353 L361	W309-L350 HydrophobicContact CH2-CB 4.45Å; W309-L350 HydrophobicContact CH2-CD2 3.84Å; W309-L350 WeakPolarHBondContact CZ2-O 3.49Å; W309-L350 HydrophobicContact CZ3-CD2 4.12Å; L312-L350 HydrophobicContact CD2-CD1 3.78Å; L312-L350 HydrophobicContact CD2-CD2 3.88Å; L312-L350 HydrophobicContact CD2-CG 4.47Å; F316-L350 HydrophobicContact CB-CD1 4.43Å; F316-L350 HydrophobicContact CD2-CD1 3.31Å; F316-L350 HydrophobicContact CE2-CD1 3.58Å; F316-L350 HydrophobicContact CG-CD1 3.85Å; F316-L350 HydrophobicContact CZ-CD1 4.28Å; I346-L350 HydrophobicContact CG2-CD1 3.94Å; I346-L350 HydrophobicContact CG2-CG 4.41Å; I346-L350 WeakPolarHBondContact O-CB 3.09Å; I346-L350 WeakPolarHBondContact O-CG 3.29Å; I346-L350 PolarHBondContact O-N 2.71Å; Y347-L350 PolarHBondContact O-N 2.89Å; L350-S352 PolarHBondContact O-N 3.48Å; L350-S352 VanDerWaalsContact O-N 3.15Å; L350-Y353 PolarHBondContact O-N 3.38Å; L350-L361 HydrophobicContact CD2-CD2 3.63Å
351	Q	62	Low	60.9	Low	136 Å²	136	57.1 Å²	57.1	64%	0.636	30%	0.299	S	S	*	.	H	α-helix	trans	-61.6	-24.2	178.6	-165.4	172.1	17.7	0	0	113.3	Y347 E348 I349 Y353	Y347-Q351 WeakPolarHBondContact O-CB 3.36Å; Y347-Q351 PolarHBondContact O-N 2.9Å; E348-Q351 PolarHBondContact O-N 2.94Å; I349-Q351 VanDerWaalsContact C-N 3.3Å; I349-Q351 PolarHBondContact O-N 3.1Å; Q351-Y353 VanDerWaalsContact C-N 3.33Å
352	S	61.3	Low	62.1	Low	88 Å²	88	55.5 Å²	55.5	62%	0.615	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.1	175.6	78.1	0	0	0	0	114.5	E348 I349 L350	E348-S352 PolarHBondContact O-N 3.05Å; I349-S352 WeakPolarHBondContact O-CB 3.48Å; I349-S352 PolarHBondContact O-N 2.69Å; I349-S352 VanDerWaalsContact O-N 3.12Å; I349-S352 PolarHBondContact O-OG 3.1Å; L350-S352 PolarHBondContact O-N 3.48Å; L350-S352 VanDerWaalsContact O-N 3.15Å
353	Y	59.6	Low	63.1	Low	38 Å²	38	53.6 Å²	53.6	15%	0.149	28%	0.28	C	S	.	.	S	Bend	trans	-101.2	149.3	179.6	-75.7	-93.2	0	0	0	112.4	W309 I349 L350 Q351 D357 L361 R364	W309-Y353 WeakPolarHBondContact CZ2-O 3.28Å; I349-Y353 HydrophobicContact CG2-CE2 4.22Å; I349-Y353 WeakPolarHBondContact O-CD2 3.44Å; L350-Y353 PolarHBondContact O-N 3.38Å; Q351-Y353 VanDerWaalsContact C-N 3.33Å; Y353-D357 HydrophobicContact CD1-CB 4.39Å; Y353-L361 HydrophobicContact CD1-CB 4.46Å; Y353-L361 HydrophobicContact CD1-CD1 4.36Å; Y353-L361 HydrophobicContact CD2-CD1 3.89Å; Y353-L361 HydrophobicContact CE1-CD1 4.08Å; Y353-L361 HydrophobicContact CE2-CD1 3.59Å; Y353-L361 HydrophobicContact CG-CD1 4.28Å; Y353-R364 WeakPolarHBondContact OH-CD 3.36Å; Y353-R364 PolarHBondContact OH-NE 3.3Å; Y353-R364 VanDerWaalsContact OH-NE 3.16Å; Y353-R364 PolarHBondContact OH-NH1 3.17Å
354	T	57	Low	63.8	Low	83 Å²	83	52.8 Å²	52.8	51%	0.509	27%	0.273	S	S	.	.			trans	-75.3	147.4	173.5	67	0	0	0	0	110.6	H356 D357	T354-H356 PolarHBondContact O-N 3.02Å; T354-D357 VanDerWaalsContact O-CB 3.25Å; T354-D357 WeakPolarHBondContact O-CB 3.27Å; T354-D357 PolarHBondContact O-N 3.27Å
355	P	57.8	Low	64.6	Low	36 Å²	36	49.5 Å²	49.5	23%	0.234	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-52.6	-26.2	-179.6	-28.4	33.2	0	0	0	115.5	I305 R306 W309 D357	I305-P355 VanDerWaalsContact CG2-O 3.25Å; I305-P355 WeakPolarHBondContact CG2-O 3.47Å; R306-P355 HydrophobicContact CB-CB 4.37Å; R306-P355 HydrophobicContact CG-CB 4.21Å; W309-P355 HydrophobicContact CB-CB 3.65Å; W309-P355 VanDerWaalsContact CD2-CA 3.49Å; W309-P355 HydrophobicContact CD2-CB 4.13Å; W309-P355 VanDerWaalsContact CG-CA 3.42Å; W309-P355 HydrophobicContact CG-CB 3.49Å; W309-P355 VanDerWaalsContact CG-CB 3.49Å; W309-P355 HydrophobicContact CG-CG 4Å; P355-D357 PolarHBondContact O-N 3.38Å
356	H	56.1	Low	65.3	Low	96 Å²	96	44.9 Å²	44.9	44%	0.444	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-83.2	1.4	-177.4	-56.2	-60	0	0	0	113.6	A302 T354	A302-H356 PolarHBondContact O-CE1 2.89Å; A302-H356 PolarHBondContact O-ND1 3.03Å; T354-H356 PolarHBondContact O-N 3.02Å
357	D	64	Low	65.7	Low	36 Å²	36	46.5 Å²	46.5	19%	0.193	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-112.5	13.8	-165.5	-141.5	26.3	0	0	0	113.9	Y353 T354 P355 S359 S360 L361	Y353-D357 HydrophobicContact CD1-CB 4.39Å; T354-D357 VanDerWaalsContact O-CB 3.25Å; T354-D357 WeakPolarHBondContact O-CB 3.27Å; T354-D357 PolarHBondContact O-N 3.27Å; P355-D357 PolarHBondContact O-N 3.38Å; D357-S359 VanDerWaalsContact C-N 3.25Å; D357-S359 PolarHBondContact O-N 3.49Å; D357-S360 VanDerWaalsContact CG-CB 3.47Å; D357-S360 CarbonylContact O-C 3.53Å; D357-S360 PolarHBondContact O-N 3.23Å; D357-S360 WeakPolarHBondContact OD1-CB 3.17Å; D357-S360 PolarHBondContact OD1-OG 3.49Å; D357-L361 WeakPolarHBondContact O-CB 3.41Å; D357-L361 PolarHBondContact O-N 3.36Å
358	I	68.9	Low	66.1	Low	8 Å²	8	44 Å²	44	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-52.1	-45.8	179.3	-62.4	170.3	0	0	0	111	I305 W309 L361 I362	I305-I358 HydrophobicContact CG2-CD1 4.49Å; W309-I358 HydrophobicContact CE3-CD1 3.86Å; W309-I358 HydrophobicContact CE3-CG1 3.36Å; W309-I358 HydrophobicContact CZ3-CG1 3.6Å; I358-L361 WeakPolarHBondContact O-CB 3.4Å; I358-L361 PolarHBondContact O-N 2.83Å; I358-I362 HydrophobicContact CG2-CD1 4.02Å; I358-I362 WeakPolarHBondContact O-CG1 3.4Å; I358-I362 PolarHBondContact O-N 3.1Å
359	S	70.9	Confident	66.3	Low	13 Å²	13	38 Å²	38	9%	0.091	21%	0.207	C	C	.	.	H	α-helix	trans	-68.1	-36.9	179.5	-69.9	0	0	0	0	112.7	L295 F296 D357 L361 I362 L363	L295-S359 VanDerWaalsContact C-OG 3.29Å; L295-S359 PolarHBondContact O-OG 2.86Å; F296-S359 WeakPolarHBondContact CA-OG 3.41Å; F296-S359 WeakPolarHBondContact CD1-OG 3.24Å; F296-S359 WeakPolarHBondContact CG-OG 3.39Å; D357-S359 VanDerWaalsContact C-N 3.25Å; D357-S359 PolarHBondContact O-N 3.49Å; S359-L361 VanDerWaalsContact C-N 3.35Å; S359-I362 PolarHBondContact O-N 2.89Å; S359-L363 WeakPolarHBondContact O-CB 3.28Å; S359-L363 WeakPolarHBondContact O-CG 3.38Å; S359-L363 PolarHBondContact O-N 2.91Å
360	S	69.2	Low	66	Low	46 Å²	46	37.1 Å²	37.1	32%	0.322	20%	0.203	S	C	.	.	H	α-helix	trans	-70.8	-33.9	175.1	-45.6	0	0	0	0	111.6	D357 L363 R364	D357-S360 VanDerWaalsContact CG-CB 3.47Å; D357-S360 CarbonylContact O-C 3.53Å; D357-S360 PolarHBondContact O-N 3.23Å; D357-S360 WeakPolarHBondContact OD1-CB 3.17Å; D357-S360 PolarHBondContact OD1-OG 3.49Å; S360-L363 PolarHBondContact O-N 2.88Å; S360-R364 WeakPolarHBondContact O-CB 3.43Å; S360-R364 PolarHBondContact O-N 3.4Å
361	L	71	Confident	65.5	Low	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-49	172.3	179.4	62.4	0	0	0	110.3	I275 L279 L350 Y353 D357 I358 S359 L363 R364 C365	I275-L361 HydrophobicContact CG2-CD2 4.47Å; L279-L361 HydrophobicContact CD1-CD2 3.74Å; L279-L361 HydrophobicContact CD1-CG 3.99Å; L350-L361 HydrophobicContact CD2-CD2 3.63Å; Y353-L361 HydrophobicContact CD1-CB 4.46Å; Y353-L361 HydrophobicContact CD1-CD1 4.36Å; Y353-L361 HydrophobicContact CD2-CD1 3.89Å; Y353-L361 HydrophobicContact CE1-CD1 4.08Å; Y353-L361 HydrophobicContact CE2-CD1 3.59Å; Y353-L361 HydrophobicContact CG-CD1 4.28Å; D357-L361 WeakPolarHBondContact O-CB 3.41Å; D357-L361 PolarHBondContact O-N 3.36Å; I358-L361 WeakPolarHBondContact O-CB 3.4Å; I358-L361 PolarHBondContact O-N 2.83Å; S359-L361 VanDerWaalsContact C-N 3.35Å; L361-L363 PolarHBondContact O-N 2.68Å; L361-R364 PolarHBondContact O-N 2.94Å; L361-C365 WeakPolarHBondContact O-CB 3.42Å; L361-C365 PolarHBondContact O-N 3.26Å; L361-C365 PolarHBondContact O-SG 3.42Å
362	I	75.7	Confident	64.7	Low	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.9	-48.3	174.3	-67.9	168.2	0	0	0	110.6	L279 I283 F296 I358 S359 R364 C365 L366	L279-I362 HydrophobicContact CB-CG1 4.35Å; L279-I362 HydrophobicContact CD1-CG1 3.97Å; I283-I362 HydrophobicContact CD1-CD1 3.72Å; F296-I362 HydrophobicContact CE1-CD1 4.41Å; F296-I362 HydrophobicContact CE1-CG2 4.27Å; F296-I362 HydrophobicContact CZ-CD1 4.27Å; I358-I362 HydrophobicContact CG2-CD1 4.02Å; I358-I362 WeakPolarHBondContact O-CG1 3.4Å; I358-I362 PolarHBondContact O-N 3.1Å; S359-I362 PolarHBondContact O-N 2.89Å; I362-R364 VanDerWaalsContact C-N 3.32Å; I362-R364 PolarHBondContact O-N 2.88Å; I362-C365 PolarHBondContact O-N 3.45Å; I362-L366 HydrophobicContact CG2-CD1 3.74Å; I362-L366 HydrophobicContact CG2-CG 4.23Å; I362-L366 WeakPolarHBondContact O-CB 3.39Å; I362-L366 WeakPolarHBondContact O-CG 3.37Å; I362-L366 PolarHBondContact O-N 2.82Å
363	L	74.3	Confident	63.9	Low	43 Å²	43	34.9 Å²	34.9	23%	0.225	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-38.1	-180	-72.5	170.5	0	0	0	112.3	S359 S360 L361 S367 T528 A531	S359-L363 WeakPolarHBondContact O-CB 3.28Å; S359-L363 WeakPolarHBondContact O-CG 3.38Å; S359-L363 PolarHBondContact O-N 2.91Å; S360-L363 PolarHBondContact O-N 2.88Å; L361-L363 PolarHBondContact O-N 2.68Å; L363-S367 WeakPolarHBondContact O-CB 3.25Å; L363-S367 PolarHBondContact O-N 2.82Å; L363-S367 PolarHBondContact O-OG 3.32Å; L363-T528 HydrophobicContact CD2-CG2 3.75Å; L363-A531 HydrophobicContact CD2-CB 3.71Å
364	R	71.4	Confident	62.9	Low	78 Å²	78	38.5 Å²	38.5	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-64.9	-53.9	175.3	-179.9	-173.2	174.5	138.7	5.1	110.1	Q218 Y353 S360 L361 I362 L366 S367 T368	Q218-R364 PolarHBondContact O-NH2 3.41Å; Y353-R364 WeakPolarHBondContact OH-CD 3.36Å; Y353-R364 PolarHBondContact OH-NE 3.3Å; Y353-R364 VanDerWaalsContact OH-NE 3.16Å; Y353-R364 PolarHBondContact OH-NH1 3.17Å; S360-R364 WeakPolarHBondContact O-CB 3.43Å; S360-R364 PolarHBondContact O-N 3.4Å; L361-R364 PolarHBondContact O-N 2.94Å; I362-R364 VanDerWaalsContact C-N 3.32Å; I362-R364 PolarHBondContact O-N 2.88Å; R364-L366 VanDerWaalsContact C-N 3.3Å; R364-L366 PolarHBondContact O-N 3.47Å; R364-S367 PolarHBondContact O-N 3.09Å; R364-S367 PolarHBondContact O-OG 3.48Å; R364-T368 PolarHBondContact O-N 3.03Å; R364-T368 VanDerWaalsContact O-N 3.09Å; R364-T368 PolarHBondContact O-OG1 2.91Å
365	C	72	Confident	61.8	Low	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-45.5	178.7	-66.2	0	0	0	0	110.6	D272 C276 L361 I362 S367 T368 C369	D272-C365 HydrophobicContact CB-CB 4.23Å; D272-C365 WeakPolarHBondContact O-CB 3.49Å; C276-C365 HydrophobicContact CB-CB 3.86Å; L361-C365 WeakPolarHBondContact O-CB 3.42Å; L361-C365 PolarHBondContact O-N 3.26Å; L361-C365 PolarHBondContact O-SG 3.42Å; I362-C365 PolarHBondContact O-N 3.45Å; C365-S367 VanDerWaalsContact C-N 3.27Å; C365-S367 PolarHBondContact O-N 2.86Å; C365-T368 PolarHBondContact O-N 3.05Å; C365-T368 PolarHBondContact O-OG1 3.15Å; C365-T368 VanDerWaalsContact O-OG1 3.09Å; C365-C369 PolarHBondContact O-N 3.18Å; C365-C369 PolarHBondContact O-SG 3.06Å
366	L	73.4	Confident	60.6	Low	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.7	-37.5	175.6	-73.8	172	0	0	0	113.2	I362 R364 T368 L418 L499 L503 A531	I362-L366 HydrophobicContact CG2-CD1 3.74Å; I362-L366 HydrophobicContact CG2-CG 4.23Å; I362-L366 WeakPolarHBondContact O-CB 3.39Å; I362-L366 WeakPolarHBondContact O-CG 3.37Å; I362-L366 PolarHBondContact O-N 2.82Å; R364-L366 VanDerWaalsContact C-N 3.3Å; R364-L366 PolarHBondContact O-N 3.47Å; L366-T368 VanDerWaalsContact C-N 3.34Å; L366-L418 HydrophobicContact CD2-CD2 4.08Å; L366-L499 HydrophobicContact CD2-CD2 4.04Å; L366-L499 HydrophobicContact CD2-CG 4.39Å; L366-L503 HydrophobicContact CD1-CD1 3.96Å; L366-L503 HydrophobicContact CD1-CD2 3.77Å; L366-L503 HydrophobicContact CD2-CD2 3.97Å; L366-A531 HydrophobicContact CB-CB 4.13Å
367	S	69.2	Low	59.5	Low	36 Å²	36	40.6 Å²	40.6	25%	0.252	20%	0.201	S	C	.	.	H	α-helix	trans	-74.8	-19.5	177.6	72.8	0	0	0	0	114.2	L363 R364 C365	L363-S367 WeakPolarHBondContact O-CB 3.25Å; L363-S367 PolarHBondContact O-N 2.82Å; L363-S367 PolarHBondContact O-OG 3.32Å; R364-S367 PolarHBondContact O-N 3.09Å; R364-S367 PolarHBondContact O-OG 3.48Å; C365-S367 VanDerWaalsContact C-N 3.27Å; C365-S367 PolarHBondContact O-N 2.86Å
368	T	67.4	Low	57.9	Low	12 Å²	12	43.4 Å²	43.4	7%	0.074	22%	0.219	C	C	.	.	H	α-helix	trans	-104.2	-12.6	180	55.9	0	0	0	0	113.2	D272 R364 C365 L366 T370 E371	D272-T368 WeakPolarHBondContact CB-OG1 3.5Å; D272-T368 VanDerWaalsContact OD2-CB 3.25Å; D272-T368 WeakPolarHBondContact OD2-CB 2.99Å; D272-T368 PolarHBondContact OD2-OG1 3.36Å; R364-T368 PolarHBondContact O-N 3.03Å; R364-T368 VanDerWaalsContact O-N 3.09Å; R364-T368 PolarHBondContact O-OG1 2.91Å; C365-T368 PolarHBondContact O-N 3.05Å; C365-T368 PolarHBondContact O-OG1 3.15Å; C365-T368 VanDerWaalsContact O-OG1 3.09Å; L366-T368 VanDerWaalsContact C-N 3.34Å; T368-T370 PolarHBondContact O-N 2.92Å; T368-E371 PolarHBondContact O-N 2.95Å
369	C	64.8	Low	56.1	Low	6 Å²	6	48.3 Å²	48.3	4%	0.041	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-55.9	-21.8	177.2	-77	0	0	0	0	114.3	S273 C365 L418 L499	S273-C369 VanDerWaalsContact CB-SG 3.58Å; C365-C369 PolarHBondContact O-N 3.18Å; C365-C369 PolarHBondContact O-SG 3.06Å; C369-L418 HydrophobicContact CB-CD1 4.11Å; C369-L499 HydrophobicContact CB-CD2 4.2Å; C369-L499 WeakPolarHBondContact SG-CD2 3.3Å
370	T	57	Low	54.2	Low	17 Å²	17	53.1 Å²	53.1	10%	0.104	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-94.8	0.8	-172.1	61.6	0	0	0	0	115.9	T368 F372 Q373 G416 G417	T368-T370 PolarHBondContact O-N 2.92Å; T370-F372 PolarHBondContact O-N 3.01Å; T370-F372 VanDerWaalsContact O-N 3.07Å; T370-Q373 PolarHBondContact O-N 3.31Å; T370-G416 PolarHBondContact OG1-O 3.47Å; T370-G417 VanDerWaalsContact CG2-C 3.49Å; T370-G417 WeakPolarHBondContact CG2-O 3.37Å
371	E	51.9	Low	52.4	Low	53 Å²	53	58.4 Å²	58.4	25%	0.248	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-63.3	-15.8	176.6	-61.3	-134.5	130.9	0	0	113	T368 Q373 R374 V375	T368-E371 PolarHBondContact O-N 2.95Å; E371-Q373 PolarHBondContact O-N 3.11Å; E371-R374 PolarHBondContact O-N 2.87Å; E371-R374 IonicContact OE1-CZ 3.24Å; E371-R374 VanDerWaalsContact OE1-CZ 3.24Å; E371-R374 IonicContact OE1-NH1 3.4Å; E371-R374 PolarHBondContact OE1-NH1 3.23Å; E371-R374 IonicContact OE1-NH2 2.81Å; E371-R374 PolarHBondContact OE1-NH2 2.8Å; E371-V375 PolarHBondContact O-N 3.43Å
372	F	45.1	Very low	50.4	Low	78 Å²	78	64.8 Å²	64.8	34%	0.342	32%	0.322	S	S	.	.	H	α-helix	trans	-54.7	-32.8	173.4	-104.9	-90.4	0	0	0	113.8	Y268 N270 T370	Y268-F372 WeakPolarHBondContact O-CE1 2.9Å; Y268-F372 WeakPolarHBondContact O-CZ 3.19Å; N270-F372 HydrophobicContact CB-CD2 4.21Å; N270-F372 HydrophobicContact CB-CE2 3.83Å; T370-F372 PolarHBondContact O-N 3.01Å; T370-F372 VanDerWaalsContact O-N 3.07Å
373	Q	45.5	Very low	48.2	Very low	53 Å²	53	68.7 Å²	68.7	25%	0.248	35%	0.349	C	S	.	.	H	α-helix	trans	-80.2	-23.3	177.9	-117.3	171.7	-7.8	0	0	113.2	T370 E371 Q377	T370-Q373 PolarHBondContact O-N 3.31Å; E371-Q373 PolarHBondContact O-N 3.11Å; Q373-Q377 WeakPolarHBondContact O-CB 3.36Å; Q373-Q377 WeakPolarHBondContact O-CG 3.11Å; Q373-Q377 PolarHBondContact O-NE2 3.39Å
374	R	38.6	Very low	46	Very low	114 Å²	114	72.4 Å²	72.4	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-81	-41.6	178.9	-91	-173.2	-83.6	130.7	3.5	112	E371 Q377 V378	E371-R374 PolarHBondContact O-N 2.87Å; E371-R374 IonicContact OE1-CZ 3.24Å; E371-R374 VanDerWaalsContact OE1-CZ 3.24Å; E371-R374 IonicContact OE1-NH1 3.4Å; E371-R374 PolarHBondContact OE1-NH1 3.23Å; E371-R374 IonicContact OE1-NH2 2.81Å; E371-R374 PolarHBondContact OE1-NH2 2.8Å; R374-Q377 PolarHBondContact O-N 3.02Å; R374-V378 WeakPolarHBondContact O-CG2 2.98Å; R374-V378 PolarHBondContact O-N 3.34Å
375	V	33.3	Very low	43.9	Very low	84 Å²	84	74.9 Å²	74.9	51%	0.509	40%	0.398	S	S	.	.	H	α-helix	trans	-70	-40	-176.7	-177.5	0	0	0	0	112	E371 Q377 V378 L379	E371-V375 PolarHBondContact O-N 3.43Å; V375-Q377 PolarHBondContact O-N 3.03Å; V375-V378 PolarHBondContact O-N 3.35Å; V375-L379 HydrophobicContact CG1-CD1 3.97Å; V375-L379 WeakPolarHBondContact O-CG 3.49Å; V375-L379 PolarHBondContact O-N 3.3Å
376	H	33.6	Very low	42	Very low	114 Å²	114	80.9 Å²	80.9	53%	0.528	43%	0.434	S	S	.	.	H	α-helix	trans	-75	-20.9	177.6	-104.4	-75	0	0	0	114.5
377	Q	32.4	Very low	39.9	Very low	60 Å²	60	88.3 Å²	88.3	28%	0.28	47%	0.474	S	S	.	.	H	α-helix	trans	-79.3	-30.8	174.2	-77	175.2	60.6	0	0	112.1	Q373 R374 V375 F381	Q373-Q377 WeakPolarHBondContact O-CB 3.36Å; Q373-Q377 WeakPolarHBondContact O-CG 3.11Å; Q373-Q377 PolarHBondContact O-NE2 3.39Å; R374-Q377 PolarHBondContact O-N 3.02Å; V375-Q377 PolarHBondContact O-N 3.03Å; Q377-F381 WeakPolarHBondContact O-CD2 3.12Å
378	V	31.1	Very low	37.9	Very low	95 Å²	95	91.9 Å²	91.9	58%	0.576	50%	0.499	S	S	*	.	H	α-helix	trans	-75	-38.6	176.2	176.6	0	0	0	0	110.7	R374 V375 N380	R374-V378 WeakPolarHBondContact O-CG2 2.98Å; R374-V378 PolarHBondContact O-N 3.34Å; V375-V378 PolarHBondContact O-N 3.35Å; V378-N380 PolarHBondContact O-N 3.39Å
379	L	29.9	Very low	36.2	Very low	111 Å²	111	96.5 Å²	96.5	58%	0.581	53%	0.529	S	S	*	.	H	α-helix	trans	-76.1	-21.1	-176.7	-67.5	170.6	0	0	0	115	V375	V375-L379 HydrophobicContact CG1-CD1 3.97Å; V375-L379 WeakPolarHBondContact O-CG 3.49Å; V375-L379 PolarHBondContact O-N 3.3Å
380	N	31.4	Very low	34.4	Very low	115 Å²	115	103 Å²	103	62%	0.615	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-6.8	179.2	-82.3	-6.4	0	0	0	114.2	V378	V378-N380 PolarHBondContact O-N 3.39Å
381	F	30.3	Very low	33.1	Very low	156 Å²	156	113.3 Å²	113.3	68%	0.684	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-14.5	175.4	-92.9	-86.1	0	0	0	113.3	Q377	Q377-F381 WeakPolarHBondContact O-CD2 3.12Å
382	D	30.6	Very low	31.9	Very low	135 Å²	135	114.8 Å²	114.8	72%	0.722	62%	0.617	S	S	*	*	S	Bend	trans	-100.5	5.8	-176.2	-80.8	-21.7	0	0	0	114.5
383	S	28.3	Very low	31.4	Very low	83 Å²	83	119.7 Å²	119.7	58%	0.58	64%	0.64	S	S	*	*	S	Bend	trans	-113.9	16.6	-171.3	62.9	0	0	0	0	116.5
384	T	29.1	Very low	30.6	Very low	120 Å²	120	124.6 Å²	124.6	74%	0.736	66%	0.663	S	S	*	*			trans	-122.9	71	168.1	60.3	0	0	0	0	111.4	V386	T384-V386 PolarHBondContact O-N 3.24Å
385	T	26.6	Very low	30.3	Very low	131 Å²	131	126.6 Å²	126.6	80%	0.804	68%	0.682	S	S	*	*			trans	-71.5	105.1	154.9	48.7	0	0	0	0	108.5
386	V	32.2	Very low	30.2	Very low	126 Å²	126	130.4 Å²	130.4	76%	0.764	69%	0.694	S	S	*	*			trans	-132.5	96.2	162.7	-173.8	0	0	0	0	107.7	T384	T384-V386 PolarHBondContact O-N 3.24Å
387	D	29.4	Very low	30	Very low	155 Å²	155	131.2 Å²	131.2	83%	0.829	71%	0.708	S	S	*	*			trans	34.4	113.7	145.2	-57.6	-30.1	0	0	0	120
388	S	26.2	Very low	29.8	Very low	111 Å²	111	134 Å²	134	78%	0.776	73%	0.729	S	S	*	*			trans	-66.4	171.1	162.4	-41.3	0	0	0	0	111.8
389	P	32.4	Very low	29.7	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	74%	0.736	S	S	*	*				-154	146.2	72.8	36.4	-14	0	0	0	118.4
390	I	26.8	Very low	29.6	Very low	142 Å²	142	137.2 Å²	137.2	73%	0.728	75%	0.748	S	S	*	*				39.1	112.3	125.7	-47.5	169.2	0	0	0	117.9
391	Y	30.2	Very low	29.7	Very low	234 Å²	234	137.9 Å²	137.9	92%	0.918	76%	0.756	S	S	*	*			trans	-144.4	115.7	135	-106.1	-81.9	0	0	0	110.8
392	S	26.2	Very low	29.5	Very low	84 Å²	84	137.9 Å²	137.9	59%	0.587	76%	0.763	S	S	*	*			trans	-77.5	143.1	170.4	48.5	0	0	0	0	111.5
393	H	35.4	Very low	29.5	Very low	180 Å²	180	138.4 Å²	138.4	83%	0.833	77%	0.766	S	S	*	*				-166.9	138.7	126.3	-108	-72.1	0	0	0	112.4
394	H	29.4	Very low	29.5	Very low	157 Å²	157	139.4 Å²	139.4	73%	0.727	77%	0.77	S	S	*	*			trans	-40.9	140	175.9	-87.7	-49.2	0	0	0	116.6
395	D	32.3	Very low	29.4	Very low	155 Å²	155	143.1 Å²	143.1	83%	0.829	77%	0.772	S	S	*	*				-165.6	149.5	97.5	-99.3	-28.4	0	0	0	112.9
396	Q	30.6	Very low	29.4	Very low	165 Å²	165	141.7 Å²	141.7	77%	0.771	77%	0.768	S	S	*	*			trans	-61.4	135.2	-173.7	-64.7	165.7	0.9	0	0	112.2
397	T	28.3	Very low	29.3	Very low	131 Å²	131	146.2 Å²	146.2	80%	0.804	77%	0.772	S	S	*	*			trans	164.1	145	134	36.6	0	0	0	0	112.3
398	T	29.1	Very low	29.1	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.724	77%	0.767	S	S	*	*			trans	87.2	106.4	149.2	60.7	0	0	0	0	122
399	T	29.2	Very low	29.2	Very low	118 Å²	118	147.4 Å²	147.4	72%	0.724	77%	0.77	S	S	*	*				74.5	120.1	120.9	63	0	0	0	0	122.3
400	N	26.7	Very low	28.9	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	78%	0.779	S	S	*	*			trans	37	100.5	136.8	-79.2	-12.9	0	0	0	118.5
401	T	33.5	Very low	29	Very low	130 Å²	130	147.2 Å²	147.2	80%	0.798	78%	0.78	S	S	*	*			trans	-121.2	95.5	159.2	50.5	0	0	0	0	110.4	N403	T401-N403 PolarHBondContact O-N 3.25Å; T401-N403 VanDerWaalsContact O-N 3.16Å
402	N	27.9	Very low	28.9	Very low	155 Å²	155	145.2 Å²	145.2	83%	0.829	77%	0.773	S	S	*	*			trans	-56.4	110.5	161.8	-75.3	-38.6	0	0	0	109.2	P404	N402-P404 WeakPolarHBondContact O-CD 3.43Å
403	N	28.6	Very low	29.2	Very low	147 Å²	147	150.1 Å²	150.1	79%	0.786	79%	0.786	S	S	*	*			trans	-99.7	103.6	166.1	-112	-10.7	0	0	0	108.5	T401 Y405	T401-N403 PolarHBondContact O-N 3.25Å; T401-N403 VanDerWaalsContact O-N 3.16Å; N403-Y405 PolarHBondContact O-N 3.45Å; N403-Y405 VanDerWaalsContact O-N 3.13Å
404	P	28.6	Very low	29.6	Very low	103 Å²	103	148.4 Å²	148.4	67%	0.669	78%	0.778	S	S	*	*			trans	-83.7	24.6	-173.6	34.4	-34.3	0	0	0	113.9	N402	N402-P404 WeakPolarHBondContact O-CD 3.43Å
405	Y	28.2	Very low	30.5	Very low	199 Å²	199	144.4 Å²	144.4	78%	0.78	77%	0.765	S	S	*	*			trans	-131	63	-177.6	-63.7	-71.2	0	0	0	111.8	N403	N403-Y405 PolarHBondContact O-N 3.45Å; N403-Y405 VanDerWaalsContact O-N 3.13Å
406	S	26.2	Very low	31.7	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	74%	0.737	S	S	*	*			trans	-100.8	99.9	160.5	-174.6	0	0	0	0	108.3	N408	S406-N408 PolarHBondContact O-N 2.69Å
407	Y	29.6	Very low	33.3	Very low	221 Å²	221	130.6 Å²	130.6	87%	0.867	70%	0.703	S	S	*	*			trans	-89.6	79.6	170.8	-98.7	-90.5	0	0	0	108.8
408	N	25.3	Very low	35.5	Very low	134 Å²	134	124.4 Å²	124.4	72%	0.717	67%	0.665	S	S	*	*			trans	-108.3	110.3	157.1	-87.7	-19.7	0	0	0	106.4	S406	S406-N408 PolarHBondContact O-N 2.69Å
409	D	29.2	Very low	37.6	Very low	157 Å²	157	118.9 Å²	118.9	84%	0.84	63%	0.631	S	S	*	*			trans	165.4	92.1	147.6	-82.8	-17.7	0	0	0	111.7	E411	D409-E411 VanDerWaalsContact C-N 3.29Å; D409-E411 PolarHBondContact O-N 2.87Å
410	G	26.5	Very low	39.4	Very low	88 Å²	88	114.2 Å²	114.2	91%	0.907	60%	0.603	S	S	*	*				55.8	-7.7	118.2	0	0	0	0	0	123.8
411	E	27.3	Very low	41.4	Very low	160 Å²	160	110 Å²	110	75%	0.748	58%	0.581	S	S	*	*	S	Bend	trans	-136.2	103.7	-173.2	-66.3	-168.5	152.4	0	0	112.4	D409	D409-E411 VanDerWaalsContact C-N 3.29Å; D409-E411 PolarHBondContact O-N 2.87Å
412	Y	28.8	Very low	42.9	Very low	193 Å²	193	107 Å²	107	76%	0.757	56%	0.557	S	S	*	*			trans	76.3	65.4	-177.4	-57.9	-86.3	0	0	0	115.9	Q414	Y412-Q414 PolarHBondContact O-N 3.23Å
413	Q	32.4	Very low	44.9	Very low	186 Å²	186	99.6 Å²	99.6	87%	0.869	52%	0.518	S	S	*	.			trans	-54.3	126.8	153.5	-76.2	175.2	-13.6	0	0	108.4	T415	Q413-T415 PolarHBondContact O-N 2.97Å
414	Q	44.2	Very low	47.1	Very low	144 Å²	144	92.8 Å²	92.8	67%	0.673	48%	0.482	S	S	*	.			trans	-40.4	101	-178.1	-69.7	167.9	-20.8	0	0	112.2	Y412 G416	Y412-Q414 PolarHBondContact O-N 3.23Å; Q414-G416 VanDerWaalsContact C-N 3.33Å; Q414-G416 PolarHBondContact O-N 3.42Å
415	T	48.9	Very low	49.1	Very low	74 Å²	74	89.5 Å²	89.5	45%	0.454	46%	0.459	S	S	.	.			trans	-70.5	96	166.6	52.9	0	0	0	0	106.9	Q413 G417	Q413-T415 PolarHBondContact O-N 2.97Å; T415-G417 PolarHBondContact O-N 2.88Å
416	G	56.4	Low	51.1	Low	23 Å²	23	81.7 Å²	81.7	24%	0.237	43%	0.43	C	S	.	.			trans	-62.9	117.1	-179.4	0	0	0	0	0	110.4	T370 Q414	T370-G416 PolarHBondContact OG1-O 3.47Å; Q414-G416 VanDerWaalsContact C-N 3.33Å; Q414-G416 PolarHBondContact O-N 3.42Å
417	G	64.5	Low	53.6	Low	6 Å²	6	76.9 Å²	76.9	6%	0.062	40%	0.397	C	S	.	.			trans	-76	162.7	167.6	0	0	0	0	0	110.9	T370 T415 I419 A531 V532	T370-G417 VanDerWaalsContact CG2-C 3.49Å; T370-G417 WeakPolarHBondContact CG2-O 3.37Å; T415-G417 PolarHBondContact O-N 2.88Å; G417-I419 CarbonylContact O-C 3.57Å; G417-I419 PolarHBondContact O-N 3Å; G417-A531 WeakPolarHBondContact CA-O 3.36Å; G417-V532 CarbonylContact C-O 3.58Å
418	L	73.8	Confident	56	Low	1 Å²	1	66.6 Å²	66.6	1%	0.005	36%	0.357	C	S	.	.	S	Bend	trans	-44.5	-36.5	178.9	-175.6	61	0	0	0	114	L366 C369 E496 L499 L500 A531 V532	L366-L418 HydrophobicContact CD2-CD2 4.08Å; C369-L418 HydrophobicContact CB-CD1 4.11Å; L418-E496 HydrophobicContact CD1-CB 3.95Å; L418-E496 HydrophobicContact CD1-CG 4.12Å; L418-L499 HydrophobicContact CD1-CD2 3.88Å; L418-L499 HydrophobicContact CD2-CD2 4.46Å; L418-L500 HydrophobicContact CD2-CB 3.82Å; L418-L500 HydrophobicContact CD2-CD1 4.05Å; L418-A531 PolarHBondContact N-O 2.61Å; L418-A531 VanDerWaalsContact N-O 3.12Å; L418-V532 PolarHBondContact N-O 3.31Å; L418-V532 VanDerWaalsContact N-O 3.07Å
419	I	73.2	Confident	58.2	Low	2 Å²	2	61.1 Å²	61.1	1%	0.01	33%	0.327	C	S	.	.	S	Bend	trans	-97.4	123.2	179.7	-58.6	-178.3	0	0	0	109.2	G417 A423 L427 L492 L500 V532 F533	G417-I419 CarbonylContact O-C 3.57Å; G417-I419 PolarHBondContact O-N 3Å; I419-A423 HydrophobicContact CG2-CB 3.61Å; I419-L427 HydrophobicContact CD1-CD1 3.84Å; I419-L427 HydrophobicContact CG2-CD1 4.22Å; I419-L492 HydrophobicContact CG1-CD2 4.34Å; I419-L492 HydrophobicContact CG2-CD1 4.26Å; I419-L500 HydrophobicContact CD1-CD1 4.22Å; I419-L500 HydrophobicContact CD1-CD2 3.79Å; I419-L500 HydrophobicContact CG1-CD2 4.17Å; I419-V532 HydrophobicContact CD1-CG1 3.64Å; I419-V532 HydrophobicContact CG1-CG1 3.97Å; I419-V532 PolarHBondContact N-O 2.94Å; I419-F533 HydrophobicContact CB-CD1 4.23Å; I419-F533 HydrophobicContact CD1-CD1 4.09Å; I419-F533 HydrophobicContact CD1-CE1 3.63Å; I419-F533 HydrophobicContact CD1-CZ 4.29Å; I419-F533 HydrophobicContact CG2-CD1 4.45Å
420	P	68.3	Low	60.3	Low	20 Å²	20	53.6 Å²	53.6	13%	0.13	29%	0.287	C	S	.	.			trans	-52.5	145.3	172.2	-25.7	33.9	0	0	0	111.8	E422 A423 G424	P420-E422 WeakPolarHBondContact CB-OE2 3.49Å; P420-E422 PolarHBondContact O-N 3.33Å; P420-E422 VanDerWaalsContact O-N 3.11Å; P420-A423 PolarHBondContact O-N 2.88Å; P420-G424 PolarHBondContact O-N 3.26Å
421	L	67.4	Low	62.6	Low	68 Å²	68	49.6 Å²	49.6	36%	0.356	25%	0.245	S	C	.	.	H	α-helix	trans	-55.1	-37.1	-174.2	-175.9	68.1	0	0	0	112.1	G424 N425 L537	L421-G424 PolarHBondContact O-N 3.49Å; L421-N425 PolarHBondContact O-N 3.27Å; L421-N425 PolarHBondContact O-ND2 3.25Å; L421-L537 HydrophobicContact CD2-CD1 3.98Å
422	E	65.4	Low	64.6	Low	65 Å²	65	43.7 Å²	43.7	30%	0.304	22%	0.218	S	C	.	.	H	α-helix	trans	-63.3	-45.9	178.5	-58	83.1	175.7	0	0	112	T2 I7 P420 N425 L426	T2-E422 PolarHBondContact OG1-OE1 3.21Å; I7-E422 HydrophobicContact CD1-CG 3.62Å; I7-E422 HydrophobicContact CG1-CG 4.24Å; P420-E422 WeakPolarHBondContact CB-OE2 3.49Å; P420-E422 PolarHBondContact O-N 3.33Å; P420-E422 VanDerWaalsContact O-N 3.11Å; E422-N425 PolarHBondContact O-N 3.38Å; E422-L426 PolarHBondContact O-N 3.3Å
423	A	71.2	Confident	66.2	Low	1 Å²	1	34.9 Å²	34.9	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-39.9	176.1	0	0	0	0	0	111.1	I419 P420 N425 L426 L427 V487 L491 L492	I419-A423 HydrophobicContact CG2-CB 3.61Å; P420-A423 PolarHBondContact O-N 2.88Å; A423-N425 PolarHBondContact O-N 3.31Å; A423-L426 PolarHBondContact O-N 3Å; A423-L427 WeakPolarHBondContact O-CG 3.47Å; A423-L427 PolarHBondContact O-N 3.05Å; A423-V487 HydrophobicContact CB-CG1 4.22Å; A423-L491 HydrophobicContact CB-CB 3.91Å; A423-L491 HydrophobicContact CB-CD1 4.45Å; A423-L492 HydrophobicContact CB-CD1 3.8Å
424	G	74.2	Confident	67.6	Low	3 Å²	3	27.7 Å²	27.7	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-57.2	-46.7	174.9	0	0	0	0	0	112.1	P420 L421 L426 L427 F428	P420-G424 PolarHBondContact O-N 3.26Å; L421-G424 PolarHBondContact O-N 3.49Å; G424-L426 PolarHBondContact O-N 2.72Å; G424-L427 WeakPolarHBondContact O-CB 2.97Å; G424-L427 PolarHBondContact O-N 3.43Å; G424-F428 WeakPolarHBondContact O-CD1 3.46Å; G424-F428 WeakPolarHBondContact O-CD2 3.36Å; G424-F428 WeakPolarHBondContact O-CE2 3.4Å; G424-F428 WeakPolarHBondContact O-CG 3.46Å; G424-F428 PolarHBondContact O-N 3.38Å
425	N	70.3	Confident	67.8	Low	34 Å²	34	25.8 Å²	25.8	18%	0.182	14%	0.137	C	C	.	.	H	α-helix	trans	-60.3	-42.9	178.8	-70	-21.6	0	0	0	112.7	L421 E422 A423 F428 L429 T575	L421-N425 PolarHBondContact O-N 3.27Å; L421-N425 PolarHBondContact O-ND2 3.25Å; E422-N425 PolarHBondContact O-N 3.38Å; A423-N425 PolarHBondContact O-N 3.31Å; N425-F428 PolarHBondContact O-N 2.84Å; N425-L429 WeakPolarHBondContact O-CG 3.03Å; N425-L429 PolarHBondContact O-N 3.14Å; N425-L429 VanDerWaalsContact O-N 3.09Å; N425-T575 HydrophobicContact CB-CG2 4.33Å; N425-T575 WeakPolarHBondContact OD1-CB 3.29Å; N425-T575 VanDerWaalsContact OD1-CG2 3.26Å; N425-T575 WeakPolarHBondContact OD1-CG2 3.38Å
426	L	71	Confident	67.9	Low	35 Å²	35	25.9 Å²	25.9	18%	0.183	13%	0.132	C	C	.	.	H	α-helix	trans	-67.3	-35.6	176.3	-73	168.7	0	0	0	112.5	F42 E422 A423 G424 L429 A430 V487 L491	F42-L426 HydrophobicContact CD1-CD2 4.39Å; F42-L426 HydrophobicContact CG-CD2 4.37Å; E422-L426 PolarHBondContact O-N 3.3Å; A423-L426 PolarHBondContact O-N 3Å; G424-L426 PolarHBondContact O-N 2.72Å; L426-L429 HydrophobicContact CD2-CD1 4.3Å; L426-L429 PolarHBondContact O-N 3.33Å; L426-A430 WeakPolarHBondContact O-CB 3.21Å; L426-A430 PolarHBondContact O-N 3.47Å; L426-V487 HydrophobicContact CB-CG1 4.35Å; L426-V487 HydrophobicContact CB-CG2 3.81Å; L426-L491 HydrophobicContact CD1-CD1 3.33Å
427	L	78.6	Confident	67.3	Low	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-40.8	172.2	-67.4	170.1	0	0	0	111.6	I419 A423 G424 L429 A430 T431 Y484 V487 L488 F533 T584 L588	I419-L427 HydrophobicContact CD1-CD1 3.84Å; I419-L427 HydrophobicContact CG2-CD1 4.22Å; A423-L427 WeakPolarHBondContact O-CG 3.47Å; A423-L427 PolarHBondContact O-N 3.05Å; G424-L427 WeakPolarHBondContact O-CB 2.97Å; G424-L427 PolarHBondContact O-N 3.43Å; L427-L429 VanDerWaalsContact C-N 3.29Å; L427-L429 PolarHBondContact O-N 2.94Å; L427-A430 PolarHBondContact O-N 3.03Å; L427-T431 PolarHBondContact O-N 3.35Å; L427-T431 PolarHBondContact O-OG1 2.91Å; L427-Y484 HydrophobicContact CB-CE1 4.49Å; L427-Y484 HydrophobicContact CD2-CD1 3.46Å; L427-Y484 VanDerWaalsContact CD2-CD1 3.46Å; L427-Y484 HydrophobicContact CD2-CE1 4.06Å; L427-Y484 HydrophobicContact CD2-CG 4.25Å; L427-V487 HydrophobicContact CD1-CG1 4.38Å; L427-V487 HydrophobicContact CD2-CB 3.96Å; L427-V487 HydrophobicContact CD2-CG1 3.7Å; L427-V487 HydrophobicContact CG-CB 4.45Å; L427-V487 HydrophobicContact CG-CG1 3.68Å; L427-L488 HydrophobicContact CD1-CD2 4.28Å; L427-L488 HydrophobicContact CD2-CD2 4.5Å; L427-F533 HydrophobicContact CD1-CE1 3.94Å; L427-T584 HydrophobicContact CB-CG2 3.7Å; L427-L588 HydrophobicContact CD1-CD1 4.29Å
428	F	79	Confident	66.3	Low	4 Å²	4	36.1 Å²	36.1	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-40.3	176.3	-54.4	-30.9	0	0	0	111.3	G424 N425 T431 E432 F533 R581 T584	G424-F428 WeakPolarHBondContact O-CD1 3.46Å; G424-F428 WeakPolarHBondContact O-CD2 3.36Å; G424-F428 WeakPolarHBondContact O-CE2 3.4Å; G424-F428 WeakPolarHBondContact O-CG 3.46Å; G424-F428 PolarHBondContact O-N 3.38Å; N425-F428 PolarHBondContact O-N 2.84Å; F428-T431 WeakPolarHBondContact O-CB 3.27Å; F428-T431 PolarHBondContact O-N 2.81Å; F428-E432 PolarHBondContact O-N 3.28Å; F428-F533 AromaticContact CE1-CD1 3.78Å; F428-F533 HydrophobicContact CE1-CD1 3.78Å; F428-F533 HydrophobicContact CE1-CD2 4.1Å; F428-F533 AromaticContact CE1-CE1 3.74Å; F428-F533 HydrophobicContact CE1-CE1 3.74Å; F428-F533 HydrophobicContact CE1-CE2 4.03Å; F428-F533 AromaticContact CE1-CG 3.96Å; F428-F533 HydrophobicContact CE1-CG 3.96Å; F428-F533 AromaticContact CE1-CZ 3.89Å; F428-F533 HydrophobicContact CE1-CZ 3.89Å; F428-F533 HydrophobicContact CZ-CB 4.14Å; F428-F533 AromaticContact CZ-CD1 3.71Å; F428-F533 HydrophobicContact CZ-CD1 3.71Å; F428-F533 HydrophobicContact CZ-CD2 4.35Å; F428-F533 HydrophobicContact CZ-CE1 4.14Å; F428-F533 AromaticContact CZ-CG 3.84Å; F428-F533 HydrophobicContact CZ-CG 3.84Å; F428-R581 HydrophobicContact CE1-CB 4.28Å; F428-R581 HydrophobicContact CE1-CG 3.77Å; F428-R581 HydrophobicContact CE2-CG 4.27Å; F428-R581 HydrophobicContact CZ-CG 3.58Å; F428-T584 HydrophobicContact CD1-CG2 4.07Å; F428-T584 WeakPolarHBondContact CD1-OG1 3.4Å; F428-T584 HydrophobicContact CE1-CG2 4.39Å
429	L	71	Confident	64.6	Low	19 Å²	19	39.8 Å²	39.8	10%	0.099	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-42.9	174.8	-69.8	163.1	0	0	0	112.7	P39 N425 L426 L427 T431 E432 F571	P39-L429 HydrophobicContact CB-CD1 3.59Å; P39-L429 HydrophobicContact CB-CD2 3.93Å; P39-L429 HydrophobicContact CB-CG 4.32Å; N425-L429 WeakPolarHBondContact O-CG 3.03Å; N425-L429 PolarHBondContact O-N 3.14Å; N425-L429 VanDerWaalsContact O-N 3.09Å; L426-L429 HydrophobicContact CD2-CD1 4.3Å; L426-L429 PolarHBondContact O-N 3.33Å; L427-L429 VanDerWaalsContact C-N 3.29Å; L427-L429 PolarHBondContact O-N 2.94Å; L429-T431 PolarHBondContact O-N 3.45Å; L429-E432 WeakPolarHBondContact O-CB 3.31Å; L429-E432 PolarHBondContact O-N 2.86Å; L429-E432 VanDerWaalsContact O-N 3.12Å; L429-F571 HydrophobicContact CD1-CE2 4Å; L429-F571 HydrophobicContact CD1-CZ 3.99Å; L429-F571 HydrophobicContact CD2-CE2 3.89Å; L429-F571 HydrophobicContact CG-CE2 4.36Å
430	A	73.1	Confident	63	Low	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-28.4	174.4	0	0	0	0	0	112.1	L426 L427 L433 Q480 A483 Y484	L426-A430 WeakPolarHBondContact O-CB 3.21Å; L426-A430 PolarHBondContact O-N 3.47Å; L427-A430 PolarHBondContact O-N 3.03Å; A430-L433 HydrophobicContact CB-CD1 4.49Å; A430-L433 VanDerWaalsContact O-CB 3.29Å; A430-L433 WeakPolarHBondContact O-CB 3.33Å; A430-L433 WeakPolarHBondContact O-CD1 3.29Å; A430-L433 WeakPolarHBondContact O-CG 3.48Å; A430-L433 PolarHBondContact O-N 3.4Å; A430-Q480 WeakPolarHBondContact O-CG 3.35Å; A430-A483 HydrophobicContact CB-CB 3.75Å; A430-Y484 HydrophobicContact CB-CD1 3.67Å; A430-Y484 HydrophobicContact CB-CE1 3.62Å
431	T	75.5	Confident	61.5	Low	4 Å²	4	47.3 Å²	47.3	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-71.1	-31.4	177	-48.9	0	0	0	0	112.2	L427 F428 L429 L433 Q434 Y435 Y484 D583 T584 N587	L427-T431 PolarHBondContact O-N 3.35Å; L427-T431 PolarHBondContact O-OG1 2.91Å; F428-T431 WeakPolarHBondContact O-CB 3.27Å; F428-T431 PolarHBondContact O-N 2.81Å; L429-T431 PolarHBondContact O-N 3.45Å; T431-L433 PolarHBondContact O-N 2.91Å; T431-Q434 PolarHBondContact O-N 2.8Å; T431-Y435 HydrophobicContact CG2-CD2 4.19Å; T431-Y435 HydrophobicContact CG2-CE2 3.66Å; T431-Y435 WeakPolarHBondContact O-CD2 3.48Å; T431-Y484 WeakPolarHBondContact CB-OH 3.37Å; T431-Y484 PolarHBondContact OG1-OH 2.84Å; T431-D583 HydrophobicContact CG2-CB 4.43Å; T431-T584 WeakPolarHBondContact CB-OG1 3.21Å; T431-T584 WeakPolarHBondContact OG1-CB 3.44Å; T431-T584 WeakPolarHBondContact OG1-CG2 3.42Å; T431-T584 PolarHBondContact OG1-OG1 3.12Å; T431-N587 VanDerWaalsContact CG2-ND2 3.31Å; T431-N587 WeakPolarHBondContact CG2-ND2 3.09Å
432	E	68.6	Low	60	Low	36 Å²	36	49.2 Å²	49.2	17%	0.168	27%	0.266	C	S	.	.	H	α-helix	trans	-58.8	-21.9	175.1	-77.2	-168.1	-143.6	0	0	113.9	F428 L429 Q434 Y435 K436 Y574	F428-E432 PolarHBondContact O-N 3.28Å; L429-E432 WeakPolarHBondContact O-CB 3.31Å; L429-E432 PolarHBondContact O-N 2.86Å; L429-E432 VanDerWaalsContact O-N 3.12Å; E432-Q434 PolarHBondContact O-N 3.48Å; E432-Q434 VanDerWaalsContact O-N 3.09Å; E432-Y435 PolarHBondContact O-N 3.09Å; E432-K436 IonicContact OE2-NZ 3.03Å; E432-K436 PolarHBondContact OE2-NZ 3.22Å; E432-Y574 VanDerWaalsContact CD-CZ 3.44Å; E432-Y574 HydrophobicContact CG-CE1 4.1Å; E432-Y574 WeakPolarHBondContact CG-OH 3.44Å; E432-Y574 WeakPolarHBondContact OE1-CE1 3.31Å; E432-Y574 WeakPolarHBondContact OE1-CE2 3.39Å; E432-Y574 PolarHBondContact OE1-OH 3.34Å
433	L	63.3	Low	58.6	Low	8 Å²	8	50.5 Å²	50.5	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-18.7	-178.7	-53.5	175.9	0	0	0	112.8	L43 A430 T431 R479 Q480 A483	L43-L433 HydrophobicContact CD1-CD2 3.61Å; L43-L433 HydrophobicContact CD2-CD1 3.61Å; L43-L433 HydrophobicContact CD2-CD2 3.31Å; L43-L433 HydrophobicContact CD2-CG 3.9Å; L43-L433 HydrophobicContact CG-CD2 4.01Å; A430-L433 HydrophobicContact CB-CD1 4.49Å; A430-L433 VanDerWaalsContact O-CB 3.29Å; A430-L433 WeakPolarHBondContact O-CB 3.33Å; A430-L433 WeakPolarHBondContact O-CD1 3.29Å; A430-L433 WeakPolarHBondContact O-CG 3.48Å; A430-L433 PolarHBondContact O-N 3.4Å; T431-L433 PolarHBondContact O-N 2.91Å; L433-R479 HydrophobicContact CD1-CG 4.08Å; L433-Q480 HydrophobicContact CB-CB 4.34Å; L433-Q480 HydrophobicContact CD1-CB 4.3Å; L433-A483 HydrophobicContact CD1-CB 4.38Å
434	Q	61.6	Low	56.9	Low	35 Å²	35	56 Å²	56	16%	0.164	32%	0.321	C	S	.	.	H	α-helix	trans	-96.7	-36.7	174.1	-78.3	-176.9	-31.1	0	0	114.5	T431 E432 K436 L437 Q480 N587 M591	T431-Q434 PolarHBondContact O-N 2.8Å; E432-Q434 PolarHBondContact O-N 3.48Å; E432-Q434 VanDerWaalsContact O-N 3.09Å; Q434-K436 PolarHBondContact O-N 2.67Å; Q434-L437 PolarHBondContact O-N 3.06Å; Q434-Q480 VanDerWaalsContact CD-CD 3.43Å; Q434-Q480 VanDerWaalsContact OE1-NE2 3.11Å; Q434-N587 PolarHBondContact OE1-ND2 3.25Å; Q434-N587 PolarHBondContact OE1-OD1 3.12Å; Q434-M591 VanDerWaalsContact NE2-CE 3.25Å
435	Y	49.3	Very low	54.8	Low	103 Å²	103	61.2 Å²	61.2	40%	0.404	36%	0.357	S	S	.	.	H	α-helix	trans	-66.9	-14.1	-166.7	-83.8	-78.6	0	0	0	114.7	T431 E432 D583	T431-Y435 HydrophobicContact CG2-CD2 4.19Å; T431-Y435 HydrophobicContact CG2-CE2 3.66Å; T431-Y435 WeakPolarHBondContact O-CD2 3.48Å; E432-Y435 PolarHBondContact O-N 3.09Å; Y435-D583 HydrophobicContact CE2-CB 4.03Å; Y435-D583 WeakPolarHBondContact OH-CB 3.32Å; Y435-D583 PolarHBondContact OH-OD1 2.99Å; Y435-D583 VanDerWaalsContact OH-OD1 3.05Å; Y435-D583 PolarHBondContact OH-OD2 3.49Å; Y435-D583 VanDerWaalsContact OH-OD2 3.1Å
436	K	49.6	Very low	53	Low	77 Å²	77	64.5 Å²	64.5	34%	0.335	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-3.6	-172.9	-69.9	162.4	161	173.1	0	114.2	L72 E432 Q434	L72-K436 HydrophobicContact CD1-CB 4Å; L72-K436 HydrophobicContact CD1-CD 3.24Å; L72-K436 HydrophobicContact CD1-CG 3.55Å; L72-K436 HydrophobicContact CD2-CD 4.28Å; L72-K436 HydrophobicContact CD2-CG 4.22Å; L72-K436 HydrophobicContact CG-CD 4.32Å; L72-K436 HydrophobicContact CG-CG 4.31Å; E432-K436 IonicContact OE2-NZ 3.03Å; E432-K436 PolarHBondContact OE2-NZ 3.22Å; Q434-K436 PolarHBondContact O-N 2.67Å
437	L	45	Very low	51.3	Low	68 Å²	68	68.9 Å²	68.9	36%	0.356	41%	0.411	S	S	.	.	S	Bend	trans	-93	-13.4	175.1	-87.1	162.1	0	0	0	114	Q434 S439 M472 C476	Q434-L437 PolarHBondContact O-N 3.06Å; L437-S439 VanDerWaalsContact C-N 3.33Å; L437-S439 PolarHBondContact O-N 3.38Å; L437-M472 HydrophobicContact CD2-CG 3.95Å; L437-C476 HydrophobicContact CD1-CB 3.52Å; L437-C476 WeakPolarHBondContact CD1-SG 3.33Å
438	K	42.1	Very low	48.9	Very low	175 Å²	175	75 Å²	75	76%	0.761	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	11.1	-164.6	-132.8	172.8	-176.1	179.5	0	115.5
439	S	38.8	Very low	46.8	Very low	79 Å²	79	81.1 Å²	81.1	55%	0.552	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	2.7	-165.4	-31.5	0	0	0	0	116.1	L437	L437-S439 VanDerWaalsContact C-N 3.33Å; L437-S439 PolarHBondContact O-N 3.38Å
440	T	40	Very low	45	Very low	65 Å²	65	87.4 Å²	87.4	40%	0.399	52%	0.519	S	S	.	.	S	Bend	trans	-105.9	-10.2	-173	22.7	0	0	0	0	116.3	S442	T440-S442 PolarHBondContact O-N 3.12Å
441	S	36.5	Very low	43.1	Very low	115 Å²	115	94.1 Å²	94.1	80%	0.804	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	6.1	-173	31.2	0	0	0	0	115.1
442	S	36.2	Very low	41.1	Very low	107 Å²	107	100.4 Å²	100.4	75%	0.748	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	18.5	-171.6	52.8	0	0	0	0	115.9	T440	T440-S442 PolarHBondContact O-N 3.12Å
443	S	36.8	Very low	39.7	Very low	93 Å²	93	104.9 Å²	104.9	65%	0.65	62%	0.618	S	S	*	*	S	Bend	trans	-143.4	10.9	-170.2	20	0	0	0	0	118
444	S	34.8	Very low	38.6	Very low	116 Å²	116	108.7 Å²	108.7	81%	0.811	65%	0.645	S	S	*	*			trans	-119.6	35.5	-177.7	59.2	0	0	0	0	115.2
445	S	28.9	Very low	37.4	Very low	113 Å²	113	113.8 Å²	113.8	79%	0.79	67%	0.673	S	S	*	*			trans	-118.8	77.1	172.2	59.8	0	0	0	0	110.8
446	S	32.6	Very low	36.7	Very low	102 Å²	102	115.7 Å²	115.7	71%	0.713	69%	0.691	S	S	*	*			trans	-177	122.9	159.8	47.4	0	0	0	0	112.6
447	T	35.1	Very low	36.1	Very low	128 Å²	128	120.2 Å²	120.2	79%	0.785	71%	0.713	S	S	*	*			trans	78.3	84	146.1	59.9	0	0	0	0	120
448	T	29.7	Very low	35.6	Very low	129 Å²	129	123.9 Å²	123.9	79%	0.791	73%	0.733	S	S	*	*				-0.7	132.2	123.6	47.8	0	0	0	0	119.3
449	T	34.2	Very low	35.5	Very low	131 Å²	131	122.8 Å²	122.8	80%	0.804	73%	0.734	S	S	*	*			trans	-175.7	100	133.4	31.3	0	0	0	0	108.1
450	L	32.7	Very low	35.2	Very low	152 Å²	152	125.8 Å²	125.8	80%	0.796	74%	0.743	S	S	*	*				59.1	111.1	102.7	-81.6	158.1	0	0	0	115
451	N	34.6	Very low	34.8	Very low	140 Å²	140	129.9 Å²	129.9	75%	0.749	76%	0.758	S	S	*	*				-177.5	112.1	122.3	-84.7	-21	0	0	0	112.5
452	N	33.7	Very low	34.7	Very low	137 Å²	137	132 Å²	132	73%	0.733	75%	0.753	S	S	*	*			trans	61.5	118.1	137.5	-48.2	-19.4	0	0	0	119.6
453	V	37.9	Very low	34.4	Very low	130 Å²	130	135.2 Å²	135.2	79%	0.788	76%	0.761	S	S	*	*				166.1	135	93.4	167.7	0	0	0	0	109.2
454	S	40	Very low	34.3	Very low	88 Å²	88	135.1 Å²	135.1	62%	0.615	76%	0.76	S	S	*	*			trans	69.3	104.2	157.8	65.7	0	0	0	0	120.8
455	D	36.2	Very low	34.3	Very low	141 Å²	141	138.2 Å²	138.2	75%	0.754	77%	0.767	S	S	*	*				70.5	130.8	118.3	-48.9	-22.7	0	0	0	121
456	N	36.5	Very low	34.8	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	77%	0.765	S	S	*	*			trans	89.4	93.8	167.4	-49	-37	0	0	0	114.4
457	E	35.1	Very low	35.3	Very low	172 Å²	172	140.4 Å²	140.4	80%	0.804	77%	0.765	S	S	*	*				80.5	116	88.3	-78.5	-163.3	177.9	0	0	112.6
458	D	34.4	Very low	35.7	Very low	144 Å²	144	144 Å²	144	77%	0.77	77%	0.766	S	S	*	*			trans	71.4	150.3	156	-69.6	-22	0	0	0	121.4
459	I	41.2	Very low	36.8	Very low	153 Å²	153	143.6 Å²	143.6	79%	0.785	76%	0.759	S	S	*	*			trans	97.4	71.4	159.4	-40.7	-178.2	0	0	0	115.4	H461	I459-H461 PolarHBondContact O-N 3.37Å
460	D	32	Very low	37.9	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	75%	0.749	S	S	*	*				-15.7	115.2	121.1	-96.9	-35.2	0	0	0	113
461	H	32	Very low	39.2	Very low	151 Å²	151	139.5 Å²	139.5	70%	0.699	73%	0.726	S	S	*	*				160.3	127.4	128.8	-84.5	-46.7	0	0	0	114.2	I459	I459-H461 PolarHBondContact O-N 3.37Å
462	K	33.6	Very low	40.4	Very low	161 Å²	161	134.3 Å²	134.3	70%	0.7	70%	0.698	S	S	*	*			trans	80.2	101.6	134.2	-70.6	170.9	-178.9	171.3	0	119.2
463	L	30.4	Very low	41.8	Very low	174 Å²	174	133.9 Å²	133.9	91%	0.911	69%	0.687	S	S	*	*				26.3	100	120	-74.5	95.7	0	0	0	116.1
464	S	35.2	Very low	43.1	Very low	91 Å²	91	128.9 Å²	128.9	64%	0.636	66%	0.656	S	S	*	*			trans	-161.1	31.4	152.4	48.8	0	0	0	0	114.8	S466	S464-S466 PolarHBondContact O-N 3.24Å
465	D	34.7	Very low	44.3	Very low	181 Å²	181	125.8 Å²	125.8	97%	0.968	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	26.6	177.8	-109.8	-7.1	0	0	0	114.6
466	S	39.3	Very low	45.7	Very low	106 Å²	106	120 Å²	120	74%	0.741	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	23.9	-168.6	77.8	0	0	0	0	116.6	S464	S464-S466 PolarHBondContact O-N 3.24Å
467	Q	42.4	Very low	47.4	Very low	154 Å²	154	115.2 Å²	115.2	72%	0.72	58%	0.576	S	S	*	*	S	Bend	trans	-131.5	-7.2	-178.4	-101.5	178.9	-6.5	0	0	116.6
468	Y	44.8	Very low	49	Very low	204 Å²	204	107.3 Å²	107.3	80%	0.8	54%	0.539	S	S	*	.	S	Bend	trans	-85.7	-7.9	-167.4	-87.5	-84.8	0	0	0	116.7	W471	Y468-W471 PolarHBondContact O-NE1 3.27Å
469	D	53.2	Low	50.7	Low	120 Å²	120	101.7 Å²	101.7	64%	0.642	51%	0.507	S	S	*	.	S	Bend	trans	-112.3	-3.2	-174.2	-82.7	-24.9	0	0	0	116.4	W471 M472 Y473	D469-W471 PolarHBondContact O-N 2.97Å; D469-M472 PolarHBondContact O-N 2.87Å; D469-Y473 PolarHBondContact O-N 2.68Å
470	D	56.9	Low	52.4	Low	110 Å²	110	94.4 Å²	94.4	59%	0.588	47%	0.47	S	S	*	.	H	α-helix	trans	-67.4	-37.4	-172.1	-97.7	2.4	0	0	0	113.8	Y473 I474	D470-Y473 PolarHBondContact O-N 2.66Å; D470-I474 VanDerWaalsContact O-CD1 3.26Å; D470-I474 WeakPolarHBondContact O-CD1 3.26Å; D470-I474 VanDerWaalsContact O-CG1 3.28Å; D470-I474 WeakPolarHBondContact O-CG1 3.26Å; D470-I474 PolarHBondContact O-N 3.38Å
471	W	58.7	Low	54.4	Low	87 Å²	87	87.8 Å²	87.8	33%	0.33	43%	0.434	S	S	.	.	H	α-helix	trans	-72.8	-30.6	-178	68.2	-89	0	0	0	112.4	W66 Y468 D469 I474 L475	W66-W471 AromaticContact CH2-CH2 3.05Å; W66-W471 HydrophobicContact CH2-CH2 3.05Å; W66-W471 HydrophobicContact CH2-CZ2 4.16Å; W66-W471 AromaticContact CH2-CZ3 3.47Å; W66-W471 HydrophobicContact CH2-CZ3 3.47Å; W66-W471 VanDerWaalsContact CH2-CZ3 3.47Å; W66-W471 AromaticContact CZ2-CH2 3.78Å; W66-W471 HydrophobicContact CZ2-CH2 3.78Å; W66-W471 AromaticContact CZ3-CH2 3.58Å; W66-W471 HydrophobicContact CZ3-CH2 3.58Å; W66-W471 AromaticContact CZ3-CZ3 3.63Å; W66-W471 HydrophobicContact CZ3-CZ3 3.63Å; Y468-W471 PolarHBondContact O-NE1 3.27Å; D469-W471 PolarHBondContact O-N 2.97Å; W471-I474 PolarHBondContact O-N 3.47Å; W471-L475 HydrophobicContact CZ3-CD2 4.17Å; W471-L475 WeakPolarHBondContact O-CB 3.3Å; W471-L475 PolarHBondContact O-N 2.96Å
472	M	60.4	Low	56.4	Low	32 Å²	32	81.5 Å²	81.5	16%	0.158	41%	0.406	C	S	.	.	H	α-helix	trans	-66.2	-41.6	175.9	-172	68	78.4	0	0	110.7	W66 L437 D469 I474 L475 C476	W66-M472 HydrophobicContact CD2-CE 4.46Å; W66-M472 HydrophobicContact CE3-CE 4.07Å; W66-M472 HydrophobicContact CE3-SD 4.36Å; W66-M472 HydrophobicContact CH2-CE 4.08Å; W66-M472 HydrophobicContact CZ2-CE 4.31Å; W66-M472 HydrophobicContact CZ3-CE 3.87Å; W66-M472 HydrophobicContact CZ3-SD 4.18Å; L437-M472 HydrophobicContact CD2-CG 3.95Å; D469-M472 PolarHBondContact O-N 2.87Å; M472-I474 VanDerWaalsContact C-N 3.35Å; M472-I474 PolarHBondContact O-N 2.83Å; M472-L475 PolarHBondContact O-N 2.91Å; M472-C476 WeakPolarHBondContact O-CB 3.36Å; M472-C476 PolarHBondContact O-N 3.27Å; M472-C476 PolarHBondContact O-SG 3.49Å
473	Y	63.2	Low	58.3	Low	128 Å²	128	73.9 Å²	73.9	50%	0.502	37%	0.373	S	S	.	.	H	α-helix	trans	-59.2	-46.1	173.3	177.6	-94.7	0	0	0	111.6	D469 D470 L475 C476 Q477	D469-Y473 PolarHBondContact O-N 2.68Å; D470-Y473 PolarHBondContact O-N 2.66Å; Y473-L475 VanDerWaalsContact C-N 3.35Å; Y473-L475 PolarHBondContact O-N 3.04Å; Y473-C476 PolarHBondContact O-N 3.47Å; Y473-Q477 WeakPolarHBondContact O-CB 3.4Å; Y473-Q477 PolarHBondContact O-N 3.46Å
474	I	64.5	Low	60.7	Low	25 Å²	25	65.6 Å²	65.6	13%	0.128	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-41.8	178	-63.9	156	0	0	0	110.9	D470 W471 M472 Q477 S478 V606	D470-I474 VanDerWaalsContact O-CD1 3.26Å; D470-I474 WeakPolarHBondContact O-CD1 3.26Å; D470-I474 VanDerWaalsContact O-CG1 3.28Å; D470-I474 WeakPolarHBondContact O-CG1 3.26Å; D470-I474 PolarHBondContact O-N 3.38Å; W471-I474 PolarHBondContact O-N 3.47Å; M472-I474 VanDerWaalsContact C-N 3.35Å; M472-I474 PolarHBondContact O-N 2.83Å; I474-Q477 PolarHBondContact O-N 2.87Å; I474-S478 VanDerWaalsContact O-CB 3.28Å; I474-S478 WeakPolarHBondContact O-CB 3.42Å; I474-S478 PolarHBondContact O-N 3.09Å; I474-S478 PolarHBondContact O-OG 3.45Å; I474-V606 HydrophobicContact CG2-CG2 3.87Å
475	L	65.3	Low	62.6	Low	23 Å²	23	62.6 Å²	62.6	12%	0.12	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-43.7	178.4	-171.6	71.2	0	0	0	111.4	L50 L54 W66 W471 M472 Y473 S478 R479	L50-L475 HydrophobicContact CD2-CD1 3.76Å; L50-L475 HydrophobicContact CD2-CG 4.48Å; L54-L475 HydrophobicContact CD1-CD1 4.05Å; W66-L475 HydrophobicContact CZ3-CD2 4.08Å; W471-L475 HydrophobicContact CZ3-CD2 4.17Å; W471-L475 WeakPolarHBondContact O-CB 3.3Å; W471-L475 PolarHBondContact O-N 2.96Å; M472-L475 PolarHBondContact O-N 2.91Å; Y473-L475 VanDerWaalsContact C-N 3.35Å; Y473-L475 PolarHBondContact O-N 3.04Å; L475-S478 WeakPolarHBondContact O-CB 3.33Å; L475-S478 PolarHBondContact O-N 3.4Å; L475-R479 PolarHBondContact O-N 3Å
476	C	67	Low	64.3	Low	18 Å²	18	54.4 Å²	54.4	12%	0.122	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-40.6	177	-73.6	0	0	0	0	112.7	L437 M472 Y473 S478 R479 Q480	L437-C476 HydrophobicContact CD1-CB 3.52Å; L437-C476 WeakPolarHBondContact CD1-SG 3.33Å; M472-C476 WeakPolarHBondContact O-CB 3.36Å; M472-C476 PolarHBondContact O-N 3.27Å; M472-C476 PolarHBondContact O-SG 3.49Å; Y473-C476 PolarHBondContact O-N 3.47Å; C476-S478 VanDerWaalsContact C-N 3.29Å; C476-S478 PolarHBondContact O-N 3.38Å; C476-R479 PolarHBondContact O-N 3.04Å; C476-Q480 PolarHBondContact O-N 3.45Å
477	Q	71.2	Confident	66	Low	45 Å²	45	49.4 Å²	49.4	21%	0.21	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-41.4	171.3	-176.8	175.8	1.3	0	0	111.1	Y473 I474 Q480 L481 M591	Y473-Q477 WeakPolarHBondContact O-CB 3.4Å; Y473-Q477 PolarHBondContact O-N 3.46Å; I474-Q477 PolarHBondContact O-N 2.87Å; Q477-Q480 PolarHBondContact O-N 3.27Å; Q477-L481 VanDerWaalsContact O-CB 3.22Å; Q477-L481 WeakPolarHBondContact O-CB 3.24Å; Q477-L481 PolarHBondContact O-N 2.89Å; Q477-M591 HydrophobicContact CG-CE 4.06Å
478	S	69	Low	67.6	Low	5 Å²	5	42.1 Å²	42.1	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-42.4	178.8	-59.9	0	0	0	0	112.3	I474 L475 C476 L481 L482 I602	I474-S478 VanDerWaalsContact O-CB 3.28Å; I474-S478 WeakPolarHBondContact O-CB 3.42Å; I474-S478 PolarHBondContact O-N 3.09Å; I474-S478 PolarHBondContact O-OG 3.45Å; L475-S478 WeakPolarHBondContact O-CB 3.33Å; L475-S478 PolarHBondContact O-N 3.4Å; C476-S478 VanDerWaalsContact C-N 3.29Å; C476-S478 PolarHBondContact O-N 3.38Å; S478-L481 PolarHBondContact O-N 3.34Å; S478-L482 WeakPolarHBondContact O-CB 3.35Å; S478-L482 PolarHBondContact O-N 3.34Å; S478-I602 WeakPolarHBondContact OG-CG2 3.42Å
479	R	70.7	Confident	68.8	Low	26 Å²	26	35.4 Å²	35.4	10%	0.098	17%	0.167	C	C	.	.	H	α-helix	trans	-61.5	-45.8	175.6	-172.3	-178.9	67.1	-175.8	-2.1	111.7	L50 L433 L475 C476 L482 A483	L50-R479 HydrophobicContact CD2-CB 4.24Å; L433-R479 HydrophobicContact CD1-CG 4.08Å; L475-R479 PolarHBondContact O-N 3Å; C476-R479 PolarHBondContact O-N 3.04Å; R479-L482 PolarHBondContact O-N 3.43Å; R479-A483 WeakPolarHBondContact O-CB 3.29Å; R479-A483 PolarHBondContact O-N 3.31Å
480	Q	75.7	Confident	69.4	Low	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-43.4	177.3	175.3	-172.4	24.9	0	0	112.1	A430 L433 Q434 C476 Q477 L482 A483 Y484 N587	A430-Q480 WeakPolarHBondContact O-CG 3.35Å; L433-Q480 HydrophobicContact CB-CB 4.34Å; L433-Q480 HydrophobicContact CD1-CB 4.3Å; Q434-Q480 VanDerWaalsContact CD-CD 3.43Å; Q434-Q480 VanDerWaalsContact OE1-NE2 3.11Å; C476-Q480 PolarHBondContact O-N 3.45Å; Q477-Q480 PolarHBondContact O-N 3.27Å; Q480-L482 VanDerWaalsContact C-N 3.34Å; Q480-A483 WeakPolarHBondContact O-CB 3.33Å; Q480-A483 PolarHBondContact O-N 2.93Å; Q480-Y484 HydrophobicContact CG-CD2 3.89Å; Q480-Y484 HydrophobicContact CG-CE1 4.22Å; Q480-Y484 HydrophobicContact CG-CE2 3.47Å; Q480-Y484 VanDerWaalsContact CG-CE2 3.47Å; Q480-Y484 HydrophobicContact CG-CG 4.42Å; Q480-Y484 PolarHBondContact NE2-OH 3.11Å; Q480-Y484 PolarHBondContact O-N 3.47Å; Q480-N587 PolarHBondContact NE2-ND2 3.43Å; Q480-N587 VanDerWaalsContact NE2-ND2 3.14Å
481	L	74.5	Confident	69.9	Low	2 Å²	2	26.3 Å²	26.3	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-66.9	-38.5	-178.3	-175.6	47.9	0	0	0	111.7	Q477 S478 R485 M591 Q594 L595 L598 I602	Q477-L481 VanDerWaalsContact O-CB 3.22Å; Q477-L481 WeakPolarHBondContact O-CB 3.24Å; Q477-L481 PolarHBondContact O-N 2.89Å; S478-L481 PolarHBondContact O-N 3.34Å; L481-R485 WeakPolarHBondContact O-CB 3.47Å; L481-R485 PolarHBondContact O-N 3.45Å; L481-M591 HydrophobicContact CB-SD 4.39Å; L481-M591 HydrophobicContact CD1-CB 4.09Å; L481-M591 HydrophobicContact CD1-SD 4.21Å; L481-Q594 HydrophobicContact CD1-CB 4.07Å; L481-Q594 HydrophobicContact CD2-CB 3.51Å; L481-Q594 HydrophobicContact CD2-CG 4.31Å; L481-Q594 HydrophobicContact CG-CB 4.37Å; L481-L595 HydrophobicContact CD1-CD2 3.57Å; L481-L595 HydrophobicContact CD1-CG 3.88Å; L481-L598 HydrophobicContact CB-CD2 4.36Å; L481-L598 HydrophobicContact CD1-CD1 4.06Å; L481-L598 HydrophobicContact CD1-CD2 4.48Å; L481-L598 HydrophobicContact CD2-CD1 3.5Å; L481-L598 VanDerWaalsContact CD2-CD1 3.5Å; L481-L598 HydrophobicContact CG-CD1 3.45Å; L481-L598 VanDerWaalsContact CG-CD1 3.45Å; L481-L598 HydrophobicContact CG-CD2 3.72Å; L481-L598 HydrophobicContact CG-CG 4.2Å; L481-I602 HydrophobicContact CB-CD1 4.11Å; L481-I602 HydrophobicContact CD2-CD1 3.61Å; L481-I602 HydrophobicContact CD2-CG1 4.21Å; L481-I602 HydrophobicContact CG-CD1 3.91Å
482	L	73.1	Confident	70.4	Confident	20 Å²	20	22.3 Å²	22.3	11%	0.105	10%	0.103	C	C	.	.	H	α-helix	trans	-61.7	-47.4	169.2	-178.4	63.8	0	0	0	111.4	C46 T49 L50 S478 R479 Q480 Y484 R485 I486	C46-L482 WeakPolarHBondContact O-CD2 3.34Å; T49-L482 HydrophobicContact CG2-CD2 4.19Å; L50-L482 HydrophobicContact CB-CD2 4.01Å; L50-L482 HydrophobicContact CD1-CD2 4.43Å; S478-L482 WeakPolarHBondContact O-CB 3.35Å; S478-L482 PolarHBondContact O-N 3.34Å; R479-L482 PolarHBondContact O-N 3.43Å; Q480-L482 VanDerWaalsContact C-N 3.34Å; L482-Y484 PolarHBondContact O-N 3.19Å; L482-R485 PolarHBondContact O-N 3.24Å; L482-I486 HydrophobicContact CD1-CD1 4.13Å; L482-I486 HydrophobicContact CD1-CG1 4.4Å; L482-I486 HydrophobicContact CG-CD1 3.92Å; L482-I486 VanDerWaalsContact O-CG1 3.31Å; L482-I486 WeakPolarHBondContact O-CG1 3.13Å; L482-I486 PolarHBondContact O-N 2.99Å
483	A	73.5	Confident	70.7	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.1	-46.1	179	0	0	0	0	0	112.5	F42 A430 L433 R479 Q480 R485 I486 V487	F42-A483 HydrophobicContact CE1-CB 3.91Å; F42-A483 HydrophobicContact CZ-CB 4.02Å; A430-A483 HydrophobicContact CB-CB 3.75Å; L433-A483 HydrophobicContact CD1-CB 4.38Å; R479-A483 WeakPolarHBondContact O-CB 3.29Å; R479-A483 PolarHBondContact O-N 3.31Å; Q480-A483 WeakPolarHBondContact O-CB 3.33Å; Q480-A483 PolarHBondContact O-N 2.93Å; A483-R485 VanDerWaalsContact C-N 3.32Å; A483-R485 PolarHBondContact O-N 3.4Å; A483-I486 PolarHBondContact O-N 3.49Å; A483-V487 VanDerWaalsContact O-CG2 3.3Å; A483-V487 WeakPolarHBondContact O-CG2 3.44Å; A483-V487 PolarHBondContact O-N 3.27Å
484	Y	81.2	Confident	70.8	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.2	-45.6	174.1	-72.7	-21.7	0	0	0	111.4	L427 A430 T431 Q480 L482 V487 L488 T584 N587 L588 M591	L427-Y484 HydrophobicContact CB-CE1 4.49Å; L427-Y484 HydrophobicContact CD2-CD1 3.46Å; L427-Y484 VanDerWaalsContact CD2-CD1 3.46Å; L427-Y484 HydrophobicContact CD2-CE1 4.06Å; L427-Y484 HydrophobicContact CD2-CG 4.25Å; A430-Y484 HydrophobicContact CB-CD1 3.67Å; A430-Y484 HydrophobicContact CB-CE1 3.62Å; T431-Y484 WeakPolarHBondContact CB-OH 3.37Å; T431-Y484 PolarHBondContact OG1-OH 2.84Å; Q480-Y484 HydrophobicContact CG-CD2 3.89Å; Q480-Y484 HydrophobicContact CG-CE1 4.22Å; Q480-Y484 HydrophobicContact CG-CE2 3.47Å; Q480-Y484 VanDerWaalsContact CG-CE2 3.47Å; Q480-Y484 HydrophobicContact CG-CG 4.42Å; Q480-Y484 PolarHBondContact NE2-OH 3.11Å; Q480-Y484 PolarHBondContact O-N 3.47Å; L482-Y484 PolarHBondContact O-N 3.19Å; Y484-V487 PolarHBondContact O-N 2.85Å; Y484-L488 WeakPolarHBondContact O-CB 3.22Å; Y484-L488 WeakPolarHBondContact O-CG 3.3Å; Y484-L488 PolarHBondContact O-N 3.08Å; Y484-T584 HydrophobicContact CE1-CG2 4.43Å; Y484-N587 HydrophobicContact CE2-CB 4.06Å; Y484-L588 HydrophobicContact CD1-CD2 4.23Å; Y484-L588 HydrophobicContact CD2-CD2 3.71Å; Y484-L588 HydrophobicContact CE2-CD2 4.07Å; Y484-L588 HydrophobicContact CE2-CG 4.47Å; Y484-L588 HydrophobicContact CG-CD2 3.79Å; Y484-M591 HydrophobicContact CD2-SD 4.16Å; Y484-M591 HydrophobicContact CE2-SD 4.07Å
485	R	75.6	Confident	70.8	Confident	28 Å²	28	18.6 Å²	18.6	11%	0.106	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-46.3	178.5	177.5	179.8	173	122.8	-20.2	112.3	L481 L482 A483 V487 L488 Q489 L595 L598	L481-R485 WeakPolarHBondContact O-CB 3.47Å; L481-R485 PolarHBondContact O-N 3.45Å; L482-R485 PolarHBondContact O-N 3.24Å; A483-R485 VanDerWaalsContact C-N 3.32Å; A483-R485 PolarHBondContact O-N 3.4Å; R485-V487 VanDerWaalsContact C-N 3.31Å; R485-V487 PolarHBondContact O-N 2.88Å; R485-L488 PolarHBondContact O-N 3.44Å; R485-Q489 HydrophobicContact CG-CG 4.11Å; R485-Q489 VanDerWaalsContact CZ-NE2 3.29Å; R485-Q489 VanDerWaalsContact NE-NE2 3.18Å; R485-Q489 VanDerWaalsContact O-CB 3.23Å; R485-Q489 WeakPolarHBondContact O-CB 3.32Å; R485-Q489 VanDerWaalsContact O-CG 3.26Å; R485-Q489 WeakPolarHBondContact O-CG 3.18Å; R485-Q489 PolarHBondContact O-N 3.01Å; R485-L595 PolarHBondContact NH1-O 2.89Å; R485-L598 HydrophobicContact CB-CD2 4.47Å; R485-L598 PolarHBondContact NH1-O 3.38Å; R485-L598 PolarHBondContact NH2-O 3.26Å
486	I	70.8	Confident	71	Confident	9 Å²	9	18.3 Å²	18.3	5%	0.046	10%	0.096	C	C	.	.	H	α-helix	trans	-58.6	-47.3	178.1	-69.4	169.3	0	0	0	109.8	L30 F42 L482 A483 Q489 L490	L30-I486 HydrophobicContact CD2-CG1 4.31Å; L30-I486 HydrophobicContact CD2-CG2 4.27Å; F42-I486 HydrophobicContact CE2-CG2 4.13Å; L482-I486 HydrophobicContact CD1-CD1 4.13Å; L482-I486 HydrophobicContact CD1-CG1 4.4Å; L482-I486 HydrophobicContact CG-CD1 3.92Å; L482-I486 VanDerWaalsContact O-CG1 3.31Å; L482-I486 WeakPolarHBondContact O-CG1 3.13Å; L482-I486 PolarHBondContact O-N 2.99Å; A483-I486 PolarHBondContact O-N 3.49Å; I486-Q489 PolarHBondContact O-N 2.93Å; I486-L490 HydrophobicContact CG2-CD1 3.69Å; I486-L490 VanDerWaalsContact O-CB 3.31Å; I486-L490 WeakPolarHBondContact O-CB 3.36Å; I486-L490 WeakPolarHBondContact O-CG 3.44Å; I486-L490 PolarHBondContact O-N 3.43Å
487	V	73.3	Confident	71.3	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-62.3	-48.5	178.4	172.8	0	0	0	0	111.3	F42 A423 L426 L427 A483 Y484 R485 Q489 L491	F42-V487 HydrophobicContact CE1-CG2 4.47Å; F42-V487 HydrophobicContact CE2-CG2 4.33Å; F42-V487 HydrophobicContact CZ-CG2 3.75Å; A423-V487 HydrophobicContact CB-CG1 4.22Å; L426-V487 HydrophobicContact CB-CG1 4.35Å; L426-V487 HydrophobicContact CB-CG2 3.81Å; L427-V487 HydrophobicContact CD1-CG1 4.38Å; L427-V487 HydrophobicContact CD2-CB 3.96Å; L427-V487 HydrophobicContact CD2-CG1 3.7Å; L427-V487 HydrophobicContact CG-CB 4.45Å; L427-V487 HydrophobicContact CG-CG1 3.68Å; A483-V487 VanDerWaalsContact O-CG2 3.3Å; A483-V487 WeakPolarHBondContact O-CG2 3.44Å; A483-V487 PolarHBondContact O-N 3.27Å; Y484-V487 PolarHBondContact O-N 2.85Å; R485-V487 VanDerWaalsContact C-N 3.31Å; R485-V487 PolarHBondContact O-N 2.88Å; V487-Q489 VanDerWaalsContact C-N 3.33Å; V487-Q489 PolarHBondContact O-N 3.21Å; V487-L491 HydrophobicContact CB-CD1 4.33Å; V487-L491 HydrophobicContact CG1-CD1 3.86Å; V487-L491 HydrophobicContact CG2-CD1 4.32Å; V487-L491 VanDerWaalsContact O-CB 3.32Å; V487-L491 WeakPolarHBondContact O-CB 3.37Å; V487-L491 PolarHBondContact O-N 2.68Å
488	L	76.4	Confident	71.3	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-66.9	-31.6	-179.8	-67.4	-177.9	0	0	0	113.4	L427 Y484 R485 L492 R497 L500 M501 L588 L595	L427-L488 HydrophobicContact CD1-CD2 4.28Å; L427-L488 HydrophobicContact CD2-CD2 4.5Å; Y484-L488 WeakPolarHBondContact O-CB 3.22Å; Y484-L488 WeakPolarHBondContact O-CG 3.3Å; Y484-L488 PolarHBondContact O-N 3.08Å; R485-L488 PolarHBondContact O-N 3.44Å; L488-L492 HydrophobicContact CD2-CD1 3.93Å; L488-L492 HydrophobicContact CD2-CD2 3.88Å; L488-R497 WeakPolarHBondContact O-CD 3.33Å; L488-L500 HydrophobicContact CD2-CD2 3.47Å; L488-L500 VanDerWaalsContact CD2-CD2 3.47Å; L488-M501 HydrophobicContact CB-CE 4.27Å; L488-M501 HydrophobicContact CD1-CE 3.62Å; L488-L588 HydrophobicContact CD1-CD2 4.16Å; L488-L595 HydrophobicContact CD1-CD1 4.1Å; L488-L595 HydrophobicContact CD1-CD2 4.28Å
489	Q	71.4	Confident	71.7	Confident	63 Å²	63	22.5 Å²	22.5	29%	0.294	11%	0.108	S	C	.	.	H	α-helix	trans	-82.7	-35.2	-179	-73.6	-177.4	-16.4	0	0	113.2	R485 I486 V487 R497	R485-Q489 HydrophobicContact CG-CG 4.11Å; R485-Q489 VanDerWaalsContact CZ-NE2 3.29Å; R485-Q489 VanDerWaalsContact NE-NE2 3.18Å; R485-Q489 VanDerWaalsContact O-CB 3.23Å; R485-Q489 WeakPolarHBondContact O-CB 3.32Å; R485-Q489 VanDerWaalsContact O-CG 3.26Å; R485-Q489 WeakPolarHBondContact O-CG 3.18Å; R485-Q489 PolarHBondContact O-N 3.01Å; I486-Q489 PolarHBondContact O-N 2.93Å; V487-Q489 VanDerWaalsContact C-N 3.33Å; V487-Q489 PolarHBondContact O-N 3.21Å; Q489-R497 PolarHBondContact O-NH1 2.63Å
490	L	65.4	Low	72.2	Confident	19 Å²	19	21.3 Å²	21.3	10%	0.099	10%	0.103	C	C	.	.	H	α-helix	trans	-98.2	-36.7	-172.9	-64.9	176.7	0	0	0	114.1	M11 L18 L30 F34 I486	M11-L490 HydrophobicContact CE-CB 4.36Å; L18-L490 HydrophobicContact CD1-CD2 3.94Å; L30-L490 HydrophobicContact CB-CD1 3.98Å; L30-L490 HydrophobicContact CB-CD2 4.44Å; L30-L490 HydrophobicContact CD1-CD1 4.18Å; L30-L490 HydrophobicContact CD1-CD2 4.11Å; L30-L490 HydrophobicContact CD1-CG 4.49Å; L30-L490 HydrophobicContact CD2-CD1 3.86Å; L30-L490 HydrophobicContact CG-CD1 4.2Å; F34-L490 HydrophobicContact CE2-CD1 3.79Å; F34-L490 HydrophobicContact CZ-CD1 4.43Å; I486-L490 HydrophobicContact CG2-CD1 3.69Å; I486-L490 VanDerWaalsContact O-CB 3.31Å; I486-L490 WeakPolarHBondContact O-CB 3.36Å; I486-L490 WeakPolarHBondContact O-CG 3.44Å; I486-L490 PolarHBondContact O-N 3.43Å
491	L	66.9	Low	72.5	Confident	20 Å²	20	22.5 Å²	22.5	11%	0.105	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-34.9	-172.9	-70.9	158.2	0	0	0	112.6	M11 R14 A423 L426 V487	M11-L491 HydrophobicContact CE-CD2 3.47Å; M11-L491 VanDerWaalsContact CE-CD2 3.47Å; M11-L491 HydrophobicContact CE-CG 3.83Å; M11-L491 HydrophobicContact CG-CD2 4.18Å; M11-L491 HydrophobicContact SD-CD2 3.39Å; M11-L491 WeakPolarHBondContact SD-CD2 3.49Å; M11-L491 HydrophobicContact SD-CG 4.39Å; R14-L491 PolarHBondContact NH1-O 3.01Å; A423-L491 HydrophobicContact CB-CB 3.91Å; A423-L491 HydrophobicContact CB-CD1 4.45Å; L426-L491 HydrophobicContact CD1-CD1 3.33Å; V487-L491 HydrophobicContact CB-CD1 4.33Å; V487-L491 HydrophobicContact CG1-CD1 3.86Å; V487-L491 HydrophobicContact CG2-CD1 4.32Å; V487-L491 VanDerWaalsContact O-CB 3.32Å; V487-L491 WeakPolarHBondContact O-CB 3.37Å; V487-L491 PolarHBondContact O-N 2.68Å
492	L	70.2	Confident	72.7	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.021	11%	0.111	C	C	.	.	S	Bend	trans	-78.8	130.2	177.1	-83.2	69.6	0	0	0	110.7	I419 A423 L488 R497 L500	I419-L492 HydrophobicContact CG1-CD2 4.34Å; I419-L492 HydrophobicContact CG2-CD1 4.26Å; A423-L492 HydrophobicContact CB-CD1 3.8Å; L488-L492 HydrophobicContact CD2-CD1 3.93Å; L488-L492 HydrophobicContact CD2-CD2 3.88Å; L492-R497 HydrophobicContact CB-CB 4.05Å; L492-L500 HydrophobicContact CD2-CB 4.41Å; L492-L500 HydrophobicContact CD2-CD2 3.51Å
493	P	66.2	Low	73.3	Confident	17 Å²	17	21.9 Å²	21.9	11%	0.11	11%	0.106	C	C	.	.			trans	-63.9	155.1	168.8	1	13.4	0	0	0	110.7	P495 E496 R497	P493-P495 VanDerWaalsContact C-CD 3.47Å; P493-E496 WeakPolarHBondContact CB-OE2 3.32Å; P493-E496 WeakPolarHBondContact CD-OE2 3.1Å; P493-E496 WeakPolarHBondContact CG-OE2 3.36Å; P493-E496 PolarHBondContact O-N 2.9Å; P493-R497 WeakPolarHBondContact O-CB 3.1Å; P493-R497 PolarHBondContact O-N 3.46Å
494	T	64.9	Low	73.9	Confident	50 Å²	50	21.9 Å²	21.9	31%	0.307	11%	0.107	S	C	.	.	H	α-helix	trans	-52.8	-44.9	-172.3	-52.6	0	0	0	0	114.7	Y261 Y498	Y261-T494 HydrophobicContact CE1-CG2 4.36Å; Y261-T494 WeakPolarHBondContact OH-CG2 3.37Å; T494-Y498 PolarHBondContact O-N 2.73Å
495	P	64.1	Low	74	Confident	39 Å²	39	26.5 Å²	26.5	25%	0.253	12%	0.124	S	C	.	.	H	α-helix	trans	-68.2	-42.7	-179.1	23.3	-28.9	0	0	0	112.7	P493 R497 Y498 L499	P493-P495 VanDerWaalsContact C-CD 3.47Å; P495-R497 VanDerWaalsContact C-N 3.33Å; P495-R497 PolarHBondContact O-N 3.44Å; P495-Y498 PolarHBondContact O-N 2.7Å; P495-L499 PolarHBondContact O-N 3.33Å
496	E	70.1	Confident	74.5	Confident	17 Å²	17	25.2 Å²	25.2	8%	0.079	12%	0.119	C	C	.	.	H	α-helix	trans	-67.1	-36.8	177.7	-58.9	85.9	164.1	0	0	111.2	L418 P493 L499 L500	L418-E496 HydrophobicContact CD1-CB 3.95Å; L418-E496 HydrophobicContact CD1-CG 4.12Å; P493-E496 WeakPolarHBondContact CB-OE2 3.32Å; P493-E496 WeakPolarHBondContact CD-OE2 3.1Å; P493-E496 WeakPolarHBondContact CG-OE2 3.36Å; P493-E496 PolarHBondContact O-N 2.9Å; E496-L499 PolarHBondContact O-N 3.04Å; E496-L500 WeakPolarHBondContact O-CB 3.21Å; E496-L500 PolarHBondContact O-N 2.77Å
497	R	73.5	Confident	75.3	Confident	69 Å²	69	24.8 Å²	24.8	26%	0.26	12%	0.117	S	C	.	.	H	α-helix	trans	-61.9	-44.6	173.6	-174.9	-179.8	68.1	-161	-0.8	111.6	L488 Q489 L492 P493 P495 L500 M501	L488-R497 WeakPolarHBondContact O-CD 3.33Å; Q489-R497 PolarHBondContact O-NH1 2.63Å; L492-R497 HydrophobicContact CB-CB 4.05Å; P493-R497 WeakPolarHBondContact O-CB 3.1Å; P493-R497 PolarHBondContact O-N 3.46Å; P495-R497 VanDerWaalsContact C-N 3.33Å; P495-R497 PolarHBondContact O-N 3.44Å; R497-L500 PolarHBondContact O-N 2.75Å; R497-M501 WeakPolarHBondContact O-CB 3Å; R497-M501 VanDerWaalsContact O-CG 3.3Å; R497-M501 WeakPolarHBondContact O-CG 3.39Å; R497-M501 PolarHBondContact O-N 3.4Å
498	Y	70.7	Confident	75.9	Confident	78 Å²	78	26.2 Å²	26.2	31%	0.306	12%	0.123	S	C	.	.	H	α-helix	trans	-64.8	-45.1	178.1	-178.6	-91.8	0	0	0	111.3	Y261 T494 P495 L500 M501 S502	Y261-Y498 HydrophobicContact CD1-CD2 4.05Å; Y261-Y498 HydrophobicContact CD1-CE2 4.29Å; Y261-Y498 AromaticContact CE1-CD2 3.93Å; Y261-Y498 HydrophobicContact CE1-CD2 3.93Å; Y261-Y498 HydrophobicContact CE1-CG 4.39Å; T494-Y498 PolarHBondContact O-N 2.73Å; P495-Y498 PolarHBondContact O-N 2.7Å; Y498-L500 VanDerWaalsContact C-N 3.35Å; Y498-L500 PolarHBondContact O-N 3.04Å; Y498-M501 PolarHBondContact O-N 3.38Å; Y498-S502 WeakPolarHBondContact O-CB 3.28Å; Y498-S502 PolarHBondContact O-N 3.2Å; Y498-S502 PolarHBondContact O-OG 3.04Å
499	L	76.8	Confident	76.2	Confident	9 Å²	9	29.3 Å²	29.3	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-62.2	-43.8	177.3	-168.9	68.4	0	0	0	111.1	C276 A277 I280 L366 C369 L418 P495 E496 S502 L503	C276-L499 HydrophobicContact CB-CD1 4.06Å; C276-L499 HydrophobicContact CB-CD2 4.4Å; A277-L499 HydrophobicContact CB-CD1 4.22Å; I280-L499 HydrophobicContact CD1-CD1 3.85Å; L366-L499 HydrophobicContact CD2-CD2 4.04Å; L366-L499 HydrophobicContact CD2-CG 4.39Å; C369-L499 HydrophobicContact CB-CD2 4.2Å; C369-L499 WeakPolarHBondContact SG-CD2 3.3Å; L418-L499 HydrophobicContact CD1-CD2 3.88Å; L418-L499 HydrophobicContact CD2-CD2 4.46Å; P495-L499 PolarHBondContact O-N 3.33Å; E496-L499 PolarHBondContact O-N 3.04Å; L499-S502 PolarHBondContact O-N 2.81Å; L499-L503 VanDerWaalsContact O-CB 3.27Å; L499-L503 WeakPolarHBondContact O-CB 3.38Å; L499-L503 PolarHBondContact O-N 3.29Å
500	L	82.8	Confident	76.9	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-62.8	-46.4	176.7	-179.5	66.7	0	0	0	111.7	L418 I419 L488 L492 E496 R497 Y498 S502 L503 L504 V532	L418-L500 HydrophobicContact CD2-CB 3.82Å; L418-L500 HydrophobicContact CD2-CD1 4.05Å; I419-L500 HydrophobicContact CD1-CD1 4.22Å; I419-L500 HydrophobicContact CD1-CD2 3.79Å; I419-L500 HydrophobicContact CG1-CD2 4.17Å; L488-L500 HydrophobicContact CD2-CD2 3.47Å; L488-L500 VanDerWaalsContact CD2-CD2 3.47Å; L492-L500 HydrophobicContact CD2-CB 4.41Å; L492-L500 HydrophobicContact CD2-CD2 3.51Å; E496-L500 WeakPolarHBondContact O-CB 3.21Å; E496-L500 PolarHBondContact O-N 2.77Å; R497-L500 PolarHBondContact O-N 2.75Å; Y498-L500 VanDerWaalsContact C-N 3.35Å; Y498-L500 PolarHBondContact O-N 3.04Å; L500-S502 VanDerWaalsContact C-N 3.34Å; L500-S502 PolarHBondContact O-N 3.26Å; L500-L503 WeakPolarHBondContact O-CB 3.49Å; L500-L503 PolarHBondContact O-N 3.09Å; L500-L504 HydrophobicContact CD1-CD1 4.38Å; L500-L504 HydrophobicContact CD1-CG 4.23Å; L500-L504 HydrophobicContact CG-CD1 4.06Å; L500-L504 HydrophobicContact CG-CG 4.31Å; L500-L504 WeakPolarHBondContact O-CB 3.19Å; L500-L504 VanDerWaalsContact O-CG 3.26Å; L500-L504 WeakPolarHBondContact O-CG 3.49Å; L500-L504 PolarHBondContact O-N 3.5Å; L500-V532 HydrophobicContact CD1-CG1 4.13Å
501	M	81.3	Confident	77.9	Confident	26 Å²	26	26.7 Å²	26.7	13%	0.128	13%	0.126	C	C	.	.	H	α-helix	trans	-64.6	-39.7	178.5	-70.7	-60	-175.4	0	0	111.6	L488 R497 Y498 L503 L504 R505 L595	L488-M501 HydrophobicContact CB-CE 4.27Å; L488-M501 HydrophobicContact CD1-CE 3.62Å; R497-M501 WeakPolarHBondContact O-CB 3Å; R497-M501 VanDerWaalsContact O-CG 3.3Å; R497-M501 WeakPolarHBondContact O-CG 3.39Å; R497-M501 PolarHBondContact O-N 3.4Å; Y498-M501 PolarHBondContact O-N 3.38Å; M501-L503 VanDerWaalsContact C-N 3.34Å; M501-L504 PolarHBondContact O-N 3.35Å; M501-L504 HydrophobicContact SD-CD1 4.28Å; M501-R505 VanDerWaalsContact O-CG 3.3Å; M501-R505 WeakPolarHBondContact O-CG 3.49Å; M501-R505 PolarHBondContact O-N 3Å; M501-L595 HydrophobicContact CE-CB 4.19Å
502	S	79.3	Confident	78.8	Confident	7 Å²	7	30.1 Å²	30.1	5%	0.049	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-41.1	175.2	-55.3	0	0	0	0	111.4	Y498 L499 L500 R505 L506	Y498-S502 WeakPolarHBondContact O-CB 3.28Å; Y498-S502 PolarHBondContact O-N 3.2Å; Y498-S502 PolarHBondContact O-OG 3.04Å; L499-S502 PolarHBondContact O-N 2.81Å; L500-S502 VanDerWaalsContact C-N 3.34Å; L500-S502 PolarHBondContact O-N 3.26Å; S502-R505 PolarHBondContact O-N 3.44Å; S502-L506 PolarHBondContact O-N 3.44Å
503	L	85.2	Confident	79.4	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-63.9	-44.9	174	-173.5	72.2	0	0	0	112.1	I280 L366 L499 L500 M501 R505 L506 F507 V532	I280-L503 HydrophobicContact CD1-CB 4.2Å; I280-L503 HydrophobicContact CD1-CD1 4.02Å; I280-L503 HydrophobicContact CG1-CD1 4.47Å; L366-L503 HydrophobicContact CD1-CD1 3.96Å; L366-L503 HydrophobicContact CD1-CD2 3.77Å; L366-L503 HydrophobicContact CD2-CD2 3.97Å; L499-L503 VanDerWaalsContact O-CB 3.27Å; L499-L503 WeakPolarHBondContact O-CB 3.38Å; L499-L503 PolarHBondContact O-N 3.29Å; L500-L503 WeakPolarHBondContact O-CB 3.49Å; L500-L503 PolarHBondContact O-N 3.09Å; M501-L503 VanDerWaalsContact C-N 3.34Å; L503-R505 VanDerWaalsContact C-N 3.35Å; L503-R505 PolarHBondContact O-N 2.74Å; L503-L506 WeakPolarHBondContact O-CB 3.46Å; L503-L506 PolarHBondContact O-N 3.35Å; L503-F507 HydrophobicContact CD1-CD1 4.43Å; L503-F507 HydrophobicContact CD1-CE1 3.71Å; L503-F507 HydrophobicContact CD1-CE2 4.01Å; L503-F507 HydrophobicContact CD1-CZ 3.46Å; L503-F507 VanDerWaalsContact CD1-CZ 3.46Å; L503-F507 HydrophobicContact CD2-CE2 3.79Å; L503-F507 HydrophobicContact CD2-CZ 3.96Å; L503-F507 HydrophobicContact CG-CD2 4.13Å; L503-F507 HydrophobicContact CG-CE1 4.18Å; L503-F507 HydrophobicContact CG-CE2 3.62Å; L503-F507 HydrophobicContact CG-CZ 3.64Å; L503-F507 WeakPolarHBondContact O-CG 3.49Å; L503-F507 PolarHBondContact O-N 3.23Å; L503-V532 HydrophobicContact CD2-CG2 4.01Å
504	L	85.9	Confident	80.1	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-39.4	178	-72.1	176.3	0	0	0	111.6	L500 M501 F507 K508 L585 L588 I589 A592 L595	L500-L504 HydrophobicContact CD1-CD1 4.38Å; L500-L504 HydrophobicContact CD1-CG 4.23Å; L500-L504 HydrophobicContact CG-CD1 4.06Å; L500-L504 HydrophobicContact CG-CG 4.31Å; L500-L504 WeakPolarHBondContact O-CB 3.19Å; L500-L504 VanDerWaalsContact O-CG 3.26Å; L500-L504 WeakPolarHBondContact O-CG 3.49Å; L500-L504 PolarHBondContact O-N 3.5Å; M501-L504 PolarHBondContact O-N 3.35Å; M501-L504 HydrophobicContact SD-CD1 4.28Å; L504-F507 PolarHBondContact O-N 3.42Å; L504-K508 VanDerWaalsContact O-CB 3.27Å; L504-K508 WeakPolarHBondContact O-CB 3.3Å; L504-K508 PolarHBondContact O-N 3.41Å; L504-L585 HydrophobicContact CD2-CD1 4.07Å; L504-L588 HydrophobicContact CD1-CB 4.21Å; L504-L588 HydrophobicContact CD2-CB 3.89Å; L504-I589 HydrophobicContact CD2-CG1 3.84Å; L504-A592 HydrophobicContact CB-CB 4.09Å; L504-L595 HydrophobicContact CD1-CD1 4.26Å
505	R	84.4	Confident	80.8	Confident	97 Å²	97	37.5 Å²	37.5	37%	0.366	19%	0.188	S	C	.	.	H	α-helix	trans	-61.4	-46.3	172.2	-73.6	176.4	-170.2	160	0.2	111.5	M501 S502 L503 K508 Q509 E596	M501-R505 VanDerWaalsContact O-CG 3.3Å; M501-R505 WeakPolarHBondContact O-CG 3.49Å; M501-R505 PolarHBondContact O-N 3Å; S502-R505 PolarHBondContact O-N 3.44Å; L503-R505 VanDerWaalsContact C-N 3.35Å; L503-R505 PolarHBondContact O-N 2.74Å; R505-K508 PolarHBondContact O-N 3.34Å; R505-Q509 WeakPolarHBondContact O-CG 3.23Å; R505-Q509 PolarHBondContact O-N 3.16Å; R505-E596 IonicContact CZ-OE1 3.33Å; R505-E596 IonicContact CZ-OE2 2.87Å; R505-E596 IonicContact NE-OE1 3.33Å; R505-E596 PolarHBondContact NE-OE1 3.27Å; R505-E596 IonicContact NE-OE2 3.01Å; R505-E596 PolarHBondContact NE-OE2 3.33Å; R505-E596 IonicContact NH2-OE1 2.74Å; R505-E596 PolarHBondContact NH2-OE1 3.25Å; R505-E596 IonicContact NH2-OE2 3.99Å; R505-E596 PolarHBondContact NH2-OE2 2.83Å
506	L	84.7	Confident	81.5	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-48.9	176.5	171.6	61.7	0	0	0	111.3	I280 I283 S502 L503 K508 Q509 I510	I280-L506 HydrophobicContact CG1-CD2 4.12Å; I280-L506 HydrophobicContact CG2-CB 4.28Å; I280-L506 HydrophobicContact CG2-CD2 4.32Å; I283-L506 HydrophobicContact CB-CD1 3.96Å; I283-L506 HydrophobicContact CB-CD2 4.46Å; I283-L506 HydrophobicContact CD1-CD2 4.36Å; I283-L506 HydrophobicContact CG2-CD1 3.35Å; I283-L506 HydrophobicContact CG2-CD2 4.44Å; S502-L506 PolarHBondContact O-N 3.44Å; L503-L506 WeakPolarHBondContact O-CB 3.46Å; L503-L506 PolarHBondContact O-N 3.35Å; L506-K508 VanDerWaalsContact C-N 3.3Å; L506-K508 PolarHBondContact O-N 2.81Å; L506-Q509 PolarHBondContact O-N 3.31Å; L506-I510 HydrophobicContact CD1-CD1 4Å; L506-I510 HydrophobicContact CD1-CG1 4.34Å; L506-I510 HydrophobicContact CG-CD1 4.1Å; L506-I510 WeakPolarHBondContact O-CG1 3.21Å; L506-I510 PolarHBondContact O-N 2.86Å
507	F	87.3	Confident	81.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-37.6	178.3	-70.9	-10.7	0	0	0	112.4	F296 L503 L504 I510 D511 L524 T528 I589	F296-F507 HydrophobicContact CE1-CE1 4.23Å; F296-F507 HydrophobicContact CE2-CE1 4.11Å; F296-F507 AromaticContact CZ-CE1 3.77Å; F296-F507 HydrophobicContact CZ-CE1 3.77Å; L503-F507 HydrophobicContact CD1-CD1 4.43Å; L503-F507 HydrophobicContact CD1-CE1 3.71Å; L503-F507 HydrophobicContact CD1-CE2 4.01Å; L503-F507 HydrophobicContact CD1-CZ 3.46Å; L503-F507 VanDerWaalsContact CD1-CZ 3.46Å; L503-F507 HydrophobicContact CD2-CE2 3.79Å; L503-F507 HydrophobicContact CD2-CZ 3.96Å; L503-F507 HydrophobicContact CG-CD2 4.13Å; L503-F507 HydrophobicContact CG-CE1 4.18Å; L503-F507 HydrophobicContact CG-CE2 3.62Å; L503-F507 HydrophobicContact CG-CZ 3.64Å; L503-F507 WeakPolarHBondContact O-CG 3.49Å; L503-F507 PolarHBondContact O-N 3.23Å; L504-F507 PolarHBondContact O-N 3.42Å; F507-I510 PolarHBondContact O-N 3.3Å; F507-D511 WeakPolarHBondContact O-CB 3.33Å; F507-D511 PolarHBondContact O-N 3.18Å; F507-L524 HydrophobicContact CB-CD1 4.12Å; F507-L524 HydrophobicContact CD1-CD2 3.93Å; F507-L524 HydrophobicContact CE1-CD2 4.23Å; F507-L524 HydrophobicContact CG-CD1 4.47Å; F507-L524 HydrophobicContact CG-CD2 4.46Å; F507-L524 WeakPolarHBondContact O-CD1 3.26Å; F507-T528 HydrophobicContact CE1-CG2 4.21Å; F507-T528 HydrophobicContact CE2-CG2 3.92Å; F507-T528 HydrophobicContact CZ-CG2 3.38Å; F507-I589 HydrophobicContact CB-CD1 3.94Å; F507-I589 HydrophobicContact CB-CG1 3.88Å; F507-I589 HydrophobicContact CB-CG2 4.05Å; F507-I589 HydrophobicContact CD2-CD1 3.73Å; F507-I589 HydrophobicContact CD2-CG1 4Å; F507-I589 HydrophobicContact CG-CD1 4.23Å; F507-I589 HydrophobicContact CG-CG1 4.46Å
508	K	85.8	Confident	82.2	Confident	32 Å²	32	40.6 Å²	40.6	14%	0.139	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-43.3	175.3	-176.7	50.4	173.9	151.7	0	111.6	L504 R505 L506 I510 D511 D512 I589 A592 H593	L504-K508 VanDerWaalsContact O-CB 3.27Å; L504-K508 WeakPolarHBondContact O-CB 3.3Å; L504-K508 PolarHBondContact O-N 3.41Å; R505-K508 PolarHBondContact O-N 3.34Å; L506-K508 VanDerWaalsContact C-N 3.3Å; L506-K508 PolarHBondContact O-N 2.81Å; K508-I510 VanDerWaalsContact C-N 3.33Å; K508-I510 PolarHBondContact O-N 3.17Å; K508-D511 PolarHBondContact O-N 3.34Å; K508-D512 WeakPolarHBondContact CE-OD1 3.2Å; K508-D512 IonicContact NZ-OD1 2.7Å; K508-D512 PolarHBondContact NZ-OD1 2.98Å; K508-D512 IonicContact NZ-OD2 2.69Å; K508-D512 PolarHBondContact O-N 3Å; K508-I589 HydrophobicContact CB-CG2 4.49Å; K508-A592 HydrophobicContact CB-CB 4.08Å; K508-A592 HydrophobicContact CG-CB 4.36Å; K508-H593 VanDerWaalsContact CG-NE2 3.35Å; K508-H593 WeakPolarHBondContact CG-NE2 3.26Å
509	Q	84.5	Confident	82.7	Confident	66 Å²	66	37 Å²	37	31%	0.308	19%	0.191	S	C	.	.	H	α-helix	trans	-61.6	-38.4	174.3	-72	179.9	-2.9	0	0	113	R505 L506 L513	R505-Q509 WeakPolarHBondContact O-CG 3.23Å; R505-Q509 PolarHBondContact O-N 3.16Å; L506-Q509 PolarHBondContact O-N 3.31Å; Q509-L513 WeakPolarHBondContact O-CG 3.46Å; Q509-L513 PolarHBondContact O-N 2.99Å
510	I	84.6	Confident	83.1	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-68.9	-39.5	176.5	-65	169.1	0	0	0	111.1	C290 L295 F296 L506 F507 K508 L513 S514 S517 M519 L524	C290-I510 HydrophobicContact CB-CG1 4.17Å; L295-I510 HydrophobicContact CD2-CD1 4.37Å; F296-I510 HydrophobicContact CE2-CD1 3.81Å; L506-I510 HydrophobicContact CD1-CD1 4Å; L506-I510 HydrophobicContact CD1-CG1 4.34Å; L506-I510 HydrophobicContact CG-CD1 4.1Å; L506-I510 WeakPolarHBondContact O-CG1 3.21Å; L506-I510 PolarHBondContact O-N 2.86Å; F507-I510 PolarHBondContact O-N 3.3Å; K508-I510 VanDerWaalsContact C-N 3.33Å; K508-I510 PolarHBondContact O-N 3.17Å; I510-L513 CarbonylContact O-C 3.5Å; I510-L513 VanDerWaalsContact O-C 3.27Å; I510-L513 PolarHBondContact O-N 3.13Å; I510-S514 PolarHBondContact O-N 3.4Å; I510-S514 VanDerWaalsContact O-N 3.09Å; I510-S517 PolarHBondContact O-OG 2.93Å; I510-M519 HydrophobicContact CG2-CB 3.67Å; I510-M519 HydrophobicContact CG2-CG 4.47Å; I510-M519 HydrophobicContact CG2-SD 4.26Å; I510-L524 HydrophobicContact CB-CD1 4.09Å; I510-L524 HydrophobicContact CD1-CD2 4.46Å; I510-L524 HydrophobicContact CG2-CD1 3.96Å; I510-L524 HydrophobicContact CG2-CD2 4.28Å
511	D	86.5	Confident	83.3	Confident	25 Å²	25	39.4 Å²	39.4	13%	0.134	21%	0.206	C	C	.	.	H	α-helix	trans	-67.4	-39.7	177.1	-177.4	53.9	0	0	0	112.3	F507 K508 L513 S514 T520 A521 L524	F507-D511 WeakPolarHBondContact O-CB 3.33Å; F507-D511 PolarHBondContact O-N 3.18Å; K508-D511 PolarHBondContact O-N 3.34Å; D511-L513 PolarHBondContact O-N 3.01Å; D511-S514 WeakPolarHBondContact O-CB 3.43Å; D511-S514 PolarHBondContact O-N 3.5Å; D511-S514 PolarHBondContact O-OG 2.85Å; D511-T520 WeakPolarHBondContact OD1-CA 3.4Å; D511-A521 HydrophobicContact CB-CB 4.27Å; D511-A521 PolarHBondContact OD1-N 3.3Å; D511-L524 HydrophobicContact CB-CD1 4.49Å
512	D	85.5	Confident	83.5	Confident	92 Å²	92	42.2 Å²	42.2	49%	0.492	22%	0.219	S	C	.	.	H	α-helix	trans	-62.8	-27.4	173.8	-68.3	-22.1	0	0	0	111.6	K508	K508-D512 WeakPolarHBondContact CE-OD1 3.2Å; K508-D512 IonicContact NZ-OD1 2.7Å; K508-D512 PolarHBondContact NZ-OD1 2.98Å; K508-D512 IonicContact NZ-OD2 2.69Å; K508-D512 PolarHBondContact O-N 3Å
513	L	83.1	Confident	83.7	Confident	52 Å²	52	44.1 Å²	44.1	27%	0.272	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	14.6	174	-66.1	169.6	0	0	0	113.1	C290 Q291 Q509 I510 D511 V515 T516 S517	C290-L513 HydrophobicContact CB-CD1 3.6Å; Q291-L513 HydrophobicContact CG-CD1 3.92Å; Q291-L513 HydrophobicContact CG-CD2 4.41Å; Q509-L513 WeakPolarHBondContact O-CG 3.46Å; Q509-L513 PolarHBondContact O-N 2.99Å; I510-L513 CarbonylContact O-C 3.5Å; I510-L513 VanDerWaalsContact O-C 3.27Å; I510-L513 PolarHBondContact O-N 3.13Å; D511-L513 PolarHBondContact O-N 3.01Å; L513-V515 PolarHBondContact O-N 2.85Å; L513-T516 WeakPolarHBondContact O-CA 3.43Å; L513-T516 PolarHBondContact O-N 3.32Å; L513-T516 PolarHBondContact O-OG1 2.95Å; L513-S517 PolarHBondContact O-N 3.47Å; L513-S517 PolarHBondContact O-OG 3.43Å
514	S	82.1	Confident	83.7	Confident	34 Å²	34	44.1 Å²	44.1	24%	0.238	23%	0.232	C	C	.	.	H	α-helix	trans	-54.5	-28.9	-174.7	54.9	0	0	0	0	114.3	I510 D511 T516 S517 K518 M519	I510-S514 PolarHBondContact O-N 3.4Å; I510-S514 VanDerWaalsContact O-N 3.09Å; D511-S514 WeakPolarHBondContact O-CB 3.43Å; D511-S514 PolarHBondContact O-N 3.5Å; D511-S514 PolarHBondContact O-OG 2.85Å; S514-T516 PolarHBondContact O-N 3.42Å; S514-S517 WeakPolarHBondContact CA-OG 3.27Å; S514-K518 WeakPolarHBondContact O-CA 3.43Å; S514-K518 PolarHBondContact O-N 3.46Å; S514-M519 WeakPolarHBondContact CB-O 3.26Å
515	V	79.4	Confident	83.7	Confident	139 Å²	139	44 Å²	44	84%	0.842	23%	0.231	S	C	*	.	H	α-helix	trans	-60.3	-36.2	174.4	-177.1	0	0	0	0	111.5	L513	L513-V515 PolarHBondContact O-N 2.85Å
516	T	79	Confident	83.7	Confident	70 Å²	70	46.6 Å²	46.6	43%	0.429	24%	0.241	S	C	.	.	H	α-helix	trans	-94.2	-43.3	-179.6	61.4	0	0	0	0	112.7	L513 S514 K518	L513-T516 WeakPolarHBondContact O-CA 3.43Å; L513-T516 PolarHBondContact O-N 3.32Å; L513-T516 PolarHBondContact O-OG1 2.95Å; S514-T516 PolarHBondContact O-N 3.42Å; T516-K518 VanDerWaalsContact C-N 3.32Å
517	S	78.3	Confident	83.5	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-77.6	-18.8	-178	68.1	0	0	0	0	112.6	E293 G294 I510 L513 S514 M519	E293-S517 WeakPolarHBondContact CA-O 3.31Å; G294-S517 PolarHBondContact N-O 3.05Å; I510-S517 PolarHBondContact O-OG 2.93Å; L513-S517 PolarHBondContact O-N 3.47Å; L513-S517 PolarHBondContact O-OG 3.43Å; S514-S517 WeakPolarHBondContact CA-OG 3.27Å; S517-M519 WeakPolarHBondContact O-CG 3.33Å; S517-M519 PolarHBondContact O-N 3.21Å; S517-M519 PolarHBondContact OG-N 3.46Å
518	K	80	Confident	83.3	Confident	120 Å²	120	49 Å²	49	52%	0.522	26%	0.257	S	S	.	.			trans	54.9	24.3	-168.4	-57	-173	-170.3	163.7	0	113.3	E293 S514 T516	E293-K518 HydrophobicContact CG-CB 4.38Å; E293-K518 HydrophobicContact CG-CD 4.02Å; E293-K518 HydrophobicContact CG-CG 4.17Å; E293-K518 VanDerWaalsContact OE1-CD 3.24Å; E293-K518 WeakPolarHBondContact OE1-CD 3.42Å; E293-K518 WeakPolarHBondContact OE1-CE 3.22Å; E293-K518 IonicContact OE1-NZ 2.67Å; E293-K518 PolarHBondContact OE1-NZ 3.44Å; E293-K518 IonicContact OE2-NZ 3.72Å; S514-K518 WeakPolarHBondContact O-CA 3.43Å; S514-K518 PolarHBondContact O-N 3.46Å; T516-K518 VanDerWaalsContact C-N 3.32Å
519	M	79.9	Confident	83.2	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.02	25%	0.251	C	S	.	.			trans	-116	98.8	-178.7	-69.3	-161.8	74.5	0	0	109.9	L295 F296 I510 S514 S517 L524	L295-M519 HydrophobicContact CB-SD 4.05Å; L295-M519 PolarHBondContact N-SD 2.92Å; L295-M519 VanDerWaalsContact N-SD 3.42Å; F296-M519 HydrophobicContact CB-CE 3.45Å; F296-M519 VanDerWaalsContact CB-CE 3.45Å; F296-M519 HydrophobicContact CB-SD 4.37Å; F296-M519 HydrophobicContact CD2-CE 3.72Å; F296-M519 HydrophobicContact CD2-SD 4.06Å; F296-M519 HydrophobicContact CG-CE 4Å; F296-M519 PolarHBondContact N-SD 3.41Å; F296-M519 VanDerWaalsContact N-SD 3.42Å; I510-M519 HydrophobicContact CG2-CB 3.67Å; I510-M519 HydrophobicContact CG2-CG 4.47Å; I510-M519 HydrophobicContact CG2-SD 4.26Å; S514-M519 WeakPolarHBondContact CB-O 3.26Å; S517-M519 WeakPolarHBondContact O-CG 3.33Å; S517-M519 PolarHBondContact O-N 3.21Å; S517-M519 PolarHBondContact OG-N 3.46Å; M519-L524 HydrophobicContact CB-CG 4.37Å; M519-L524 HydrophobicContact CE-CD2 3.3Å; M519-L524 HydrophobicContact CE-CG 3.83Å; M519-L524 HydrophobicContact SD-CD2 4.29Å
520	T	86.6	Confident	82.9	Confident	58 Å²	58	48.9 Å²	48.9	36%	0.356	26%	0.256	S	S	.	.			trans	-78.4	161.3	171.1	64	0	0	0	0	110.9	D511 E522 C523 L524	D511-T520 WeakPolarHBondContact OD1-CA 3.4Å; T520-E522 PolarHBondContact O-N 3.37Å; T520-E522 VanDerWaalsContact O-N 3.16Å; T520-C523 WeakPolarHBondContact O-CA 3.34Å; T520-C523 WeakPolarHBondContact O-CB 3.2Å; T520-C523 PolarHBondContact O-N 3.48Å; T520-C523 PolarHBondContact OG1-N 3.49Å; T520-C523 PolarHBondContact OG1-SG 2.9Å; T520-L524 PolarHBondContact O-N 3.31Å
521	A	85.9	Confident	82.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-53.2	-35.3	173.9	0	0	0	0	0	112.2	D511 S525 T586 I589 K590	D511-A521 HydrophobicContact CB-CB 4.27Å; D511-A521 PolarHBondContact OD1-N 3.3Å; A521-S525 VanDerWaalsContact O-CB 3.24Å; A521-S525 WeakPolarHBondContact O-CB 3.42Å; A521-S525 PolarHBondContact O-N 3.41Å; A521-S525 PolarHBondContact O-OG 2.86Å; A521-T586 HydrophobicContact CB-CG2 4.18Å; A521-I589 HydrophobicContact CB-CB 4.18Å; A521-I589 HydrophobicContact CB-CD1 4.47Å; A521-I589 HydrophobicContact CB-CG2 3.74Å; A521-K590 HydrophobicContact CB-CG 4.39Å
522	E	84.7	Confident	82.3	Confident	86 Å²	86	48 Å²	48	40%	0.402	25%	0.252	S	S	.	.	H	α-helix	trans	-68	-44.3	174.5	-170.3	-171.4	164.6	0	0	111.7	T520 S525 R526 I582	T520-E522 PolarHBondContact O-N 3.37Å; T520-E522 VanDerWaalsContact O-N 3.16Å; E522-S525 PolarHBondContact O-N 3.14Å; E522-R526 VanDerWaalsContact O-CG 3.29Å; E522-R526 WeakPolarHBondContact O-CG 3.28Å; E522-R526 PolarHBondContact O-N 3.24Å; E522-R526 IonicContact OE1-CZ 3.25Å; E522-R526 VanDerWaalsContact OE1-CZ 3.25Å; E522-R526 IonicContact OE1-NE 3.23Å; E522-R526 PolarHBondContact OE1-NE 2.89Å; E522-R526 IonicContact OE1-NH2 2.64Å; E522-R526 PolarHBondContact OE1-NH2 3.49Å; E522-I582 HydrophobicContact CG-CG2 4.42Å
523	C	83.8	Confident	82	Confident	47 Å²	47	43.9 Å²	43.9	32%	0.318	23%	0.23	S	C	.	.	H	α-helix	trans	-62.4	-44.9	176.1	-68	0	0	0	0	111.5	T520 S525 R526 C527	T520-C523 WeakPolarHBondContact O-CA 3.34Å; T520-C523 WeakPolarHBondContact O-CB 3.2Å; T520-C523 PolarHBondContact O-N 3.48Å; T520-C523 PolarHBondContact OG1-N 3.49Å; T520-C523 PolarHBondContact OG1-SG 2.9Å; C523-S525 VanDerWaalsContact C-N 3.32Å; C523-S525 PolarHBondContact O-N 3.22Å; C523-R526 PolarHBondContact O-N 3.47Å; C523-C527 PolarHBondContact O-N 3.48Å; C523-C527 PolarHBondContact O-SG 3.03Å; C523-C527 VanDerWaalsContact O-SG 3.36Å
524	L	85.6	Confident	81.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.3	-45.8	174.1	-75	161.3	0	0	0	110.9	F296 F507 I510 D511 M519 T520 R526 C527 T528 I589	F296-L524 HydrophobicContact CD2-CD2 3.77Å; F296-L524 HydrophobicContact CE2-CD2 4.14Å; F296-L524 HydrophobicContact CG-CD2 4.4Å; F507-L524 HydrophobicContact CB-CD1 4.12Å; F507-L524 HydrophobicContact CD1-CD2 3.93Å; F507-L524 HydrophobicContact CE1-CD2 4.23Å; F507-L524 HydrophobicContact CG-CD1 4.47Å; F507-L524 HydrophobicContact CG-CD2 4.46Å; F507-L524 WeakPolarHBondContact O-CD1 3.26Å; I510-L524 HydrophobicContact CB-CD1 4.09Å; I510-L524 HydrophobicContact CD1-CD2 4.46Å; I510-L524 HydrophobicContact CG2-CD1 3.96Å; I510-L524 HydrophobicContact CG2-CD2 4.28Å; D511-L524 HydrophobicContact CB-CD1 4.49Å; M519-L524 HydrophobicContact CB-CG 4.37Å; M519-L524 HydrophobicContact CE-CD2 3.3Å; M519-L524 HydrophobicContact CE-CG 3.83Å; M519-L524 HydrophobicContact SD-CD2 4.29Å; T520-L524 PolarHBondContact O-N 3.31Å; L524-R526 PolarHBondContact O-N 3.47Å; L524-C527 PolarHBondContact O-N 2.87Å; L524-T528 WeakPolarHBondContact O-CB 3.28Å; L524-T528 WeakPolarHBondContact O-CG2 3.22Å; L524-T528 PolarHBondContact O-N 2.66Å; L524-T528 PolarHBondContact O-OG1 2.96Å; L524-I589 HydrophobicContact CB-CD1 4.25Å
525	S	86.4	Confident	80.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-41.2	179.5	-63.1	0	0	0	0	112.4	A521 E522 C523 C527 T528 A529 I582 T586 I589	A521-S525 VanDerWaalsContact O-CB 3.24Å; A521-S525 WeakPolarHBondContact O-CB 3.42Å; A521-S525 PolarHBondContact O-N 3.41Å; A521-S525 PolarHBondContact O-OG 2.86Å; E522-S525 PolarHBondContact O-N 3.14Å; C523-S525 VanDerWaalsContact C-N 3.32Å; C523-S525 PolarHBondContact O-N 3.22Å; S525-C527 VanDerWaalsContact C-N 3.28Å; S525-C527 PolarHBondContact O-N 2.96Å; S525-T528 PolarHBondContact O-N 3.16Å; S525-A529 WeakPolarHBondContact O-CB 3.37Å; S525-A529 PolarHBondContact O-N 3.27Å; S525-I582 WeakPolarHBondContact CB-O 3.28Å; S525-T586 WeakPolarHBondContact CB-OG1 3.48Å; S525-T586 WeakPolarHBondContact OG-CA 3.41Å; S525-T586 PolarHBondContact OG-N 3.35Å; S525-T586 VanDerWaalsContact OG-N 3.1Å; S525-T586 PolarHBondContact OG-OG1 3.44Å; S525-T586 VanDerWaalsContact OG-OG1 3.1Å; S525-I589 WeakPolarHBondContact OG-CD1 3.14Å
526	R	83.6	Confident	80.1	Confident	151 Å²	151	37.1 Å²	37.1	57%	0.57	20%	0.196	S	C	*	.	H	α-helix	trans	-59.2	-38.1	174.4	-73.7	171.5	179.9	-151.6	2	112.4	E522 C523 L524 I582	E522-R526 VanDerWaalsContact O-CG 3.29Å; E522-R526 WeakPolarHBondContact O-CG 3.28Å; E522-R526 PolarHBondContact O-N 3.24Å; E522-R526 IonicContact OE1-CZ 3.25Å; E522-R526 VanDerWaalsContact OE1-CZ 3.25Å; E522-R526 IonicContact OE1-NE 3.23Å; E522-R526 PolarHBondContact OE1-NE 2.89Å; E522-R526 IonicContact OE1-NH2 2.64Å; E522-R526 PolarHBondContact OE1-NH2 3.49Å; C523-R526 PolarHBondContact O-N 3.47Å; L524-R526 PolarHBondContact O-N 3.47Å; R526-I582 HydrophobicContact CG-CD1 3.91Å; R526-I582 HydrophobicContact CG-CG1 4.29Å; R526-I582 HydrophobicContact CG-CG2 3.94Å
527	C	80.6	Confident	79.2	Confident	50 Å²	50	37.8 Å²	37.8	34%	0.338	20%	0.196	S	C	.	.	H	α-helix	trans	-77.2	-29.3	179.1	-64.2	0	0	0	0	113.4	F296 C523 L524 S525	F296-C527 HydrophobicContact CB-CB 4.29Å; F296-C527 PolarHBondContact O-SG 2.93Å; C523-C527 PolarHBondContact O-N 3.48Å; C523-C527 PolarHBondContact O-SG 3.03Å; C523-C527 VanDerWaalsContact O-SG 3.36Å; L524-C527 PolarHBondContact O-N 2.87Å; S525-C527 VanDerWaalsContact C-N 3.28Å; S525-C527 PolarHBondContact O-N 2.96Å
528	T	83.6	Confident	77.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-115.1	-16.6	-164.6	59.1	0	0	0	0	114.2	F296 L363 F507 L524 S525 F530 A531 V532 L585	F296-T528 HydrophobicContact CD1-CG2 4.34Å; L363-T528 HydrophobicContact CD2-CG2 3.75Å; F507-T528 HydrophobicContact CE1-CG2 4.21Å; F507-T528 HydrophobicContact CE2-CG2 3.92Å; F507-T528 HydrophobicContact CZ-CG2 3.38Å; L524-T528 WeakPolarHBondContact O-CB 3.28Å; L524-T528 WeakPolarHBondContact O-CG2 3.22Å; L524-T528 PolarHBondContact O-N 2.66Å; L524-T528 PolarHBondContact O-OG1 2.96Å; S525-T528 PolarHBondContact O-N 3.16Å; T528-F530 PolarHBondContact O-N 3.46Å; T528-F530 VanDerWaalsContact O-N 3.1Å; T528-A531 PolarHBondContact O-N 2.99Å; T528-V532 WeakPolarHBondContact O-CG2 3.42Å; T528-V532 PolarHBondContact O-N 3.24Å; T528-L585 VanDerWaalsContact OG1-CD2 3.29Å; T528-L585 WeakPolarHBondContact OG1-CD2 3.22Å
529	A	82.9	Confident	76.3	Confident	2 Å²	2	45.1 Å²	45.1	2%	0.017	23%	0.231	C	C	.	.	H	α-helix	trans	-55.7	-34.2	-176	0	0	0	0	0	113.5	S525 F533 R581 I582 L585	S525-A529 WeakPolarHBondContact O-CB 3.37Å; S525-A529 PolarHBondContact O-N 3.27Å; A529-F533 HydrophobicContact CB-CD2 4.5Å; A529-F533 WeakPolarHBondContact O-CB 2.9Å; A529-F533 PolarHBondContact O-N 2.58Å; A529-R581 HydrophobicContact CB-CB 4.22Å; A529-I582 HydrophobicContact CB-CG1 4.23Å; A529-L585 HydrophobicContact CB-CD2 4.19Å
530	F	79.5	Confident	74.3	Confident	93 Å²	93	54 Å²	54	41%	0.408	27%	0.27	S	S	.	.	H	α-helix	trans	-67.8	-40.4	175.1	-76.3	-79.4	0	0	0	113.1	T528 G534 P536 I578	T528-F530 PolarHBondContact O-N 3.46Å; T528-F530 VanDerWaalsContact O-N 3.1Å; F530-G534 CarbonylContact O-C 3.58Å; F530-G534 WeakPolarHBondContact O-CA 3.45Å; F530-G534 PolarHBondContact O-N 3.29Å; F530-P536 VanDerWaalsContact CE1-CD 3.44Å; F530-P536 HydrophobicContact CE1-CG 4.28Å; F530-I578 HydrophobicContact CE2-CD1 3.47Å; F530-I578 VanDerWaalsContact CE2-CD1 3.47Å; F530-I578 HydrophobicContact CE2-CG1 4.25Å; F530-I578 HydrophobicContact CZ-CD1 3.41Å; F530-I578 VanDerWaalsContact CZ-CD1 3.41Å; F530-I578 HydrophobicContact CZ-CG1 4.13Å
531	A	77.3	Confident	72	Confident	8 Å²	8	60.3 Å²	60.3	7%	0.066	29%	0.292	C	S	.	.	H	α-helix	trans	-71.8	-33	177.5	0	0	0	0	0	111.6	L363 L366 G417 L418 T528	L363-A531 HydrophobicContact CD2-CB 3.71Å; L366-A531 HydrophobicContact CB-CB 4.13Å; G417-A531 WeakPolarHBondContact CA-O 3.36Å; L418-A531 PolarHBondContact N-O 2.61Å; L418-A531 VanDerWaalsContact N-O 3.12Å; T528-A531 PolarHBondContact O-N 2.99Å
532	V	80.9	Confident	69.5	Low	0 Å²	0	65 Å²	65	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-80.1	-44.4	-179	177.4	0	0	0	0	112.4	G417 L418 I419 L500 L503 T528 L585	G417-V532 CarbonylContact C-O 3.58Å; L418-V532 PolarHBondContact N-O 3.31Å; L418-V532 VanDerWaalsContact N-O 3.07Å; I419-V532 HydrophobicContact CD1-CG1 3.64Å; I419-V532 HydrophobicContact CG1-CG1 3.97Å; I419-V532 PolarHBondContact N-O 2.94Å; L500-V532 HydrophobicContact CD1-CG1 4.13Å; L503-V532 HydrophobicContact CD2-CG2 4.01Å; T528-V532 WeakPolarHBondContact O-CG2 3.42Å; T528-V532 PolarHBondContact O-N 3.24Å; V532-L585 HydrophobicContact CB-CD2 4.33Å; V532-L585 HydrophobicContact CG1-CD1 4.38Å; V532-L585 HydrophobicContact CG2-CD2 4.13Å
533	F	78.5	Confident	67	Low	7 Å²	7	69.8 Å²	69.8	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-106.8	-6.8	-175.2	-64.7	-67.9	0	0	0	114.9	I419 L427 F428 A529 R581 T584 L585 L588	I419-F533 HydrophobicContact CB-CD1 4.23Å; I419-F533 HydrophobicContact CD1-CD1 4.09Å; I419-F533 HydrophobicContact CD1-CE1 3.63Å; I419-F533 HydrophobicContact CD1-CZ 4.29Å; I419-F533 HydrophobicContact CG2-CD1 4.45Å; L427-F533 HydrophobicContact CD1-CE1 3.94Å; F428-F533 AromaticContact CE1-CD1 3.78Å; F428-F533 HydrophobicContact CE1-CD1 3.78Å; F428-F533 HydrophobicContact CE1-CD2 4.1Å; F428-F533 AromaticContact CE1-CE1 3.74Å; F428-F533 HydrophobicContact CE1-CE1 3.74Å; F428-F533 HydrophobicContact CE1-CE2 4.03Å; F428-F533 AromaticContact CE1-CG 3.96Å; F428-F533 HydrophobicContact CE1-CG 3.96Å; F428-F533 AromaticContact CE1-CZ 3.89Å; F428-F533 HydrophobicContact CE1-CZ 3.89Å; F428-F533 HydrophobicContact CZ-CB 4.14Å; F428-F533 AromaticContact CZ-CD1 3.71Å; F428-F533 HydrophobicContact CZ-CD1 3.71Å; F428-F533 HydrophobicContact CZ-CD2 4.35Å; F428-F533 HydrophobicContact CZ-CE1 4.14Å; F428-F533 AromaticContact CZ-CG 3.84Å; F428-F533 HydrophobicContact CZ-CG 3.84Å; A529-F533 HydrophobicContact CB-CD2 4.5Å; A529-F533 WeakPolarHBondContact O-CB 2.9Å; A529-F533 PolarHBondContact O-N 2.58Å; F533-R581 HydrophobicContact CD2-CB 3.98Å; F533-R581 HydrophobicContact CD2-CG 4.4Å; F533-R581 HydrophobicContact CE2-CB 4.49Å; F533-R581 WeakPolarHBondContact CE2-O 3.44Å; F533-R581 PolarHBondContact O-NH1 3.44Å; F533-T584 HydrophobicContact CE1-CG2 4.46Å; F533-T584 HydrophobicContact CE2-CG2 4.48Å; F533-T584 HydrophobicContact CZ-CG2 3.74Å; F533-L585 HydrophobicContact CE2-CB 3.96Å; F533-L588 HydrophobicContact CZ-CD1 4.34Å
534	G	73.3	Confident	64.5	Low	5 Å²	5	73.7 Å²	73.7	5%	0.052	37%	0.365	C	S	.	.			trans	80.4	172	-171.7	0	0	0	0	0	113.2	F530 R581	F530-G534 CarbonylContact O-C 3.58Å; F530-G534 WeakPolarHBondContact O-CA 3.45Å; F530-G534 PolarHBondContact O-N 3.29Å; G534-R581 PolarHBondContact O-NH1 3.07Å
535	A	66.9	Low	61.9	Low	39 Å²	39	79.2 Å²	79.2	32%	0.322	40%	0.403	S	S	.	.			trans	-68.3	143.5	176.5	0	0	0	0	0	111.8	L537	A535-L537 PolarHBondContact O-N 2.93Å
536	P	64.1	Low	59.3	Low	39 Å²	39	86 Å²	86	25%	0.253	44%	0.438	S	S	.	.			trans	-63.2	136.2	171.7	28.2	-31.8	0	0	0	109.2	F530 K538 N576	F530-P536 VanDerWaalsContact CE1-CD 3.44Å; F530-P536 HydrophobicContact CE1-CG 4.28Å; P536-K538 PolarHBondContact O-N 3.26Å; P536-N576 HydrophobicContact CB-CB 4.48Å; P536-N576 WeakPolarHBondContact CB-O 3.33Å
537	L	60.3	Low	56.7	Low	83 Å²	83	83.9 Å²	83.9	44%	0.435	44%	0.442	S	S	.	.			trans	-71.6	114.9	179.3	-63.2	172.1	0	0	0	108.4	L421 A535 I539 N576	L421-L537 HydrophobicContact CD2-CD1 3.98Å; A535-L537 PolarHBondContact O-N 2.93Å; L537-I539 PolarHBondContact O-N 3.48Å; L537-N576 WeakPolarHBondContact CA-OD1 3.31Å; L537-N576 PolarHBondContact N-OD1 3.14Å; L537-N576 PolarHBondContact O-ND2 3.21Å; L537-N576 VanDerWaalsContact O-ND2 3.09Å; L537-N576 PolarHBondContact O-OD1 3.22Å; L537-N576 VanDerWaalsContact O-OD1 3.13Å
538	K	52	Low	54.4	Low	184 Å²	184	88.3 Å²	88.3	80%	0.8	46%	0.461	S	S	*	.			trans	-73.1	94.9	169.5	-73	-174.6	179.6	178.7	0	108.5	P536 K540	P536-K538 PolarHBondContact O-N 3.26Å; K538-K540 PolarHBondContact O-N 2.99Å; K538-K540 VanDerWaalsContact O-N 3.13Å
539	I	45.9	Very low	51.9	Low	91 Å²	91	92.5 Å²	92.5	47%	0.467	49%	0.486	S	S	.	.			trans	-70.8	108.5	169.2	-56.2	172.6	0	0	0	106.6	L537 K541 E572	L537-I539 PolarHBondContact O-N 3.48Å; I539-K541 PolarHBondContact O-N 2.93Å; I539-E572 HydrophobicContact CD1-CB 3.68Å; I539-E572 HydrophobicContact CD1-CG 4.5Å
540	K	38	Very low	49.4	Very low	190 Å²	190	100 Å²	100	83%	0.826	53%	0.527	S	S	*	.			trans	-59.4	110.8	164	-78.2	-179.3	179.8	173.3	0	105.6	K538 S542	K538-K540 PolarHBondContact O-N 2.99Å; K538-K540 VanDerWaalsContact O-N 3.13Å; K540-S542 VanDerWaalsContact C-N 3.29Å; K540-S542 PolarHBondContact O-N 3.14Å
541	K	37.5	Very low	46.9	Very low	191 Å²	191	105.4 Å²	105.4	83%	0.83	54%	0.544	S	S	*	.			trans	-57.1	98.1	168.3	-73.5	-177.9	178	-178.9	0	106.7	I539 H543	I539-K541 PolarHBondContact O-N 2.93Å; K541-H543 PolarHBondContact O-N 2.8Å
542	S	34.1	Very low	44.9	Very low	98 Å²	98	113.5 Å²	113.5	69%	0.685	58%	0.58	S	S	*	*			trans	-67	119.9	164.1	48.1	0	0	0	0	105.9	K540 N544	K540-S542 VanDerWaalsContact C-N 3.29Å; K540-S542 PolarHBondContact O-N 3.14Å; S542-N544 PolarHBondContact O-N 3Å
543	H	32.7	Very low	42.7	Very low	187 Å²	187	121 Å²	121	87%	0.866	62%	0.615	S	S	*	*	S	Bend	trans	-65.1	80.6	164.9	-84.6	-88	0	0	0	107.8	K541	K541-H543 PolarHBondContact O-N 2.8Å
544	N	31.7	Very low	40.5	Very low	130 Å²	130	126.7 Å²	126.7	70%	0.695	65%	0.645	S	S	*	*			trans	-149.6	101.3	157.9	-90.5	-19.4	0	0	0	105.1	S542 I546	S542-N544 PolarHBondContact O-N 3Å; N544-I546 PolarHBondContact O-N 3.38Å
545	S	29.2	Very low	38.6	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	68%	0.682	S	S	*	*			trans	-59.6	88.5	164.8	48.5	0	0	0	0	107.8	T547	S545-T547 PolarHBondContact O-N 3.46Å
546	I	32.5	Very low	36.9	Very low	143 Å²	143	145.1 Å²	145.1	73%	0.733	71%	0.713	S	S	*	*			trans	-74.3	89.2	165	-61.1	176.6	0	0	0	105.1	N544 I548	N544-I546 PolarHBondContact O-N 3.38Å; I546-I548 VanDerWaalsContact C-N 3.29Å; I546-I548 HydrophobicContact CG2-CG1 4.22Å; I546-I548 PolarHBondContact O-N 2.93Å
547	T	28.4	Very low	35.3	Very low	105 Å²	105	154.6 Å²	154.6	64%	0.644	74%	0.743	S	S	*	*			trans	-58.2	95.9	162.9	-40.4	0	0	0	0	106.4	S545 T549	S545-T547 PolarHBondContact O-N 3.46Å; T547-T549 HydrophobicContact CG2-CG2 4.01Å; T547-T549 PolarHBondContact O-N 2.79Å
548	I	32.6	Very low	34.1	Very low	143 Å²	143	158.9 Å²	158.9	73%	0.733	77%	0.765	S	S	*	*			trans	-69.8	87.4	165.6	-58.9	176.7	0	0	0	105.4	I546 N550	I546-I548 VanDerWaalsContact C-N 3.29Å; I546-I548 HydrophobicContact CG2-CG1 4.22Å; I546-I548 PolarHBondContact O-N 2.93Å; I548-N550 PolarHBondContact O-N 3.28Å; I548-N550 VanDerWaalsContact O-N 3.11Å
549	T	31.3	Very low	33.2	Very low	88 Å²	88	160.3 Å²	160.3	54%	0.54	77%	0.772	S	S	.	*			trans	-65.4	107.7	166.7	53.3	0	0	0	0	106.9	T547 R551	T547-T549 HydrophobicContact CG2-CG2 4.01Å; T547-T549 PolarHBondContact O-N 2.79Å; T549-R551 VanDerWaalsContact C-N 3.25Å; T549-R551 PolarHBondContact O-N 2.8Å
550	N	29.8	Very low	32.4	Very low	161 Å²	161	159 Å²	159	86%	0.861	78%	0.781	S	S	*	*			trans	-56.7	92.7	162	-92.5	-25.5	0	0	0	108.4	I548	I548-N550 PolarHBondContact O-N 3.28Å; I548-N550 VanDerWaalsContact O-N 3.11Å
551	R	28.3	Very low	32.2	Very low	206 Å²	206	157.2 Å²	157.2	78%	0.777	78%	0.781	S	S	*	*			trans	-103.3	73.4	169.5	-83.8	-172.7	179.1	160.7	0.5	109.1	T549	T549-R551 VanDerWaalsContact C-N 3.25Å; T549-R551 PolarHBondContact O-N 2.8Å
552	H	35	Very low	32	Very low	178 Å²	178	155.4 Å²	155.4	82%	0.824	78%	0.779	S	S	*	*			trans	-150.1	92.1	151.1	-81.8	-64.6	0	0	0	105.9
553	H	33.6	Very low	31.8	Very low	158 Å²	158	158.3 Å²	158.3	73%	0.731	79%	0.786	S	S	*	*				96.5	110	91.5	-109.3	50.4	0	0	0	111.3
554	N	33.9	Very low	31.9	Very low	125 Å²	125	154.3 Å²	154.3	67%	0.668	78%	0.779	S	S	*	*			trans	95.7	94.6	152.4	-55.3	-19.7	0	0	0	119.7
555	H	31.9	Very low	31.9	Very low	177 Å²	177	155.4 Å²	155.4	82%	0.819	79%	0.785	S	S	*	*			trans	59.8	94.8	130.3	-69.2	-69.3	0	0	0	120.1
556	R	31.6	Very low	32.1	Very low	255 Å²	255	157 Å²	157	96%	0.962	79%	0.785	S	S	*	*				-171.3	133	104	-116	176.4	-178.4	-178.4	0.5	111.7
557	R	30.1	Very low	32	Very low	237 Å²	237	155.9 Å²	155.9	89%	0.894	78%	0.78	S	S	*	*			trans	-64.8	144.6	-179.5	-66	171.8	168.7	-175.4	-3.9	112.2
558	L	36.1	Very low	32.3	Very low	173 Å²	173	156.1 Å²	156.1	91%	0.906	78%	0.781	S	S	*	*			trans	175.4	84.3	143.9	-92.4	148	0	0	0	106.1
559	K	32.2	Very low	32.3	Very low	214 Å²	214	157.8 Å²	157.8	93%	0.93	78%	0.779	S	S	*	*				56.2	99.1	83	-146.4	-177.1	-171.5	-172.4	0	112.5
560	G	30.7	Very low	32.7	Very low	65 Å²	65	156.6 Å²	156.6	67%	0.67	77%	0.772	S	S	*	*			trans	150.3	112.5	163.7	0	0	0	0	0	115
561	D	32.7	Very low	33	Very low	152 Å²	152	154 Å²	154	81%	0.813	75%	0.754	S	S	*	*			trans	65.4	94.7	148.6	-47.9	-23.7	0	0	0	118.4
562	I	34	Very low	33.7	Very low	153 Å²	153	149.6 Å²	149.6	79%	0.785	74%	0.742	S	S	*	*				46.1	109.1	82.8	-50.1	176.4	0	0	0	112.6
563	N	29.9	Very low	34	Very low	158 Å²	158	144.3 Å²	144.3	85%	0.845	73%	0.725	S	S	*	*			trans	102.4	76.7	172.6	-55	-27.6	0	0	0	116.4
564	S	33.6	Very low	34.6	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	70%	0.704	S	S	*	*			trans	-143.9	127.1	145.6	74.8	0	0	0	0	110.3	N566	S564-N566 PolarHBondContact O-N 3.49Å
565	D	33.6	Very low	35.5	Very low	154 Å²	154	135.1 Å²	135.1	82%	0.824	68%	0.677	S	S	*	*			trans	-57.1	118.6	178.5	-70.8	-49.1	0	0	0	110.1	N567	D565-N567 PolarHBondContact O-N 3.42Å
566	N	32.1	Very low	36.8	Very low	150 Å²	150	128.3 Å²	128.3	80%	0.802	65%	0.646	S	S	*	*			trans	-64.4	74.8	174.3	-76.6	-41	0	0	0	110.8	S564 V568	S564-N566 PolarHBondContact O-N 3.49Å; N566-V568 PolarHBondContact O-N 3.48Å
567	N	30.4	Very low	38.6	Very low	119 Å²	119	117.8 Å²	117.8	64%	0.636	61%	0.612	S	S	*	*			trans	-77.6	64.4	166.4	-96	-15	0	0	0	110	D565 Y569	D565-N567 PolarHBondContact O-N 3.42Å; N567-Y569 HydrophobicContact CB-CD2 4.13Å; N567-Y569 HydrophobicContact CB-CE2 4.11Å; N567-Y569 PolarHBondContact O-N 3.26Å
568	V	34.9	Very low	40.9	Very low	109 Å²	109	110 Å²	110	66%	0.661	59%	0.587	S	S	*	*			trans	-77.1	77.8	163.2	-175.6	0	0	0	0	107.1	N566 T570	N566-V568 PolarHBondContact O-N 3.48Å; V568-T570 HydrophobicContact CG1-CG2 4.01Å; V568-T570 PolarHBondContact O-N 3.23Å
569	Y	33.7	Very low	42.9	Very low	178 Å²	178	105.4 Å²	105.4	70%	0.698	57%	0.567	S	S	*	*			trans	-67.3	91.9	162.9	-78.2	-81.6	0	0	0	107.4	N567 F571	N567-Y569 HydrophobicContact CB-CD2 4.13Å; N567-Y569 HydrophobicContact CB-CE2 4.11Å; N567-Y569 PolarHBondContact O-N 3.26Å; Y569-F571 PolarHBondContact O-N 3.2Å
570	T	38.1	Very low	45	Very low	64 Å²	64	97.1 Å²	97.1	39%	0.393	53%	0.53	S	S	.	.			trans	-56.2	135.6	174.8	47.6	0	0	0	0	109.6	V568 E572 S573	V568-T570 HydrophobicContact CG1-CG2 4.01Å; V568-T570 PolarHBondContact O-N 3.23Å; T570-E572 PolarHBondContact O-N 3.49Å; T570-S573 WeakPolarHBondContact O-CB 3.37Å; T570-S573 PolarHBondContact O-N 3.36Å
571	F	36.3	Very low	47.5	Very low	107 Å²	107	94.1 Å²	94.1	47%	0.469	50%	0.499	S	S	.	.	H	α-helix	trans	-43.7	-28.6	173.7	178.5	-96.6	0	0	0	113.1	P39 L429 Y569 Y574 T575	P39-F571 HydrophobicContact CG-CE2 4.22Å; L429-F571 HydrophobicContact CD1-CE2 4Å; L429-F571 HydrophobicContact CD1-CZ 3.99Å; L429-F571 HydrophobicContact CD2-CE2 3.89Å; L429-F571 HydrophobicContact CG-CE2 4.36Å; Y569-F571 PolarHBondContact O-N 3.2Å; F571-Y574 VanDerWaalsContact O-CB 3.26Å; F571-Y574 WeakPolarHBondContact O-CB 3.42Å; F571-Y574 PolarHBondContact O-N 2.97Å; F571-Y574 VanDerWaalsContact O-N 3.15Å; F571-T575 HydrophobicContact CD1-CG2 4.42Å; F571-T575 HydrophobicContact CE1-CG2 4.12Å; F571-T575 HydrophobicContact CZ-CG2 4.49Å; F571-T575 PolarHBondContact O-N 2.79Å
572	E	42.6	Very low	49.9	Very low	112 Å²	112	88 Å²	88	52%	0.523	47%	0.466	S	S	.	.	H	α-helix	trans	-68.9	-30.4	175.5	-63.6	178.8	160.1	0	0	115	I539 T570 Y574 T575 N576	I539-E572 HydrophobicContact CD1-CB 3.68Å; I539-E572 HydrophobicContact CD1-CG 4.5Å; T570-E572 PolarHBondContact O-N 3.49Å; E572-Y574 PolarHBondContact O-N 2.87Å; E572-T575 PolarHBondContact O-OG1 2.83Å; E572-N576 PolarHBondContact O-ND2 2.79Å
573	S	43.3	Very low	52.3	Low	67 Å²	67	82.4 Å²	82.4	47%	0.469	44%	0.438	S	S	.	.	H	α-helix	trans	-69.6	-28	170.5	-62.7	0	0	0	0	110.8	T570	T570-S573 WeakPolarHBondContact O-CB 3.37Å; T570-S573 PolarHBondContact O-N 3.36Å
574	Y	44.7	Very low	54.9	Low	74 Å²	74	74.9 Å²	74.9	29%	0.29	40%	0.398	S	S	.	.	H	α-helix	trans	-75.3	-42.5	-174.5	-165.6	-82.5	0	0	0	112.3	E432 F571 E572 N576 S577 K580	E432-Y574 VanDerWaalsContact CD-CZ 3.44Å; E432-Y574 HydrophobicContact CG-CE1 4.1Å; E432-Y574 WeakPolarHBondContact CG-OH 3.44Å; E432-Y574 WeakPolarHBondContact OE1-CE1 3.31Å; E432-Y574 WeakPolarHBondContact OE1-CE2 3.39Å; E432-Y574 PolarHBondContact OE1-OH 3.34Å; F571-Y574 VanDerWaalsContact O-CB 3.26Å; F571-Y574 WeakPolarHBondContact O-CB 3.42Å; F571-Y574 PolarHBondContact O-N 2.97Å; F571-Y574 VanDerWaalsContact O-N 3.15Å; E572-Y574 PolarHBondContact O-N 2.87Å; Y574-N576 PolarHBondContact O-N 2.99Å; Y574-S577 PolarHBondContact O-N 3.41Å; Y574-K580 HydrophobicContact CD1-CD 3.83Å; Y574-K580 HydrophobicContact CE1-CD 3.25Å; Y574-K580 VanDerWaalsContact CE1-CE 3.49Å; Y574-K580 VanDerWaalsContact CE1-NZ 3.29Å; Y574-K580 HydrophobicContact CE2-CD 4.04Å; Y574-K580 HydrophobicContact CG-CD 4.4Å; Y574-K580 PolarHBondContact O-NZ 3.24Å; Y574-K580 WeakPolarHBondContact OH-CD 3.44Å; Y574-K580 VanDerWaalsContact OH-CE 3.24Å; Y574-K580 WeakPolarHBondContact OH-CE 3.36Å
575	T	52.7	Low	57.4	Low	17 Å²	17	70 Å²	70	10%	0.104	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.8	178.1	56.2	0	0	0	0	113.9	N425 F571 E572 R581	N425-T575 HydrophobicContact CB-CG2 4.33Å; N425-T575 WeakPolarHBondContact OD1-CB 3.29Å; N425-T575 VanDerWaalsContact OD1-CG2 3.26Å; N425-T575 WeakPolarHBondContact OD1-CG2 3.38Å; F571-T575 HydrophobicContact CD1-CG2 4.42Å; F571-T575 HydrophobicContact CE1-CG2 4.12Å; F571-T575 HydrophobicContact CZ-CG2 4.49Å; F571-T575 PolarHBondContact O-N 2.79Å; E572-T575 PolarHBondContact O-OG1 2.83Å; T575-R581 PolarHBondContact O-NH2 2.74Å
576	N	59.4	Low	59.9	Low	33 Å²	33	63.1 Å²	63.1	18%	0.176	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	1.9	179.8	-78.1	-38.3	0	0	0	114.5	P536 L537 E572 Y574 I578	P536-N576 HydrophobicContact CB-CB 4.48Å; P536-N576 WeakPolarHBondContact CB-O 3.33Å; L537-N576 WeakPolarHBondContact CA-OD1 3.31Å; L537-N576 PolarHBondContact N-OD1 3.14Å; L537-N576 PolarHBondContact O-ND2 3.21Å; L537-N576 VanDerWaalsContact O-ND2 3.09Å; L537-N576 PolarHBondContact O-OD1 3.22Å; L537-N576 VanDerWaalsContact O-OD1 3.13Å; E572-N576 PolarHBondContact O-ND2 2.79Å; Y574-N576 PolarHBondContact O-N 2.99Å; N576-I578 PolarHBondContact O-N 2.67Å
577	S	70.3	Confident	62.4	Low	34 Å²	34	56.7 Å²	56.7	24%	0.238	29%	0.293	C	S	.	.			trans	-77.8	117.2	177	179.1	0	0	0	0	111.6	Y574 T579 K580 R581	Y574-S577 PolarHBondContact O-N 3.41Å; S577-T579 PolarHBondContact O-N 3.41Å; S577-T579 PolarHBondContact OG-N 2.8Å; S577-K580 PolarHBondContact O-N 2.8Å; S577-R581 PolarHBondContact O-N 3.38Å
578	I	77.6	Confident	65.1	Low	73 Å²	73	51 Å²	51	37%	0.374	26%	0.262	S	S	.	.	H	α-helix	trans	-58.4	-37.3	172.5	-167.7	177.2	0	0	0	112.1	F530 N576 K580 R581 I582	F530-I578 HydrophobicContact CE2-CD1 3.47Å; F530-I578 VanDerWaalsContact CE2-CD1 3.47Å; F530-I578 HydrophobicContact CE2-CG1 4.25Å; F530-I578 HydrophobicContact CZ-CD1 3.41Å; F530-I578 VanDerWaalsContact CZ-CD1 3.41Å; F530-I578 HydrophobicContact CZ-CG1 4.13Å; N576-I578 PolarHBondContact O-N 2.67Å; I578-K580 VanDerWaalsContact C-N 3.28Å; I578-K580 PolarHBondContact O-N 3.11Å; I578-R581 WeakPolarHBondContact O-CB 3.04Å; I578-R581 PolarHBondContact O-N 2.94Å; I578-R581 VanDerWaalsContact O-N 3.13Å; I578-I582 HydrophobicContact CD1-CD1 4.43Å; I578-I582 HydrophobicContact CG1-CD1 3.95Å; I578-I582 HydrophobicContact CG1-CG1 4.46Å; I578-I582 WeakPolarHBondContact O-CG1 3.18Å; I578-I582 PolarHBondContact O-N 3.48Å
579	T	78.8	Confident	67.4	Low	78 Å²	78	45.9 Å²	45.9	48%	0.479	23%	0.231	S	C	.	.	H	α-helix	trans	-57.5	-44.5	179.2	-46.6	0	0	0	0	110.5	S577 R581 I582 D583	S577-T579 PolarHBondContact O-N 3.41Å; S577-T579 PolarHBondContact OG-N 2.8Å; T579-R581 PolarHBondContact O-N 3.49Å; T579-I582 WeakPolarHBondContact O-CB 3.43Å; T579-I582 PolarHBondContact O-N 2.84Å; T579-D583 WeakPolarHBondContact O-CB 3.37Å; T579-D583 PolarHBondContact O-N 2.82Å
580	K	76.2	Confident	69.9	Low	39 Å²	39	43.1 Å²	43.1	17%	0.17	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-36.1	178.6	-63.6	-177.4	-161.3	143.1	0	113	Y574 S577 I578 I582 D583 T584	Y574-K580 HydrophobicContact CD1-CD 3.83Å; Y574-K580 HydrophobicContact CE1-CD 3.25Å; Y574-K580 VanDerWaalsContact CE1-CE 3.49Å; Y574-K580 VanDerWaalsContact CE1-NZ 3.29Å; Y574-K580 HydrophobicContact CE2-CD 4.04Å; Y574-K580 HydrophobicContact CG-CD 4.4Å; Y574-K580 PolarHBondContact O-NZ 3.24Å; Y574-K580 WeakPolarHBondContact OH-CD 3.44Å; Y574-K580 VanDerWaalsContact OH-CE 3.24Å; Y574-K580 WeakPolarHBondContact OH-CE 3.36Å; S577-K580 PolarHBondContact O-N 2.8Å; I578-K580 VanDerWaalsContact C-N 3.28Å; I578-K580 PolarHBondContact O-N 3.11Å; K580-I582 VanDerWaalsContact C-N 3.32Å; K580-D583 PolarHBondContact O-N 3.29Å; K580-T584 VanDerWaalsContact O-CB 3.28Å; K580-T584 WeakPolarHBondContact O-CB 3.47Å; K580-T584 PolarHBondContact O-N 3.29Å; K580-T584 PolarHBondContact O-OG1 2.99Å
581	R	82.1	Confident	71.9	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.011	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-44.9	174	-63.8	-179.9	-179.2	-112.8	-12.4	110.6	F428 A529 F533 G534 T575 S577 I578 T579 L585	F428-R581 HydrophobicContact CE1-CB 4.28Å; F428-R581 HydrophobicContact CE1-CG 3.77Å; F428-R581 HydrophobicContact CE2-CG 4.27Å; F428-R581 HydrophobicContact CZ-CG 3.58Å; A529-R581 HydrophobicContact CB-CB 4.22Å; F533-R581 HydrophobicContact CD2-CB 3.98Å; F533-R581 HydrophobicContact CD2-CG 4.4Å; F533-R581 HydrophobicContact CE2-CB 4.49Å; F533-R581 WeakPolarHBondContact CE2-O 3.44Å; F533-R581 PolarHBondContact O-NH1 3.44Å; G534-R581 PolarHBondContact O-NH1 3.07Å; T575-R581 PolarHBondContact O-NH2 2.74Å; S577-R581 PolarHBondContact O-N 3.38Å; I578-R581 WeakPolarHBondContact O-CB 3.04Å; I578-R581 PolarHBondContact O-N 2.94Å; I578-R581 VanDerWaalsContact O-N 3.13Å; T579-R581 PolarHBondContact O-N 3.49Å; R581-L585 WeakPolarHBondContact O-CB 3.26Å; R581-L585 PolarHBondContact O-N 3.47Å
582	I	83.5	Confident	74	Confident	23 Å²	23	35.4 Å²	35.4	12%	0.118	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-46.4	176.4	-66.2	162.1	0	0	0	110.4	E522 S525 R526 A529 I578 T579 K580 L585 T586	E522-I582 HydrophobicContact CG-CG2 4.42Å; S525-I582 WeakPolarHBondContact CB-O 3.28Å; R526-I582 HydrophobicContact CG-CD1 3.91Å; R526-I582 HydrophobicContact CG-CG1 4.29Å; R526-I582 HydrophobicContact CG-CG2 3.94Å; A529-I582 HydrophobicContact CB-CG1 4.23Å; I578-I582 HydrophobicContact CD1-CD1 4.43Å; I578-I582 HydrophobicContact CG1-CD1 3.95Å; I578-I582 HydrophobicContact CG1-CG1 4.46Å; I578-I582 WeakPolarHBondContact O-CG1 3.18Å; I578-I582 PolarHBondContact O-N 3.48Å; T579-I582 WeakPolarHBondContact O-CB 3.43Å; T579-I582 PolarHBondContact O-N 2.84Å; K580-I582 VanDerWaalsContact C-N 3.32Å; I582-L585 PolarHBondContact O-N 3.39Å; I582-T586 VanDerWaalsContact O-CB 3.29Å; I582-T586 WeakPolarHBondContact O-CB 3.31Å; I582-T586 PolarHBondContact O-N 3.23Å; I582-T586 PolarHBondContact O-OG1 3.02Å
583	D	84.2	Confident	75.7	Confident	36 Å²	36	34.9 Å²	34.9	19%	0.193	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-47.2	-179.6	-73.5	-24.7	0	0	0	112.3	T431 Y435 T579 K580 T586 N587	T431-D583 HydrophobicContact CG2-CB 4.43Å; Y435-D583 HydrophobicContact CE2-CB 4.03Å; Y435-D583 WeakPolarHBondContact OH-CB 3.32Å; Y435-D583 PolarHBondContact OH-OD1 2.99Å; Y435-D583 VanDerWaalsContact OH-OD1 3.05Å; Y435-D583 PolarHBondContact OH-OD2 3.49Å; Y435-D583 VanDerWaalsContact OH-OD2 3.1Å; T579-D583 WeakPolarHBondContact O-CB 3.37Å; T579-D583 PolarHBondContact O-N 2.82Å; K580-D583 PolarHBondContact O-N 3.29Å; D583-T586 WeakPolarHBondContact O-CB 3.35Å; D583-T586 PolarHBondContact O-N 3.21Å; D583-N587 WeakPolarHBondContact O-CB 3.32Å; D583-N587 PolarHBondContact O-N 2.97Å
584	T	84.1	Confident	77	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-46	175.8	-61.7	0	0	0	0	111.2	L427 F428 T431 Y484 F533 K580 T586 N587 L588	L427-T584 HydrophobicContact CB-CG2 3.7Å; F428-T584 HydrophobicContact CD1-CG2 4.07Å; F428-T584 WeakPolarHBondContact CD1-OG1 3.4Å; F428-T584 HydrophobicContact CE1-CG2 4.39Å; T431-T584 WeakPolarHBondContact CB-OG1 3.21Å; T431-T584 WeakPolarHBondContact OG1-CB 3.44Å; T431-T584 WeakPolarHBondContact OG1-CG2 3.42Å; T431-T584 PolarHBondContact OG1-OG1 3.12Å; Y484-T584 HydrophobicContact CE1-CG2 4.43Å; F533-T584 HydrophobicContact CE1-CG2 4.46Å; F533-T584 HydrophobicContact CE2-CG2 4.48Å; F533-T584 HydrophobicContact CZ-CG2 3.74Å; K580-T584 VanDerWaalsContact O-CB 3.28Å; K580-T584 WeakPolarHBondContact O-CB 3.47Å; K580-T584 PolarHBondContact O-N 3.29Å; K580-T584 PolarHBondContact O-OG1 2.99Å; T584-T586 VanDerWaalsContact C-N 3.33Å; T584-T586 PolarHBondContact O-N 2.86Å; T584-N587 PolarHBondContact O-N 3.27Å; T584-L588 HydrophobicContact CG2-CD1 4.24Å; T584-L588 VanDerWaalsContact O-CG 3.31Å; T584-L588 WeakPolarHBondContact O-CG 3.15Å; T584-L588 PolarHBondContact O-N 3.1Å
585	L	86.7	Confident	78.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.6	-39.1	177.1	-168.4	49.1	0	0	0	111.8	L504 T528 A529 V532 F533 R581 I582 N587 L588 I589	L504-L585 HydrophobicContact CD2-CD1 4.07Å; T528-L585 VanDerWaalsContact OG1-CD2 3.29Å; T528-L585 WeakPolarHBondContact OG1-CD2 3.22Å; A529-L585 HydrophobicContact CB-CD2 4.19Å; V532-L585 HydrophobicContact CB-CD2 4.33Å; V532-L585 HydrophobicContact CG1-CD1 4.38Å; V532-L585 HydrophobicContact CG2-CD2 4.13Å; F533-L585 HydrophobicContact CE2-CB 3.96Å; R581-L585 WeakPolarHBondContact O-CB 3.26Å; R581-L585 PolarHBondContact O-N 3.47Å; I582-L585 PolarHBondContact O-N 3.39Å; L585-N587 VanDerWaalsContact C-N 3.3Å; L585-N587 PolarHBondContact O-N 2.99Å; L585-L588 PolarHBondContact O-N 3.4Å; L585-I589 HydrophobicContact CD1-CG1 4.45Å; L585-I589 HydrophobicContact CG-CD1 4.13Å; L585-I589 VanDerWaalsContact O-CG1 3.28Å; L585-I589 WeakPolarHBondContact O-CG1 3.4Å; L585-I589 PolarHBondContact O-N 3.34Å
586	T	86.5	Confident	78.9	Confident	10 Å²	10	34.3 Å²	34.3	6%	0.061	17%	0.173	C	C	.	.	H	α-helix	trans	-60.6	-42.9	176.8	-60	0	0	0	0	110.5	A521 S525 I582 D583 T584 I589 K590	A521-T586 HydrophobicContact CB-CG2 4.18Å; S525-T586 WeakPolarHBondContact CB-OG1 3.48Å; S525-T586 WeakPolarHBondContact OG-CA 3.41Å; S525-T586 PolarHBondContact OG-N 3.35Å; S525-T586 VanDerWaalsContact OG-N 3.1Å; S525-T586 PolarHBondContact OG-OG1 3.44Å; S525-T586 VanDerWaalsContact OG-OG1 3.1Å; I582-T586 VanDerWaalsContact O-CB 3.29Å; I582-T586 WeakPolarHBondContact O-CB 3.31Å; I582-T586 PolarHBondContact O-N 3.23Å; I582-T586 PolarHBondContact O-OG1 3.02Å; D583-T586 WeakPolarHBondContact O-CB 3.35Å; D583-T586 PolarHBondContact O-N 3.21Å; T584-T586 VanDerWaalsContact C-N 3.33Å; T584-T586 PolarHBondContact O-N 2.86Å; T586-I589 PolarHBondContact O-N 3.3Å; T586-K590 HydrophobicContact CG2-CD 4.24Å; T586-K590 WeakPolarHBondContact O-CB 3.46Å; T586-K590 WeakPolarHBondContact O-CG 3.32Å; T586-K590 PolarHBondContact O-N 2.82Å
587	N	84.7	Confident	79	Confident	15 Å²	15	37.4 Å²	37.4	8%	0.08	19%	0.189	C	C	.	.	H	α-helix	trans	-66.6	-42.5	176.1	-76.7	-17.5	0	0	0	112.4	T431 Q434 Q480 Y484 D583 T584 L585 I589 K590 M591	T431-N587 VanDerWaalsContact CG2-ND2 3.31Å; T431-N587 WeakPolarHBondContact CG2-ND2 3.09Å; Q434-N587 PolarHBondContact OE1-ND2 3.25Å; Q434-N587 PolarHBondContact OE1-OD1 3.12Å; Q480-N587 PolarHBondContact NE2-ND2 3.43Å; Q480-N587 VanDerWaalsContact NE2-ND2 3.14Å; Y484-N587 HydrophobicContact CE2-CB 4.06Å; D583-N587 WeakPolarHBondContact O-CB 3.32Å; D583-N587 PolarHBondContact O-N 2.97Å; T584-N587 PolarHBondContact O-N 3.27Å; L585-N587 VanDerWaalsContact C-N 3.3Å; L585-N587 PolarHBondContact O-N 2.99Å; N587-I589 VanDerWaalsContact C-N 3.35Å; N587-I589 PolarHBondContact O-N 3.48Å; N587-K590 PolarHBondContact O-N 3.18Å; N587-M591 WeakPolarHBondContact O-CB 3.38Å; N587-M591 VanDerWaalsContact O-CG 3.26Å; N587-M591 WeakPolarHBondContact O-CG 3.37Å; N587-M591 PolarHBondContact O-N 2.9Å
588	L	86	Confident	78.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61	-41.7	175.2	-71.5	171.8	0	0	0	112.1	L427 Y484 L488 L504 F533 T584 L585 M591 A592 L595	L427-L588 HydrophobicContact CD1-CD1 4.29Å; Y484-L588 HydrophobicContact CD1-CD2 4.23Å; Y484-L588 HydrophobicContact CD2-CD2 3.71Å; Y484-L588 HydrophobicContact CE2-CD2 4.07Å; Y484-L588 HydrophobicContact CE2-CG 4.47Å; Y484-L588 HydrophobicContact CG-CD2 3.79Å; L488-L588 HydrophobicContact CD1-CD2 4.16Å; L504-L588 HydrophobicContact CD1-CB 4.21Å; L504-L588 HydrophobicContact CD2-CB 3.89Å; F533-L588 HydrophobicContact CZ-CD1 4.34Å; T584-L588 HydrophobicContact CG2-CD1 4.24Å; T584-L588 VanDerWaalsContact O-CG 3.31Å; T584-L588 WeakPolarHBondContact O-CG 3.15Å; T584-L588 PolarHBondContact O-N 3.1Å; L585-L588 PolarHBondContact O-N 3.4Å; L588-M591 CarbonylContact O-C 3.45Å; L588-M591 PolarHBondContact O-N 2.64Å; L588-A592 WeakPolarHBondContact O-CA 3.49Å; L588-A592 PolarHBondContact O-N 3.12Å; L588-L595 HydrophobicContact CD2-CD1 3.96Å
589	I	85.1	Confident	77.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-48.8	175.9	-67	166.3	0	0	0	110.2	L504 F507 K508 A521 L524 S525 L585 T586 N587 M591 A592	L504-I589 HydrophobicContact CD2-CG1 3.84Å; F507-I589 HydrophobicContact CB-CD1 3.94Å; F507-I589 HydrophobicContact CB-CG1 3.88Å; F507-I589 HydrophobicContact CB-CG2 4.05Å; F507-I589 HydrophobicContact CD2-CD1 3.73Å; F507-I589 HydrophobicContact CD2-CG1 4Å; F507-I589 HydrophobicContact CG-CD1 4.23Å; F507-I589 HydrophobicContact CG-CG1 4.46Å; K508-I589 HydrophobicContact CB-CG2 4.49Å; A521-I589 HydrophobicContact CB-CB 4.18Å; A521-I589 HydrophobicContact CB-CD1 4.47Å; A521-I589 HydrophobicContact CB-CG2 3.74Å; L524-I589 HydrophobicContact CB-CD1 4.25Å; S525-I589 WeakPolarHBondContact OG-CD1 3.14Å; L585-I589 HydrophobicContact CD1-CG1 4.45Å; L585-I589 HydrophobicContact CG-CD1 4.13Å; L585-I589 VanDerWaalsContact O-CG1 3.28Å; L585-I589 WeakPolarHBondContact O-CG1 3.4Å; L585-I589 PolarHBondContact O-N 3.34Å; T586-I589 PolarHBondContact O-N 3.3Å; N587-I589 VanDerWaalsContact C-N 3.35Å; N587-I589 PolarHBondContact O-N 3.48Å; I589-M591 PolarHBondContact O-N 3.26Å; I589-A592 VanDerWaalsContact O-CB 3.29Å; I589-A592 WeakPolarHBondContact O-CB 3.26Å; I589-A592 PolarHBondContact O-N 3.39Å
590	K	84.8	Confident	76.2	Confident	121 Å²	121	35.4 Å²	35.4	53%	0.526	19%	0.185	S	C	.	.	H	α-helix	trans	-62.1	-33.4	-179.9	-74.8	178.3	178.5	-179.9	0	112.7	A521 T586 N587	A521-K590 HydrophobicContact CB-CG 4.39Å; T586-K590 HydrophobicContact CG2-CD 4.24Å; T586-K590 WeakPolarHBondContact O-CB 3.46Å; T586-K590 WeakPolarHBondContact O-CG 3.32Å; T586-K590 PolarHBondContact O-N 2.82Å; N587-K590 PolarHBondContact O-N 3.18Å
591	M	79.5	Confident	75.3	Confident	6 Å²	6	37.6 Å²	37.6	3%	0.03	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	6.8	-179.3	-61.5	-178.2	-170.8	0	0	113.9	Q434 Q477 L481 Y484 N587 L588 I589 H593 Q594 L595	Q434-M591 VanDerWaalsContact NE2-CE 3.25Å; Q477-M591 HydrophobicContact CG-CE 4.06Å; L481-M591 HydrophobicContact CB-SD 4.39Å; L481-M591 HydrophobicContact CD1-CB 4.09Å; L481-M591 HydrophobicContact CD1-SD 4.21Å; Y484-M591 HydrophobicContact CD2-SD 4.16Å; Y484-M591 HydrophobicContact CE2-SD 4.07Å; N587-M591 WeakPolarHBondContact O-CB 3.38Å; N587-M591 VanDerWaalsContact O-CG 3.26Å; N587-M591 WeakPolarHBondContact O-CG 3.37Å; N587-M591 PolarHBondContact O-N 2.9Å; L588-M591 CarbonylContact O-C 3.45Å; L588-M591 PolarHBondContact O-N 2.64Å; I589-M591 PolarHBondContact O-N 3.26Å; M591-H593 VanDerWaalsContact C-N 3.34Å; M591-H593 PolarHBondContact O-N 3.4Å; M591-Q594 WeakPolarHBondContact O-CA 3.48Å; M591-Q594 PolarHBondContact O-N 2.89Å; M591-L595 PolarHBondContact O-N 3.07Å
592	A	81.9	Confident	74.1	Confident	2 Å²	2	38.5 Å²	38.5	2%	0.017	20%	0.203	C	C	.	.	H	α-helix	trans	-52.2	-46.4	-171.3	0	0	0	0	0	113.7	L504 K508 L588 I589 Q594 L595	L504-A592 HydrophobicContact CB-CB 4.09Å; K508-A592 HydrophobicContact CB-CB 4.08Å; K508-A592 HydrophobicContact CG-CB 4.36Å; L588-A592 WeakPolarHBondContact O-CA 3.49Å; L588-A592 PolarHBondContact O-N 3.12Å; I589-A592 VanDerWaalsContact O-CB 3.29Å; I589-A592 WeakPolarHBondContact O-CB 3.26Å; I589-A592 PolarHBondContact O-N 3.39Å; A592-Q594 VanDerWaalsContact C-N 3.32Å; A592-Q594 PolarHBondContact O-N 3.3Å; A592-L595 PolarHBondContact O-N 3.3Å
593	H	77.4	Confident	72.9	Confident	101 Å²	101	41 Å²	41	47%	0.468	21%	0.211	S	C	.	.	H	α-helix	trans	-64.5	-36.5	176.9	-64.9	-61.9	0	0	0	112.8	K508 M591	K508-H593 VanDerWaalsContact CG-NE2 3.35Å; K508-H593 WeakPolarHBondContact CG-NE2 3.26Å; M591-H593 VanDerWaalsContact C-N 3.34Å; M591-H593 PolarHBondContact O-N 3.4Å
594	Q	71.8	Confident	72	Confident	69 Å²	69	43.5 Å²	43.5	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-74.9	-32.2	-176.5	-49.3	-178.5	-50.5	0	0	111.2	L481 M591 A592 E596 D597 L598	L481-Q594 HydrophobicContact CD1-CB 4.07Å; L481-Q594 HydrophobicContact CD2-CB 3.51Å; L481-Q594 HydrophobicContact CD2-CG 4.31Å; L481-Q594 HydrophobicContact CG-CB 4.37Å; M591-Q594 WeakPolarHBondContact O-CA 3.48Å; M591-Q594 PolarHBondContact O-N 2.89Å; A592-Q594 VanDerWaalsContact C-N 3.32Å; A592-Q594 PolarHBondContact O-N 3.3Å; Q594-E596 PolarHBondContact O-N 2.79Å; Q594-E596 VanDerWaalsContact O-N 3.16Å; Q594-D597 PolarHBondContact O-N 3.47Å; Q594-L598 HydrophobicContact CB-CD1 4.24Å; Q594-L598 WeakPolarHBondContact O-CD1 3.1Å; Q594-L598 PolarHBondContact O-N 2.78Å; Q594-L598 VanDerWaalsContact O-N 3.14Å
595	L	71.9	Confident	70.9	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-57.6	-31.1	179.9	-73.7	167.2	0	0	0	113.2	L481 R485 L488 M501 L504 L588 M591 A592	L481-L595 HydrophobicContact CD1-CD2 3.57Å; L481-L595 HydrophobicContact CD1-CG 3.88Å; R485-L595 PolarHBondContact NH1-O 2.89Å; L488-L595 HydrophobicContact CD1-CD1 4.1Å; L488-L595 HydrophobicContact CD1-CD2 4.28Å; M501-L595 HydrophobicContact CE-CB 4.19Å; L504-L595 HydrophobicContact CD1-CD1 4.26Å; L588-L595 HydrophobicContact CD2-CD1 3.96Å; M591-L595 PolarHBondContact O-N 3.07Å; A592-L595 PolarHBondContact O-N 3.3Å
596	E	64.9	Low	69.6	Low	75 Å²	75	46.7 Å²	46.7	35%	0.35	24%	0.244	S	C	.	.	H	α-helix	trans	-82.9	-38.3	179.4	-61.7	-173.9	177.2	0	0	112.7	R505 Q594	R505-E596 IonicContact CZ-OE1 3.33Å; R505-E596 IonicContact CZ-OE2 2.87Å; R505-E596 IonicContact NE-OE1 3.33Å; R505-E596 PolarHBondContact NE-OE1 3.27Å; R505-E596 IonicContact NE-OE2 3.01Å; R505-E596 PolarHBondContact NE-OE2 3.33Å; R505-E596 IonicContact NH2-OE1 2.74Å; R505-E596 PolarHBondContact NH2-OE1 3.25Å; R505-E596 IonicContact NH2-OE2 3.99Å; R505-E596 PolarHBondContact NH2-OE2 2.83Å; Q594-E596 PolarHBondContact O-N 2.79Å; Q594-E596 VanDerWaalsContact O-N 3.16Å
597	D	60.4	Low	68.5	Low	98 Å²	98	49.4 Å²	49.4	52%	0.524	25%	0.253	S	S	.	.	H	α-helix	trans	-95.5	0.3	-170.2	-68.2	-29.8	0	0	0	115	Q594 I601	Q594-D597 PolarHBondContact O-N 3.47Å; D597-I601 HydrophobicContact CB-CD1 3.67Å; D597-I601 HydrophobicContact CB-CG1 4.48Å
598	L	56.8	Low	67.5	Low	10 Å²	10	52.1 Å²	52.1	5%	0.052	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	127.8	167.1	-104	71.2	0	0	0	108.5	L481 R485 Q594 I602	L481-L598 HydrophobicContact CB-CD2 4.36Å; L481-L598 HydrophobicContact CD1-CD1 4.06Å; L481-L598 HydrophobicContact CD1-CD2 4.48Å; L481-L598 HydrophobicContact CD2-CD1 3.5Å; L481-L598 VanDerWaalsContact CD2-CD1 3.5Å; L481-L598 HydrophobicContact CG-CD1 3.45Å; L481-L598 VanDerWaalsContact CG-CD1 3.45Å; L481-L598 HydrophobicContact CG-CD2 3.72Å; L481-L598 HydrophobicContact CG-CG 4.2Å; R485-L598 HydrophobicContact CB-CD2 4.47Å; R485-L598 PolarHBondContact NH1-O 3.38Å; R485-L598 PolarHBondContact NH2-O 3.26Å; Q594-L598 HydrophobicContact CB-CD1 4.24Å; Q594-L598 WeakPolarHBondContact O-CD1 3.1Å; Q594-L598 PolarHBondContact O-N 2.78Å; Q594-L598 VanDerWaalsContact O-N 3.14Å; L598-I602 HydrophobicContact CD1-CD1 3.5Å; L598-I602 HydrophobicContact CD1-CG1 3.84Å; L598-I602 HydrophobicContact CD2-CD1 3.65Å; L598-I602 HydrophobicContact CG-CD1 3.56Å; L598-I602 HydrophobicContact CG-CG1 4.12Å
599	P	55.2	Low	66.1	Low	78 Å²	78	57.6 Å²	57.6	51%	0.506	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	cis	-113.9	-7	37.3	-2.5	26.9	0	0	0	114.7	Y603	P599-Y603 WeakPolarHBondContact O-CB 3.36Å; P599-Y603 PolarHBondContact O-N 3.34Å
600	A	57.2	Low	64.9	Low	54 Å²	54	59.6 Å²	59.6	45%	0.446	31%	0.305	S	S	.	.	H	α-helix	trans	-75.6	-41.2	-165.5	0	0	0	0	0	113.8	N604	A600-N604 VanDerWaalsContact O-CB 3.24Å; A600-N604 WeakPolarHBondContact O-CB 2.94Å; A600-N604 PolarHBondContact O-N 3.19Å; A600-N604 PolarHBondContact O-ND2 2.8Å
601	I	56.6	Low	63.8	Low	86 Å²	86	60.7 Å²	60.7	44%	0.441	31%	0.306	S	S	.	.	H	α-helix	trans	-69.6	-47.9	-174.2	-60.3	175.5	0	0	0	111.1	D597 N604 T605	D597-I601 HydrophobicContact CB-CD1 3.67Å; D597-I601 HydrophobicContact CB-CG1 4.48Å; I601-N604 PolarHBondContact O-N 3.08Å; I601-T605 VanDerWaalsContact O-CB 3.26Å; I601-T605 WeakPolarHBondContact O-CB 3.39Å; I601-T605 PolarHBondContact O-N 3.03Å; I601-T605 PolarHBondContact O-OG1 2.91Å
602	I	56.4	Low	62.8	Low	21 Å²	21	65.6 Å²	65.6	11%	0.108	34%	0.336	C	S	.	.	H	α-helix	trans	-61.8	-50.3	176.8	-67.5	-175.4	0	0	0	109.8	S478 L481 L598 N604 T605 V606	S478-I602 WeakPolarHBondContact OG-CG2 3.42Å; L481-I602 HydrophobicContact CB-CD1 4.11Å; L481-I602 HydrophobicContact CD2-CD1 3.61Å; L481-I602 HydrophobicContact CD2-CG1 4.21Å; L481-I602 HydrophobicContact CG-CD1 3.91Å; L598-I602 HydrophobicContact CD1-CD1 3.5Å; L598-I602 HydrophobicContact CD1-CG1 3.84Å; L598-I602 HydrophobicContact CD2-CD1 3.65Å; L598-I602 HydrophobicContact CG-CD1 3.56Å; L598-I602 HydrophobicContact CG-CG1 4.12Å; I602-N604 VanDerWaalsContact C-N 3.34Å; I602-N604 PolarHBondContact O-N 3.19Å; I602-T605 PolarHBondContact O-N 3.34Å; I602-V606 HydrophobicContact CG2-CG2 3.86Å; I602-V606 WeakPolarHBondContact O-CB 3.25Å; I602-V606 VanDerWaalsContact O-CG2 3.31Å; I602-V606 WeakPolarHBondContact O-CG2 3.39Å; I602-V606 PolarHBondContact O-N 2.88Å
603	Y	59.3	Low	61.4	Low	76 Å²	76	72 Å²	72	30%	0.298	37%	0.365	S	S	.	.	H	α-helix	trans	-56.5	-50	-179.5	169.7	-95.1	0	0	0	110.7	F53 P599 T605 R607	F53-Y603 WeakPolarHBondContact O-CD2 3.24Å; F53-Y603 VanDerWaalsContact O-CE2 3.25Å; F53-Y603 WeakPolarHBondContact O-CE2 3.38Å; P599-Y603 WeakPolarHBondContact O-CB 3.36Å; P599-Y603 PolarHBondContact O-N 3.34Å; Y603-T605 VanDerWaalsContact C-N 3.34Å; Y603-T605 PolarHBondContact O-N 3.41Å; Y603-R607 VanDerWaalsContact CZ-CD 3.43Å; Y603-R607 WeakPolarHBondContact O-CA 3.12Å; Y603-R607 WeakPolarHBondContact O-CB 3.42Å; Y603-R607 PolarHBondContact O-N 3.18Å; Y603-R607 PolarHBondContact OH-NH1 3.45Å
604	N	64.6	Low	60.3	Low	89 Å²	89	73 Å²	73	48%	0.476	37%	0.373	S	S	.	.	H	α-helix	trans	-63.3	-39.6	178.9	-72.3	-20.3	0	0	0	112	A600 I601 I602 S608	A600-N604 VanDerWaalsContact O-CB 3.24Å; A600-N604 WeakPolarHBondContact O-CB 2.94Å; A600-N604 PolarHBondContact O-N 3.19Å; A600-N604 PolarHBondContact O-ND2 2.8Å; I601-N604 PolarHBondContact O-N 3.08Å; I602-N604 VanDerWaalsContact C-N 3.34Å; I602-N604 PolarHBondContact O-N 3.19Å; N604-S608 WeakPolarHBondContact O-CB 3.22Å; N604-S608 PolarHBondContact O-N 2.96Å; N604-S608 PolarHBondContact O-OG 3.16Å
605	T	60.8	Low	59.4	Low	56 Å²	56	71.5 Å²	71.5	34%	0.344	38%	0.376	S	S	.	.	H	α-helix	trans	-70.1	-47.6	-178.3	-55.3	0	0	0	0	111.7	I601 I602 Y603 R609	I601-T605 VanDerWaalsContact O-CB 3.26Å; I601-T605 WeakPolarHBondContact O-CB 3.39Å; I601-T605 PolarHBondContact O-N 3.03Å; I601-T605 PolarHBondContact O-OG1 2.91Å; I602-T605 PolarHBondContact O-N 3.34Å; Y603-T605 VanDerWaalsContact C-N 3.34Å; Y603-T605 PolarHBondContact O-N 3.41Å; T605-R609 WeakPolarHBondContact O-CB 3.25Å; T605-R609 PolarHBondContact O-N 3.1Å; T605-R609 VanDerWaalsContact O-N 3.12Å
606	V	59.9	Low	58.3	Low	11 Å²	11	76.8 Å²	76.8	7%	0.067	40%	0.404	C	S	.	.	H	α-helix	trans	-70.8	-45.1	179.6	-179.6	0	0	0	0	109.9	L54 I474 I602 S608 R609 L610	L54-V606 HydrophobicContact CD1-CG1 3.64Å; L54-V606 HydrophobicContact CD2-CB 3.82Å; L54-V606 HydrophobicContact CD2-CG1 3.53Å; L54-V606 HydrophobicContact CG-CG1 4.24Å; I474-V606 HydrophobicContact CG2-CG2 3.87Å; I602-V606 HydrophobicContact CG2-CG2 3.86Å; I602-V606 WeakPolarHBondContact O-CB 3.25Å; I602-V606 VanDerWaalsContact O-CG2 3.31Å; I602-V606 WeakPolarHBondContact O-CG2 3.39Å; I602-V606 PolarHBondContact O-N 2.88Å; V606-S608 PolarHBondContact O-N 3.35Å; V606-R609 PolarHBondContact O-N 3.35Å; V606-L610 HydrophobicContact CG1-CD1 3.74Å; V606-L610 HydrophobicContact CG1-CG 4.1Å; V606-L610 WeakPolarHBondContact O-CB 3.28Å; V606-L610 VanDerWaalsContact O-CG 3.25Å; V606-L610 WeakPolarHBondContact O-CG 3.04Å; V606-L610 PolarHBondContact O-N 2.81Å
607	R	63.3	Low	57.1	Low	66 Å²	66	75.3 Å²	75.3	25%	0.249	40%	0.402	C	S	.	.	H	α-helix	trans	-61.9	-43	176.5	-171.6	172.9	-175.9	122.7	11.9	111.8	E55 Y603 R609 R611	E55-R607 VanDerWaalsContact CD-NH1 3.32Å; E55-R607 IonicContact OE1-CZ 2.63Å; E55-R607 IonicContact OE1-NH1 2.73Å; E55-R607 PolarHBondContact OE1-NH1 3.29Å; E55-R607 IonicContact OE1-NH2 3.41Å; E55-R607 PolarHBondContact OE1-NH2 3.45Å; E55-R607 IonicContact OE2-CZ 3.6Å; E55-R607 IonicContact OE2-NH1 2.78Å; E55-R607 IonicContact OE2-NH2 3.63Å; E55-R607 PolarHBondContact OE2-NH2 3.21Å; Y603-R607 VanDerWaalsContact CZ-CD 3.43Å; Y603-R607 WeakPolarHBondContact O-CA 3.12Å; Y603-R607 WeakPolarHBondContact O-CB 3.42Å; Y603-R607 PolarHBondContact O-N 3.18Å; Y603-R607 PolarHBondContact OH-NH1 3.45Å; R607-R609 VanDerWaalsContact C-N 3.34Å; R607-R609 PolarHBondContact O-N 3.36Å; R607-R611 WeakPolarHBondContact O-CB 3.43Å; R607-R611 PolarHBondContact O-N 2.87Å
608	S	63.2	Low	56.1	Low	72 Å²	72	75.5 Å²	75.5	50%	0.503	41%	0.409	S	S	.	.	H	α-helix	trans	-63	-42	177.1	-61.4	0	0	0	0	111.4	N604 V606 R611 T612	N604-S608 WeakPolarHBondContact O-CB 3.22Å; N604-S608 PolarHBondContact O-N 2.96Å; N604-S608 PolarHBondContact O-OG 3.16Å; V606-S608 PolarHBondContact O-N 3.35Å; S608-R611 WeakPolarHBondContact O-CB 3.39Å; S608-R611 PolarHBondContact O-N 3.33Å; S608-T612 WeakPolarHBondContact O-CG2 3.46Å; S608-T612 PolarHBondContact O-N 3.24Å; S608-T612 PolarHBondContact O-OG1 3.29Å
609	R	57.8	Low	55.2	Low	116 Å²	116	77.8 Å²	77.8	44%	0.438	42%	0.421	S	S	.	.	H	α-helix	trans	-72.9	-38.3	178.7	-78.6	-174.5	164.1	144.3	-9.2	113.8	T605 V606 R607 R611 T612 H613	T605-R609 WeakPolarHBondContact O-CB 3.25Å; T605-R609 PolarHBondContact O-N 3.1Å; T605-R609 VanDerWaalsContact O-N 3.12Å; V606-R609 PolarHBondContact O-N 3.35Å; R607-R609 VanDerWaalsContact C-N 3.34Å; R607-R609 PolarHBondContact O-N 3.36Å; R609-R611 PolarHBondContact O-N 3.05Å; R609-T612 VanDerWaalsContact CA-OG1 3.32Å; R609-T612 WeakPolarHBondContact CA-OG1 3.2Å; R609-T612 PolarHBondContact O-N 3.15Å; R609-T612 PolarHBondContact O-OG1 3.41Å; R609-H613 PolarHBondContact O-CD2 3.47Å; R609-H613 VanDerWaalsContact O-CD2 3.3Å; R609-H613 PolarHBondContact O-N 2.82Å
610	L	59	Low	54.2	Low	42 Å²	42	78.8 Å²	78.8	22%	0.22	43%	0.427	C	S	.	.	H	α-helix	trans	-60.5	-39.8	169.8	-71.8	172.4	0	0	0	109.7	L54 V606 T612 H613 L614	L54-L610 HydrophobicContact CD1-CD1 4.45Å; L54-L610 HydrophobicContact CD2-CD1 4.36Å; V606-L610 HydrophobicContact CG1-CD1 3.74Å; V606-L610 HydrophobicContact CG1-CG 4.1Å; V606-L610 WeakPolarHBondContact O-CB 3.28Å; V606-L610 VanDerWaalsContact O-CG 3.25Å; V606-L610 WeakPolarHBondContact O-CG 3.04Å; V606-L610 PolarHBondContact O-N 2.81Å; L610-T612 PolarHBondContact O-N 3.09Å; L610-H613 PolarHBondContact O-N 3.33Å; L610-L614 HydrophobicContact CD2-CD1 3.67Å; L610-L614 WeakPolarHBondContact O-CA 3.32Å; L610-L614 VanDerWaalsContact O-CB 3.32Å; L610-L614 WeakPolarHBondContact O-CB 3.47Å; L610-L614 PolarHBondContact O-N 2.96Å
611	R	61.2	Low	53	Low	144 Å²	144	88.1 Å²	88.1	54%	0.543	45%	0.451	S	S	.	.	H	α-helix	trans	-66.2	-35.5	177	-162.4	176.3	-167.3	155.5	3.4	113.4	R607 S608 R609 G615 N616	R607-R611 WeakPolarHBondContact O-CB 3.43Å; R607-R611 PolarHBondContact O-N 2.87Å; S608-R611 WeakPolarHBondContact O-CB 3.39Å; S608-R611 PolarHBondContact O-N 3.33Å; R609-R611 PolarHBondContact O-N 3.05Å; R611-G615 VanDerWaalsContact CA-O 3.31Å; R611-G615 WeakPolarHBondContact CA-O 3.44Å; R611-G615 CarbonylContact O-C 3.59Å; R611-G615 WeakPolarHBondContact O-CA 3.36Å; R611-G615 PolarHBondContact O-N 3.31Å; R611-N616 PolarHBondContact NE-OD1 2.74Å; R611-N616 PolarHBondContact NH2-OD1 3.28Å
612	T	59.1	Low	51.7	Low	108 Å²	108	89.7 Å²	89.7	66%	0.663	47%	0.465	S	S	*	.	H	α-helix	trans	-73.9	-30.5	176.2	54.1	0	0	0	0	113	S608 R609 L610	S608-T612 WeakPolarHBondContact O-CG2 3.46Å; S608-T612 PolarHBondContact O-N 3.24Å; S608-T612 PolarHBondContact O-OG1 3.29Å; R609-T612 VanDerWaalsContact CA-OG1 3.32Å; R609-T612 WeakPolarHBondContact CA-OG1 3.2Å; R609-T612 PolarHBondContact O-N 3.15Å; R609-T612 PolarHBondContact O-OG1 3.41Å; L610-T612 PolarHBondContact O-N 3.09Å
613	H	52.9	Low	50.4	Low	138 Å²	138	92.5 Å²	92.5	64%	0.639	49%	0.491	S	S	*	.	H	α-helix	trans	-95.9	-32.4	-177	-78.4	-69.6	0	0	0	114.6	R609 L610	R609-H613 PolarHBondContact O-CD2 3.47Å; R609-H613 VanDerWaalsContact O-CD2 3.3Å; R609-H613 PolarHBondContact O-N 2.82Å; L610-H613 PolarHBondContact O-N 3.33Å
614	L	53.8	Low	48.9	Very low	121 Å²	121	95.2 Å²	95.2	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-113.6	3.2	-173.9	-63.8	163.2	0	0	0	112.9	L610	L610-L614 HydrophobicContact CD2-CD1 3.67Å; L610-L614 WeakPolarHBondContact O-CA 3.32Å; L610-L614 VanDerWaalsContact O-CB 3.32Å; L610-L614 WeakPolarHBondContact O-CB 3.47Å; L610-L614 PolarHBondContact O-N 2.96Å
615	G	53.2	Low	47	Very low	37 Å²	37	99.5 Å²	99.5	38%	0.381	53%	0.531	S	S	.	.	S	Bend	trans	72.9	-166.6	-170.9	0	0	0	0	0	111.8	R611 S617	R611-G615 VanDerWaalsContact CA-O 3.31Å; R611-G615 WeakPolarHBondContact CA-O 3.44Å; R611-G615 CarbonylContact O-C 3.59Å; R611-G615 WeakPolarHBondContact O-CA 3.36Å; R611-G615 PolarHBondContact O-N 3.31Å; G615-S617 PolarHBondContact O-N 3.29Å
616	N	48.3	Very low	45.5	Very low	114 Å²	114	105.6 Å²	105.6	61%	0.61	56%	0.56	S	S	*	*	S	Bend	trans	-49.3	138.3	171.8	-69.2	-37.6	0	0	0	109	R611	R611-N616 PolarHBondContact NE-OD1 2.74Å; R611-N616 PolarHBondContact NH2-OD1 3.28Å
617	S	40.7	Very low	44	Very low	44 Å²	44	110.9 Å²	110.9	31%	0.308	58%	0.584	S	S	.	*			trans	-43	135.3	176.2	45.9	0	0	0	0	108.6	G615 I619	G615-S617 PolarHBondContact O-N 3.29Å; S617-I619 PolarHBondContact O-N 2.79Å
618	P	39.6	Very low	42.2	Very low	103 Å²	103	113.9 Å²	113.9	67%	0.669	61%	0.614	S	S	*	*	S	Bend	trans	-66.4	16	-173.1	26.3	-33.6	0	0	0	113.5	P620	P618-P620 VanDerWaalsContact O-CD 3.23Å; P618-P620 WeakPolarHBondContact O-CD 3.31Å
619	I	37.9	Very low	40.5	Very low	57 Å²	57	120 Å²	120	29%	0.292	63%	0.632	S	S	.	*			trans	-101.4	105.2	-179.4	-67.9	168.8	0	0	0	108.3	E55 S617 R621	E55-I619 HydrophobicContact CB-CD1 3.34Å; E55-I619 WeakPolarHBondContact O-CD1 2.89Å; S617-I619 PolarHBondContact O-N 2.79Å; I619-R621 PolarHBondContact O-N 2.86Å
620	P	34	Very low	39	Very low	100 Å²	100	119.6 Å²	119.6	65%	0.649	65%	0.646	S	S	*	*			trans	-55.1	132	155.7	25.1	-30.9	0	0	0	106.7	P618 T622	P618-P620 VanDerWaalsContact O-CD 3.23Å; P618-P620 WeakPolarHBondContact O-CD 3.31Å; P620-T622 PolarHBondContact O-N 3.46Å
621	R	30.9	Very low	37.6	Very low	250 Å²	250	124.3 Å²	124.3	94%	0.943	68%	0.677	S	S	*	*			trans	-50.1	89	174.2	-72.2	177.5	174	135.8	-5.6	109.5	I619 A623	I619-R621 PolarHBondContact O-N 2.86Å; R621-A623 PolarHBondContact O-N 3.33Å; R621-A623 VanDerWaalsContact O-N 3.16Å
622	T	30.8	Very low	36	Very low	119 Å²	119	124.1 Å²	124.1	73%	0.73	69%	0.692	S	S	*	*			trans	-76.3	108	167.6	45.1	0	0	0	0	105	P620 S624	P620-T622 PolarHBondContact O-N 3.46Å; T622-S624 PolarHBondContact O-N 2.66Å
623	A	27.5	Very low	34.6	Very low	80 Å²	80	128.2 Å²	128.2	66%	0.661	70%	0.704	S	S	*	*			trans	-42	133.5	175.8	0	0	0	0	0	110.5	R621 R625	R621-A623 PolarHBondContact O-N 3.33Å; R621-A623 VanDerWaalsContact O-N 3.16Å; A623-R625 PolarHBondContact O-N 2.78Å
624	S	27.8	Very low	33.2	Very low	132 Å²	132	131.7 Å²	131.7	92%	0.923	72%	0.717	S	S	*	*	S	Bend	trans	-41.9	90.4	150.6	167.8	0	0	0	0	109.7	T622	T622-S624 PolarHBondContact O-N 2.66Å
625	R	26.4	Very low	31.9	Very low	179 Å²	179	131.7 Å²	131.7	68%	0.675	73%	0.725	S	S	*	*			trans	-162.9	72.3	173.3	-128.5	-169.4	178.6	-160.6	3.3	109.3	A623 Q627	A623-R625 PolarHBondContact O-N 2.78Å; R625-Q627 HydrophobicContact CG-CG 4.03Å; R625-Q627 VanDerWaalsContact CZ-NE2 3.3Å; R625-Q627 VanDerWaalsContact NH1-NE2 3.13Å; R625-Q627 PolarHBondContact O-N 3.41Å
626	L	28.8	Very low	30.5	Very low	184 Å²	184	137.7 Å²	137.7	96%	0.963	75%	0.749	S	S	*	*			trans	-67.7	82.1	150	-85.8	160.4	0	0	0	106.6	C628	L626-C628 PolarHBondContact O-N 3.33Å
627	Q	27.8	Very low	29.7	Very low	123 Å²	123	140 Å²	140	58%	0.575	76%	0.76	S	S	*	*			trans	-68.4	119.7	158.6	-84.3	-176.4	-57.4	0	0	107.4	R625 K629	R625-Q627 HydrophobicContact CG-CG 4.03Å; R625-Q627 VanDerWaalsContact CZ-NE2 3.3Å; R625-Q627 VanDerWaalsContact NH1-NE2 3.13Å; R625-Q627 PolarHBondContact O-N 3.41Å; Q627-K629 PolarHBondContact O-N 3.19Å
628	C	25.9	Very low	29.2	Very low	129 Å²	129	146.4 Å²	146.4	87%	0.872	78%	0.784	S	S	*	*			trans	-37.7	121.9	159	-62.6	0	0	0	0	110.4	L626	L626-C628 PolarHBondContact O-N 3.33Å
629	K	26.7	Very low	28.6	Very low	201 Å²	201	146.6 Å²	146.6	87%	0.874	79%	0.788	S	S	*	*			trans	-75	128.5	168.1	-83.5	177.7	174.3	176	0	109	Q627	Q627-K629 PolarHBondContact O-N 3.19Å
630	S	27.5	Very low	28.2	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	81%	0.812	S	S	*	*			trans	60.5	92.6	148.3	64	0	0	0	0	118.5
631	T	29.8	Very low	27.9	Very low	142 Å²	142	156.4 Å²	156.4	87%	0.871	82%	0.817	S	S	*	*				-147.5	129.6	115.9	39.4	0	0	0	0	108.8	E633	T631-E633 PolarHBondContact O-N 2.81Å
632	T	26.8	Very low	27.6	Very low	139 Å²	139	149.4 Å²	149.4	85%	0.853	81%	0.805	S	S	*	*			trans	-60	107.9	173.4	37.9	0	0	0	0	110.3
633	E	28.8	Very low	27.3	Very low	195 Å²	195	151 Å²	151	91%	0.911	81%	0.809	S	S	*	*			trans	-163.2	135.9	149.5	-111	162.4	-154.8	0	0	110.6	T631 C635	T631-E633 PolarHBondContact O-N 2.81Å; E633-C635 PolarHBondContact O-N 2.7Å
634	K	24.9	Very low	27.4	Very low	210 Å²	210	153.5 Å²	153.5	91%	0.913	82%	0.815	S	S	*	*			trans	-61.4	123.2	-170.2	-65	165.4	175.5	174.6	0	111
635	C	26.6	Very low	27.4	Very low	121 Å²	121	153.9 Å²	153.9	82%	0.818	81%	0.807	S	S	*	*			trans	-152.9	105.2	149.4	-131.7	0	0	0	0	111.6	E633	E633-C635 PolarHBondContact O-N 2.7Å
636	N	24	Very low	27.6	Very low	163 Å²	163	152.9 Å²	152.9	87%	0.872	82%	0.815	S	S	*	*			trans	-66.7	121	160.4	-84.8	-18.4	0	0	0	108.7
637	I	31.7	Very low	27.5	Very low	163 Å²	163	155.7 Å²	155.7	84%	0.836	81%	0.813	S	S	*	*			trans	-141.5	124.8	143.8	-58.2	-175.9	0	0	0	108.3
638	E	30	Very low	27.5	Very low	178 Å²	178	154.5 Å²	154.5	83%	0.832	82%	0.818	S	S	*	*			trans	-67.4	155.8	-174.4	-77.8	160.4	128	0	0	114.8
639	S	26.5	Very low	27.8	Very low	107 Å²	107	157.6 Å²	157.6	75%	0.748	82%	0.822	S	S	*	*			trans	-45.3	134.2	163.3	51.9	0	0	0	0	114.5
640	Q	28.5	Very low	27.8	Very low	168 Å²	168	155.6 Å²	155.6	79%	0.785	82%	0.819	S	S	*	*			trans	-155	114.8	148.3	-93.7	-159.2	-3.7	0	0	112.1
641	Y	27.9	Very low	27.9	Very low	195 Å²	195	157.7 Å²	157.7	77%	0.765	82%	0.822	S	S	*	*			trans	60.6	112.8	150.2	-57	-77.1	0	0	0	120.1
642	C	24.3	Very low	28	Very low	103 Å²	103	159.7 Å²	159.7	70%	0.696	82%	0.818	S	S	*	*				69.7	128.4	70.4	-79.6	0	0	0	0	115.7
643	L	25.7	Very low	28.1	Very low	152 Å²	152	162.3 Å²	162.3	80%	0.796	82%	0.821	S	S	*	*			trans	46.3	109.1	143.7	-81.4	140.8	0	0	0	117.3
644	V	29.2	Very low	28	Very low	133 Å²	133	160 Å²	160	81%	0.806	81%	0.814	S	S	*	*			trans	-144.9	124.8	144.6	-168	0	0	0	0	111.6
645	D	27.1	Very low	28.5	Very low	141 Å²	141	156 Å²	156	75%	0.754	81%	0.808	S	S	*	*			trans	-52.4	165.1	168.3	-76.9	-60.2	0	0	0	115.7
646	D	30.5	Very low	28.5	Very low	158 Å²	158	157.4 Å²	157.4	85%	0.845	81%	0.807	S	S	*	*	S	Bend	trans	-40.7	142.1	158	-87.9	-38	0	0	0	113.1
647	R	26.9	Very low	28.8	Very low	243 Å²	243	154.6 Å²	154.6	92%	0.917	80%	0.795	S	S	*	*			trans	80.9	69.2	166.7	-58.3	173.9	163.6	-179.8	-5.1	118.2
648	S	29.1	Very low	28.9	Very low	97 Å²	97	154.1 Å²	154.1	68%	0.678	79%	0.794	S	S	*	*			trans	-177.1	85.9	144.5	52.3	0	0	0	0	112.5
649	M	30.8	Very low	28.8	Very low	195 Å²	195	153.7 Å²	153.7	96%	0.961	79%	0.792	S	S	*	*			trans	-148	62.7	152.3	-85.2	-138.6	-150.3	0	0	109
650	I	27.8	Very low	29.1	Very low	158 Å²	158	154.5 Å²	154.5	81%	0.81	79%	0.792	S	S	*	*	S	Bend	trans	-127.2	90.9	153.6	-60.5	174.5	0	0	0	103.3
651	L	28.2	Very low	29.1	Very low	151 Å²	151	154.9 Å²	154.9	79%	0.791	79%	0.794	S	S	*	*	S	Bend	trans	164.1	136.7	151.2	-114.4	72.9	0	0	0	110
652	K	32.2	Very low	29.5	Very low	183 Å²	183	150.4 Å²	150.4	80%	0.796	79%	0.789	S	S	*	*			trans	87.5	55.3	161.9	-61.9	176.7	174.2	-176.2	0	118.2
653	E	29	Very low	30	Very low	195 Å²	195	153.4 Å²	153.4	91%	0.911	79%	0.792	S	S	*	*				-78	102.6	118.5	-88.5	-176.4	152.3	0	0	106.1
654	L	27.9	Very low	30.3	Very low	146 Å²	146	153.2 Å²	153.2	76%	0.764	79%	0.788	S	S	*	*			trans	177.6	126.9	159.1	-97.3	157.2	0	0	0	107.8
655	T	33.8	Very low	30.4	Very low	127 Å²	127	153.6 Å²	153.6	78%	0.779	78%	0.784	S	S	*	*			trans	82.6	99.9	165.4	68.2	0	0	0	0	117
656	N	28.3	Very low	30.5	Very low	150 Å²	150	154.8 Å²	154.8	80%	0.802	79%	0.785	S	S	*	*				76.3	108.8	82	-109.3	4.3	0	0	0	115.1
657	V	29.7	Very low	30.4	Very low	103 Å²	103	152.4 Å²	152.4	62%	0.624	78%	0.781	S	S	*	*				73	126.6	118.3	172.9	0	0	0	0	119.7
658	N	32.8	Very low	30.6	Very low	154 Å²	154	147 Å²	147	82%	0.824	77%	0.774	S	S	*	*			trans	79.6	148.2	162	-60.7	-22.7	0	0	0	118.2
659	H	29.2	Very low	30.6	Very low	168 Å²	168	149.3 Å²	149.3	78%	0.778	78%	0.778	S	S	*	*			cis	178	162.1	-17.3	-176.6	31.3	0	0	0	104.9
660	V	31.3	Very low	30.7	Very low	124 Å²	124	147.2 Å²	147.2	75%	0.752	77%	0.766	S	S	*	*			trans	98.2	143.5	160.3	-163.9	0	0	0	0	118.3
661	Q	29.2	Very low	30.7	Very low	177 Å²	177	147.7 Å²	147.7	83%	0.827	76%	0.762	S	S	*	*			trans	-106.9	173.4	-138.3	-94.4	-119.4	0.3	0	0	115.4
662	P	36.6	Very low	30.8	Very low	100 Å²	100	151.1 Å²	151.1	65%	0.649	76%	0.764	S	S	*	*			trans	-97.5	174.8	-170.2	39.2	-28.1	0	0	0	113.1
663	E	33.9	Very low	30.6	Very low	166 Å²	166	146.6 Å²	146.6	78%	0.776	76%	0.761	S	S	*	*			trans	-171	129.4	150.5	-104.1	-166.7	153.5	0	0	114.8
664	Q	32.4	Very low	30.6	Very low	149 Å²	149	145.6 Å²	145.6	70%	0.696	75%	0.754	S	S	*	*			trans	83	127.1	136.1	-61.1	-167.3	17.4	0	0	125.6
665	L	31.5	Very low	30.7	Very low	140 Å²	140	148.2 Å²	148.2	73%	0.733	76%	0.755	S	S	*	*			trans	97.6	94.2	134.4	-128.2	69	0	0	0	118.6
666	E	29.8	Very low	30.5	Very low	167 Å²	167	148.9 Å²	148.9	78%	0.78	75%	0.749	S	S	*	*				76.8	123.4	76.8	-100.6	-177.1	165.2	0	0	117.9
667	S	28.9	Very low	30.5	Very low	108 Å²	108	147 Å²	147	76%	0.755	74%	0.739	S	S	*	*			trans	72.6	139.5	147.6	75.7	0	0	0	0	116.9
668	V	30.9	Very low	30.4	Very low	128 Å²	128	148.1 Å²	148.1	78%	0.776	74%	0.742	S	S	*	*				-163.1	140.6	57.4	167.5	0	0	0	0	110.6
669	I	28.3	Very low	30.4	Very low	146 Å²	146	145.6 Å²	145.6	75%	0.749	74%	0.736	S	S	*	*			trans	-45.1	156.8	164.4	-67	152.5	0	0	0	112.9
670	Q	32.4	Very low	30.4	Very low	151 Å²	151	145 Å²	145	71%	0.706	74%	0.739	S	S	*	*				141.2	110.1	127.1	-148.1	148	42.2	0	0	115.6
671	K	29.1	Very low	30.3	Very low	169 Å²	169	146.9 Å²	146.9	74%	0.735	74%	0.739	S	S	*	*			trans	43.8	141.8	133.5	-63.9	177.8	177.5	173.8	0	118.3
672	R	30.6	Very low	30.3	Very low	223 Å²	223	144.2 Å²	144.2	84%	0.842	73%	0.73	S	S	*	*				173.4	146.2	52.5	-146.4	170.2	-169.4	165.3	-0.9	108.8
673	A	27	Very low	30	Very low	88 Å²	88	145.5 Å²	145.5	73%	0.727	73%	0.73	S	S	*	*			trans	-93.3	147.2	154.1	0	0	0	0	0	109.7
674	K	28.3	Very low	29.8	Very low	173 Å²	173	144.5 Å²	144.5	75%	0.752	73%	0.725	S	S	*	*			trans	108.3	141.9	166.7	-67.5	-173.1	173.5	-175.3	0	117.8
675	Y	31.3	Very low	30	Very low	201 Å²	201	142.6 Å²	142.6	79%	0.788	73%	0.728	S	S	*	*			trans	84.7	144.3	170.4	-57	-78.2	0	0	0	115.1
676	Q	29.5	Very low	30.1	Very low	142 Å²	142	143.3 Å²	143.3	66%	0.664	73%	0.727	S	S	*	*			cis	169.1	132.7	-15.2	178.4	88.9	26.4	0	0	101.3
677	N	27.7	Very low	30.6	Very low	110 Å²	110	139.4 Å²	139.4	59%	0.588	72%	0.717	S	S	*	*			trans	63.3	131	152.3	-79.5	32	0	0	0	122
678	D	28.2	Very low	30.7	Very low	127 Å²	127	140.9 Å²	140.9	68%	0.679	71%	0.713	S	S	*	*				79.4	137.8	129.4	-60.2	-22.3	0	0	0	120.3
679	S	32.6	Very low	30.8	Very low	101 Å²	101	140.1 Å²	140.1	71%	0.706	71%	0.705	S	S	*	*			trans	71.8	102.3	155.5	41.3	0	0	0	0	116
680	D	28	Very low	31.1	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	70%	0.702	S	S	*	*				85.4	138.6	72.4	-90.5	-28.8	0	0	0	111.7
681	E	30.6	Very low	30.9	Very low	163 Å²	163	140 Å²	140	76%	0.762	70%	0.703	S	S	*	*			trans	78.5	104.9	155.9	-69.6	-152.1	149.7	0	0	116.6
682	L	28.7	Very low	31	Very low	120 Å²	120	139.1 Å²	139.1	63%	0.628	70%	0.701	S	S	*	*				91.4	114.7	95.1	-105.7	144.9	0	0	0	108.5
683	I	30.9	Very low	30.8	Very low	127 Å²	127	133 Å²	133	65%	0.651	69%	0.693	S	S	*	*				-176.6	129	73.9	-92.8	148.4	0	0	0	109.1
684	Q	30	Very low	30.9	Very low	146 Å²	146	136.2 Å²	136.2	68%	0.682	70%	0.697	S	S	*	*			trans	41.3	130.7	131.1	-50.3	167.1	-26.2	0	0	117.7
685	S	35.7	Very low	31	Very low	108 Å²	108	132.5 Å²	132.5	76%	0.755	69%	0.693	S	S	*	*				-167.9	120	53.6	31	0	0	0	0	107.5
686	H	34.2	Very low	31	Very low	155 Å²	155	130.1 Å²	130.1	72%	0.718	69%	0.693	S	S	*	*				65.9	154.5	82	-96.2	-23.9	0	0	0	112.6
687	P	38.7	Very low	31.2	Very low	86 Å²	86	127 Å²	127	56%	0.558	69%	0.687	S	S	*	*			cis	-151.6	-172.6	-22	33.9	-13.5	0	0	0	115
688	M	31.6	Very low	31.6	Very low	138 Å²	138	128.1 Å²	128.1	68%	0.68	69%	0.693	S	S	*	*			trans	80.4	129.3	143.7	-71.6	-18	155.5	0	0	115.3
689	N	33.6	Very low	31.7	Very low	112 Å²	112	129.5 Å²	129.5	60%	0.599	69%	0.689	S	S	*	*			cis	-164	159.5	21.4	-100.3	-6.4	0	0	0	105.2
690	E	34.3	Very low	31.5	Very low	148 Å²	148	129.3 Å²	129.3	69%	0.692	69%	0.688	S	S	*	*			cis	-167.3	118.2	16.9	-110.6	150.2	-157.2	0	0	103.2
691	M	28.1	Very low	31.7	Very low	147 Å²	147	128.1 Å²	128.1	72%	0.724	68%	0.681	S	S	*	*				37.6	116.2	91.6	-82.5	-154.3	-95.9	0	0	114.4
692	H	32.1	Very low	31.7	Very low	150 Å²	150	128.4 Å²	128.4	69%	0.694	68%	0.682	S	S	*	*				178.8	99.8	103.8	-88.7	-63.9	0	0	0	111.5
693	S	26.5	Very low	31.9	Very low	95 Å²	95	129.2 Å²	129.2	66%	0.664	69%	0.686	S	S	*	*			trans	-48.2	160.7	136.3	43	0	0	0	0	112
694	L	27.9	Very low	32.1	Very low	156 Å²	156	130 Å²	130	82%	0.817	69%	0.686	S	S	*	*			trans	95.3	119.6	175	-52.1	150.5	0	0	0	111.4
695	S	30.8	Very low	32.1	Very low	95 Å²	95	133 Å²	133	66%	0.664	69%	0.692	S	S	*	*				174.6	161.1	54.8	45.1	0	0	0	0	110.1
696	N	30.6	Very low	32	Very low	150 Å²	150	133 Å²	133	80%	0.802	69%	0.687	S	S	*	*			trans	78.9	137.3	157.8	-61.7	-17.5	0	0	0	118.9
697	S	34.7	Very low	32.2	Very low	76 Å²	76	134.9 Å²	134.9	53%	0.531	69%	0.693	S	S	.	*			cis	-178.6	142.6	-15.8	-151.3	0	0	0	0	106.5
698	N	35.4	Very low	31.9	Very low	134 Å²	134	134.6 Å²	134.6	72%	0.717	69%	0.693	S	S	*	*			trans	60.9	105.3	148.1	-54.3	-19.9	0	0	0	118.5
699	R	30.7	Very low	31.9	Very low	157 Å²	157	133.8 Å²	133.8	59%	0.592	70%	0.696	S	S	*	*				48.6	78.9	67.6	-144.7	179.9	-172.5	-154.2	-2.3	111.4	H704	R699-H704 PolarHBondContact NH2-CD2 3.32Å; R699-H704 PolarHBondContact NH2-CE1 2.65Å; R699-H704 PolarHBondContact NH2-NE2 3.16Å
700	S	28.6	Very low	31.8	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	69%	0.694	S	S	*	*			trans	-133.4	119.2	156.4	171.9	0	0	0	0	106.6
701	N	32.1	Very low	31.6	Very low	131 Å²	131	132.3 Å²	132.3	70%	0.701	70%	0.699	S	S	*	*	S	Bend	cis	-130.2	150.5	-5.9	-70.1	-35.6	0	0	0	105.5
702	H	30.6	Very low	31.8	Very low	168 Å²	168	128.6 Å²	128.6	78%	0.778	69%	0.692	S	S	*	*	S	Bend	trans	59.5	104	160.4	-100.5	-82.9	0	0	0	115.8
703	I	31.7	Very low	31.7	Very low	138 Å²	138	127.3 Å²	127.3	71%	0.708	70%	0.695	S	S	*	*	S	Bend	trans	77.1	65.9	153.8	-39.7	179.9	0	0	0	115.4
704	H	36.7	Very low	32	Very low	142 Å²	142	126.4 Å²	126.4	66%	0.657	69%	0.689	S	S	*	*	S	Bend	trans	67.3	76.6	146.1	-67.1	-77.9	0	0	0	122.6	R699	R699-H704 PolarHBondContact NH2-CD2 3.32Å; R699-H704 PolarHBondContact NH2-CE1 2.65Å; R699-H704 PolarHBondContact NH2-NE2 3.16Å
705	R	29.1	Very low	32.4	Very low	211 Å²	211	127.2 Å²	127.2	80%	0.796	69%	0.686	S	S	*	*			trans	71.8	79.5	132	-141.5	171.8	-172	164.8	0.4	121.4
706	T	33.4	Very low	32.5	Very low	107 Å²	107	129.1 Å²	129.1	66%	0.656	69%	0.688	S	S	*	*			trans	7	128.1	138.3	48.3	0	0	0	0	120.6
707	K	38.8	Very low	32.7	Very low	194 Å²	194	125.4 Å²	125.4	84%	0.843	67%	0.674	S	S	*	*				65.6	137.2	84	-84.6	-175.7	-176.2	177	0	111.9
708	S	33.5	Very low	32.6	Very low	80 Å²	80	128.4 Å²	128.4	56%	0.559	68%	0.683	S	S	*	*			cis	172.4	178.9	13.9	42	0	0	0	0	106.7
709	T	30.5	Very low	32.6	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	68%	0.678	S	S	*	*			trans	66.9	132.6	136.6	50.6	0	0	0	0	116.6
710	S	32	Very low	32.8	Very low	80 Å²	80	128 Å²	128	56%	0.559	68%	0.684	S	S	*	*			cis	161.4	154.9	20.2	43.8	0	0	0	0	104
711	N	30.5	Very low	33.2	Very low	150 Å²	150	128.9 Å²	128.9	80%	0.802	68%	0.68	S	S	*	*				125.8	137.5	122.5	-80.6	-23.7	0	0	0	104.7
712	A	31.8	Very low	33.3	Very low	69 Å²	69	131 Å²	131	57%	0.57	68%	0.683	S	S	*	*			cis	-156.8	142.1	16.7	0	0	0	0	0	106.9
713	T	30.9	Very low	33.6	Very low	123 Å²	123	128.3 Å²	128.3	76%	0.755	68%	0.683	S	S	*	*				53	133.3	126.3	54.4	0	0	0	0	118.8
714	S	32.4	Very low	33.7	Very low	76 Å²	76	128.2 Å²	128.2	53%	0.531	68%	0.684	S	S	.	*			cis	165	158.1	8.6	51.4	0	0	0	0	105.7
715	K	34.7	Very low	33.5	Very low	173 Å²	173	129.4 Å²	129.4	75%	0.752	69%	0.69	S	S	*	*			trans	69.9	127.3	144.8	-71.5	161.6	-174.3	-175.8	0	112.6
716	N	33.4	Very low	33.8	Very low	135 Å²	135	123.9 Å²	123.9	72%	0.722	68%	0.684	S	S	*	*			cis	168.2	152.3	24.7	-112	0.1	0	0	0	101.4
717	S	35.4	Very low	33.7	Very low	71 Å²	71	129.2 Å²	129.2	50%	0.497	69%	0.692	S	S	.	*			cis	160.9	148.9	2.1	45	0	0	0	0	104.2
718	L	32.8	Very low	33.4	Very low	140 Å²	140	126.2 Å²	126.2	73%	0.733	69%	0.685	S	S	*	*			trans	71	134.3	140.3	-87.3	67.9	0	0	0	113.7
719	Q	35.8	Very low	33.3	Very low	131 Å²	131	128.7 Å²	128.7	61%	0.612	69%	0.692	S	S	*	*			cis	-171.3	129.5	33.6	-123.8	164.6	-2.3	0	0	104.9
720	Q	35	Very low	33.4	Very low	150 Å²	150	131.2 Å²	131.2	70%	0.701	70%	0.696	S	S	*	*				82	138.9	109.1	-83.2	-176.1	8.3	0	0	113.2
721	L	35.6	Very low	33.2	Very low	116 Å²	116	135.6 Å²	135.6	61%	0.607	71%	0.712	S	S	*	*			cis	-160	126.9	9.9	-96.9	148.1	0	0	0	105.1
722	K	34.9	Very low	33.2	Very low	176 Å²	176	135.5 Å²	135.5	77%	0.765	71%	0.711	S	S	*	*				64.2	110.7	101.3	-76.3	-168.3	-167.9	175.4	0	116.2
723	S	36.7	Very low	33.2	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	72%	0.717	S	S	*	*				178.6	104.8	107.8	48.7	0	0	0	0	107.4
724	N	33.7	Very low	33.1	Very low	137 Å²	137	139 Å²	139	73%	0.733	72%	0.715	S	S	*	*				52.3	125.6	81.3	-73.3	9.7	0	0	0	111.1
725	E	33.8	Very low	33.1	Very low	166 Å²	166	142.4 Å²	142.4	78%	0.776	72%	0.722	S	S	*	*			cis	-160.1	138.1	32.4	-106.5	156.6	154.7	0	0	107.4
726	S	34.4	Very low	32.8	Very low	96 Å²	96	142.4 Å²	142.4	67%	0.671	72%	0.722	S	S	*	*				65	136.2	86.2	103.9	0	0	0	0	112.9
727	R	31.9	Very low	32.7	Very low	218 Å²	218	141.8 Å²	141.8	82%	0.823	72%	0.723	S	S	*	*			cis	-179	163.2	10.5	-137.5	171.2	177.7	160.3	-4	106.6
728	N	31.9	Very low	32.3	Very low	132 Å²	132	144.2 Å²	144.2	71%	0.706	74%	0.736	S	S	*	*			trans	87.2	134.3	167.8	-48.5	-8.7	0	0	0	115.6
729	D	31.7	Very low	32.2	Very low	132 Å²	132	146 Å²	146	71%	0.706	74%	0.738	S	S	*	*			cis	-165.2	145.1	-15.5	-109.1	-35.7	0	0	0	107.2
730	Q	31.6	Very low	31.9	Very low	174 Å²	174	146.3 Å²	146.3	81%	0.813	74%	0.742	S	S	*	*			trans	78.1	111.3	157.3	-65.1	178.6	6.8	0	0	121.3
731	L	29.4	Very low	31.6	Very low	171 Å²	171	144.5 Å²	144.5	90%	0.895	74%	0.741	S	S	*	*			trans	87.3	70.6	158.5	-64.6	162	0	0	0	118.2
732	N	29.1	Very low	31.4	Very low	148 Å²	148	144.1 Å²	144.1	79%	0.791	74%	0.744	S	S	*	*			trans	-77.4	130.1	165.5	-85.3	-34.2	0	0	0	111.8
733	N	31.1	Very low	31.1	Very low	129 Å²	129	142.5 Å²	142.5	69%	0.69	74%	0.744	S	S	*	*				70.5	115.2	74.9	-69.3	-39.3	0	0	0	113.5
734	L	29.5	Very low	30.8	Very low	138 Å²	138	142.7 Å²	142.7	72%	0.723	74%	0.74	S	S	*	*				73.7	118.2	77.2	-140.8	89.3	0	0	0	114.7
735	H	32.3	Very low	30.7	Very low	147 Å²	147	142.9 Å²	142.9	68%	0.681	74%	0.741	S	S	*	*			trans	85	115.6	147.4	-75.2	-28.5	0	0	0	124.7
736	K	29.4	Very low	30.6	Very low	173 Å²	173	140.7 Å²	140.7	75%	0.752	74%	0.739	S	S	*	*				66	127.8	124.5	-81.6	-179.6	175.1	174.9	0	123
737	T	29.8	Very low	30.3	Very low	121 Å²	121	141.9 Å²	141.9	74%	0.742	74%	0.743	S	S	*	*			trans	91.2	107	132.8	45.1	0	0	0	0	123.5
738	T	28.2	Very low	30.2	Very low	123 Å²	123	137.5 Å²	137.5	76%	0.755	74%	0.74	S	S	*	*			trans	51.8	117.9	132.4	33.9	0	0	0	0	122.8
739	K	31.1	Very low	30	Very low	178 Å²	178	138.5 Å²	138.5	77%	0.774	75%	0.746	S	S	*	*				157.4	131.3	91.9	-107.2	175.3	175.5	-179.1	0	113.6
740	I	28.8	Very low	29.9	Very low	136 Å²	136	138.8 Å²	138.8	70%	0.697	75%	0.747	S	S	*	*			trans	75.2	99.8	135.7	-67.6	169.6	0	0	0	118.8
741	T	28.8	Very low	29.7	Very low	113 Å²	113	135.3 Å²	135.3	69%	0.693	74%	0.738	S	S	*	*				99.1	135.9	96.6	-33.1	0	0	0	0	109.8
742	T	31.5	Very low	29.7	Very low	107 Å²	107	133.8 Å²	133.8	66%	0.656	74%	0.738	S	S	*	*			cis	-162.1	141.5	36.6	31.7	0	0	0	0	110.7
743	N	27.9	Very low	29.7	Very low	143 Å²	143	131 Å²	131	77%	0.765	72%	0.723	S	S	*	*			trans	53.9	127.6	136.9	-53.2	-10.8	0	0	0	119.4
744	T	31.8	Very low	29.4	Very low	115 Å²	115	131.4 Å²	131.4	71%	0.706	73%	0.725	S	S	*	*			cis	-159.6	140.3	49.9	34.8	0	0	0	0	113.3
745	N	30.1	Very low	29.3	Very low	141 Å²	141	130 Å²	130	75%	0.754	73%	0.726	S	S	*	*			trans	68.9	116.9	143.9	-56.8	-5.3	0	0	0	118.6
746	T	31.7	Very low	29.1	Very low	119 Å²	119	131.3 Å²	131.3	73%	0.73	73%	0.73	S	S	*	*			cis	-162.9	117.5	19.7	12.6	0	0	0	0	110.9
747	T	28.2	Very low	29	Very low	121 Å²	121	131.6 Å²	131.6	74%	0.742	73%	0.734	S	S	*	*			trans	56.3	126.8	137.6	48.6	0	0	0	0	120.9
748	T	30.8	Very low	28.8	Very low	127 Å²	127	133.9 Å²	133.9	78%	0.779	74%	0.741	S	S	*	*			cis	-165.2	130.7	6.5	30.7	0	0	0	0	110
749	N	26.4	Very low	28.7	Very low	153 Å²	153	138.4 Å²	138.4	82%	0.818	74%	0.744	S	S	*	*			trans	-62.5	154.2	164.3	-68.8	-40.1	0	0	0	111.8
750	N	29.7	Very low	28.5	Very low	137 Å²	137	139.5 Å²	139.5	73%	0.733	75%	0.749	S	S	*	*			trans	-152.7	112.4	150.4	-89.4	-25.8	0	0	0	112.7	I753	N750-I753 HydrophobicContact CB-CD1 4.15Å; N750-I753 WeakPolarHBondContact OD1-CD1 3.4Å
751	T	28	Very low	28.6	Very low	102 Å²	102	140.2 Å²	140.2	63%	0.626	74%	0.743	S	S	*	*			trans	-30	157	149.4	40.2	0	0	0	0	114.8	I753	T751-I753 PolarHBondContact O-N 3.38Å; T751-I753 WeakPolarHBondContact OG1-CG1 3.23Å
752	P	28.9	Very low	28.6	Very low	138 Å²	138	145.8 Å²	145.8	90%	0.896	75%	0.753	S	S	*	*			trans	-67.6	88.5	164.5	29.9	-29.8	0	0	0	107.7	D754	P752-D754 PolarHBondContact O-N 2.74Å
753	I	29.1	Very low	28.6	Very low	90 Å²	90	149.9 Å²	149.9	46%	0.462	76%	0.762	S	S	.	*			trans	-69.1	113.5	177.5	-72.4	166	0	0	0	107.4	N750 T751 S755	N750-I753 HydrophobicContact CB-CD1 4.15Å; N750-I753 WeakPolarHBondContact OD1-CD1 3.4Å; T751-I753 PolarHBondContact O-N 3.38Å; T751-I753 WeakPolarHBondContact OG1-CG1 3.23Å; I753-S755 VanDerWaalsContact C-N 3.3Å; I753-S755 PolarHBondContact O-N 3.27Å; I753-S755 PolarHBondContact O-OG 2.88Å; I753-S755 VanDerWaalsContact O-OG 3.09Å
754	D	26.3	Very low	28.7	Very low	137 Å²	137	149.4 Å²	149.4	73%	0.733	77%	0.766	S	S	*	*			trans	-38.2	92.4	151.7	-157.4	1.4	0	0	0	109.8	P752 F756	P752-D754 PolarHBondContact O-N 2.74Å; D754-F756 PolarHBondContact O-N 3.47Å
755	S	27.6	Very low	28.7	Very low	109 Å²	109	146.9 Å²	146.9	76%	0.762	76%	0.763	S	S	*	*			trans	-94.4	50.5	-179.8	-63.2	0	0	0	0	110.2	I753	I753-S755 VanDerWaalsContact C-N 3.3Å; I753-S755 PolarHBondContact O-N 3.27Å; I753-S755 PolarHBondContact O-OG 2.88Å; I753-S755 VanDerWaalsContact O-OG 3.09Å
756	F	26.6	Very low	28.7	Very low	174 Å²	174	146.9 Å²	146.9	76%	0.763	77%	0.769	S	S	*	*			trans	-90.2	95.7	150.6	-91.5	-86.2	0	0	0	107.2	D754	D754-F756 PolarHBondContact O-N 3.47Å
757	H	27.8	Very low	28.6	Very low	180 Å²	180	148.8 Å²	148.8	83%	0.833	77%	0.773	S	S	*	*			trans	172.7	74.8	151.7	-89.9	-49.5	0	0	0	110.3
758	L	25.7	Very low	28.5	Very low	169 Å²	169	154.7 Å²	154.7	89%	0.885	78%	0.781	S	S	*	*	S	Bend	trans	-169.3	97.8	153.6	-101.1	143.6	0	0	0	106
759	W	26.3	Very low	28.6	Very low	218 Å²	218	157.4 Å²	157.4	83%	0.826	79%	0.785	S	S	*	*			trans	165.7	56.8	156.2	-95.9	57.6	0	0	0	106.5	R761	W759-R761 PolarHBondContact O-N 3.21Å; W759-R761 VanDerWaalsContact O-N 3.07Å
760	K	27.2	Very low	28.6	Very low	201 Å²	201	158.8 Å²	158.8	87%	0.874	79%	0.787	S	S	*	*			trans	-69.8	96.5	163.6	-112.3	-179.2	178.3	176.6	0	106.4	Y762	K760-Y762 PolarHBondContact O-N 3.41Å
761	R	30	Very low	28.7	Very low	151 Å²	151	160.7 Å²	160.7	57%	0.57	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.9	116.8	164.9	-73.3	-167.4	-173.2	-173	6.2	108	W759 K763	W759-R761 PolarHBondContact O-N 3.21Å; W759-R761 VanDerWaalsContact O-N 3.07Å; R761-K763 PolarHBondContact O-N 2.77Å
762	Y	28.7	Very low	28.8	Very low	230 Å²	230	164.9 Å²	164.9	90%	0.902	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-46.5	121.3	172.8	-86.7	-102.4	0	0	0	111.1	K760	K760-Y762 PolarHBondContact O-N 3.41Å
763	K	32.9	Very low	28.8	Very low	192 Å²	192	163.7 Å²	163.7	84%	0.835	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81.9	129.6	154.1	-85.1	-172.4	173.7	-175	0	107.1	R761 G765	R761-K763 PolarHBondContact O-N 2.77Å; K763-G765 PolarHBondContact O-N 3.03Å
764	P	28.5	Very low	28.7	Very low	133 Å²	133	163.6 Å²	163.6	86%	0.864	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.4	123.4	167.7	31.2	-28.4	0	0	0	107.2
765	G	31.6	Very low	28.9	Very low	62 Å²	62	164.2 Å²	164.2	64%	0.639	81%	0.81	S	S	*	*			trans	-168.3	84.1	-174.1	0	0	0	0	0	110.7	K763	K763-G765 PolarHBondContact O-N 3.03Å
766	T	31.4	Very low	28.9	Very low	142 Å²	142	167 Å²	167	87%	0.871	81%	0.808	S	S	*	*			trans	62.1	105.1	143.4	-29.3	0	0	0	0	117.9	R768	T766-R768 PolarHBondContact O-N 3.46Å
767	I	29.4	Very low	29.1	Very low	159 Å²	159	164.9 Å²	164.9	82%	0.815	81%	0.805	S	S	*	*			trans	-43.4	122	163	-67	160	0	0	0	110.6
768	R	26.8	Very low	29	Very low	244 Å²	244	162.7 Å²	162.7	92%	0.921	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-75.8	116.9	161	-88.4	-176.1	168	-162	-3.7	108.1	T766	T766-R768 PolarHBondContact O-N 3.46Å
769	Q	32.3	Very low	29.2	Very low	185 Å²	185	160.5 Å²	160.5	86%	0.864	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-97.1	135.4	150.9	-106.6	176.6	-5.3	0	0	108.7
770	E	25.8	Very low	29.3	Very low	182 Å²	182	154.4 Å²	154.4	85%	0.85	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-59.5	147.1	-177.5	-57.5	170.5	137.9	0	0	111.8
771	L	32.7	Very low	29.4	Very low	176 Å²	176	153.4 Å²	153.4	92%	0.921	78%	0.78	S	S	*	*				-172.2	139.7	124.9	-95.2	159	0	0	0	110.2
772	K	30.2	Very low	29.4	Very low	191 Å²	191	152.4 Å²	152.4	83%	0.83	78%	0.784	S	S	*	*			trans	-77.6	158.3	-165	-68.5	165.5	173.4	171.4	0	113.1
773	S	29.1	Very low	29.3	Very low	112 Å²	112	148.4 Å²	148.4	78%	0.783	78%	0.778	S	S	*	*			trans	61.9	140.3	146.4	56.1	0	0	0	0	117.7
774	S	26.4	Very low	29.3	Very low	89 Å²	89	145.1 Å²	145.1	62%	0.622	78%	0.78	S	S	*	*			cis	172.2	166.7	1.7	48.4	0	0	0	0	105.6
775	I	30.6	Very low	29.2	Very low	150 Å²	150	147.9 Å²	147.9	77%	0.769	78%	0.778	S	S	*	*			trans	80.5	136.4	159.9	-53.9	158.3	0	0	0	114.3
776	F	27.7	Very low	29.2	Very low	167 Å²	167	150.5 Å²	150.5	73%	0.732	78%	0.782	S	S	*	*			cis	177.3	155.4	-23	-127.4	-76.7	0	0	0	104
777	N	30	Very low	29.1	Very low	130 Å²	130	150.5 Å²	150.5	70%	0.695	78%	0.777	S	S	*	*			trans	70.8	152.7	157	-63.9	-32.5	0	0	0	119.3
778	N	26	Very low	29	Very low	133 Å²	133	148.7 Å²	148.7	71%	0.711	77%	0.773	S	S	*	*			cis	177.4	163.3	-34.6	-137.9	-11.2	0	0	0	104
779	T	30.5	Very low	29.3	Very low	124 Å²	124	148.6 Å²	148.6	76%	0.761	77%	0.774	S	S	*	*			trans	68.7	146.6	160	59.3	0	0	0	0	118.1
780	S	27.8	Very low	29.2	Very low	89 Å²	89	146.5 Å²	146.5	62%	0.622	77%	0.769	S	S	*	*			cis	168.9	154.6	-29.9	46.2	0	0	0	0	105.6
781	F	28.5	Very low	29.3	Very low	181 Å²	181	143.6 Å²	143.6	79%	0.794	76%	0.756	S	S	*	*			trans	92.2	120.2	149.1	-78	-59	0	0	0	122.8
782	I	31.4	Very low	29	Very low	130 Å²	130	144.3 Å²	144.3	67%	0.667	75%	0.746	S	S	*	*				95.9	110.3	126	-62.9	165.2	0	0	0	120.3
783	N	26.6	Very low	29.1	Very low	145 Å²	145	144.5 Å²	144.5	78%	0.775	75%	0.747	S	S	*	*			trans	25.2	131.9	134.4	-54.9	-24.5	0	0	0	120.2
784	S	31.6	Very low	29.4	Very low	124 Å²	124	145.9 Å²	145.9	87%	0.867	75%	0.745	S	S	*	*				175.8	154.5	94.9	57	0	0	0	0	113.9
785	K	27.4	Very low	29.5	Very low	190 Å²	190	150.4 Å²	150.4	83%	0.826	75%	0.753	S	S	*	*			trans	-57.9	175.6	-175.9	-74.6	168.4	163.8	177.9	0	118.3
786	T	31.1	Very low	29.6	Very low	117 Å²	117	152.7 Å²	152.7	72%	0.718	76%	0.763	S	S	*	*			trans	86.4	142.2	157.5	65.8	0	0	0	0	115.3
787	D	30.2	Very low	29.7	Very low	143 Å²	143	149.7 Å²	149.7	77%	0.765	76%	0.758	S	S	*	*			cis	-163.3	159.9	-12	-97.8	-29.1	0	0	0	106.2
788	T	27.5	Very low	29.8	Very low	120 Å²	120	151.9 Å²	151.9	74%	0.736	77%	0.77	S	S	*	*			trans	-12.7	134.3	163.2	40.9	0	0	0	0	119.3
789	Y	32.8	Very low	30	Very low	242 Å²	242	153.7 Å²	153.7	95%	0.949	77%	0.774	S	S	*	*			trans	-158.6	151.6	136.2	-99	-72.1	0	0	0	112.7
790	D	29.2	Very low	29.9	Very low	142 Å²	142	153.9 Å²	153.9	76%	0.759	78%	0.779	S	S	*	*			trans	-86.4	166.5	-160.5	-120.7	-31.8	0	0	0	115.6
791	E	27.5	Very low	30	Very low	121 Å²	121	155 Å²	155	57%	0.565	78%	0.782	S	S	*	*			trans	65.6	122.8	143.5	-74.4	-159.9	138.1	0	0	123.8
792	R	27.3	Very low	30.3	Very low	191 Å²	191	152.7 Å²	152.7	72%	0.721	78%	0.782	S	S	*	*			trans	67.4	120.6	138.1	-61.2	171.7	-160.7	-173.9	13.7	117.5
793	F	32.9	Very low	30.3	Very low	194 Å²	194	151.3 Å²	151.3	85%	0.851	78%	0.779	S	S	*	*				-172.5	122.2	126.4	-92.8	-60.4	0	0	0	113.1
794	I	34.9	Very low	30.6	Very low	142 Å²	142	149.9 Å²	149.9	73%	0.728	78%	0.778	S	S	*	*			trans	77.9	112.6	134.6	-67	155	0	0	0	122
795	K	27.9	Very low	30.9	Very low	184 Å²	184	152.1 Å²	152.1	80%	0.8	78%	0.775	S	S	*	*			trans	-35.9	146.3	151.5	-78.3	170.5	166.5	175.9	0	115.6
796	M	32.4	Very low	31.4	Very low	197 Å²	197	148.2 Å²	148.2	97%	0.97	77%	0.771	S	S	*	*			trans	-149.2	122.2	132.5	-121	166.6	169.6	0	0	111.4
797	T	29.5	Very low	31.4	Very low	105 Å²	105	149 Å²	149	64%	0.644	78%	0.776	S	S	*	*			trans	-79.9	155.8	-177.8	41.8	0	0	0	0	112.9
798	N	32.6	Very low	31.7	Very low	176 Å²	176	147.2 Å²	147.2	94%	0.941	77%	0.772	S	S	*	*			trans	-142.9	107	142.9	-92.9	-25.4	0	0	0	109.9
799	H	30.4	Very low	31.7	Very low	171 Å²	171	147 Å²	147	79%	0.792	78%	0.776	S	S	*	*			trans	-91.6	140.9	166.1	-101.6	-54.9	0	0	0	108.7
800	C	29.3	Very low	31.6	Very low	128 Å²	128	140.1 Å²	140.1	87%	0.865	76%	0.763	S	S	*	*			trans	-125.6	116.6	153.4	-150.6	0	0	0	0	107.6
801	V	28.1	Very low	31.6	Very low	112 Å²	112	140.7 Å²	140.7	68%	0.679	76%	0.761	S	S	*	*			trans	-116.6	128.9	176.8	169.3	0	0	0	0	106.5
802	V	34.8	Very low	31.8	Very low	132 Å²	132	144.5 Å²	144.5	80%	0.8	77%	0.771	S	S	*	*			trans	-136.6	99.2	158.1	-177.1	0	0	0	0	109.9
803	V	33.3	Very low	31.8	Very low	101 Å²	101	142.3 Å²	142.3	61%	0.612	77%	0.769	S	S	*	*			trans	40.6	126.7	137.4	-166.8	0	0	0	0	121.1
804	P	32.6	Very low	31.6	Very low	116 Å²	116	141.3 Å²	141.3	75%	0.753	76%	0.761	S	S	*	*			trans	-104.1	150.5	164.7	37.4	-26.9	0	0	0	112.8
805	H	37.9	Very low	31.3	Very low	171 Å²	171	140.6 Å²	140.6	79%	0.792	75%	0.754	S	S	*	*			trans	-144.3	118.3	164.9	-91.1	-63.2	0	0	0	113.3
806	S	36.4	Very low	31.2	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	75%	0.747	S	S	*	*			trans	59	113.4	137.8	48.3	0	0	0	0	123.4
807	T	31.6	Very low	31.3	Very low	132 Å²	132	138.8 Å²	138.8	81%	0.81	74%	0.743	S	S	*	*			trans	-43.9	-175.8	148.7	47.5	0	0	0	0	117.3
808	P	36.2	Very low	31.3	Very low	106 Å²	106	138.3 Å²	138.3	69%	0.688	74%	0.74	S	S	*	*			cis	-141.5	-176.4	-42.3	38.7	-20	0	0	0	114.8
809	S	27.8	Very low	31.1	Very low	117 Å²	117	136.8 Å²	136.8	82%	0.818	73%	0.731	S	S	*	*			trans	72.9	150.9	161.6	93.7	0	0	0	0	115.9
810	S	31.2	Very low	30.9	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	72%	0.723	S	S	*	*			cis	-166.1	146.2	18.4	52.9	0	0	0	0	109.3
811	H	28.3	Very low	30.9	Very low	154 Å²	154	137.4 Å²	137.4	71%	0.713	72%	0.721	S	S	*	*			trans	54.9	149.4	139	-81.4	4.1	0	0	0	124.4
812	Y	31.9	Very low	31.1	Very low	201 Å²	201	137 Å²	137	79%	0.788	72%	0.724	S	S	*	*			trans	83.5	145.1	161.7	-58.6	-77.1	0	0	0	117
813	H	27.6	Very low	30.8	Very low	144 Å²	144	142.1 Å²	142.1	67%	0.667	73%	0.728	S	S	*	*			cis	169.6	151.1	-27.3	-136.2	-24.8	0	0	0	103.5
814	Y	28.8	Very low	30.7	Very low	173 Å²	173	141.7 Å²	141.7	68%	0.678	73%	0.73	S	S	*	*			trans	71.3	148.4	160.3	-75.9	-116.9	0	0	0	116.7
815	H	28.6	Very low	30.5	Very low	127 Å²	127	141 Å²	141	59%	0.588	73%	0.728	S	S	*	*			cis	-171.1	157.6	-6.9	-121	-145.9	0	0	0	107.8
816	H	26.9	Very low	30.1	Very low	143 Å²	143	137.5 Å²	137.5	66%	0.662	72%	0.723	S	S	*	*			trans	40.5	127.1	148.6	-74.3	-64.1	0	0	0	123.5
817	K	33.4	Very low	29.8	Very low	201 Å²	201	138.9 Å²	138.9	87%	0.874	72%	0.721	S	S	*	*				-153.3	94.6	126.6	-103.7	175.3	-179.4	179	0	107.9
818	T	28.9	Very low	29.7	Very low	95 Å²	95	139.2 Å²	139.2	58%	0.583	72%	0.717	S	S	*	*				47	134.7	85.7	51.6	0	0	0	0	117.5
819	L	28.4	Very low	29.3	Very low	144 Å²	144	140.9 Å²	140.9	75%	0.754	72%	0.715	S	S	*	*			trans	85.4	139.5	155.9	-66	129.6	0	0	0	117.8
820	I	27.8	Very low	29.4	Very low	124 Å²	124	143.2 Å²	143.2	64%	0.636	71%	0.714	S	S	*	*			cis	163.1	138.3	-18.8	-104.8	161.9	0	0	0	104.1
821	K	27.9	Very low	29.4	Very low	188 Å²	188	142.6 Å²	142.6	82%	0.817	71%	0.709	S	S	*	*			trans	59.9	130.8	159.9	-73.7	163.6	-175.3	172.5	0	117.2
822	S	32.3	Very low	29.5	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	72%	0.715	S	S	*	*				-172.7	129.4	74.1	-54.5	0	0	0	0	108.3
823	R	28.3	Very low	29.6	Very low	238 Å²	238	141.7 Å²	141.7	90%	0.898	72%	0.715	S	S	*	*				61.2	127.2	85.6	-102.2	-177.2	177.5	-167.9	-3	111.6
824	S	31.3	Very low	29.7	Very low	93 Å²	93	143.9 Å²	143.9	65%	0.65	72%	0.723	S	S	*	*			cis	-172.2	147.3	28.9	-40.4	0	0	0	0	109.1
825	S	29.6	Very low	30.2	Very low	101 Å²	101	146.8 Å²	146.8	71%	0.706	75%	0.751	S	S	*	*				86.2	111.4	110.6	68.4	0	0	0	0	116
826	S	29.1	Very low	30.3	Very low	98 Å²	98	147.8 Å²	147.8	69%	0.685	76%	0.759	S	S	*	*				86.8	131.6	96.3	71.1	0	0	0	0	111.4
827	L	30.9	Very low	30.4	Very low	137 Å²	137	148.1 Å²	148.1	72%	0.717	76%	0.764	S	S	*	*				-162.2	146.2	54.8	-92.6	111.5	0	0	0	106.9
828	L	28	Very low	30.3	Very low	138 Å²	138	145.1 Å²	145.1	72%	0.723	76%	0.758	S	S	*	*				42.4	127.4	92.5	-67.8	159.6	0	0	0	111
829	E	29.3	Very low	30.3	Very low	141 Å²	141	148.1 Å²	148.1	66%	0.659	77%	0.768	S	S	*	*			cis	177.9	160.7	42	-130.9	163.3	169.4	0	0	105.1
830	E	29.1	Very low	30.5	Very low	167 Å²	167	148.3 Å²	148.3	78%	0.78	77%	0.769	S	S	*	*			trans	62	138.2	146.8	-74	173.5	162.5	0	0	118.5
831	S	30.4	Very low	30.6	Very low	84 Å²	84	149.9 Å²	149.9	59%	0.587	78%	0.778	S	S	*	*			cis	177.4	164.9	6.3	50.4	0	0	0	0	105.5
832	H	30.3	Very low	30.8	Very low	178 Å²	178	147.2 Å²	147.2	82%	0.824	78%	0.775	S	S	*	*			trans	53.6	118.4	139.6	-68.9	-47	0	0	0	117.1
833	I	35.4	Very low	30.7	Very low	157 Å²	157	150.5 Å²	150.5	81%	0.805	78%	0.779	S	S	*	*				177.8	144.4	63.7	-72.2	-169.1	0	0	0	107.9
834	F	28.3	Very low	30.9	Very low	191 Å²	191	143.3 Å²	143.3	84%	0.838	77%	0.769	S	S	*	*			trans	-45.5	130.4	161.5	-99	-103.9	0	0	0	115.1
835	N	39.5	Very low	30.9	Very low	234 Å²	234	147.8 Å²	147.8	100%	1.251	78%	0.78	S	S	*	*				-160.4	0	122.7	-112.9	-10.9	0	0	0	110

Retrieved 835 of 835 residues in 815.7 ms (Link to these results)

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