A0A5K4F0Y9_SCHMA Loading...

LisH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0Y9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,004 aa.

						>A0A5K4F0Y9_SCHMA|A0A5K4F0Y9
MSRLDKYENVRHVYRLLKEKGDIDKMKSQIRTKLILGFGSLDNSITKIDNQTTDRNIKMANCLVADHLNIHGYNYSLSVFLPEIGLTNFELEEFIKDISHLRPYSCFKDPERLTSFYKDSYSLLVSILKAYEDVSSLSKEHKAVQAVEADGCDLDHRLNSINKEYEAIKLLEILGAKKLFDDRLEQCKSEIDGRSRMEMERQMSEFRQNELNSLKSELEEEFQKRLLQNTQRLQEEFELRCQSLNEQEVLLREKYNLFQQKEERESFVRRQALQAELDAIQLVKTQLDKEKLQIDNDKLQLHKDYEKNELEFKKRENLLEIREKTLESEIHKHVNQIRMEDEIKLMKQRKELELQSVQLSENQKMLEEKLKTFEQLKQELLKQQNKFTEMEIVGYDTIKTQNEVFKAEISTLQKQLKNSLVELEEQKQIAASATTELNVLKVVKQEIEKLMNTLNNDHAVIIQEKFTLQKKLNEQQSEIYELMERLRSYEGGNKLNHAQTTEVSSVGHWSTVNQNLNNPQILTEAERRSIYEECNLSISSDLSHVSMIDTKNSGKSFTVPIQLSTDPKFDHWSKRLELSRRRMTQLKLVNEEFDSIYEEWKSVDLKEFLSKIHNDLPSFVNVHELNQPIKLKEDNLSDQIVMTNNDTKSDHVKHHHPLDQQVELNPCQENEYLTSFTKANAESKNMKMGFEKTDQNAQLHSNARIIRDFSPSSSSIDTPKSNKLELKKSSNETLSTSSQKSIKSSSTVTHHSFKKASSDHLPSYRSKSVLSTESISQAESTESKTSRKSQTNSLANDKLNHTISCQSNKNDIENKSVSSEQNINENKEKEELLNPNQTNVNGEIANNNHNNDTIENGFPLLLETSRYEVGSLKQCSLGNNDQNKPISNGNISPTSRHTTTKQTDCNGLMEKYLKLSLNASSKSPVSTTCNQTANEAKITNGYHSPGSKEKRLWFDNGHHFSSSESDIISLHNDKTKCHFTSGNFNKDEFIPNDIDVDSGSDYIW
					

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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	47.8	Very low	68	Low	195 Å²	195	135.5 Å²	135.5	96%	0.961	64%	0.643	S	S	*	*				0	-72.6	0	-84.5	59.7	174.2	0	0	112.6	R3 L4	M1-R3 PolarHBondContact O-N 3.4Å; M1-L4 PolarHBondContact O-N 3.12Å
2	S	57.4	Low	69.3	Low	102 Å²	102	132.8 Å²	132.8	71%	0.713	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	4	-151.6	-26.4	0	0	0	0	120.6	D5	S2-D5 WeakPolarHBondContact CA-OD2 3.17Å
3	R	51.8	Low	70.4	Confident	223 Å²	223	128.5 Å²	128.5	84%	0.842	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-28.1	165.2	-93.1	-175.2	170.1	175	-3	112.9	M1 Y7	M1-R3 PolarHBondContact O-N 3.4Å; R3-Y7 WeakPolarHBondContact O-CD2 3.43Å
4	L	53.3	Low	71.6	Confident	118 Å²	118	128.6 Å²	128.6	62%	0.618	61%	0.609	S	S	*	*	H	α-helix	trans	-71.1	-43.4	178.8	-76.9	163.1	0	0	0	111.6	M1 K6 Y7 E8	M1-L4 PolarHBondContact O-N 3.12Å; L4-K6 PolarHBondContact O-N 2.94Å; L4-K6 VanDerWaalsContact O-N 3.08Å; L4-Y7 PolarHBondContact O-N 3.46Å; L4-E8 PolarHBondContact O-N 3.22Å
5	D	67.4	Low	72.5	Confident	86 Å²	86	128.8 Å²	128.8	46%	0.46	60%	0.602	S	S	.	*	H	α-helix	trans	-57.1	-29.5	-179	-52.6	-64.4	0	0	0	113.2	S2 N9	S2-D5 WeakPolarHBondContact CA-OD2 3.17Å; D5-N9 VanDerWaalsContact O-CB 3.3Å; D5-N9 WeakPolarHBondContact O-CB 3.05Å; D5-N9 PolarHBondContact O-N 3.42Å; D5-N9 PolarHBondContact O-ND2 2.66Å
6	K	71.7	Confident	73.2	Confident	159 Å²	159	125.2 Å²	125.2	69%	0.691	59%	0.587	S	S	*	*	H	α-helix	trans	-69.8	-39.8	174.8	-71.1	-163.8	174.3	-169.1	0	112.5	L4 V10	L4-K6 PolarHBondContact O-N 2.94Å; L4-K6 VanDerWaalsContact O-N 3.08Å; K6-V10 VanDerWaalsContact O-CG2 3.28Å; K6-V10 WeakPolarHBondContact O-CG2 3.26Å; K6-V10 PolarHBondContact O-N 3.01Å; K6-V10 VanDerWaalsContact O-N 3.12Å
7	Y	76.9	Confident	74	Confident	168 Å²	168	121.6 Å²	121.6	66%	0.659	57%	0.573	S	S	*	*	H	α-helix	trans	-72.6	-38.7	176.4	-77.9	-78.5	0	0	0	112	R3 L4 V10 R11	R3-Y7 WeakPolarHBondContact O-CD2 3.43Å; L4-Y7 PolarHBondContact O-N 3.46Å; Y7-V10 PolarHBondContact O-N 3.41Å; Y7-R11 WeakPolarHBondContact O-CB 3.43Å; Y7-R11 WeakPolarHBondContact O-CG 3.49Å; Y7-R11 PolarHBondContact O-N 2.87Å
8	E	76.4	Confident	74.7	Confident	89 Å²	89	121.3 Å²	121.3	42%	0.416	57%	0.569	S	S	.	*	H	α-helix	trans	-68.5	-40	177.8	-125.3	55.6	-114.5	0	0	112	L4 R11 H12	L4-E8 PolarHBondContact O-N 3.22Å; E8-R11 PolarHBondContact O-N 2.98Å; E8-R11 WeakPolarHBondContact OE1-CD 3.39Å; E8-R11 IonicContact OE1-CZ 2.66Å; E8-R11 IonicContact OE1-NE 2.86Å; E8-R11 IonicContact OE1-NH1 2.68Å; E8-R11 PolarHBondContact OE1-NH1 3.08Å; E8-R11 IonicContact OE2-NH1 2.69Å; E8-R11 PolarHBondContact OE2-NH1 3.18Å; E8-H12 WeakPolarHBondContact O-CB 3.34Å; E8-H12 PolarHBondContact O-N 3.4Å
9	N	79	Confident	75.3	Confident	99 Å²	99	122.4 Å²	122.4	53%	0.529	57%	0.574	S	S	.	*	H	α-helix	trans	-63.1	-44.7	171.8	-83.5	-66.8	0	0	0	112.5	D5 R11 H12 V13	D5-N9 VanDerWaalsContact O-CB 3.3Å; D5-N9 WeakPolarHBondContact O-CB 3.05Å; D5-N9 PolarHBondContact O-N 3.42Å; D5-N9 PolarHBondContact O-ND2 2.66Å; N9-R11 VanDerWaalsContact C-N 3.33Å; N9-R11 PolarHBondContact O-N 3.47Å; N9-H12 PolarHBondContact O-N 3.17Å; N9-H12 VanDerWaalsContact O-N 3.15Å; N9-V13 WeakPolarHBondContact O-CG2 3.44Å; N9-V13 PolarHBondContact O-N 3Å
10	V	82.8	Confident	75.7	Confident	105 Å²	105	123.9 Å²	123.9	64%	0.636	58%	0.578	S	S	*	*	H	α-helix	trans	-63.2	-39.4	177	169.8	0	0	0	0	111.3	K6 Y7 Y14	K6-V10 VanDerWaalsContact O-CG2 3.28Å; K6-V10 WeakPolarHBondContact O-CG2 3.26Å; K6-V10 PolarHBondContact O-N 3.01Å; K6-V10 VanDerWaalsContact O-N 3.12Å; Y7-V10 PolarHBondContact O-N 3.41Å; V10-Y14 VanDerWaalsContact O-CB 3.25Å; V10-Y14 WeakPolarHBondContact O-CB 3.22Å; V10-Y14 PolarHBondContact O-N 3.08Å
11	R	84.1	Confident	76.1	Confident	146 Å²	146	119.3 Å²	119.3	55%	0.551	57%	0.565	S	S	*	*	H	α-helix	trans	-62.6	-40.8	171.5	-78.1	171.8	173.7	172.2	1.3	112.5	Y7 E8 N9 R15	Y7-R11 WeakPolarHBondContact O-CB 3.43Å; Y7-R11 WeakPolarHBondContact O-CG 3.49Å; Y7-R11 PolarHBondContact O-N 2.87Å; E8-R11 PolarHBondContact O-N 2.98Å; E8-R11 WeakPolarHBondContact OE1-CD 3.39Å; E8-R11 IonicContact OE1-CZ 2.66Å; E8-R11 IonicContact OE1-NE 2.86Å; E8-R11 IonicContact OE1-NH1 2.68Å; E8-R11 PolarHBondContact OE1-NH1 3.08Å; E8-R11 IonicContact OE2-NH1 2.69Å; E8-R11 PolarHBondContact OE2-NH1 3.18Å; N9-R11 VanDerWaalsContact C-N 3.33Å; N9-R11 PolarHBondContact O-N 3.47Å; R11-R15 VanDerWaalsContact O-CB 3.32Å; R11-R15 WeakPolarHBondContact O-CB 3.02Å; R11-R15 PolarHBondContact O-N 3.47Å
12	H	83.4	Confident	78.1	Confident	104 Å²	104	112.8 Å²	112.8	48%	0.481	53%	0.534	S	S	.	.	H	α-helix	trans	-68.6	-45.3	-179.4	-171.9	64.9	0	0	0	111.4	E8 N9 R15 L16	E8-H12 WeakPolarHBondContact O-CB 3.34Å; E8-H12 PolarHBondContact O-N 3.4Å; N9-H12 PolarHBondContact O-N 3.17Å; N9-H12 VanDerWaalsContact O-N 3.15Å; H12-R15 WeakPolarHBondContact O-CB 3.46Å; H12-R15 PolarHBondContact O-N 3.45Å; H12-L16 PolarHBondContact O-N 2.68Å
13	V	83.6	Confident	79.5	Confident	76 Å²	76	108.9 Å²	108.9	46%	0.461	50%	0.504	S	S	.	.	H	α-helix	trans	-61.7	-45	173.5	172.3	0	0	0	0	111.4	N9 R15 L16 L17	N9-V13 WeakPolarHBondContact O-CG2 3.44Å; N9-V13 PolarHBondContact O-N 3Å; V13-R15 VanDerWaalsContact C-N 3.27Å; V13-R15 PolarHBondContact O-N 2.93Å; V13-L16 PolarHBondContact O-N 2.82Å; V13-L17 HydrophobicContact CG1-CD1 3.77Å; V13-L17 HydrophobicContact CG1-CG 4.35Å; V13-L17 WeakPolarHBondContact O-CB 3.5Å; V13-L17 WeakPolarHBondContact O-CG 3.41Å; V13-L17 PolarHBondContact O-N 3.2Å
14	Y	86.7	Confident	81.1	Confident	131 Å²	131	101.8 Å²	101.8	51%	0.514	48%	0.483	S	S	.	.	H	α-helix	trans	-60.4	-37.3	174.9	179.9	-92	0	0	0	112.2	V10 K18 I23	V10-Y14 VanDerWaalsContact O-CB 3.25Å; V10-Y14 WeakPolarHBondContact O-CB 3.22Å; V10-Y14 PolarHBondContact O-N 3.08Å; Y14-K18 VanDerWaalsContact O-CB 3.31Å; Y14-K18 WeakPolarHBondContact O-CB 3.25Å; Y14-K18 PolarHBondContact O-N 3.04Å; Y14-K18 VanDerWaalsContact O-N 3.07Å; Y14-I23 HydrophobicContact CD2-CD1 3.62Å; Y14-I23 HydrophobicContact CE2-CD1 3.64Å; Y14-I23 HydrophobicContact CG-CD1 4.2Å; Y14-I23 WeakPolarHBondContact O-CD1 3.27Å
15	R	84.6	Confident	82.6	Confident	131 Å²	131	102.5 Å²	102.5	49%	0.494	48%	0.481	S	S	.	.	H	α-helix	trans	-68.9	-47.6	177.3	-158.2	-173.1	-51.7	175.3	6.4	111.5	R11 H12 V13 L17 K18 E19	R11-R15 VanDerWaalsContact O-CB 3.32Å; R11-R15 WeakPolarHBondContact O-CB 3.02Å; R11-R15 PolarHBondContact O-N 3.47Å; H12-R15 WeakPolarHBondContact O-CB 3.46Å; H12-R15 PolarHBondContact O-N 3.45Å; V13-R15 VanDerWaalsContact C-N 3.27Å; V13-R15 PolarHBondContact O-N 2.93Å; R15-L17 PolarHBondContact O-N 2.88Å; R15-K18 CarbonylContact O-C 3.55Å; R15-K18 WeakPolarHBondContact O-CB 3.35Å; R15-K18 PolarHBondContact O-N 2.88Å; R15-E19 WeakPolarHBondContact CD-OE1 3.38Å; R15-E19 VanDerWaalsContact CG-OE1 3.29Å; R15-E19 WeakPolarHBondContact CG-OE1 3.45Å; R15-E19 WeakPolarHBondContact O-CB 3.41Å; R15-E19 WeakPolarHBondContact O-CG 3.26Å; R15-E19 PolarHBondContact O-N 3.27Å
16	L	84.9	Confident	83.5	Confident	71 Å²	71	102.7 Å²	102.7	37%	0.372	48%	0.481	S	S	.	.	H	α-helix	trans	-56.3	-47.2	174.3	-93.1	159.8	0	0	0	112.7	H12 V13 K18 E19 K20	H12-L16 PolarHBondContact O-N 2.68Å; V13-L16 PolarHBondContact O-N 2.82Å; L16-K18 PolarHBondContact O-N 2.8Å; L16-E19 PolarHBondContact O-N 2.82Å; L16-K20 WeakPolarHBondContact O-CB 3.34Å; L16-K20 WeakPolarHBondContact O-CG 3.19Å; L16-K20 PolarHBondContact O-N 3.35Å
17	L	85.5	Confident	84.2	Confident	64 Å²	64	99.7 Å²	99.7	34%	0.335	47%	0.468	S	S	.	.	H	α-helix	trans	-71.3	-17.7	178.1	-65.8	171.1	0	0	0	113.1	V13 R15 D22 I23	V13-L17 HydrophobicContact CG1-CD1 3.77Å; V13-L17 HydrophobicContact CG1-CG 4.35Å; V13-L17 WeakPolarHBondContact O-CB 3.5Å; V13-L17 WeakPolarHBondContact O-CG 3.41Å; V13-L17 PolarHBondContact O-N 3.2Å; R15-L17 PolarHBondContact O-N 2.88Å; L17-D22 HydrophobicContact CD2-CB 4.15Å; L17-D22 PolarHBondContact O-N 3.45Å; L17-D22 VanDerWaalsContact O-N 3.14Å; L17-I23 HydrophobicContact CB-CD1 3.81Å; L17-I23 HydrophobicContact CB-CG1 3.83Å; L17-I23 PolarHBondContact O-N 2.89Å
18	K	87.9	Confident	84.4	Confident	116 Å²	116	95 Å²	95	50%	0.504	46%	0.459	S	S	.	.	H	α-helix	trans	-83.9	-44.8	171.1	-169.7	-176.3	177.2	-168.1	0	111.3	Y14 R15 L16 K20 G21 I23	Y14-K18 VanDerWaalsContact O-CB 3.31Å; Y14-K18 WeakPolarHBondContact O-CB 3.25Å; Y14-K18 PolarHBondContact O-N 3.04Å; Y14-K18 VanDerWaalsContact O-N 3.07Å; R15-K18 CarbonylContact O-C 3.55Å; R15-K18 WeakPolarHBondContact O-CB 3.35Å; R15-K18 PolarHBondContact O-N 2.88Å; L16-K18 PolarHBondContact O-N 2.8Å; K18-K20 VanDerWaalsContact C-N 3.32Å; K18-K20 PolarHBondContact O-N 3Å; K18-G21 PolarHBondContact O-N 3.48Å; K18-I23 HydrophobicContact CB-CD1 4.21Å
19	E	84.9	Confident	84.9	Confident	142 Å²	142	96 Å²	96	66%	0.664	46%	0.464	S	S	*	.	H	α-helix	trans	-66.7	-32.3	179.2	-74	165.2	-179.4	0	0	112	R15 L16 G21	R15-E19 WeakPolarHBondContact CD-OE1 3.38Å; R15-E19 VanDerWaalsContact CG-OE1 3.29Å; R15-E19 WeakPolarHBondContact CG-OE1 3.45Å; R15-E19 WeakPolarHBondContact O-CB 3.41Å; R15-E19 WeakPolarHBondContact O-CG 3.26Å; R15-E19 PolarHBondContact O-N 3.27Å; L16-E19 PolarHBondContact O-N 2.82Å; E19-G21 VanDerWaalsContact C-N 3.28Å; E19-G21 PolarHBondContact O-N 3.4Å
20	K	84.5	Confident	85.1	Confident	152 Å²	152	96 Å²	96	66%	0.661	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-7.2	169.2	-71.7	-172.8	173.9	-169.5	0	114.9	L16 K18 D22	L16-K20 WeakPolarHBondContact O-CB 3.34Å; L16-K20 WeakPolarHBondContact O-CG 3.19Å; L16-K20 PolarHBondContact O-N 3.35Å; K18-K20 VanDerWaalsContact C-N 3.32Å; K18-K20 PolarHBondContact O-N 3Å; K20-D22 WeakPolarHBondContact CB-OD2 3.37Å; K20-D22 PolarHBondContact O-N 3.38Å
21	G	84.4	Confident	85.1	Confident	29 Å²	29	99.8 Å²	99.8	30%	0.299	47%	0.466	S	S	.	.	S	Bend	trans	74.2	-2.7	-175.9	0	0	0	0	0	115.6	K18 E19 I23 D24 K25	K18-G21 PolarHBondContact O-N 3.48Å; E19-G21 VanDerWaalsContact C-N 3.28Å; E19-G21 PolarHBondContact O-N 3.4Å; G21-I23 VanDerWaalsContact C-N 3.27Å; G21-I23 PolarHBondContact O-N 3.32Å; G21-D24 PolarHBondContact O-N 3.45Å; G21-K25 WeakPolarHBondContact O-CB 3.24Å; G21-K25 PolarHBondContact O-N 2.6Å
22	D	88.5	Confident	84.9	Confident	58 Å²	58	96.2 Å²	96.2	31%	0.31	46%	0.461	S	S	.	.	H	α-helix	trans	-56.8	-37.9	-178.9	-68.8	-49.3	0	0	0	112.8	L17 K20 M26	L17-D22 HydrophobicContact CD2-CB 4.15Å; L17-D22 PolarHBondContact O-N 3.45Å; L17-D22 VanDerWaalsContact O-N 3.14Å; K20-D22 WeakPolarHBondContact CB-OD2 3.37Å; K20-D22 PolarHBondContact O-N 3.38Å; D22-M26 HydrophobicContact CB-CE 4.46Å; D22-M26 WeakPolarHBondContact O-CB 3.4Å; D22-M26 WeakPolarHBondContact O-CE 3.35Å; D22-M26 PolarHBondContact O-N 2.81Å
23	I	87.3	Confident	84.8	Confident	19 Å²	19	99.2 Å²	99.2	10%	0.097	47%	0.472	C	S	.	.	H	α-helix	trans	-62.7	-43.1	175.3	-78.3	173.1	0	0	0	111.9	Y14 L17 K18 G21 M26 K27	Y14-I23 HydrophobicContact CD2-CD1 3.62Å; Y14-I23 HydrophobicContact CE2-CD1 3.64Å; Y14-I23 HydrophobicContact CG-CD1 4.2Å; Y14-I23 WeakPolarHBondContact O-CD1 3.27Å; L17-I23 HydrophobicContact CB-CD1 3.81Å; L17-I23 HydrophobicContact CB-CG1 3.83Å; L17-I23 PolarHBondContact O-N 2.89Å; K18-I23 HydrophobicContact CB-CD1 4.21Å; G21-I23 VanDerWaalsContact C-N 3.27Å; G21-I23 PolarHBondContact O-N 3.32Å; I23-M26 PolarHBondContact O-N 2.86Å; I23-K27 HydrophobicContact CG2-CD 4.43Å; I23-K27 VanDerWaalsContact CG2-CE 3.46Å; I23-K27 WeakPolarHBondContact O-CG 3.27Å; I23-K27 PolarHBondContact O-N 3.08Å
24	D	85.1	Confident	84.6	Confident	74 Å²	74	99.9 Å²	99.9	40%	0.396	47%	0.473	S	S	.	.	H	α-helix	trans	-79.7	-28.3	-177.4	-66.9	-43.8	0	0	0	111.5	G21 K27 S28	G21-D24 PolarHBondContact O-N 3.45Å; D24-K27 PolarHBondContact O-N 3.41Å; D24-K27 WeakPolarHBondContact OD1-CD 3.27Å; D24-K27 WeakPolarHBondContact OD1-CE 3.32Å; D24-K27 IonicContact OD1-NZ 2.62Å; D24-K27 PolarHBondContact OD1-NZ 2.91Å; D24-S28 WeakPolarHBondContact O-CB 3.49Å; D24-S28 PolarHBondContact O-N 3.05Å
25	K	85.1	Confident	84.1	Confident	133 Å²	133	99.5 Å²	99.5	58%	0.578	48%	0.478	S	S	*	.	H	α-helix	trans	-60.9	-46.2	165.3	-167.3	173.9	-176.2	176.7	0	111.6	G21 S28 Q29	G21-K25 WeakPolarHBondContact O-CB 3.24Å; G21-K25 PolarHBondContact O-N 2.6Å; K25-S28 PolarHBondContact O-N 2.86Å; K25-Q29 WeakPolarHBondContact O-CG 3.18Å; K25-Q29 PolarHBondContact O-N 2.81Å
26	M	85.5	Confident	83.5	Confident	90 Å²	90	98.7 Å²	98.7	44%	0.443	48%	0.483	S	S	.	.	H	α-helix	trans	-64	-44.4	173.7	-81.9	-175	-81.4	0	0	112.7	D22 I23 S28 Q29 I30	D22-M26 HydrophobicContact CB-CE 4.46Å; D22-M26 WeakPolarHBondContact O-CB 3.4Å; D22-M26 WeakPolarHBondContact O-CE 3.35Å; D22-M26 PolarHBondContact O-N 2.81Å; I23-M26 PolarHBondContact O-N 2.86Å; M26-S28 VanDerWaalsContact C-N 3.3Å; M26-S28 PolarHBondContact O-N 3.24Å; M26-Q29 PolarHBondContact O-N 2.94Å; M26-I30 WeakPolarHBondContact O-CB 3.45Å; M26-I30 VanDerWaalsContact O-CG1 3.29Å; M26-I30 WeakPolarHBondContact O-CG1 3.19Å; M26-I30 PolarHBondContact O-N 3.32Å
27	K	86.4	Confident	82.7	Confident	97 Å²	97	96.8 Å²	96.8	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-59.9	-40.1	174.7	-72.5	174.6	-160.1	154.9	0	112.2	I23 D24 I30 R31	I23-K27 HydrophobicContact CG2-CD 4.43Å; I23-K27 VanDerWaalsContact CG2-CE 3.46Å; I23-K27 WeakPolarHBondContact O-CG 3.27Å; I23-K27 PolarHBondContact O-N 3.08Å; D24-K27 PolarHBondContact O-N 3.41Å; D24-K27 WeakPolarHBondContact OD1-CD 3.27Å; D24-K27 WeakPolarHBondContact OD1-CE 3.32Å; D24-K27 IonicContact OD1-NZ 2.62Å; D24-K27 PolarHBondContact OD1-NZ 2.91Å; K27-I30 PolarHBondContact O-N 2.78Å; K27-R31 PolarHBondContact O-N 3.05Å
28	S	83	Confident	81.6	Confident	69 Å²	69	99.5 Å²	99.5	48%	0.483	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-51.4	175.7	-170.2	0	0	0	0	110.4	D24 K25 M26 I30 R31 T32	D24-S28 WeakPolarHBondContact O-CB 3.49Å; D24-S28 PolarHBondContact O-N 3.05Å; K25-S28 PolarHBondContact O-N 2.86Å; M26-S28 VanDerWaalsContact C-N 3.3Å; M26-S28 PolarHBondContact O-N 3.24Å; S28-I30 VanDerWaalsContact C-N 3.31Å; S28-I30 PolarHBondContact O-N 2.89Å; S28-R31 PolarHBondContact O-N 2.86Å; S28-R31 VanDerWaalsContact O-N 3.11Å; S28-T32 PolarHBondContact O-N 3.33Å; S28-T32 PolarHBondContact O-OG1 3.42Å; S28-T32 VanDerWaalsContact O-OG1 3.11Å
29	Q	85.5	Confident	80	Confident	109 Å²	109	96.9 Å²	96.9	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-58.4	-38.5	175.6	-73	176.8	-18.7	0	0	113.3	K25 M26 T32 K33	K25-Q29 WeakPolarHBondContact O-CG 3.18Å; K25-Q29 PolarHBondContact O-N 2.81Å; M26-Q29 PolarHBondContact O-N 2.94Å; Q29-T32 PolarHBondContact O-N 3.13Å; Q29-K33 WeakPolarHBondContact O-CB 3.49Å; Q29-K33 WeakPolarHBondContact O-CG 3.39Å; Q29-K33 PolarHBondContact O-N 3.31Å
30	I	84.7	Confident	78.5	Confident	101 Å²	101	94.3 Å²	94.3	52%	0.518	49%	0.494	S	S	.	.	H	α-helix	trans	-66.9	-43.6	175.2	-70.3	165.8	0	0	0	110.7	M26 K27 S28 K33 L34	M26-I30 WeakPolarHBondContact O-CB 3.45Å; M26-I30 VanDerWaalsContact O-CG1 3.29Å; M26-I30 WeakPolarHBondContact O-CG1 3.19Å; M26-I30 PolarHBondContact O-N 3.32Å; K27-I30 PolarHBondContact O-N 2.78Å; S28-I30 VanDerWaalsContact C-N 3.31Å; S28-I30 PolarHBondContact O-N 2.89Å; I30-K33 PolarHBondContact O-N 3.4Å; I30-L34 HydrophobicContact CG2-CD1 3.86Å; I30-L34 HydrophobicContact CG2-CG 4.38Å; I30-L34 WeakPolarHBondContact O-CB 3.28Å; I30-L34 VanDerWaalsContact O-CG 3.29Å; I30-L34 WeakPolarHBondContact O-CG 3.23Å; I30-L34 PolarHBondContact O-N 2.89Å
31	R	80.7	Confident	76.8	Confident	183 Å²	183	90.2 Å²	90.2	69%	0.691	48%	0.479	S	S	*	.	H	α-helix	trans	-60.5	-47	172.9	-83.2	-174.3	175.7	143.9	-3.1	111.9	K27 S28 K33 L34 I35	K27-R31 PolarHBondContact O-N 3.05Å; S28-R31 PolarHBondContact O-N 2.86Å; S28-R31 VanDerWaalsContact O-N 3.11Å; R31-K33 VanDerWaalsContact C-N 3.34Å; R31-K33 PolarHBondContact O-N 2.84Å; R31-L34 PolarHBondContact O-N 2.94Å; R31-I35 WeakPolarHBondContact O-CB 3.43Å; R31-I35 VanDerWaalsContact O-CG1 3.26Å; R31-I35 WeakPolarHBondContact O-CG1 3.43Å; R31-I35 PolarHBondContact O-N 2.92Å
32	T	80.2	Confident	75.1	Confident	72 Å²	72	94.4 Å²	94.4	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-42.6	178	-53.9	0	0	0	0	111.3	S28 Q29 I35 L36	S28-T32 PolarHBondContact O-N 3.33Å; S28-T32 PolarHBondContact O-OG1 3.42Å; S28-T32 VanDerWaalsContact O-OG1 3.11Å; Q29-T32 PolarHBondContact O-N 3.13Å; T32-I35 PolarHBondContact O-N 3.44Å; T32-L36 HydrophobicContact CG2-CD1 3.94Å; T32-L36 HydrophobicContact CG2-CG 4.45Å; T32-L36 WeakPolarHBondContact O-CB 3.47Å; T32-L36 VanDerWaalsContact O-CG 3.28Å; T32-L36 WeakPolarHBondContact O-CG 3.19Å; T32-L36 PolarHBondContact O-N 2.9Å
33	K	81.8	Confident	73.1	Confident	166 Å²	166	99.2 Å²	99.2	72%	0.722	52%	0.52	S	S	*	.	H	α-helix	trans	-66	-36.5	175	-77.7	-173.7	174.3	-170.9	0	113.2	Q29 I30 R31 G37	Q29-K33 WeakPolarHBondContact O-CB 3.49Å; Q29-K33 WeakPolarHBondContact O-CG 3.39Å; Q29-K33 PolarHBondContact O-N 3.31Å; I30-K33 PolarHBondContact O-N 3.4Å; R31-K33 VanDerWaalsContact C-N 3.34Å; R31-K33 PolarHBondContact O-N 2.84Å; K33-G37 WeakPolarHBondContact O-CA 3.27Å; K33-G37 PolarHBondContact O-N 3.26Å
34	L	79	Confident	71.2	Confident	90 Å²	90	101.1 Å²	101.1	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-70	-42.3	174.6	-72.9	170.2	0	0	0	111.6	I30 R31 G37 F38	I30-L34 HydrophobicContact CG2-CD1 3.86Å; I30-L34 HydrophobicContact CG2-CG 4.38Å; I30-L34 WeakPolarHBondContact O-CB 3.28Å; I30-L34 VanDerWaalsContact O-CG 3.29Å; I30-L34 WeakPolarHBondContact O-CG 3.23Å; I30-L34 PolarHBondContact O-N 2.89Å; R31-L34 PolarHBondContact O-N 2.94Å; L34-G37 PolarHBondContact O-N 3.1Å; L34-F38 HydrophobicContact CB-CD2 4.36Å; L34-F38 HydrophobicContact CB-CE2 4.36Å; L34-F38 HydrophobicContact CD2-CE2 4.07Å; L34-F38 WeakPolarHBondContact O-CB 3.49Å; L34-F38 WeakPolarHBondContact O-CD2 3.41Å; L34-F38 PolarHBondContact O-N 3.06Å
35	I	76.3	Confident	69.4	Low	123 Å²	123	103.2 Å²	103.2	63%	0.631	55%	0.545	S	S	*	.	H	α-helix	trans	-65.3	-44.4	178.1	-68.9	164.1	0	0	0	110.9	R31 T32 G37 G39	R31-I35 WeakPolarHBondContact O-CB 3.43Å; R31-I35 VanDerWaalsContact O-CG1 3.26Å; R31-I35 WeakPolarHBondContact O-CG1 3.43Å; R31-I35 PolarHBondContact O-N 2.92Å; T32-I35 PolarHBondContact O-N 3.44Å; I35-G37 VanDerWaalsContact C-N 3.34Å; I35-G39 PolarHBondContact O-N 3.43Å
36	L	72.3	Confident	67.3	Low	115 Å²	115	102.4 Å²	102.4	60%	0.602	55%	0.551	S	S	*	*	H	α-helix	trans	-67	-35.4	173.8	-68.5	171.5	0	0	0	112.1	T32 S40	T32-L36 HydrophobicContact CG2-CD1 3.94Å; T32-L36 HydrophobicContact CG2-CG 4.45Å; T32-L36 WeakPolarHBondContact O-CB 3.47Å; T32-L36 VanDerWaalsContact O-CG 3.28Å; T32-L36 WeakPolarHBondContact O-CG 3.19Å; T32-L36 PolarHBondContact O-N 2.9Å; L36-S40 WeakPolarHBondContact O-CB 3.28Å; L36-S40 PolarHBondContact O-N 3.41Å; L36-S40 PolarHBondContact O-OG 2.9Å
37	G	67.3	Low	65.3	Low	31 Å²	31	106.7 Å²	106.7	32%	0.32	57%	0.567	S	S	.	*	H	α-helix	trans	-64.5	-53.6	176	0	0	0	0	0	112.3	K33 L34 I35 S40 L41	K33-G37 WeakPolarHBondContact O-CA 3.27Å; K33-G37 PolarHBondContact O-N 3.26Å; L34-G37 PolarHBondContact O-N 3.1Å; I35-G37 VanDerWaalsContact C-N 3.34Å; G37-S40 PolarHBondContact O-N 3.09Å; G37-L41 WeakPolarHBondContact O-CB 3.46Å; G37-L41 PolarHBondContact O-N 2.84Å
38	F	63.2	Low	63.3	Low	121 Å²	121	108.4 Å²	108.4	53%	0.531	58%	0.579	S	S	.	*	H	α-helix	trans	-66.6	-44.1	177.5	-72.9	-60.6	0	0	0	112.4	L34 S40 L41 D42	L34-F38 HydrophobicContact CB-CD2 4.36Å; L34-F38 HydrophobicContact CB-CE2 4.36Å; L34-F38 HydrophobicContact CD2-CE2 4.07Å; L34-F38 WeakPolarHBondContact O-CB 3.49Å; L34-F38 WeakPolarHBondContact O-CD2 3.41Å; L34-F38 PolarHBondContact O-N 3.06Å; F38-S40 PolarHBondContact O-N 3.15Å; F38-L41 HydrophobicContact CD1-CD2 4.32Å; F38-L41 WeakPolarHBondContact O-CA 3.45Å; F38-L41 WeakPolarHBondContact O-CB 3.39Å; F38-L41 PolarHBondContact O-N 3.42Å; F38-D42 PolarHBondContact O-N 3.01Å
39	G	54.3	Low	61.2	Low	60 Å²	60	111.9 Å²	111.9	62%	0.619	59%	0.593	S	S	*	*	H	α-helix	trans	-64	-11.2	175.6	0	0	0	0	0	115	I35	I35-G39 PolarHBondContact O-N 3.43Å
40	S	53.3	Low	59.2	Low	89 Å²	89	111.7 Å²	111.7	62%	0.622	60%	0.595	S	S	*	*	H	α-helix	trans	-101.1	-12	168.7	-50.8	0	0	0	0	113.3	L36 G37 F38	L36-S40 WeakPolarHBondContact O-CB 3.28Å; L36-S40 PolarHBondContact O-N 3.41Å; L36-S40 PolarHBondContact O-OG 2.9Å; G37-S40 PolarHBondContact O-N 3.09Å; F38-S40 PolarHBondContact O-N 3.15Å
41	L	49.4	Very low	57.3	Low	66 Å²	66	115.4 Å²	115.4	35%	0.346	61%	0.61	S	S	.	*	H	α-helix	trans	-92.9	-29.8	-174	-120.2	58	0	0	0	113	G37 F38 N43 S44 I45	G37-L41 WeakPolarHBondContact O-CB 3.46Å; G37-L41 PolarHBondContact O-N 2.84Å; F38-L41 HydrophobicContact CD1-CD2 4.32Å; F38-L41 WeakPolarHBondContact O-CA 3.45Å; F38-L41 WeakPolarHBondContact O-CB 3.39Å; F38-L41 PolarHBondContact O-N 3.42Å; L41-N43 PolarHBondContact O-N 3.24Å; L41-N43 VanDerWaalsContact O-N 3.12Å; L41-S44 WeakPolarHBondContact O-CA 3.38Å; L41-S44 PolarHBondContact O-N 3.37Å; L41-S44 PolarHBondContact O-OG 2.97Å; L41-I45 HydrophobicContact CB-CD1 4.18Å; L41-I45 HydrophobicContact CD2-CD1 3.53Å; L41-I45 HydrophobicContact CG-CD1 3.62Å; L41-I45 HydrophobicContact CG-CG1 4.16Å; L41-I45 PolarHBondContact O-N 2.97Å
42	D	48.7	Very low	55.9	Low	117 Å²	117	113.1 Å²	113.1	63%	0.626	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-26.1	-175.4	-68.5	-24.2	0	0	0	113.2	F38 S44	F38-D42 PolarHBondContact O-N 3.01Å; D42-S44 VanDerWaalsContact C-N 3.31Å; D42-S44 PolarHBondContact O-N 3.44Å
43	N	46.7	Very low	54.3	Low	159 Å²	159	114 Å²	114	85%	0.85	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	8.7	173.6	-72.5	-9.5	0	0	0	114.3	L41	L41-N43 PolarHBondContact O-N 3.24Å; L41-N43 VanDerWaalsContact O-N 3.12Å
44	S	46	Very low	53.3	Low	58 Å²	58	108.9 Å²	108.9	41%	0.406	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-135.4	-23.9	-172.3	69.1	0	0	0	0	115.9	L41 D42	L41-S44 WeakPolarHBondContact O-CA 3.38Å; L41-S44 PolarHBondContact O-N 3.37Å; L41-S44 PolarHBondContact O-OG 2.97Å; D42-S44 VanDerWaalsContact C-N 3.31Å; D42-S44 PolarHBondContact O-N 3.44Å
45	I	46.9	Very low	52.8	Low	118 Å²	118	113.1 Å²	113.1	61%	0.605	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-19.4	-173.2	-79.8	-177.8	0	0	0	114.4	L41 K47	L41-I45 HydrophobicContact CB-CD1 4.18Å; L41-I45 HydrophobicContact CD2-CD1 3.53Å; L41-I45 HydrophobicContact CG-CD1 3.62Å; L41-I45 HydrophobicContact CG-CG1 4.16Å; L41-I45 PolarHBondContact O-N 2.97Å; I45-K47 VanDerWaalsContact C-N 3.27Å; I45-K47 PolarHBondContact O-N 2.84Å
46	T	42.4	Very low	52.6	Low	117 Å²	117	112.7 Å²	112.7	72%	0.718	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	12.2	178.8	49.1	0	0	0	0	114.6	I48	T46-I48 PolarHBondContact O-N 2.74Å
47	K	43	Very low	52.7	Low	180 Å²	180	111.6 Å²	111.6	78%	0.783	61%	0.605	S	S	*	*			trans	-73.5	68.7	167.7	-73.1	-172.4	176.6	-179.6	0	111.4	I45 D49	I45-K47 VanDerWaalsContact C-N 3.27Å; I45-K47 PolarHBondContact O-N 2.84Å; K47-D49 PolarHBondContact O-N 3.42Å
48	I	43.7	Very low	53.1	Low	132 Å²	132	116.3 Å²	116.3	68%	0.677	62%	0.617	S	S	*	*			trans	-67	124.9	164.4	-59.9	178.9	0	0	0	107.5	T46 N50	T46-I48 PolarHBondContact O-N 2.74Å; I48-N50 PolarHBondContact O-N 2.97Å
49	D	39.2	Very low	53.8	Low	142 Å²	142	112.7 Å²	112.7	76%	0.759	60%	0.603	S	S	*	*			trans	-81.1	53.8	-162.2	-157.7	11	0	0	0	113.9	K47 Q51	K47-D49 PolarHBondContact O-N 3.42Å; D49-Q51 PolarHBondContact O-N 3.41Å
50	N	43.2	Very low	55	Low	106 Å²	106	112 Å²	112	57%	0.567	59%	0.591	S	S	*	*			trans	-94.9	52	-176.4	-70.1	-11.4	0	0	0	111.8	I48 T52	I48-N50 PolarHBondContact O-N 2.97Å; N50-T52 VanDerWaalsContact C-N 3.28Å; N50-T52 PolarHBondContact O-N 2.82Å
51	Q	46.1	Very low	56.6	Low	178 Å²	178	110.2 Å²	110.2	83%	0.832	57%	0.574	S	S	*	*	S	Bend	trans	-80.2	-1.2	-173.2	-152.8	171.5	103	0	0	114.7	D49	D49-Q51 PolarHBondContact O-N 3.41Å
52	T	50.6	Low	58.2	Low	135 Å²	135	107.1 Å²	107.1	83%	0.828	56%	0.558	S	S	*	*	S	Bend	trans	-129.3	-6.5	-177.9	48.4	0	0	0	0	115.4	N50	N50-T52 VanDerWaalsContact C-N 3.28Å; N50-T52 PolarHBondContact O-N 2.82Å
53	T	47.7	Very low	59.9	Low	92 Å²	92	102.6 Å²	102.6	56%	0.564	53%	0.534	S	S	*	.	S	Bend	trans	-141.5	134.7	177.2	50.1	0	0	0	0	110.2
54	D	60.6	Low	61.8	Low	58 Å²	58	97.7 Å²	97.7	31%	0.31	51%	0.51	S	S	.	.			cis	-146.9	129.6	-10	169	4.1	0	0	0	106.6	N56 I57 K58	D54-N56 PolarHBondContact O-N 2.99Å; D54-N56 WeakPolarHBondContact OD1-CB 3.43Å; D54-N56 PolarHBondContact OD1-N 3.47Å; D54-N56 PolarHBondContact OD1-ND2 3.22Å; D54-I57 HydrophobicContact CB-CB 4Å; D54-I57 HydrophobicContact CB-CD1 3.92Å; D54-I57 HydrophobicContact CB-CG1 3.88Å; D54-I57 PolarHBondContact O-N 3.21Å; D54-I57 VanDerWaalsContact O-N 3.12Å; D54-K58 PolarHBondContact O-N 3.35Å
55	R	67.9	Low	63.6	Low	179 Å²	179	94.9 Å²	94.9	68%	0.675	49%	0.49	S	S	*	.	H	α-helix	trans	-60.4	-30.8	180	-173.7	176.3	-178.2	173.8	2.8	111.4	M59	R55-M59 WeakPolarHBondContact O-CB 3.37Å; R55-M59 PolarHBondContact O-N 3.09Å
56	N	72	Confident	65.4	Low	113 Å²	113	89.6 Å²	89.6	60%	0.604	46%	0.463	S	S	*	.	H	α-helix	trans	-74.9	-36.5	177.9	-47.8	-68.3	0	0	0	111.3	D54 M59 A60	D54-N56 PolarHBondContact O-N 2.99Å; D54-N56 WeakPolarHBondContact OD1-CB 3.43Å; D54-N56 PolarHBondContact OD1-N 3.47Å; D54-N56 PolarHBondContact OD1-ND2 3.22Å; N56-M59 PolarHBondContact O-N 2.84Å; N56-A60 VanDerWaalsContact O-CB 3.26Å; N56-A60 WeakPolarHBondContact O-CB 3.28Å; N56-A60 PolarHBondContact O-N 3.38Å
57	I	74.8	Confident	67.6	Low	92 Å²	92	86.7 Å²	86.7	47%	0.472	44%	0.441	S	S	.	.	H	α-helix	trans	-65.1	-44.7	170.9	-69	177.1	0	0	0	110.7	D54 M59 A60 N61	D54-I57 HydrophobicContact CB-CB 4Å; D54-I57 HydrophobicContact CB-CD1 3.92Å; D54-I57 HydrophobicContact CB-CG1 3.88Å; D54-I57 PolarHBondContact O-N 3.21Å; D54-I57 VanDerWaalsContact O-N 3.12Å; I57-M59 VanDerWaalsContact C-N 3.33Å; I57-M59 PolarHBondContact O-N 3.38Å; I57-A60 PolarHBondContact O-N 3.01Å; I57-N61 WeakPolarHBondContact O-CB 3.31Å; I57-N61 VanDerWaalsContact O-CG 3.28Å; I57-N61 PolarHBondContact O-N 3.29Å; I57-N61 PolarHBondContact O-OD1 3.17Å
58	K	76	Confident	69.7	Low	130 Å²	130	79.3 Å²	79.3	57%	0.565	41%	0.41	S	S	*	.	H	α-helix	trans	-58.9	-45.8	174.6	-73.5	-158.5	173.6	-162.5	0	111.5	D54 N61 C62	D54-K58 PolarHBondContact O-N 3.35Å; K58-N61 PolarHBondContact O-N 3.07Å; K58-C62 PolarHBondContact O-N 3.18Å; K58-C62 PolarHBondContact O-SG 2.95Å
59	M	76.6	Confident	71.6	Confident	46 Å²	46	76.2 Å²	76.2	23%	0.227	40%	0.395	C	S	.	.	H	α-helix	trans	-61	-44.3	175.2	-173.6	176.7	-71.3	0	0	112.5	R55 N56 I57 C62 L63 I98 L101	R55-M59 WeakPolarHBondContact O-CB 3.37Å; R55-M59 PolarHBondContact O-N 3.09Å; N56-M59 PolarHBondContact O-N 2.84Å; I57-M59 VanDerWaalsContact C-N 3.33Å; I57-M59 PolarHBondContact O-N 3.38Å; M59-C62 PolarHBondContact O-N 3.29Å; M59-L63 HydrophobicContact CG-CD1 4.32Å; M59-L63 VanDerWaalsContact O-CG 3.29Å; M59-L63 WeakPolarHBondContact O-CG 3.42Å; M59-L63 PolarHBondContact O-N 2.95Å; M59-I98 HydrophobicContact CE-CG1 4.36Å; M59-I98 HydrophobicContact CG-CD1 3.95Å; M59-I98 HydrophobicContact CG-CG1 4.34Å; M59-L101 HydrophobicContact CE-CD1 3.42Å; M59-L101 VanDerWaalsContact CE-CD1 3.42Å
60	A	80.8	Confident	73.7	Confident	45 Å²	45	72.9 Å²	72.9	37%	0.372	38%	0.377	S	S	.	.	H	α-helix	trans	-64	-41.9	177.8	0	0	0	0	0	112.3	N56 I57 C62 L63 V64	N56-A60 VanDerWaalsContact O-CB 3.26Å; N56-A60 WeakPolarHBondContact O-CB 3.28Å; N56-A60 PolarHBondContact O-N 3.38Å; I57-A60 PolarHBondContact O-N 3.01Å; A60-C62 VanDerWaalsContact C-N 3.34Å; A60-C62 PolarHBondContact O-N 2.99Å; A60-L63 PolarHBondContact O-N 2.87Å; A60-V64 WeakPolarHBondContact O-CG2 3.4Å; A60-V64 PolarHBondContact O-N 3.3Å
61	N	85.5	Confident	75.6	Confident	51 Å²	51	71.7 Å²	71.7	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-62.4	-41.6	174.6	-71.9	1.6	0	0	0	111.1	I57 K58 V64 A65 I84	I57-N61 WeakPolarHBondContact O-CB 3.31Å; I57-N61 VanDerWaalsContact O-CG 3.28Å; I57-N61 PolarHBondContact O-N 3.29Å; I57-N61 PolarHBondContact O-OD1 3.17Å; K58-N61 PolarHBondContact O-N 3.07Å; N61-V64 PolarHBondContact O-N 3.19Å; N61-A65 WeakPolarHBondContact O-CB 3.39Å; N61-A65 PolarHBondContact O-N 2.86Å; N61-I84 HydrophobicContact CB-CB 4.41Å; N61-I84 HydrophobicContact CB-CD1 4.39Å; N61-I84 HydrophobicContact CB-CG2 4.11Å
62	C	84	Confident	77.4	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.014	35%	0.349	C	S	.	.	H	α-helix	trans	-64.5	-39	173.3	-64.8	0	0	0	0	112.5	K58 M59 A60 V64 A65 D66 L86 F94 I98	K58-C62 PolarHBondContact O-N 3.18Å; K58-C62 PolarHBondContact O-SG 2.95Å; M59-C62 PolarHBondContact O-N 3.29Å; A60-C62 VanDerWaalsContact C-N 3.34Å; A60-C62 PolarHBondContact O-N 2.99Å; C62-V64 VanDerWaalsContact C-N 3.34Å; C62-V64 PolarHBondContact O-N 3.24Å; C62-A65 PolarHBondContact O-N 3.47Å; C62-D66 VanDerWaalsContact O-CB 3.27Å; C62-D66 WeakPolarHBondContact O-CB 3.32Å; C62-D66 PolarHBondContact O-N 3.27Å; C62-L86 VanDerWaalsContact SG-CD1 3.53Å; C62-F94 HydrophobicContact CB-CD1 3.97Å; C62-F94 HydrophobicContact CB-CE1 4.47Å; C62-F94 WeakPolarHBondContact SG-CD1 3.38Å; C62-I98 HydrophobicContact CB-CD1 3.98Å
63	L	85.1	Confident	79.1	Confident	21 Å²	21	64.9 Å²	64.9	11%	0.11	33%	0.333	C	S	.	.	H	α-helix	trans	-64.9	-34.9	174.6	-70.8	171.1	0	0	0	112.8	M59 A60 H67 L123 L124 I127	M59-L63 HydrophobicContact CG-CD1 4.32Å; M59-L63 VanDerWaalsContact O-CG 3.29Å; M59-L63 WeakPolarHBondContact O-CG 3.42Å; M59-L63 PolarHBondContact O-N 2.95Å; A60-L63 PolarHBondContact O-N 2.87Å; L63-H67 WeakPolarHBondContact O-CB 3.42Å; L63-H67 PolarHBondContact O-N 3.34Å; L63-L123 HydrophobicContact CD2-CB 3.8Å; L63-L123 HydrophobicContact CD2-CD2 3.61Å; L63-L123 HydrophobicContact CD2-CG 3.47Å; L63-L123 VanDerWaalsContact CD2-CG 3.47Å; L63-L124 HydrophobicContact CB-CB 4.29Å; L63-L124 HydrophobicContact CB-CD1 4.21Å; L63-L124 HydrophobicContact CD1-CD1 4.45Å; L63-I127 HydrophobicContact CD1-CD1 4.41Å; L63-I127 HydrophobicContact CD2-CD1 4.12Å
64	V	85.5	Confident	80.9	Confident	56 Å²	56	65.9 Å²	65.9	34%	0.339	34%	0.335	S	S	.	.	H	α-helix	trans	-71.4	-42.2	172.5	172.1	0	0	0	0	110.8	A60 N61 C62 H67 L68 F80	A60-V64 WeakPolarHBondContact O-CG2 3.4Å; A60-V64 PolarHBondContact O-N 3.3Å; N61-V64 PolarHBondContact O-N 3.19Å; C62-V64 VanDerWaalsContact C-N 3.34Å; C62-V64 PolarHBondContact O-N 3.24Å; V64-H67 WeakPolarHBondContact O-CB 3.16Å; V64-H67 PolarHBondContact O-N 3.05Å; V64-L68 HydrophobicContact CG1-CD1 4.26Å; V64-L68 HydrophobicContact CG1-CG 4.41Å; V64-L68 WeakPolarHBondContact O-CG 3.29Å; V64-L68 PolarHBondContact O-N 2.69Å; V64-F80 HydrophobicContact CB-CE1 4Å; V64-F80 HydrophobicContact CB-CZ 4.05Å; V64-F80 HydrophobicContact CG1-CD1 4.46Å; V64-F80 HydrophobicContact CG1-CE1 3.65Å; V64-F80 HydrophobicContact CG1-CE2 4.47Å; V64-F80 HydrophobicContact CG1-CZ 3.65Å
65	A	84.9	Confident	82.1	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-68.8	-38.1	179.6	0	0	0	0	0	112.6	N61 C62 L68 N69 L77 F80 I84 L91	N61-A65 WeakPolarHBondContact O-CB 3.39Å; N61-A65 PolarHBondContact O-N 2.86Å; C62-A65 PolarHBondContact O-N 3.47Å; A65-L68 PolarHBondContact O-N 2.91Å; A65-N69 WeakPolarHBondContact O-CB 3.43Å; A65-N69 PolarHBondContact O-N 3.04Å; A65-L77 HydrophobicContact CB-CD1 4.21Å; A65-F80 HydrophobicContact CB-CD1 4.12Å; A65-F80 HydrophobicContact CB-CE1 4.06Å; A65-I84 HydrophobicContact CB-CD1 4.19Å; A65-L91 HydrophobicContact CB-CD1 3.39Å
66	D	84.8	Confident	83.1	Confident	7 Å²	7	65.9 Å²	65.9	4%	0.037	34%	0.34	C	S	.	.	H	α-helix	trans	-55.5	-49.1	167.9	176.3	65.8	0	0	0	111.2	C62 L68 N69 I70 I95 S122 L123	C62-D66 VanDerWaalsContact O-CB 3.27Å; C62-D66 WeakPolarHBondContact O-CB 3.32Å; C62-D66 PolarHBondContact O-N 3.27Å; D66-L68 PolarHBondContact O-N 3.28Å; D66-N69 PolarHBondContact O-N 3.11Å; D66-I70 WeakPolarHBondContact O-CB 3.47Å; D66-I70 WeakPolarHBondContact O-CG1 3.32Å; D66-I70 PolarHBondContact O-N 2.89Å; D66-I70 VanDerWaalsContact OD1-CD1 3.28Å; D66-I70 WeakPolarHBondContact OD1-CD1 3.34Å; D66-I95 HydrophobicContact CB-CD1 3.73Å; D66-I95 HydrophobicContact CB-CG1 4.24Å; D66-S122 VanDerWaalsContact OD2-CB 3.3Å; D66-S122 WeakPolarHBondContact OD2-CB 3.46Å; D66-L123 PolarHBondContact OD2-N 3.14Å
67	H	86.6	Confident	83.7	Confident	56 Å²	56	60.9 Å²	60.9	26%	0.259	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-41.6	174.5	175.7	-78.2	0	0	0	112.8	L63 V64 N69 H71 L124	L63-H67 WeakPolarHBondContact O-CB 3.42Å; L63-H67 PolarHBondContact O-N 3.34Å; V64-H67 WeakPolarHBondContact O-CB 3.16Å; V64-H67 PolarHBondContact O-N 3.05Å; H67-N69 VanDerWaalsContact C-N 3.35Å; H67-H71 AromaticContact CD2-CD2 3.5Å; H67-H71 PolarHBondContact CD2-CD2 3.37Å; H67-H71 VanDerWaalsContact CD2-CD2 3.5Å; H67-H71 AromaticContact CD2-NE2 3.72Å; H67-H71 AromaticContact CE1-CD2 3.69Å; H67-H71 AromaticContact CG-CD2 3.78Å; H67-H71 AromaticContact ND1-CD2 3.89Å; H67-H71 AromaticContact NE2-CD2 3.45Å; H67-H71 PolarHBondContact NE2-CD2 2.67Å; H67-H71 AromaticContact NE2-NE2 3.76Å; H67-H71 WeakPolarHBondContact O-CB 3.45Å; H67-H71 PolarHBondContact O-CD2 3.08Å; H67-H71 VanDerWaalsContact O-CD2 3.24Å; H67-H71 PolarHBondContact O-N 3.21Å; H67-H71 VanDerWaalsContact O-N 3.11Å; H67-L124 HydrophobicContact CB-CD2 4.48Å
68	L	87.1	Confident	84.1	Confident	24 Å²	24	60 Å²	60	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-64.8	-38.1	176.1	-71.2	176.5	0	0	0	112.3	V64 A65 D66 G72 Y73 L77 F80	V64-L68 HydrophobicContact CG1-CD1 4.26Å; V64-L68 HydrophobicContact CG1-CG 4.41Å; V64-L68 WeakPolarHBondContact O-CG 3.29Å; V64-L68 PolarHBondContact O-N 2.69Å; A65-L68 PolarHBondContact O-N 2.91Å; D66-L68 PolarHBondContact O-N 3.28Å; L68-G72 PolarHBondContact O-N 2.73Å; L68-Y73 HydrophobicContact CD2-CD2 4Å; L68-Y73 HydrophobicContact CD2-CG 4.25Å; L68-Y73 PolarHBondContact O-N 3.09Å; L68-L77 HydrophobicContact CB-CB 4.3Å; L68-L77 HydrophobicContact CB-CD1 4.13Å; L68-F80 HydrophobicContact CD1-CB 4.08Å; L68-F80 HydrophobicContact CD1-CD1 3.77Å; L68-F80 HydrophobicContact CD1-CE1 4.41Å; L68-F80 HydrophobicContact CD1-CG 4.02Å
69	N	85.2	Confident	84.6	Confident	67 Å²	67	56.5 Å²	56.5	36%	0.358	30%	0.304	S	S	.	.	H	α-helix	trans	-69	-53.8	177.8	-168.2	20.1	0	0	0	111.4	A65 D66 H67 H71 G72 L77	A65-N69 WeakPolarHBondContact O-CB 3.43Å; A65-N69 PolarHBondContact O-N 3.04Å; D66-N69 PolarHBondContact O-N 3.11Å; H67-N69 VanDerWaalsContact C-N 3.35Å; N69-H71 VanDerWaalsContact C-N 3.3Å; N69-H71 PolarHBondContact O-N 3.12Å; N69-G72 PolarHBondContact O-N 3.23Å; N69-L77 HydrophobicContact CB-CD2 3.97Å
70	I	82.2	Confident	85	Confident	73 Å²	73	56.4 Å²	56.4	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-35	-178.1	-72.1	171.3	0	0	0	112.4	D66 G72	D66-I70 WeakPolarHBondContact O-CB 3.47Å; D66-I70 WeakPolarHBondContact O-CG1 3.32Å; D66-I70 PolarHBondContact O-N 2.89Å; D66-I70 VanDerWaalsContact OD1-CD1 3.28Å; D66-I70 WeakPolarHBondContact OD1-CD1 3.34Å; I70-G72 VanDerWaalsContact C-N 3.32Å
71	H	83.8	Confident	85.2	Confident	80 Å²	80	54.8 Å²	54.8	37%	0.37	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	8.4	175.1	-65.6	-60.7	0	0	0	114.2	H67 N69 Y73	H67-H71 AromaticContact CD2-CD2 3.5Å; H67-H71 PolarHBondContact CD2-CD2 3.37Å; H67-H71 VanDerWaalsContact CD2-CD2 3.5Å; H67-H71 AromaticContact CD2-NE2 3.72Å; H67-H71 AromaticContact CE1-CD2 3.69Å; H67-H71 AromaticContact CG-CD2 3.78Å; H67-H71 AromaticContact ND1-CD2 3.89Å; H67-H71 AromaticContact NE2-CD2 3.45Å; H67-H71 PolarHBondContact NE2-CD2 2.67Å; H67-H71 AromaticContact NE2-NE2 3.76Å; H67-H71 WeakPolarHBondContact O-CB 3.45Å; H67-H71 PolarHBondContact O-CD2 3.08Å; H67-H71 VanDerWaalsContact O-CD2 3.24Å; H67-H71 PolarHBondContact O-N 3.21Å; H67-H71 VanDerWaalsContact O-N 3.11Å; N69-H71 VanDerWaalsContact C-N 3.3Å; N69-H71 PolarHBondContact O-N 3.12Å; H71-Y73 VanDerWaalsContact C-N 3.32Å; H71-Y73 HydrophobicContact CB-CD2 3.63Å; H71-Y73 HydrophobicContact CB-CE2 3.39Å; H71-Y73 PolarHBondContact O-N 2.92Å
72	G	82.8	Confident	84.8	Confident	43 Å²	43	56.9 Å²	56.9	44%	0.443	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	21.5	170.6	0	0	0	0	0	115.3	L68 N69 I70 N74	L68-G72 PolarHBondContact O-N 2.73Å; N69-G72 PolarHBondContact O-N 3.23Å; I70-G72 VanDerWaalsContact C-N 3.32Å; G72-N74 PolarHBondContact O-N 3.38Å
73	Y	87.6	Confident	84.6	Confident	127 Å²	127	63.8 Å²	63.8	50%	0.498	34%	0.336	S	S	.	.			trans	-78	54.5	-179.4	-65.9	-62	0	0	0	112.1	L68 H71 Y75 S76 L77	L68-Y73 HydrophobicContact CD2-CD2 4Å; L68-Y73 HydrophobicContact CD2-CG 4.25Å; L68-Y73 PolarHBondContact O-N 3.09Å; H71-Y73 VanDerWaalsContact C-N 3.32Å; H71-Y73 HydrophobicContact CB-CD2 3.63Å; H71-Y73 HydrophobicContact CB-CE2 3.39Å; H71-Y73 PolarHBondContact O-N 2.92Å; Y73-Y75 VanDerWaalsContact C-N 3.28Å; Y73-Y75 PolarHBondContact O-N 3.27Å; Y73-Y75 VanDerWaalsContact O-N 3.14Å; Y73-S76 WeakPolarHBondContact O-CB 3.34Å; Y73-S76 PolarHBondContact O-N 3.28Å; Y73-L77 PolarHBondContact O-N 3.31Å
74	N	84.8	Confident	84.3	Confident	113 Å²	113	64.4 Å²	64.4	60%	0.604	34%	0.34	S	S	*	.	H	α-helix	trans	-53.1	-38.5	-170.1	-66.7	-40.4	0	0	0	114.1	G72 S78	G72-N74 PolarHBondContact O-N 3.38Å; N74-S78 VanDerWaalsContact O-CB 3.28Å; N74-S78 WeakPolarHBondContact O-CB 3.28Å; N74-S78 PolarHBondContact O-N 3.32Å; N74-S78 PolarHBondContact O-OG 3.17Å
75	Y	86.5	Confident	83.6	Confident	185 Å²	185	64.4 Å²	64.4	73%	0.725	35%	0.351	S	S	*	.	H	α-helix	trans	-63.5	-53.7	175.3	175.7	-104.8	0	0	0	111.3	Y73 L77 S78 V79	Y73-Y75 VanDerWaalsContact C-N 3.28Å; Y73-Y75 PolarHBondContact O-N 3.27Å; Y73-Y75 VanDerWaalsContact O-N 3.14Å; Y75-L77 VanDerWaalsContact C-N 3.3Å; Y75-L77 PolarHBondContact O-N 3.29Å; Y75-S78 PolarHBondContact O-N 3.47Å; Y75-S78 VanDerWaalsContact O-N 3.13Å; Y75-S78 PolarHBondContact O-OG 3.03Å; Y75-V79 HydrophobicContact CE2-CG2 4.32Å; Y75-V79 PolarHBondContact O-N 3.23Å
76	S	88.3	Confident	82.9	Confident	53 Å²	53	66 Å²	66	37%	0.371	36%	0.359	S	S	.	.	H	α-helix	trans	-57.6	-43.7	177.3	-48.5	0	0	0	0	111.6	Y73 S78 V79 F80	Y73-S76 WeakPolarHBondContact O-CB 3.34Å; Y73-S76 PolarHBondContact O-N 3.28Å; S76-S78 PolarHBondContact O-N 3.02Å; S76-V79 PolarHBondContact O-N 2.95Å; S76-F80 WeakPolarHBondContact O-CB 3.19Å; S76-F80 PolarHBondContact O-N 3.35Å
77	L	85.7	Confident	82.3	Confident	8 Å²	8	69.2 Å²	69.2	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-62	-41.8	176.5	-174	65.8	0	0	0	111.9	A65 L68 N69 Y73 Y75 V79 F80 L81 L91	A65-L77 HydrophobicContact CB-CD1 4.21Å; L68-L77 HydrophobicContact CB-CB 4.3Å; L68-L77 HydrophobicContact CB-CD1 4.13Å; N69-L77 HydrophobicContact CB-CD2 3.97Å; Y73-L77 PolarHBondContact O-N 3.31Å; Y75-L77 VanDerWaalsContact C-N 3.3Å; Y75-L77 PolarHBondContact O-N 3.29Å; L77-V79 VanDerWaalsContact C-N 3.26Å; L77-V79 PolarHBondContact O-N 3.46Å; L77-F80 PolarHBondContact O-N 3.45Å; L77-L81 HydrophobicContact CD1-CD1 3.87Å; L77-L81 HydrophobicContact CD1-CD2 4.46Å; L77-L81 HydrophobicContact CD1-CG 3.88Å; L77-L81 HydrophobicContact CD2-CD1 4.41Å; L77-L81 HydrophobicContact CG-CD1 3.73Å; L77-L81 HydrophobicContact CG-CG 4.19Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 WeakPolarHBondContact O-CG 3.39Å; L77-L81 PolarHBondContact O-N 2.75Å; L77-L91 HydrophobicContact CD1-CD1 4.38Å
78	S	82.9	Confident	81.5	Confident	72 Å²	72	71.5 Å²	71.5	50%	0.503	39%	0.393	S	S	.	.	H	α-helix	trans	-67.7	-21.3	179.4	72	0	0	0	0	114.7	N74 Y75 S76 P82	N74-S78 VanDerWaalsContact O-CB 3.28Å; N74-S78 WeakPolarHBondContact O-CB 3.28Å; N74-S78 PolarHBondContact O-N 3.32Å; N74-S78 PolarHBondContact O-OG 3.17Å; Y75-S78 PolarHBondContact O-N 3.47Å; Y75-S78 VanDerWaalsContact O-N 3.13Å; Y75-S78 PolarHBondContact O-OG 3.03Å; S76-S78 PolarHBondContact O-N 3.02Å; S78-P82 VanDerWaalsContact O-CD 3.23Å; S78-P82 WeakPolarHBondContact O-CD 3.5Å; S78-P82 WeakPolarHBondContact O-CG 3.5Å
79	V	85.2	Confident	80.6	Confident	57 Å²	57	77.4 Å²	77.4	35%	0.345	42%	0.418	S	S	.	.	H	α-helix	trans	-89.9	-44.8	172.1	177.5	0	0	0	0	110.4	Y75 S76 L77 L81 P82 E83	Y75-V79 HydrophobicContact CE2-CG2 4.32Å; Y75-V79 PolarHBondContact O-N 3.23Å; S76-V79 PolarHBondContact O-N 2.95Å; L77-V79 VanDerWaalsContact C-N 3.26Å; L77-V79 PolarHBondContact O-N 3.46Å; V79-L81 PolarHBondContact O-N 3.01Å; V79-P82 WeakPolarHBondContact O-CD 3.27Å; V79-E83 WeakPolarHBondContact CG1-OE1 3.46Å; V79-E83 WeakPolarHBondContact O-CG 3.43Å; V79-E83 PolarHBondContact O-N 3.12Å
80	F	86.3	Confident	79.9	Confident	44 Å²	44	78.1 Å²	78.1	19%	0.193	42%	0.419	C	S	.	.	H	α-helix	trans	-66.7	-36.2	-175.7	-169.2	-116.9	0	0	0	113.1	V64 A65 L68 S76 L77 E83 I84	V64-F80 HydrophobicContact CB-CE1 4Å; V64-F80 HydrophobicContact CB-CZ 4.05Å; V64-F80 HydrophobicContact CG1-CD1 4.46Å; V64-F80 HydrophobicContact CG1-CE1 3.65Å; V64-F80 HydrophobicContact CG1-CE2 4.47Å; V64-F80 HydrophobicContact CG1-CZ 3.65Å; A65-F80 HydrophobicContact CB-CD1 4.12Å; A65-F80 HydrophobicContact CB-CE1 4.06Å; L68-F80 HydrophobicContact CD1-CB 4.08Å; L68-F80 HydrophobicContact CD1-CD1 3.77Å; L68-F80 HydrophobicContact CD1-CE1 4.41Å; L68-F80 HydrophobicContact CD1-CG 4.02Å; S76-F80 WeakPolarHBondContact O-CB 3.19Å; S76-F80 PolarHBondContact O-N 3.35Å; L77-F80 PolarHBondContact O-N 3.45Å; F80-E83 PolarHBondContact O-N 2.89Å; F80-I84 HydrophobicContact CD1-CD1 3.86Å; F80-I84 HydrophobicContact CD1-CG2 4.19Å; F80-I84 HydrophobicContact CD2-CG2 4.03Å; F80-I84 HydrophobicContact CE1-CD1 3.8Å; F80-I84 HydrophobicContact CE1-CG2 3.88Å; F80-I84 HydrophobicContact CE2-CG2 3.71Å; F80-I84 HydrophobicContact CG-CG2 4.27Å; F80-I84 HydrophobicContact CZ-CG2 3.63Å; F80-I84 WeakPolarHBondContact O-CG1 3.47Å; F80-I84 WeakPolarHBondContact O-CG2 3.31Å; F80-I84 PolarHBondContact O-N 3.18Å
81	L	83.2	Confident	79.3	Confident	11 Å²	11	74.8 Å²	74.8	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-61.3	-51.7	179.3	-81.4	169.9	0	0	0	113.3	L77 V79 E83 I84 G85 L86 N88 L91	L77-L81 HydrophobicContact CD1-CD1 3.87Å; L77-L81 HydrophobicContact CD1-CD2 4.46Å; L77-L81 HydrophobicContact CD1-CG 3.88Å; L77-L81 HydrophobicContact CD2-CD1 4.41Å; L77-L81 HydrophobicContact CG-CD1 3.73Å; L77-L81 HydrophobicContact CG-CG 4.19Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 WeakPolarHBondContact O-CG 3.39Å; L77-L81 PolarHBondContact O-N 2.75Å; V79-L81 PolarHBondContact O-N 3.01Å; L81-E83 VanDerWaalsContact C-N 3.31Å; L81-E83 PolarHBondContact O-N 3.36Å; L81-I84 HydrophobicContact CD2-CD1 4.37Å; L81-I84 PolarHBondContact O-N 3.01Å; L81-G85 PolarHBondContact O-N 3.2Å; L81-G85 VanDerWaalsContact O-N 3.08Å; L81-L86 CarbonylContact C-O 3.54Å; L81-L86 WeakPolarHBondContact CB-O 3.49Å; L81-L86 HydrophobicContact CD2-CB 4.09Å; L81-L86 WeakPolarHBondContact CD2-O 3.47Å; L81-L86 PolarHBondContact O-N 3.06Å; L81-L86 VanDerWaalsContact O-N 3.09Å; L81-N88 WeakPolarHBondContact CD1-OD1 3.41Å; L81-L91 HydrophobicContact CD2-CB 4.43Å; L81-L91 HydrophobicContact CD2-CD1 3.85Å
82	P	79	Confident	78.7	Confident	96 Å²	96	77.3 Å²	77.3	62%	0.623	41%	0.414	S	S	*	.	H	α-helix	trans	-55.8	-40.4	168.5	-28.2	34.6	0	0	0	114.1	S78 V79 G85	S78-P82 VanDerWaalsContact O-CD 3.23Å; S78-P82 WeakPolarHBondContact O-CD 3.5Å; S78-P82 WeakPolarHBondContact O-CG 3.5Å; V79-P82 WeakPolarHBondContact O-CD 3.27Å; P82-G85 PolarHBondContact O-N 2.93Å
83	E	80	Confident	78.2	Confident	146 Å²	146	80.8 Å²	80.8	68%	0.682	42%	0.419	S	S	*	.	H	α-helix	trans	-68.4	-35.5	-178.4	-73.7	178.3	172.4	0	0	113.4	V79 F80 L81	V79-E83 WeakPolarHBondContact CG1-OE1 3.46Å; V79-E83 WeakPolarHBondContact O-CG 3.43Å; V79-E83 PolarHBondContact O-N 3.12Å; F80-E83 PolarHBondContact O-N 2.89Å; L81-E83 VanDerWaalsContact C-N 3.31Å; L81-E83 PolarHBondContact O-N 3.36Å
84	I	78	Confident	77.5	Confident	35 Å²	35	77.8 Å²	77.8	18%	0.179	41%	0.409	C	S	.	.	H	α-helix	trans	-87.5	-4.9	175.4	71.8	-171.8	0	0	0	113.4	N61 A65 F80 L81 L86	N61-I84 HydrophobicContact CB-CB 4.41Å; N61-I84 HydrophobicContact CB-CD1 4.39Å; N61-I84 HydrophobicContact CB-CG2 4.11Å; A65-I84 HydrophobicContact CB-CD1 4.19Å; F80-I84 HydrophobicContact CD1-CD1 3.86Å; F80-I84 HydrophobicContact CD1-CG2 4.19Å; F80-I84 HydrophobicContact CD2-CG2 4.03Å; F80-I84 HydrophobicContact CE1-CD1 3.8Å; F80-I84 HydrophobicContact CE1-CG2 3.88Å; F80-I84 HydrophobicContact CE2-CG2 3.71Å; F80-I84 HydrophobicContact CG-CG2 4.27Å; F80-I84 HydrophobicContact CZ-CG2 3.63Å; F80-I84 WeakPolarHBondContact O-CG1 3.47Å; F80-I84 WeakPolarHBondContact O-CG2 3.31Å; F80-I84 PolarHBondContact O-N 3.18Å; L81-I84 HydrophobicContact CD2-CD1 4.37Å; L81-I84 PolarHBondContact O-N 3.01Å; I84-L86 HydrophobicContact CD1-CB 4.31Å; I84-L86 HydrophobicContact CD1-CD1 3.84Å; I84-L86 HydrophobicContact CD1-CG 4.32Å; I84-L86 HydrophobicContact CG1-CB 4.02Å; I84-L86 HydrophobicContact CG1-CD1 4.1Å; I84-L86 HydrophobicContact CG1-CG 4.05Å
85	G	70.5	Confident	76.7	Confident	55 Å²	55	73.5 Å²	73.5	57%	0.567	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	38.6	180	0	0	0	0	0	113.8	L81 P82	L81-G85 PolarHBondContact O-N 3.2Å; L81-G85 VanDerWaalsContact O-N 3.08Å; P82-G85 PolarHBondContact O-N 2.93Å
86	L	71.4	Confident	76.1	Confident	33 Å²	33	71.2 Å²	71.2	17%	0.173	38%	0.379	C	S	.	.			trans	-123.3	139.5	175.1	-67	176	0	0	0	111	C62 L81 I84 E90	C62-L86 VanDerWaalsContact SG-CD1 3.53Å; L81-L86 CarbonylContact C-O 3.54Å; L81-L86 WeakPolarHBondContact CB-O 3.49Å; L81-L86 HydrophobicContact CD2-CB 4.09Å; L81-L86 WeakPolarHBondContact CD2-O 3.47Å; L81-L86 PolarHBondContact O-N 3.06Å; L81-L86 VanDerWaalsContact O-N 3.09Å; I84-L86 HydrophobicContact CD1-CB 4.31Å; I84-L86 HydrophobicContact CD1-CD1 3.84Å; I84-L86 HydrophobicContact CD1-CG 4.32Å; I84-L86 HydrophobicContact CG1-CB 4.02Å; I84-L86 HydrophobicContact CG1-CD1 4.1Å; I84-L86 HydrophobicContact CG1-CG 4.05Å; L86-E90 HydrophobicContact CD2-CB 4.08Å
87	T	71.6	Confident	75.2	Confident	75 Å²	75	73.7 Å²	73.7	46%	0.46	39%	0.388	S	S	.	.			trans	-82.8	163.3	165.2	63	0	0	0	0	111.5	F89 E90 L91	T87-F89 PolarHBondContact O-N 2.88Å; T87-E90 VanDerWaalsContact CB-OE2 3.29Å; T87-E90 WeakPolarHBondContact CB-OE2 3.47Å; T87-E90 WeakPolarHBondContact CG2-OE2 3.46Å; T87-E90 PolarHBondContact N-OE2 3.06Å; T87-E90 PolarHBondContact O-N 2.96Å; T87-E90 WeakPolarHBondContact OG1-CG 3.46Å; T87-E90 PolarHBondContact OG1-N 3.11Å; T87-E90 PolarHBondContact OG1-OE2 3.14Å; T87-L91 PolarHBondContact O-N 2.89Å
88	N	68.4	Low	74.4	Confident	104 Å²	104	74.1 Å²	74.1	56%	0.556	39%	0.39	S	S	*	.	H	α-helix	trans	-54.4	-34.5	171.7	-78.3	-33.4	0	0	0	112.7	L81 E92	L81-N88 WeakPolarHBondContact CD1-OD1 3.41Å; N88-E92 PolarHBondContact O-N 3.07Å
89	F	69.6	Low	73.4	Confident	148 Å²	148	73.6 Å²	73.6	65%	0.649	39%	0.386	S	S	*	.	H	α-helix	trans	-71.7	-47.1	-178.6	-173.8	-90	0	0	0	111.7	T87 L91 E92 E93	T87-F89 PolarHBondContact O-N 2.88Å; F89-L91 PolarHBondContact O-N 2.93Å; F89-E92 PolarHBondContact O-N 2.99Å; F89-E93 PolarHBondContact O-N 3.48Å; F89-E93 VanDerWaalsContact O-N 3.1Å
90	E	70.3	Confident	72.5	Confident	82 Å²	82	77.4 Å²	77.4	38%	0.383	40%	0.4	S	S	.	.	H	α-helix	trans	-63	-31.7	175.1	-68	160.8	121	0	0	111.7	L86 T87 F94	L86-E90 HydrophobicContact CD2-CB 4.08Å; T87-E90 VanDerWaalsContact CB-OE2 3.29Å; T87-E90 WeakPolarHBondContact CB-OE2 3.47Å; T87-E90 WeakPolarHBondContact CG2-OE2 3.46Å; T87-E90 PolarHBondContact N-OE2 3.06Å; T87-E90 PolarHBondContact O-N 2.96Å; T87-E90 WeakPolarHBondContact OG1-CG 3.46Å; T87-E90 PolarHBondContact OG1-N 3.11Å; T87-E90 PolarHBondContact OG1-OE2 3.14Å; E90-F94 WeakPolarHBondContact O-CB 3.46Å; E90-F94 PolarHBondContact O-N 3.06Å
91	L	69.5	Low	71.1	Confident	3 Å²	3	79.4 Å²	79.4	2%	0.016	41%	0.412	C	S	.	.	H	α-helix	trans	-62.8	-47	173.6	175.6	146.4	0	0	0	112.1	A65 L77 L81 T87 F89 F94 I95	A65-L91 HydrophobicContact CB-CD1 3.39Å; L77-L91 HydrophobicContact CD1-CD1 4.38Å; L81-L91 HydrophobicContact CD2-CB 4.43Å; L81-L91 HydrophobicContact CD2-CD1 3.85Å; T87-L91 PolarHBondContact O-N 2.89Å; F89-L91 PolarHBondContact O-N 2.93Å; L91-F94 PolarHBondContact O-N 3.06Å; L91-I95 HydrophobicContact CD2-CD1 3.48Å; L91-I95 VanDerWaalsContact CD2-CD1 3.48Å; L91-I95 HydrophobicContact CG-CD1 3.77Å; L91-I95 WeakPolarHBondContact O-CB 3.3Å; L91-I95 WeakPolarHBondContact O-CD1 3.46Å; L91-I95 WeakPolarHBondContact O-CG1 3.33Å; L91-I95 PolarHBondContact O-N 2.79Å
92	E	71.7	Confident	69.7	Low	133 Å²	133	86.5 Å²	86.5	62%	0.621	44%	0.438	S	S	*	.	H	α-helix	trans	-63.7	-42.7	177.5	-72.1	-174.3	177	0	0	111.9	N88 F89 K96	N88-E92 PolarHBondContact O-N 3.07Å; F89-E92 PolarHBondContact O-N 2.99Å; E92-K96 WeakPolarHBondContact O-CB 3.21Å; E92-K96 PolarHBondContact O-N 3.19Å; E92-K96 VanDerWaalsContact O-N 3.17Å
93	E	72	Confident	68.5	Low	117 Å²	117	84.6 Å²	84.6	55%	0.547	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-45.2	177.6	-173	164.2	-140.2	0	0	111.8	F89 K96 D97	F89-E93 PolarHBondContact O-N 3.48Å; F89-E93 VanDerWaalsContact O-N 3.1Å; E93-K96 WeakPolarHBondContact O-CB 3.35Å; E93-K96 PolarHBondContact O-N 3.04Å; E93-D97 PolarHBondContact O-N 3.48Å
94	F	71.8	Confident	66.9	Low	64 Å²	64	86.6 Å²	86.6	28%	0.281	43%	0.429	S	S	.	.	H	α-helix	trans	-71.2	-34.2	-178.5	-152.1	-85.3	0	0	0	112.7	C62 E90 L91 K96 D97 I98	C62-F94 HydrophobicContact CB-CD1 3.97Å; C62-F94 HydrophobicContact CB-CE1 4.47Å; C62-F94 WeakPolarHBondContact SG-CD1 3.38Å; E90-F94 WeakPolarHBondContact O-CB 3.46Å; E90-F94 PolarHBondContact O-N 3.06Å; L91-F94 PolarHBondContact O-N 3.06Å; F94-K96 VanDerWaalsContact C-N 3.33Å; F94-D97 PolarHBondContact O-N 3.36Å; F94-I98 HydrophobicContact CD1-CD1 3.64Å; F94-I98 HydrophobicContact CD1-CG1 3.94Å; F94-I98 HydrophobicContact CE1-CD1 3.87Å; F94-I98 HydrophobicContact CE1-CG1 4.05Å; F94-I98 VanDerWaalsContact O-CG1 3.29Å; F94-I98 WeakPolarHBondContact O-CG1 3.38Å; F94-I98 PolarHBondContact O-N 2.93Å
95	I	69.8	Low	65.8	Low	22 Å²	22	90.6 Å²	90.6	11%	0.113	46%	0.46	C	S	.	.	H	α-helix	trans	-63.7	-40.4	172.5	-73.1	166.5	0	0	0	110.8	D66 L91 I98 S99 Y117	D66-I95 HydrophobicContact CB-CD1 3.73Å; D66-I95 HydrophobicContact CB-CG1 4.24Å; L91-I95 HydrophobicContact CD2-CD1 3.48Å; L91-I95 VanDerWaalsContact CD2-CD1 3.48Å; L91-I95 HydrophobicContact CG-CD1 3.77Å; L91-I95 WeakPolarHBondContact O-CB 3.3Å; L91-I95 WeakPolarHBondContact O-CD1 3.46Å; L91-I95 WeakPolarHBondContact O-CG1 3.33Å; L91-I95 PolarHBondContact O-N 2.79Å; I95-I98 PolarHBondContact O-N 2.86Å; I95-S99 WeakPolarHBondContact O-CB 3.37Å; I95-S99 PolarHBondContact O-N 3.4Å; I95-S99 PolarHBondContact O-OG 3.33Å; I95-Y117 VanDerWaalsContact CG2-OH 3.24Å; I95-Y117 WeakPolarHBondContact CG2-OH 3.36Å
96	K	73	Confident	64.8	Low	137 Å²	137	90.4 Å²	90.4	60%	0.596	45%	0.449	S	S	*	.	H	α-helix	trans	-63.6	-41.4	175.6	-173.1	-177.7	177.9	-172	0	111.7	E92 E93 F94 S99 H100	E92-K96 WeakPolarHBondContact O-CB 3.21Å; E92-K96 PolarHBondContact O-N 3.19Å; E92-K96 VanDerWaalsContact O-N 3.17Å; E93-K96 WeakPolarHBondContact O-CB 3.35Å; E93-K96 PolarHBondContact O-N 3.04Å; F94-K96 VanDerWaalsContact C-N 3.33Å; K96-S99 WeakPolarHBondContact O-CB 3.5Å; K96-S99 PolarHBondContact O-N 2.87Å; K96-H100 PolarHBondContact O-CD2 3.28Å; K96-H100 PolarHBondContact O-N 2.91Å
97	D	70	Confident	63.8	Low	105 Å²	105	91 Å²	91	56%	0.561	45%	0.451	S	S	*	.	H	α-helix	trans	-63.5	-44.8	173.9	-102.3	18.3	0	0	0	112.6	E93 F94 S99 H100 L101	E93-D97 PolarHBondContact O-N 3.48Å; F94-D97 PolarHBondContact O-N 3.36Å; D97-S99 VanDerWaalsContact C-N 3.28Å; D97-S99 PolarHBondContact O-N 2.86Å; D97-H100 PolarHBondContact O-N 3.15Å; D97-H100 VanDerWaalsContact O-N 3.1Å; D97-L101 PolarHBondContact O-N 3.33Å
98	I	67.8	Low	63.1	Low	18 Å²	18	97.1 Å²	97.1	9%	0.092	47%	0.471	C	S	.	.	H	α-helix	trans	-62.7	-37.9	174.9	-58.3	163.4	0	0	0	110.5	M59 C62 F94 I95 H100 L101 L123	M59-I98 HydrophobicContact CE-CG1 4.36Å; M59-I98 HydrophobicContact CG-CD1 3.95Å; M59-I98 HydrophobicContact CG-CG1 4.34Å; C62-I98 HydrophobicContact CB-CD1 3.98Å; F94-I98 HydrophobicContact CD1-CD1 3.64Å; F94-I98 HydrophobicContact CD1-CG1 3.94Å; F94-I98 HydrophobicContact CE1-CD1 3.87Å; F94-I98 HydrophobicContact CE1-CG1 4.05Å; F94-I98 VanDerWaalsContact O-CG1 3.29Å; F94-I98 WeakPolarHBondContact O-CG1 3.38Å; F94-I98 PolarHBondContact O-N 2.93Å; I95-I98 PolarHBondContact O-N 2.86Å; I98-H100 PolarHBondContact O-N 3.32Å; I98-H100 VanDerWaalsContact O-N 3.11Å; I98-L101 HydrophobicContact CG2-CD1 4.49Å; I98-L101 WeakPolarHBondContact O-CB 3.42Å; I98-L101 PolarHBondContact O-N 3.14Å; I98-L123 HydrophobicContact CB-CD2 4.18Å; I98-L123 HydrophobicContact CG2-CD2 3.58Å
99	S	63.5	Low	62.5	Low	60 Å²	60	96.8 Å²	96.8	42%	0.42	47%	0.469	S	S	.	.	H	α-helix	trans	-61	-18.9	176.2	-58.5	0	0	0	0	113.6	I95 K96 D97	I95-S99 WeakPolarHBondContact O-CB 3.37Å; I95-S99 PolarHBondContact O-N 3.4Å; I95-S99 PolarHBondContact O-OG 3.33Å; K96-S99 WeakPolarHBondContact O-CB 3.5Å; K96-S99 PolarHBondContact O-N 2.87Å; D97-S99 VanDerWaalsContact C-N 3.28Å; D97-S99 PolarHBondContact O-N 2.86Å
100	H	64.7	Low	61.8	Low	137 Å²	137	93.4 Å²	93.4	63%	0.634	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-5.1	175.6	-65.3	-40.2	0	0	0	114.1	K96 D97 I98 R102	K96-H100 PolarHBondContact O-CD2 3.28Å; K96-H100 PolarHBondContact O-N 2.91Å; D97-H100 PolarHBondContact O-N 3.15Å; D97-H100 VanDerWaalsContact O-N 3.1Å; I98-H100 PolarHBondContact O-N 3.32Å; I98-H100 VanDerWaalsContact O-N 3.11Å; H100-R102 VanDerWaalsContact C-N 3.33Å; H100-R102 PolarHBondContact O-N 3.41Å
101	L	57.4	Low	61.2	Low	86 Å²	86	97 Å²	97	45%	0.45	48%	0.479	S	S	.	.			trans	-75	79.7	176.7	-69.8	176.1	0	0	0	112.1	M59 D97 I98 P103	M59-L101 HydrophobicContact CE-CD1 3.42Å; M59-L101 VanDerWaalsContact CE-CD1 3.42Å; D97-L101 PolarHBondContact O-N 3.33Å; I98-L101 HydrophobicContact CG2-CD1 4.49Å; I98-L101 WeakPolarHBondContact O-CB 3.42Å; I98-L101 PolarHBondContact O-N 3.14Å; L101-P103 VanDerWaalsContact O-CD 3.31Å; L101-P103 WeakPolarHBondContact O-CD 3.48Å
102	R	53.7	Low	60.6	Low	160 Å²	160	103.1 Å²	103.1	60%	0.604	50%	0.502	S	S	*	.			trans	-51.4	117	172.3	178.8	-174.3	-99.4	175.9	-6.1	110.8	H100 Y104	H100-R102 VanDerWaalsContact C-N 3.33Å; H100-R102 PolarHBondContact O-N 3.41Å; R102-Y104 HydrophobicContact CB-CD2 4.4Å; R102-Y104 HydrophobicContact CB-CE2 4.02Å; R102-Y104 WeakPolarHBondContact CD-OH 3.5Å; R102-Y104 HydrophobicContact CG-CD2 4.31Å; R102-Y104 HydrophobicContact CG-CE1 4.47Å; R102-Y104 HydrophobicContact CG-CE2 4.05Å; R102-Y104 PolarHBondContact NH1-OH 2.87Å; R102-Y104 WeakPolarHBondContact O-CD2 3.37Å; R102-Y104 PolarHBondContact O-N 3.37Å
103	P	53.8	Low	59.8	Low	57 Å²	57	98.7 Å²	98.7	37%	0.37	48%	0.482	S	S	.	.			trans	-77.4	88.4	-178.2	29.7	-34.5	0	0	0	111.7	L101 S105 F107 L113	L101-P103 VanDerWaalsContact O-CD 3.31Å; L101-P103 WeakPolarHBondContact O-CD 3.48Å; P103-S105 VanDerWaalsContact C-N 3.27Å; P103-S105 PolarHBondContact O-N 3.02Å; P103-F107 HydrophobicContact CB-CD2 3.97Å; P103-F107 HydrophobicContact CB-CE2 4.27Å; P103-F107 HydrophobicContact CG-CD2 3.56Å; P103-F107 HydrophobicContact CG-CE2 4.12Å; P103-L113 HydrophobicContact CG-CD1 3.62Å
104	Y	46.8	Very low	59.1	Low	187 Å²	187	97.9 Å²	97.9	73%	0.733	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	72.2	177	-72	-82	0	0	0	113.1	R102	R102-Y104 HydrophobicContact CB-CD2 4.4Å; R102-Y104 HydrophobicContact CB-CE2 4.02Å; R102-Y104 WeakPolarHBondContact CD-OH 3.5Å; R102-Y104 HydrophobicContact CG-CD2 4.31Å; R102-Y104 HydrophobicContact CG-CE1 4.47Å; R102-Y104 HydrophobicContact CG-CE2 4.05Å; R102-Y104 PolarHBondContact NH1-OH 2.87Å; R102-Y104 WeakPolarHBondContact O-CD2 3.37Å; R102-Y104 PolarHBondContact O-N 3.37Å
105	S	54.4	Low	58.5	Low	119 Å²	119	97.6 Å²	97.6	83%	0.832	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	173.3	-38.5	154.1	39.4	0	0	0	0	113.9	P103	P103-S105 VanDerWaalsContact C-N 3.27Å; P103-S105 PolarHBondContact O-N 3.02Å
106	C	50	Low	57.8	Low	51 Å²	51	98.1 Å²	98.1	35%	0.345	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-24.9	-160.5	-157.5	0	0	0	0	115.3
107	F	50.9	Low	57.1	Low	46 Å²	46	95.3 Å²	95.3	20%	0.202	48%	0.479	C	S	.	.			trans	-116.1	121.5	-174.1	-58.2	-80.6	0	0	0	110.8	P103 L113 A130 V134	P103-F107 HydrophobicContact CB-CD2 3.97Å; P103-F107 HydrophobicContact CB-CE2 4.27Å; P103-F107 HydrophobicContact CG-CD2 3.56Å; P103-F107 HydrophobicContact CG-CE2 4.12Å; F107-L113 HydrophobicContact CD2-CD1 3.81Å; F107-L113 HydrophobicContact CE2-CD1 4.06Å; F107-L113 HydrophobicContact CG-CD1 4.1Å; F107-A130 HydrophobicContact CD1-CB 4.47Å; F107-A130 HydrophobicContact CE1-CB 3.59Å; F107-A130 HydrophobicContact CZ-CB 3.99Å; F107-V134 HydrophobicContact CD1-CG2 3.65Å; F107-V134 HydrophobicContact CE1-CG2 3.66Å
108	K	56.2	Low	56.6	Low	204 Å²	204	98.8 Å²	98.8	89%	0.887	49%	0.489	S	S	*	.	S	Bend	trans	-74.6	-35.2	-180	-69.7	-179.4	179.5	173.2	0	112.7
109	D	55.5	Low	56.2	Low	97 Å²	97	103 Å²	103	52%	0.519	51%	0.512	S	S	.	.			trans	-111.1	101.1	177.8	-56.4	-44.8	0	0	0	109.5	E111 R112	D109-E111 PolarHBondContact O-N 2.95Å; D109-R112 HydrophobicContact CB-CG 4.43Å; D109-R112 PolarHBondContact O-N 3.11Å
110	P	54.2	Low	56.2	Low	77 Å²	77	105.2 Å²	105.2	50%	0.5	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-17.6	-176.2	26.6	-34.5	0	0	0	113.5	R112	P110-R112 VanDerWaalsContact C-N 3.27Å; P110-R112 PolarHBondContact O-N 3.15Å
111	E	58.9	Low	56.5	Low	157 Å²	157	103.1 Å²	103.1	73%	0.734	52%	0.515	S	S	*	.	H	α-helix	trans	-70.2	-19.1	-179.7	-58.8	-173.3	155.9	0	0	113.6	D109 T114 S115	D109-E111 PolarHBondContact O-N 2.95Å; E111-T114 PolarHBondContact O-OG1 3.01Å; E111-S115 PolarHBondContact O-N 3.45Å
112	R	57.4	Low	57.5	Low	132 Å²	132	99 Å²	99	50%	0.498	49%	0.493	S	S	.	.	H	α-helix	trans	-67.3	-39.7	179.1	-74.5	-167.1	178.4	-138.1	-2.7	112.6	D109 P110 S115 F116 D133	D109-R112 HydrophobicContact CB-CG 4.43Å; D109-R112 PolarHBondContact O-N 3.11Å; P110-R112 VanDerWaalsContact C-N 3.27Å; P110-R112 PolarHBondContact O-N 3.15Å; R112-S115 WeakPolarHBondContact O-CB 3.48Å; R112-S115 PolarHBondContact O-N 3.01Å; R112-S115 VanDerWaalsContact O-N 3.16Å; R112-S115 PolarHBondContact O-OG 2.95Å; R112-F116 WeakPolarHBondContact O-CD2 3.15Å; R112-D133 IonicContact CZ-OD2 3.18Å; R112-D133 IonicContact NH1-OD2 3.72Å; R112-D133 PolarHBondContact NH1-OD2 2.66Å
113	L	54.4	Low	58.6	Low	39 Å²	39	92.4 Å²	92.4	20%	0.204	47%	0.469	C	S	.	.	H	α-helix	trans	-66.5	-39.8	-179	-76	165.9	0	0	0	112	P103 F107 S115 F116 A130	P103-L113 HydrophobicContact CG-CD1 3.62Å; F107-L113 HydrophobicContact CD2-CD1 3.81Å; F107-L113 HydrophobicContact CE2-CD1 4.06Å; F107-L113 HydrophobicContact CG-CD1 4.1Å; L113-S115 PolarHBondContact O-N 2.65Å; L113-F116 PolarHBondContact O-N 3.42Å; L113-A130 HydrophobicContact CD2-CB 3.62Å
114	T	57.7	Low	60	Low	100 Å²	100	92.4 Å²	92.4	61%	0.613	47%	0.466	S	S	*	.	H	α-helix	trans	-70.6	-13.9	174.6	28.5	0	0	0	0	114	E111	E111-T114 PolarHBondContact O-OG1 3.01Å
115	S	58.1	Low	61.4	Low	59 Å²	59	85.4 Å²	85.4	41%	0.413	44%	0.443	S	S	.	.	H	α-helix	trans	-77.2	-42.9	173.8	77.5	0	0	0	0	112.3	E111 R112 L113 Y117 K118	E111-S115 PolarHBondContact O-N 3.45Å; R112-S115 WeakPolarHBondContact O-CB 3.48Å; R112-S115 PolarHBondContact O-N 3.01Å; R112-S115 VanDerWaalsContact O-N 3.16Å; R112-S115 PolarHBondContact O-OG 2.95Å; L113-S115 PolarHBondContact O-N 2.65Å; S115-Y117 PolarHBondContact O-N 3.42Å; S115-K118 PolarHBondContact O-N 3.36Å
116	F	56.1	Low	62.5	Low	32 Å²	32	79.8 Å²	79.8	14%	0.14	40%	0.403	C	S	.	.	H	α-helix	trans	-68.9	-29.9	-177.1	-68	-60.9	0	0	0	114	R112 L113 K118 D119 K129	R112-F116 WeakPolarHBondContact O-CD2 3.15Å; L113-F116 PolarHBondContact O-N 3.42Å; F116-K118 PolarHBondContact O-N 3.02Å; F116-D119 PolarHBondContact O-N 2.72Å; F116-K129 HydrophobicContact CD1-CD 4.04Å; F116-K129 HydrophobicContact CE1-CD 3.76Å; F116-K129 HydrophobicContact CE1-CG 4.21Å; F116-K129 HydrophobicContact CZ-CD 4.3Å; F116-K129 HydrophobicContact CZ-CG 4.25Å
117	Y	57.9	Low	63.8	Low	78 Å²	78	80.4 Å²	80.4	31%	0.306	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-13	-179.2	-139.7	-69.6	0	0	0	113.9	I95 S115 L123	I95-Y117 VanDerWaalsContact CG2-OH 3.24Å; I95-Y117 WeakPolarHBondContact CG2-OH 3.36Å; S115-Y117 PolarHBondContact O-N 3.42Å; Y117-L123 HydrophobicContact CD2-CD1 4.12Å; Y117-L123 HydrophobicContact CE2-CB 3.64Å; Y117-L123 HydrophobicContact CE2-CD1 3.75Å; Y117-L123 HydrophobicContact CE2-CD2 4.09Å; Y117-L123 HydrophobicContact CE2-CG 3.98Å
118	K	60.4	Low	65.1	Low	179 Å²	179	83.6 Å²	83.6	78%	0.778	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-22.9	178.5	-70.9	-175.2	175.2	-179.9	0	114.3	S115 F116 S120	S115-K118 PolarHBondContact O-N 3.36Å; F116-K118 PolarHBondContact O-N 3.02Å; K118-S120 PolarHBondContact O-N 2.94Å
119	D	57.6	Low	66	Low	105 Å²	105	77.2 Å²	77.2	56%	0.561	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	62.8	-161.4	-71.2	-6.7	0	0	0	112.6	F116 Y121	F116-D119 PolarHBondContact O-N 2.72Å; D119-Y121 HydrophobicContact CB-CD2 4.47Å; D119-Y121 WeakPolarHBondContact O-CD2 3.43Å; D119-Y121 VanDerWaalsContact O-CE2 3.25Å; D119-Y121 WeakPolarHBondContact O-CE2 3.21Å; D119-Y121 PolarHBondContact O-N 2.93Å
120	S	65.1	Low	66.7	Low	107 Å²	107	72.7 Å²	72.7	75%	0.748	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	6.9	170.2	-52	0	0	0	0	117.5	K118	K118-S120 PolarHBondContact O-N 2.94Å
121	Y	70	Confident	67.5	Low	94 Å²	94	76 Å²	76	37%	0.369	37%	0.373	S	S	.	.			trans	-102.3	138.5	176.5	-61.2	-66.2	0	0	0	110.6	D119 V125	D119-Y121 HydrophobicContact CB-CD2 4.47Å; D119-Y121 WeakPolarHBondContact O-CD2 3.43Å; D119-Y121 VanDerWaalsContact O-CE2 3.25Å; D119-Y121 WeakPolarHBondContact O-CE2 3.21Å; D119-Y121 PolarHBondContact O-N 2.93Å; Y121-V125 HydrophobicContact CD1-CB 4.3Å; Y121-V125 HydrophobicContact CD1-CG1 3.52Å; Y121-V125 HydrophobicContact CE1-CG1 4.28Å; Y121-V125 HydrophobicContact CG-CG1 4.04Å
122	S	78	Confident	68	Low	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.372	C	S	.	.			trans	-66.6	166.3	169.1	68.8	0	0	0	0	111.8	D66 L124 V125 S126	D66-S122 VanDerWaalsContact OD2-CB 3.3Å; D66-S122 WeakPolarHBondContact OD2-CB 3.46Å; S122-L124 PolarHBondContact O-N 2.9Å; S122-V125 PolarHBondContact O-N 2.82Å; S122-V125 VanDerWaalsContact O-N 3.14Å; S122-S126 PolarHBondContact O-N 2.79Å; S122-S126 PolarHBondContact O-OG 3.26Å
123	L	77.4	Confident	68.5	Low	20 Å²	20	72.3 Å²	72.3	11%	0.105	36%	0.364	C	S	.	.	H	α-helix	trans	-59.3	-37.5	176.7	178.7	51.1	0	0	0	111.3	L63 D66 I98 Y117 V125 S126 I127	L63-L123 HydrophobicContact CD2-CB 3.8Å; L63-L123 HydrophobicContact CD2-CD2 3.61Å; L63-L123 HydrophobicContact CD2-CG 3.47Å; L63-L123 VanDerWaalsContact CD2-CG 3.47Å; D66-L123 PolarHBondContact OD2-N 3.14Å; I98-L123 HydrophobicContact CB-CD2 4.18Å; I98-L123 HydrophobicContact CG2-CD2 3.58Å; Y117-L123 HydrophobicContact CD2-CD1 4.12Å; Y117-L123 HydrophobicContact CE2-CB 3.64Å; Y117-L123 HydrophobicContact CE2-CD1 3.75Å; Y117-L123 HydrophobicContact CE2-CD2 4.09Å; Y117-L123 HydrophobicContact CE2-CG 3.98Å; L123-V125 VanDerWaalsContact C-N 3.35Å; L123-V125 PolarHBondContact O-N 2.93Å; L123-S126 PolarHBondContact O-N 2.92Å; L123-I127 HydrophobicContact CD1-CD1 3.79Å; L123-I127 HydrophobicContact CD1-CG1 3.87Å; L123-I127 HydrophobicContact CG-CD1 3.85Å; L123-I127 HydrophobicContact CG-CG1 4.41Å; L123-I127 VanDerWaalsContact O-CG1 3.3Å; L123-I127 WeakPolarHBondContact O-CG1 3.14Å; L123-I127 PolarHBondContact O-N 2.89Å
124	L	82.3	Confident	69	Low	57 Å²	57	73.4 Å²	73.4	30%	0.298	37%	0.372	S	S	.	.	H	α-helix	trans	-54.5	-48.9	174.5	-177.2	65.6	0	0	0	111.7	L63 H67 S122 L128	L63-L124 HydrophobicContact CB-CB 4.29Å; L63-L124 HydrophobicContact CB-CD1 4.21Å; L63-L124 HydrophobicContact CD1-CD1 4.45Å; H67-L124 HydrophobicContact CB-CD2 4.48Å; S122-L124 PolarHBondContact O-N 2.9Å; L124-L128 WeakPolarHBondContact O-CG 3.41Å; L124-L128 PolarHBondContact O-N 3.16Å
125	V	77.6	Confident	69.1	Low	40 Å²	40	72.8 Å²	72.8	24%	0.242	37%	0.371	C	S	.	.	H	α-helix	trans	-73.2	-35.6	-179.5	-179.6	0	0	0	0	111.4	Y121 S122 L123 I127 L128 K129	Y121-V125 HydrophobicContact CD1-CB 4.3Å; Y121-V125 HydrophobicContact CD1-CG1 3.52Å; Y121-V125 HydrophobicContact CE1-CG1 4.28Å; Y121-V125 HydrophobicContact CG-CG1 4.04Å; S122-V125 PolarHBondContact O-N 2.82Å; S122-V125 VanDerWaalsContact O-N 3.14Å; L123-V125 VanDerWaalsContact C-N 3.35Å; L123-V125 PolarHBondContact O-N 2.93Å; V125-I127 PolarHBondContact O-N 3.45Å; V125-L128 PolarHBondContact O-N 3Å; V125-K129 WeakPolarHBondContact O-CB 3.41Å; V125-K129 PolarHBondContact O-N 3.38Å
126	S	77	Confident	69.2	Low	1 Å²	1	74 Å²	74	1%	0.007	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-41.5	175.1	-61.7	0	0	0	0	112.4	S122 L123 A130	S122-S126 PolarHBondContact O-N 2.79Å; S122-S126 PolarHBondContact O-OG 3.26Å; L123-S126 PolarHBondContact O-N 2.92Å; S126-A130 WeakPolarHBondContact O-CB 3.42Å; S126-A130 PolarHBondContact O-N 3.24Å; S126-A130 VanDerWaalsContact O-N 3.11Å
127	I	76.3	Confident	69.1	Low	64 Å²	64	79.6 Å²	79.6	33%	0.328	41%	0.411	S	S	.	.	H	α-helix	trans	-65.2	-47.1	175.8	-70.4	164.9	0	0	0	111	L63 L123 V125 K129 A130 Y131	L63-I127 HydrophobicContact CD1-CD1 4.41Å; L63-I127 HydrophobicContact CD2-CD1 4.12Å; L123-I127 HydrophobicContact CD1-CD1 3.79Å; L123-I127 HydrophobicContact CD1-CG1 3.87Å; L123-I127 HydrophobicContact CG-CD1 3.85Å; L123-I127 HydrophobicContact CG-CG1 4.41Å; L123-I127 VanDerWaalsContact O-CG1 3.3Å; L123-I127 WeakPolarHBondContact O-CG1 3.14Å; L123-I127 PolarHBondContact O-N 2.89Å; V125-I127 PolarHBondContact O-N 3.45Å; I127-K129 VanDerWaalsContact C-N 3.35Å; I127-K129 PolarHBondContact O-N 2.77Å; I127-A130 PolarHBondContact O-N 3.4Å; I127-Y131 PolarHBondContact O-N 2.95Å; I127-Y131 VanDerWaalsContact O-N 3.13Å
128	L	79.3	Confident	68.3	Low	113 Å²	113	80.9 Å²	80.9	59%	0.592	43%	0.431	S	S	*	.	H	α-helix	trans	-59.3	-45.5	179.7	-71.5	167.8	0	0	0	111.7	L124 V125 Y131 E132	L124-L128 WeakPolarHBondContact O-CG 3.41Å; L124-L128 PolarHBondContact O-N 3.16Å; V125-L128 PolarHBondContact O-N 3Å; L128-Y131 WeakPolarHBondContact O-CB 3.21Å; L128-Y131 PolarHBondContact O-N 3.49Å; L128-Y131 VanDerWaalsContact O-N 3.14Å; L128-E132 PolarHBondContact O-N 3.06Å
129	K	75.3	Confident	67.6	Low	70 Å²	70	81.3 Å²	81.3	30%	0.304	43%	0.433	S	S	.	.	H	α-helix	trans	-66.5	-36.6	179.9	-164.9	169.7	-173.7	174.6	0	113	F116 V125 I127 Y131 E132 D133	F116-K129 HydrophobicContact CD1-CD 4.04Å; F116-K129 HydrophobicContact CE1-CD 3.76Å; F116-K129 HydrophobicContact CE1-CG 4.21Å; F116-K129 HydrophobicContact CZ-CD 4.3Å; F116-K129 HydrophobicContact CZ-CG 4.25Å; V125-K129 WeakPolarHBondContact O-CB 3.41Å; V125-K129 PolarHBondContact O-N 3.38Å; I127-K129 VanDerWaalsContact C-N 3.35Å; I127-K129 PolarHBondContact O-N 2.77Å; K129-Y131 VanDerWaalsContact C-N 3.28Å; K129-Y131 PolarHBondContact O-N 2.79Å; K129-E132 WeakPolarHBondContact O-CB 3.36Å; K129-E132 PolarHBondContact O-N 2.95Å; K129-D133 PolarHBondContact O-N 3.43Å
130	A	70.9	Confident	66.7	Low	3 Å²	3	84.9 Å²	84.9	3%	0.025	45%	0.446	C	S	.	.	H	α-helix	trans	-66.7	-29.9	173.4	0	0	0	0	0	112.5	F107 L113 S126 I127 D133 V134	F107-A130 HydrophobicContact CD1-CB 4.47Å; F107-A130 HydrophobicContact CE1-CB 3.59Å; F107-A130 HydrophobicContact CZ-CB 3.99Å; L113-A130 HydrophobicContact CD2-CB 3.62Å; S126-A130 WeakPolarHBondContact O-CB 3.42Å; S126-A130 PolarHBondContact O-N 3.24Å; S126-A130 VanDerWaalsContact O-N 3.11Å; I127-A130 PolarHBondContact O-N 3.4Å; A130-D133 WeakPolarHBondContact O-CB 3.42Å; A130-V134 WeakPolarHBondContact O-CG2 3.29Å; A130-V134 PolarHBondContact O-N 2.88Å
131	Y	69.8	Low	65.4	Low	146 Å²	146	89 Å²	89	57%	0.573	45%	0.454	S	S	*	.	H	α-helix	trans	-71.7	-35	175.6	-134.2	-85.6	0	0	0	112.7	I127 L128 K129 S135	I127-Y131 PolarHBondContact O-N 2.95Å; I127-Y131 VanDerWaalsContact O-N 3.13Å; L128-Y131 WeakPolarHBondContact O-CB 3.21Å; L128-Y131 PolarHBondContact O-N 3.49Å; L128-Y131 VanDerWaalsContact O-N 3.14Å; K129-Y131 VanDerWaalsContact C-N 3.28Å; K129-Y131 PolarHBondContact O-N 2.79Å; Y131-S135 PolarHBondContact O-N 3.17Å; Y131-S135 PolarHBondContact O-OG 2.96Å
132	E	70.4	Confident	63.9	Low	149 Å²	149	94.5 Å²	94.5	70%	0.696	48%	0.479	S	S	*	.	H	α-helix	trans	-61.9	-47.6	172.7	-168.8	173.2	-161.2	0	0	111	L128 K129 V134 S135	L128-E132 PolarHBondContact O-N 3.06Å; K129-E132 WeakPolarHBondContact O-CB 3.36Å; K129-E132 PolarHBondContact O-N 2.95Å; E132-V134 PolarHBondContact O-N 3.45Å; E132-S135 WeakPolarHBondContact O-CB 3.5Å; E132-S135 PolarHBondContact O-N 2.87Å
133	D	67.5	Low	62.1	Low	62 Å²	62	99.3 Å²	99.3	33%	0.332	52%	0.519	S	S	.	.	H	α-helix	trans	-53.8	-53.9	175.2	-111.7	19	0	0	0	112.6	R112 K129 A130 S135 S136	R112-D133 IonicContact CZ-OD2 3.18Å; R112-D133 IonicContact NH1-OD2 3.72Å; R112-D133 PolarHBondContact NH1-OD2 2.66Å; K129-D133 PolarHBondContact O-N 3.43Å; A130-D133 WeakPolarHBondContact O-CB 3.42Å; D133-S135 PolarHBondContact O-N 3.38Å; D133-S136 PolarHBondContact O-N 3.19Å; D133-S136 PolarHBondContact O-OG 2.68Å
134	V	63.9	Low	60.3	Low	63 Å²	63	105.5 Å²	105.5	38%	0.382	56%	0.557	S	S	.	*	H	α-helix	trans	-64	-29.8	-175.4	171.4	0	0	0	0	112.3	F107 A130 E132 S136	F107-V134 HydrophobicContact CD1-CG2 3.65Å; F107-V134 HydrophobicContact CE1-CG2 3.66Å; A130-V134 WeakPolarHBondContact O-CG2 3.29Å; A130-V134 PolarHBondContact O-N 2.88Å; E132-V134 PolarHBondContact O-N 3.45Å; V134-S136 PolarHBondContact O-N 2.82Å; V134-S136 VanDerWaalsContact O-N 3.12Å
135	S	60.4	Low	58.3	Low	86 Å²	86	112.3 Å²	112.3	60%	0.601	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-11.3	-179.2	-60.8	0	0	0	0	114	Y131 E132 D133	Y131-S135 PolarHBondContact O-N 3.17Å; Y131-S135 PolarHBondContact O-OG 2.96Å; E132-S135 WeakPolarHBondContact O-CB 3.5Å; E132-S135 PolarHBondContact O-N 2.87Å; D133-S135 PolarHBondContact O-N 3.38Å
136	S	59.6	Low	56.6	Low	86 Å²	86	115.1 Å²	115.1	60%	0.601	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-12.7	-172.8	69.4	0	0	0	0	116.4	D133 V134	D133-S136 PolarHBondContact O-N 3.19Å; D133-S136 PolarHBondContact O-OG 2.68Å; V134-S136 PolarHBondContact O-N 2.82Å; V134-S136 VanDerWaalsContact O-N 3.12Å
137	L	54.6	Low	54.8	Low	148 Å²	148	122.3 Å²	122.3	78%	0.775	66%	0.659	S	S	*	*			trans	-112.3	13.3	-152.9	-123.1	80	0	0	0	118.4
138	S	42.1	Very low	53.1	Low	106 Å²	106	128 Å²	128	74%	0.741	68%	0.684	S	S	*	*			trans	-103.4	52.6	-154.5	57	0	0	0	0	119
139	K	44	Very low	51.2	Low	187 Å²	187	127.4 Å²	127.4	81%	0.813	70%	0.695	S	S	*	*			trans	-137.5	143.7	177.7	-61.4	-178.1	-178.5	174.6	0	115.4
140	E	40	Very low	49.7	Very low	180 Å²	180	129.7 Å²	129.7	84%	0.841	71%	0.711	S	S	*	*			trans	85.8	172.5	164.2	-66.7	162.3	-118	0	0	121.8
141	H	37.9	Very low	48.7	Very low	195 Å²	195	132.4 Å²	132.4	90%	0.903	74%	0.739	S	S	*	*			trans	-147.3	-164.9	-146.7	-95.7	34.3	0	0	0	118.1
142	K	38.2	Very low	47.5	Very low	208 Å²	208	130.7 Å²	130.7	90%	0.904	75%	0.748	S	S	*	*			trans	-146.4	151.9	-167.9	-54.2	177.7	177.5	-177.9	0	115.8
143	A	39.6	Very low	46.7	Very low	101 Å²	101	128 Å²	128	84%	0.835	74%	0.738	S	S	*	*			trans	175.6	157	151.1	0	0	0	0	0	115.7
144	V	38.8	Very low	46.5	Very low	150 Å²	150	130.6 Å²	130.6	91%	0.909	75%	0.751	S	S	*	*			trans	-158.5	156.4	-179.1	-177.2	0	0	0	0	114.7
145	Q	40.8	Very low	46.8	Very low	200 Å²	200	133 Å²	133	94%	0.935	76%	0.762	S	S	*	*			trans	-158.6	177.2	167.1	-110.2	177.6	6.5	0	0	116.1
146	A	41.7	Very low	47.2	Very low	99 Å²	99	135.3 Å²	135.3	82%	0.818	76%	0.763	S	S	*	*			trans	-148.1	-177.6	-166.6	0	0	0	0	0	118.4
147	V	40.1	Very low	47.6	Very low	152 Å²	152	135.3 Å²	135.3	92%	0.921	75%	0.75	S	S	*	*			trans	-144.8	165.2	-166.2	179.6	0	0	0	0	115.6
148	E	40.8	Very low	48.6	Very low	184 Å²	184	133 Å²	133	86%	0.86	74%	0.737	S	S	*	*			trans	-112.6	169.1	-165.4	-48	-180	138.8	0	0	119.2
149	A	38.5	Very low	50.4	Low	101 Å²	101	132.1 Å²	132.1	84%	0.835	73%	0.725	S	S	*	*			trans	174.3	148.2	136.5	0	0	0	0	0	112.5
150	D	44.9	Very low	52	Low	117 Å²	117	126.5 Å²	126.5	63%	0.626	71%	0.709	S	S	*	*			cis	-142.1	-89.1	-26.8	-176.5	53.1	0	0	0	113.4	R157	D150-R157 IonicContact OD1-CZ 3.97Å; D150-R157 VanDerWaalsContact OD1-CZ 3.27Å; D150-R157 IonicContact OD1-NH1 2.66Å; D150-R157 PolarHBondContact OD1-NH1 2.94Å; D150-R157 IonicContact OD1-NH2 2.8Å; D150-R157 PolarHBondContact OD1-NH2 3.13Å; D150-R157 IonicContact OD2-CZ 2.75Å; D150-R157 IonicContact OD2-NH1 3.83Å; D150-R157 PolarHBondContact OD2-NH1 2.9Å; D150-R157 IonicContact OD2-NH2 2.68Å
151	G	48.1	Very low	53.7	Low	61 Å²	61	122.3 Å²	122.3	63%	0.629	69%	0.691	S	S	*	*			cis	175.2	56.6	-5.7	0	0	0	0	0	117
152	C	46.4	Very low	55.9	Low	110 Å²	110	117.6 Å²	117.6	74%	0.743	67%	0.673	S	S	*	*	S	Bend	trans	-164.2	176.1	174.2	-146	0	0	0	0	112.5
153	D	53.5	Low	58.1	Low	91 Å²	91	115 Å²	115	49%	0.487	66%	0.662	S	S	.	*			trans	-38.4	133.9	-175.5	171.3	48.6	0	0	0	115.5	D155 H156 R157	D153-D155 PolarHBondContact O-N 3.06Å; D153-H156 HydrophobicContact CB-CB 4.29Å; D153-H156 PolarHBondContact O-N 3.32Å; D153-H156 IonicContact OD2-CD2 3.37Å; D153-H156 PolarHBondContact OD2-CD2 2.79Å; D153-H156 IonicContact OD2-CG 3.79Å; D153-H156 PolarHBondContact OD2-N 3.02Å; D153-R157 VanDerWaalsContact O-CB 3.24Å; D153-R157 WeakPolarHBondContact O-CB 3.43Å; D153-R157 PolarHBondContact O-N 2.86Å
154	L	63.1	Low	60.1	Low	118 Å²	118	116.1 Å²	116.1	62%	0.618	65%	0.649	S	S	*	*	H	α-helix	trans	-67.1	-42.1	-165.5	-176.3	62.3	0	0	0	113	R157 L158	L154-R157 PolarHBondContact O-N 3.24Å; L154-L158 HydrophobicContact CD1-CD1 4.22Å; L154-L158 WeakPolarHBondContact O-CB 3.27Å; L154-L158 PolarHBondContact O-N 3.47Å
155	D	70	Confident	62.3	Low	112 Å²	112	115.3 Å²	115.3	60%	0.599	63%	0.631	S	S	*	*	H	α-helix	trans	-72.8	-34	179	-84.6	-26.3	0	0	0	111.6	D153 N159	D153-D155 PolarHBondContact O-N 3.06Å; D155-N159 VanDerWaalsContact O-CB 3.31Å; D155-N159 WeakPolarHBondContact O-CB 3.22Å; D155-N159 PolarHBondContact O-N 3.41Å; D155-N159 PolarHBondContact O-ND2 3.37Å
156	H	67.8	Low	64.4	Low	135 Å²	135	109.4 Å²	109.4	63%	0.625	60%	0.603	S	S	*	*	H	α-helix	trans	-66.9	-36.3	169.1	-90.7	-54.7	0	0	0	113.1	D153 S160	D153-H156 HydrophobicContact CB-CB 4.29Å; D153-H156 PolarHBondContact O-N 3.32Å; D153-H156 IonicContact OD2-CD2 3.37Å; D153-H156 PolarHBondContact OD2-CD2 2.79Å; D153-H156 IonicContact OD2-CG 3.79Å; D153-H156 PolarHBondContact OD2-N 3.02Å; H156-S160 WeakPolarHBondContact O-CB 3.47Å; H156-S160 PolarHBondContact O-N 2.9Å; H156-S160 PolarHBondContact O-OG 3.32Å
157	R	68.4	Low	66.4	Low	86 Å²	86	107.3 Å²	107.3	33%	0.325	59%	0.586	S	S	.	*	H	α-helix	trans	-69.8	-42.6	175.1	-173.3	169.8	168.9	173.8	0.4	110.9	D150 D153 L154 S160 I161	D150-R157 IonicContact OD1-CZ 3.97Å; D150-R157 VanDerWaalsContact OD1-CZ 3.27Å; D150-R157 IonicContact OD1-NH1 2.66Å; D150-R157 PolarHBondContact OD1-NH1 2.94Å; D150-R157 IonicContact OD1-NH2 2.8Å; D150-R157 PolarHBondContact OD1-NH2 3.13Å; D150-R157 IonicContact OD2-CZ 2.75Å; D150-R157 IonicContact OD2-NH1 3.83Å; D150-R157 PolarHBondContact OD2-NH1 2.9Å; D150-R157 IonicContact OD2-NH2 2.68Å; D153-R157 VanDerWaalsContact O-CB 3.24Å; D153-R157 WeakPolarHBondContact O-CB 3.43Å; D153-R157 PolarHBondContact O-N 2.86Å; L154-R157 PolarHBondContact O-N 3.24Å; R157-S160 PolarHBondContact O-N 2.96Å; R157-I161 HydrophobicContact CG-CD1 4.07Å; R157-I161 WeakPolarHBondContact O-CB 3.49Å; R157-I161 VanDerWaalsContact O-CG1 3.27Å; R157-I161 WeakPolarHBondContact O-CG1 3.45Å; R157-I161 PolarHBondContact O-N 2.88Å
158	L	75.4	Confident	68.4	Low	99 Å²	99	104 Å²	104	52%	0.518	56%	0.563	S	S	.	*	H	α-helix	trans	-61.8	-46.2	172.4	-123	77.5	0	0	0	111.4	L154 S160 I161 N162	L154-L158 HydrophobicContact CD1-CD1 4.22Å; L154-L158 WeakPolarHBondContact O-CB 3.27Å; L154-L158 PolarHBondContact O-N 3.47Å; L158-S160 VanDerWaalsContact C-N 3.28Å; L158-S160 PolarHBondContact O-N 2.9Å; L158-I161 PolarHBondContact O-N 3.3Å; L158-N162 VanDerWaalsContact O-CB 3.28Å; L158-N162 WeakPolarHBondContact O-CB 3.35Å; L158-N162 PolarHBondContact O-N 2.81Å
159	N	80.2	Confident	70.6	Confident	89 Å²	89	98.7 Å²	98.7	48%	0.476	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-27.9	176.8	-83.5	-75.7	0	0	0	113.1	D155 K163	D155-N159 VanDerWaalsContact O-CB 3.31Å; D155-N159 WeakPolarHBondContact O-CB 3.22Å; D155-N159 PolarHBondContact O-N 3.41Å; D155-N159 PolarHBondContact O-ND2 3.37Å; N159-K163 WeakPolarHBondContact O-CB 3.48Å; N159-K163 VanDerWaalsContact O-CG 3.25Å; N159-K163 WeakPolarHBondContact O-CG 3.4Å; N159-K163 PolarHBondContact O-N 2.8Å; N159-K163 VanDerWaalsContact O-N 3.08Å
160	S	77	Confident	72.8	Confident	68 Å²	68	98.6 Å²	98.6	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-72.4	-49.2	172.4	-59.3	0	0	0	0	110.4	H156 R157 L158 N162 K163 E164	H156-S160 WeakPolarHBondContact O-CB 3.47Å; H156-S160 PolarHBondContact O-N 2.9Å; H156-S160 PolarHBondContact O-OG 3.32Å; R157-S160 PolarHBondContact O-N 2.96Å; L158-S160 VanDerWaalsContact C-N 3.28Å; L158-S160 PolarHBondContact O-N 2.9Å; S160-N162 VanDerWaalsContact C-N 3.26Å; S160-N162 PolarHBondContact O-N 2.99Å; S160-K163 PolarHBondContact O-N 3.02Å; S160-K163 VanDerWaalsContact O-N 3.17Å; S160-E164 VanDerWaalsContact O-CB 3.26Å; S160-E164 WeakPolarHBondContact O-CB 3.3Å; S160-E164 PolarHBondContact O-N 3.35Å
161	I	76.8	Confident	74.9	Confident	93 Å²	93	99 Å²	99	48%	0.477	52%	0.523	S	S	.	.	H	α-helix	trans	-56.4	-39.8	173.5	-69.8	163.5	0	0	0	111	R157 L158 E164 Y165	R157-I161 HydrophobicContact CG-CD1 4.07Å; R157-I161 WeakPolarHBondContact O-CB 3.49Å; R157-I161 VanDerWaalsContact O-CG1 3.27Å; R157-I161 WeakPolarHBondContact O-CG1 3.45Å; R157-I161 PolarHBondContact O-N 2.88Å; L158-I161 PolarHBondContact O-N 3.3Å; I161-E164 PolarHBondContact O-N 3.5Å; I161-Y165 WeakPolarHBondContact O-CB 3.47Å; I161-Y165 PolarHBondContact O-N 3.41Å
162	N	83.3	Confident	76.6	Confident	96 Å²	96	102.5 Å²	102.5	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-73.3	-34.6	-179.3	-148.8	25.4	0	0	0	112.1	L158 S160 E166	L158-N162 VanDerWaalsContact O-CB 3.28Å; L158-N162 WeakPolarHBondContact O-CB 3.35Å; L158-N162 PolarHBondContact O-N 2.81Å; S160-N162 VanDerWaalsContact C-N 3.26Å; S160-N162 PolarHBondContact O-N 2.99Å; N162-E166 WeakPolarHBondContact O-CB 3.47Å; N162-E166 WeakPolarHBondContact O-CG 3.45Å; N162-E166 PolarHBondContact O-N 3.39Å
163	K	84.2	Confident	78.6	Confident	154 Å²	154	102 Å²	102	67%	0.67	51%	0.512	S	S	*	.	H	α-helix	trans	-69.5	-40.9	170.7	-77.4	172.7	-179.5	178.5	0	112.3	N159 S160 E166 A167	N159-K163 WeakPolarHBondContact O-CB 3.48Å; N159-K163 VanDerWaalsContact O-CG 3.25Å; N159-K163 WeakPolarHBondContact O-CG 3.4Å; N159-K163 PolarHBondContact O-N 2.8Å; N159-K163 VanDerWaalsContact O-N 3.08Å; S160-K163 PolarHBondContact O-N 3.02Å; S160-K163 VanDerWaalsContact O-N 3.17Å; K163-E166 PolarHBondContact O-N 2.85Å; K163-A167 VanDerWaalsContact O-CB 3.24Å; K163-A167 WeakPolarHBondContact O-CB 3.4Å; K163-A167 PolarHBondContact O-N 3.1Å
164	E	83.3	Confident	80.3	Confident	123 Å²	123	102.7 Å²	102.7	58%	0.575	52%	0.515	S	S	*	.	H	α-helix	trans	-69.1	-39.4	177.9	-173.3	165.5	-139.8	0	0	110.7	S160 I161 A167 I168	S160-E164 VanDerWaalsContact O-CB 3.26Å; S160-E164 WeakPolarHBondContact O-CB 3.3Å; S160-E164 PolarHBondContact O-N 3.35Å; I161-E164 PolarHBondContact O-N 3.5Å; E164-A167 CarbonylContact O-C 3.56Å; E164-A167 PolarHBondContact O-N 3.37Å; E164-I168 HydrophobicContact CG-CD1 4.02Å; E164-I168 WeakPolarHBondContact O-CB 3.3Å; E164-I168 VanDerWaalsContact O-CG1 3.23Å; E164-I168 WeakPolarHBondContact O-CG1 3.37Å; E164-I168 PolarHBondContact O-N 2.83Å
165	Y	83.3	Confident	81.4	Confident	133 Å²	133	98.6 Å²	98.6	52%	0.522	50%	0.501	S	S	.	.	H	α-helix	trans	-62.8	-47.6	170.9	176.5	-102.6	0	0	0	112	I161 A167 I168 K169	I161-Y165 WeakPolarHBondContact O-CB 3.47Å; I161-Y165 PolarHBondContact O-N 3.41Å; Y165-A167 VanDerWaalsContact C-N 3.28Å; Y165-A167 PolarHBondContact O-N 2.69Å; Y165-I168 PolarHBondContact O-N 3.41Å; Y165-K169 HydrophobicContact CE1-CD 3.98Å; Y165-K169 WeakPolarHBondContact O-CB 3.44Å; Y165-K169 PolarHBondContact O-N 3.19Å
166	E	86	Confident	82.3	Confident	76 Å²	76	95.2 Å²	95.2	36%	0.355	49%	0.489	S	S	.	.	H	α-helix	trans	-66	-29.9	174.4	-74.1	-63.3	145.5	0	0	112.5	N162 K163 K169 L170	N162-E166 WeakPolarHBondContact O-CB 3.47Å; N162-E166 WeakPolarHBondContact O-CG 3.45Å; N162-E166 PolarHBondContact O-N 3.39Å; K163-E166 PolarHBondContact O-N 2.85Å; E166-K169 IonicContact OE1-NZ 2.65Å; E166-K169 PolarHBondContact OE1-NZ 3.31Å; E166-K169 IonicContact OE2-NZ 3.23Å; E166-K169 PolarHBondContact OE2-NZ 3.37Å; E166-L170 VanDerWaalsContact O-CB 3.26Å; E166-L170 WeakPolarHBondContact O-CB 3.3Å; E166-L170 WeakPolarHBondContact O-CG 3.41Å; E166-L170 PolarHBondContact O-N 2.87Å
167	A	83.2	Confident	83.4	Confident	56 Å²	56	94.4 Å²	94.4	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-72	-42.1	172.9	0	0	0	0	0	112.6	K163 E164 Y165 L170 L171	K163-A167 VanDerWaalsContact O-CB 3.24Å; K163-A167 WeakPolarHBondContact O-CB 3.4Å; K163-A167 PolarHBondContact O-N 3.1Å; E164-A167 CarbonylContact O-C 3.56Å; E164-A167 PolarHBondContact O-N 3.37Å; Y165-A167 VanDerWaalsContact C-N 3.28Å; Y165-A167 PolarHBondContact O-N 2.69Å; A167-L170 PolarHBondContact O-N 3.42Å; A167-L171 WeakPolarHBondContact O-CB 3.25Å; A167-L171 PolarHBondContact O-N 3.12Å
168	I	83.1	Confident	84.5	Confident	83 Å²	83	96.1 Å²	96.1	43%	0.426	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-47.5	173	-72.5	164.5	0	0	0	109.4	E164 Y165 L170 L171 E172	E164-I168 HydrophobicContact CG-CD1 4.02Å; E164-I168 WeakPolarHBondContact O-CB 3.3Å; E164-I168 VanDerWaalsContact O-CG1 3.23Å; E164-I168 WeakPolarHBondContact O-CG1 3.37Å; E164-I168 PolarHBondContact O-N 2.83Å; Y165-I168 PolarHBondContact O-N 3.41Å; I168-L170 VanDerWaalsContact C-N 3.33Å; I168-L170 PolarHBondContact O-N 2.87Å; I168-L171 CarbonylContact O-C 3.57Å; I168-L171 WeakPolarHBondContact O-CA 3.46Å; I168-L171 WeakPolarHBondContact O-CB 3.5Å; I168-L171 PolarHBondContact O-N 2.82Å; I168-E172 HydrophobicContact CG2-CG 4.32Å; I168-E172 WeakPolarHBondContact O-CB 3.37Å; I168-E172 WeakPolarHBondContact O-CG 3.36Å; I168-E172 PolarHBondContact O-N 2.85Å
169	K	85.5	Confident	85.2	Confident	72 Å²	72	97.1 Å²	97.1	31%	0.313	50%	0.499	S	S	.	.	H	α-helix	trans	-59.9	-39.1	174.9	174.1	169.6	160.4	-112	0	112.2	Y165 E166 I173	Y165-K169 HydrophobicContact CE1-CD 3.98Å; Y165-K169 WeakPolarHBondContact O-CB 3.44Å; Y165-K169 PolarHBondContact O-N 3.19Å; E166-K169 IonicContact OE1-NZ 2.65Å; E166-K169 PolarHBondContact OE1-NZ 3.31Å; E166-K169 IonicContact OE2-NZ 3.23Å; E166-K169 PolarHBondContact OE2-NZ 3.37Å; K169-I173 HydrophobicContact CG-CD1 4.03Å; K169-I173 VanDerWaalsContact O-CB 3.29Å; K169-I173 WeakPolarHBondContact O-CB 3.45Å; K169-I173 WeakPolarHBondContact O-CD1 3.16Å; K169-I173 WeakPolarHBondContact O-CG1 3.42Å; K169-I173 PolarHBondContact O-N 2.89Å
170	L	85.6	Confident	85.8	Confident	98 Å²	98	99.1 Å²	99.1	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-67.1	-38.2	170.3	-84.8	165.9	0	0	0	112.4	E166 A167 I168 I173 L174	E166-L170 VanDerWaalsContact O-CB 3.26Å; E166-L170 WeakPolarHBondContact O-CB 3.3Å; E166-L170 WeakPolarHBondContact O-CG 3.41Å; E166-L170 PolarHBondContact O-N 2.87Å; A167-L170 PolarHBondContact O-N 3.42Å; I168-L170 VanDerWaalsContact C-N 3.33Å; I168-L170 PolarHBondContact O-N 2.87Å; L170-I173 PolarHBondContact O-N 3.43Å; L170-L174 VanDerWaalsContact O-CB 3.26Å; L170-L174 WeakPolarHBondContact O-CB 3.34Å; L170-L174 WeakPolarHBondContact O-CG 3.45Å; L170-L174 PolarHBondContact O-N 3.32Å
171	L	87.8	Confident	86.6	Confident	127 Å²	127	99.1 Å²	99.1	67%	0.665	50%	0.498	S	S	*	.	H	α-helix	trans	-69.4	-36.9	176.6	-168.5	71.7	0	0	0	112	A167 I168 G175	A167-L171 WeakPolarHBondContact O-CB 3.25Å; A167-L171 PolarHBondContact O-N 3.12Å; I168-L171 CarbonylContact O-C 3.57Å; I168-L171 WeakPolarHBondContact O-CA 3.46Å; I168-L171 WeakPolarHBondContact O-CB 3.5Å; I168-L171 PolarHBondContact O-N 2.82Å; L171-G175 WeakPolarHBondContact O-CA 3.27Å; L171-G175 PolarHBondContact O-N 3.09Å
172	E	85	Confident	87.4	Confident	133 Å²	133	98.4 Å²	98.4	62%	0.621	50%	0.495	S	S	*	.	H	α-helix	trans	-68.1	-43.5	171.8	-74.8	-176.5	159.1	0	0	110.9	I168 G175 A176	I168-E172 HydrophobicContact CG2-CG 4.32Å; I168-E172 WeakPolarHBondContact O-CB 3.37Å; I168-E172 WeakPolarHBondContact O-CG 3.36Å; I168-E172 PolarHBondContact O-N 2.85Å; E172-G175 PolarHBondContact O-N 2.67Å; E172-A176 WeakPolarHBondContact O-CB 3.37Å; E172-A176 PolarHBondContact O-N 2.99Å
173	I	87.4	Confident	87.9	Confident	99 Å²	99	101.4 Å²	101.4	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-41.5	173.9	-72.5	164.6	0	0	0	110.6	K169 L170 K177	K169-I173 HydrophobicContact CG-CD1 4.03Å; K169-I173 VanDerWaalsContact O-CB 3.29Å; K169-I173 WeakPolarHBondContact O-CB 3.45Å; K169-I173 WeakPolarHBondContact O-CD1 3.16Å; K169-I173 WeakPolarHBondContact O-CG1 3.42Å; K169-I173 PolarHBondContact O-N 2.89Å; L170-I173 PolarHBondContact O-N 3.43Å; I173-K177 WeakPolarHBondContact O-CB 3.3Å; I173-K177 PolarHBondContact O-N 2.93Å
174	L	89.4	Confident	88.4	Confident	107 Å²	107	99 Å²	99	56%	0.56	49%	0.493	S	S	*	.	H	α-helix	trans	-70.3	-37.3	176.1	-75.6	168.8	0	0	0	112.5	L170 K178	L170-L174 VanDerWaalsContact O-CB 3.26Å; L170-L174 WeakPolarHBondContact O-CB 3.34Å; L170-L174 WeakPolarHBondContact O-CG 3.45Å; L170-L174 PolarHBondContact O-N 3.32Å; L174-K178 WeakPolarHBondContact O-CB 3.37Å; L174-K178 PolarHBondContact O-N 3.45Å
175	G	87.2	Confident	88.8	Confident	31 Å²	31	97.8 Å²	97.8	32%	0.32	49%	0.487	S	S	.	.	H	α-helix	trans	-70.9	-43.4	176.8	0	0	0	0	0	112.2	L171 E172 K178 L179	L171-G175 WeakPolarHBondContact O-CA 3.27Å; L171-G175 PolarHBondContact O-N 3.09Å; E172-G175 PolarHBondContact O-N 2.67Å; G175-K178 PolarHBondContact O-N 3.45Å; G175-L179 WeakPolarHBondContact O-CB 3.45Å; G175-L179 WeakPolarHBondContact O-CG 3.28Å; G175-L179 PolarHBondContact O-N 2.84Å
176	A	88.8	Confident	89.3	Confident	42 Å²	42	97.6 Å²	97.6	35%	0.347	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-44.9	170.9	0	0	0	0	0	110.8	E172 K178 L179 F180	E172-A176 WeakPolarHBondContact O-CB 3.37Å; E172-A176 PolarHBondContact O-N 2.99Å; A176-K178 PolarHBondContact O-N 3.38Å; A176-L179 CarbonylContact O-C 3.48Å; A176-L179 PolarHBondContact O-N 3.04Å; A176-F180 WeakPolarHBondContact O-CD2 3.37Å; A176-F180 PolarHBondContact O-N 2.77Å
177	K	91.2	Very high	89.6	Confident	117 Å²	117	96.6 Å²	96.6	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-58.9	-46.4	173.6	-168.3	-156	173.4	-144.5	0	110.9	I173 L179 F180 D181	I173-K177 WeakPolarHBondContact O-CB 3.3Å; I173-K177 PolarHBondContact O-N 2.93Å; K177-L179 VanDerWaalsContact C-N 3.34Å; K177-L179 PolarHBondContact O-N 2.9Å; K177-F180 CarbonylContact O-C 3.59Å; K177-F180 PolarHBondContact O-N 2.95Å; K177-F180 VanDerWaalsContact O-N 3.12Å; K177-D181 WeakPolarHBondContact CE-OD2 3.46Å; K177-D181 IonicContact NZ-OD2 3.81Å; K177-D181 PolarHBondContact NZ-OD2 3.44Å; K177-D181 WeakPolarHBondContact O-CB 3.43Å; K177-D181 PolarHBondContact O-N 3.41Å
178	K	90.4	Very high	90.2	Very high	122 Å²	122	99 Å²	99	53%	0.53	49%	0.492	S	S	.	.	H	α-helix	trans	-60.6	-42.8	176	-165.6	-170	178.1	-75.8	0	111.4	L174 G175 A176 F180 D181 D182	L174-K178 WeakPolarHBondContact O-CB 3.37Å; L174-K178 PolarHBondContact O-N 3.45Å; G175-K178 PolarHBondContact O-N 3.45Å; A176-K178 PolarHBondContact O-N 3.38Å; K178-F180 VanDerWaalsContact C-N 3.31Å; K178-F180 PolarHBondContact O-N 3.34Å; K178-D181 PolarHBondContact O-N 2.84Å; K178-D182 IonicContact NZ-OD1 2.99Å; K178-D182 PolarHBondContact NZ-OD1 2.91Å; K178-D182 IonicContact NZ-OD2 2.71Å; K178-D182 PolarHBondContact NZ-OD2 2.93Å; K178-D182 VanDerWaalsContact O-CB 3.24Å; K178-D182 WeakPolarHBondContact O-CB 3.39Å; K178-D182 PolarHBondContact O-N 2.92Å
179	L	91.4	Very high	90.7	Very high	121 Å²	121	98.2 Å²	98.2	63%	0.634	49%	0.494	S	S	*	.	H	α-helix	trans	-63.2	-34.4	174.4	-78.4	165.6	0	0	0	112.7	G175 A176 K177 R183	G175-L179 WeakPolarHBondContact O-CB 3.45Å; G175-L179 WeakPolarHBondContact O-CG 3.28Å; G175-L179 PolarHBondContact O-N 2.84Å; A176-L179 CarbonylContact O-C 3.48Å; A176-L179 PolarHBondContact O-N 3.04Å; K177-L179 VanDerWaalsContact C-N 3.34Å; K177-L179 PolarHBondContact O-N 2.9Å; L179-R183 WeakPolarHBondContact O-CB 3.4Å; L179-R183 PolarHBondContact O-N 2.83Å
180	F	92.6	Very high	91.2	Very high	130 Å²	130	99 Å²	99	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-71.2	-41.9	171.4	-78.3	-64.3	0	0	0	112.2	A176 K177 K178 R183 L184	A176-F180 WeakPolarHBondContact O-CD2 3.37Å; A176-F180 PolarHBondContact O-N 2.77Å; K177-F180 CarbonylContact O-C 3.59Å; K177-F180 PolarHBondContact O-N 2.95Å; K177-F180 VanDerWaalsContact O-N 3.12Å; K178-F180 VanDerWaalsContact C-N 3.31Å; K178-F180 PolarHBondContact O-N 3.34Å; F180-R183 PolarHBondContact O-N 2.94Å; F180-L184 VanDerWaalsContact O-CB 3.3Å; F180-L184 WeakPolarHBondContact O-CB 3.43Å; F180-L184 WeakPolarHBondContact O-CG 3.31Å; F180-L184 PolarHBondContact O-N 3.27Å
181	D	93.7	Very high	91.6	Very high	69 Å²	69	99.2 Å²	99.2	37%	0.369	50%	0.499	S	S	.	.	H	α-helix	trans	-66	-46.9	177.5	-70.5	-23.4	0	0	0	110.5	K177 K178 R183 L184 E185	K177-D181 WeakPolarHBondContact CE-OD2 3.46Å; K177-D181 IonicContact NZ-OD2 3.81Å; K177-D181 PolarHBondContact NZ-OD2 3.44Å; K177-D181 WeakPolarHBondContact O-CB 3.43Å; K177-D181 PolarHBondContact O-N 3.41Å; K178-D181 PolarHBondContact O-N 2.84Å; D181-R183 VanDerWaalsContact C-N 3.35Å; D181-R183 PolarHBondContact O-N 3.32Å; D181-L184 PolarHBondContact O-N 3.5Å; D181-E185 PolarHBondContact O-N 3.42Å
182	D	92.3	Very high	91.9	Very high	77 Å²	77	97.2 Å²	97.2	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-59.4	-43.1	174.1	-70.1	-27.4	0	0	0	110.7	K178 E185 Q186	K178-D182 IonicContact NZ-OD1 2.99Å; K178-D182 PolarHBondContact NZ-OD1 2.91Å; K178-D182 IonicContact NZ-OD2 2.71Å; K178-D182 PolarHBondContact NZ-OD2 2.93Å; K178-D182 VanDerWaalsContact O-CB 3.24Å; K178-D182 WeakPolarHBondContact O-CB 3.39Å; K178-D182 PolarHBondContact O-N 2.92Å; D182-E185 PolarHBondContact O-N 3.19Å; D182-Q186 WeakPolarHBondContact O-CB 3.35Å; D182-Q186 PolarHBondContact O-N 2.8Å
183	R	94.3	Very high	92.4	Very high	160 Å²	160	92 Å²	92	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-71.6	-33.7	177.3	-177.2	176.3	173.1	-172.2	-2.3	112.7	L179 F180 D181 C187	L179-R183 WeakPolarHBondContact O-CB 3.4Å; L179-R183 PolarHBondContact O-N 2.83Å; F180-R183 PolarHBondContact O-N 2.94Å; D181-R183 VanDerWaalsContact C-N 3.35Å; D181-R183 PolarHBondContact O-N 3.32Å; R183-C187 WeakPolarHBondContact O-CB 3.43Å; R183-C187 PolarHBondContact O-N 3.35Å; R183-C187 PolarHBondContact O-SG 3.37Å
184	L	94.2	Very high	92.7	Very high	102 Å²	102	95 Å²	95	53%	0.534	48%	0.476	S	S	.	.	H	α-helix	trans	-65.6	-42.6	171.3	-80.4	166.8	0	0	0	110.6	F180 D181 C187 K188	F180-L184 VanDerWaalsContact O-CB 3.3Å; F180-L184 WeakPolarHBondContact O-CB 3.43Å; F180-L184 WeakPolarHBondContact O-CG 3.31Å; F180-L184 PolarHBondContact O-N 3.27Å; D181-L184 PolarHBondContact O-N 3.5Å; L184-C187 PolarHBondContact O-N 3.29Å; L184-K188 WeakPolarHBondContact O-CG 3.33Å; L184-K188 PolarHBondContact O-N 3.43Å
185	E	93.1	Very high	92.9	Very high	98 Å²	98	92.9 Å²	92.9	46%	0.458	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-34.6	177.1	-154	60.5	-138.8	0	0	112.1	D181 D182 K188 S189	D181-E185 PolarHBondContact O-N 3.42Å; D182-E185 PolarHBondContact O-N 3.19Å; E185-K188 PolarHBondContact O-N 3.45Å; E185-K188 IonicContact OE1-NZ 2.66Å; E185-K188 IonicContact OE2-NZ 3.12Å; E185-K188 PolarHBondContact OE2-NZ 3.44Å; E185-S189 VanDerWaalsContact O-CB 3.26Å; E185-S189 WeakPolarHBondContact O-CB 3.43Å; E185-S189 PolarHBondContact O-N 2.87Å; E185-S189 PolarHBondContact O-OG 2.87Å
186	Q	93.2	Very high	93.3	Very high	130 Å²	130	98.2 Å²	98.2	61%	0.607	48%	0.48	S	S	*	.	H	α-helix	trans	-61.1	-47.7	167.8	-174	-178.6	7.9	0	0	111.2	D182 K188 S189 E190	D182-Q186 WeakPolarHBondContact O-CB 3.35Å; D182-Q186 PolarHBondContact O-N 2.8Å; Q186-K188 PolarHBondContact O-N 3.47Å; Q186-S189 PolarHBondContact O-N 2.84Å; Q186-E190 WeakPolarHBondContact O-CB 3.27Å; Q186-E190 PolarHBondContact O-N 2.91Å
187	C	93	Very high	93.6	Very high	55 Å²	55	102.7 Å²	102.7	37%	0.372	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-40.5	177.4	-72.1	0	0	0	0	112.5	R183 L184 E190 I191	R183-C187 WeakPolarHBondContact O-CB 3.43Å; R183-C187 PolarHBondContact O-N 3.35Å; R183-C187 PolarHBondContact O-SG 3.37Å; L184-C187 PolarHBondContact O-N 3.29Å; C187-E190 PolarHBondContact O-N 3.02Å; C187-I191 WeakPolarHBondContact O-CB 3.49Å; C187-I191 WeakPolarHBondContact O-CD1 3.32Å; C187-I191 VanDerWaalsContact O-CG1 3.22Å; C187-I191 WeakPolarHBondContact O-CG1 3.24Å; C187-I191 PolarHBondContact O-N 2.92Å
188	K	95.2	Very high	93.7	Very high	106 Å²	106	100.5 Å²	100.5	46%	0.461	49%	0.487	S	S	.	.	H	α-helix	trans	-60.7	-50.7	171.5	-68.7	176.5	-156.2	162.1	0	111.1	L184 E185 Q186 E190 I191 D192	L184-K188 WeakPolarHBondContact O-CG 3.33Å; L184-K188 PolarHBondContact O-N 3.43Å; E185-K188 PolarHBondContact O-N 3.45Å; E185-K188 IonicContact OE1-NZ 2.66Å; E185-K188 IonicContact OE2-NZ 3.12Å; E185-K188 PolarHBondContact OE2-NZ 3.44Å; Q186-K188 PolarHBondContact O-N 3.47Å; K188-E190 PolarHBondContact O-N 3.43Å; K188-I191 PolarHBondContact O-N 2.85Å; K188-I191 VanDerWaalsContact O-N 3.11Å; K188-D192 WeakPolarHBondContact O-CB 3.38Å; K188-D192 PolarHBondContact O-N 3.08Å
189	S	94.5	Very high	94	Very high	66 Å²	66	100.5 Å²	100.5	46%	0.462	49%	0.491	S	S	.	.	H	α-helix	trans	-59.4	-34.5	-179.8	-61.5	0	0	0	0	112.4	E185 Q186 G193	E185-S189 VanDerWaalsContact O-CB 3.26Å; E185-S189 WeakPolarHBondContact O-CB 3.43Å; E185-S189 PolarHBondContact O-N 2.87Å; E185-S189 PolarHBondContact O-OG 2.87Å; Q186-S189 PolarHBondContact O-N 2.84Å; S189-G193 PolarHBondContact O-N 2.85Å
190	E	94.9	Very high	94.1	Very high	90 Å²	90	101.1 Å²	101.1	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-73.5	-42.5	174.4	-162.4	-168.7	151.3	0	0	112.3	Q186 C187 K188 G193 R194	Q186-E190 WeakPolarHBondContact O-CB 3.27Å; Q186-E190 PolarHBondContact O-N 2.91Å; C187-E190 PolarHBondContact O-N 3.02Å; K188-E190 PolarHBondContact O-N 3.43Å; E190-G193 PolarHBondContact O-N 2.93Å; E190-R194 WeakPolarHBondContact O-CB 3.34Å; E190-R194 WeakPolarHBondContact O-CD 3.26Å; E190-R194 WeakPolarHBondContact O-CG 3.35Å; E190-R194 PolarHBondContact O-N 2.76Å; E190-R194 IonicContact OE1-CZ 3.58Å; E190-R194 IonicContact OE1-NE 2.62Å; E190-R194 PolarHBondContact OE1-NE 2.99Å; E190-R194 IonicContact OE1-NH2 2.67Å; E190-R194 PolarHBondContact OE1-NH2 2.82Å
191	I	93.5	Very high	94.3	Very high	102 Å²	102	100 Å²	100	52%	0.523	48%	0.483	S	S	.	.	H	α-helix	trans	-62.4	-45.6	174.7	-71.8	164.4	0	0	0	110.6	C187 K188 R194 S195	C187-I191 WeakPolarHBondContact O-CB 3.49Å; C187-I191 WeakPolarHBondContact O-CD1 3.32Å; C187-I191 VanDerWaalsContact O-CG1 3.22Å; C187-I191 WeakPolarHBondContact O-CG1 3.24Å; C187-I191 PolarHBondContact O-N 2.92Å; K188-I191 PolarHBondContact O-N 2.85Å; K188-I191 VanDerWaalsContact O-N 3.11Å; I191-R194 PolarHBondContact O-N 3.49Å; I191-S195 VanDerWaalsContact O-CB 3.29Å; I191-S195 WeakPolarHBondContact O-CB 3.27Å; I191-S195 PolarHBondContact O-N 3.43Å; I191-S195 PolarHBondContact O-OG 2.86Å
192	D	95	Very high	94.4	Very high	84 Å²	84	101.5 Å²	101.5	45%	0.449	49%	0.487	S	S	.	.	H	α-helix	trans	-64.8	-39.5	175	-81.3	7.6	0	0	0	111.8	K188 S195 R196	K188-D192 WeakPolarHBondContact O-CB 3.38Å; K188-D192 PolarHBondContact O-N 3.08Å; D192-S195 PolarHBondContact O-N 2.84Å; D192-R196 WeakPolarHBondContact O-CB 3.43Å; D192-R196 WeakPolarHBondContact O-CG 3.17Å; D192-R196 PolarHBondContact O-N 3.48Å
193	G	94.6	Very high	94.5	Very high	24 Å²	24	103 Å²	103	25%	0.247	49%	0.493	C	S	.	.	H	α-helix	trans	-63.1	-48.7	175.2	0	0	0	0	0	112	S189 E190 S195 R196 M197	S189-G193 PolarHBondContact O-N 2.85Å; E190-G193 PolarHBondContact O-N 2.93Å; G193-S195 VanDerWaalsContact C-N 3.33Å; G193-S195 PolarHBondContact O-N 3.27Å; G193-R196 PolarHBondContact O-N 3Å; G193-M197 VanDerWaalsContact O-CB 3.31Å; G193-M197 WeakPolarHBondContact O-CB 3.39Å; G193-M197 PolarHBondContact O-N 3.38Å
194	R	94.6	Very high	94.5	Very high	163 Å²	163	97.7 Å²	97.7	62%	0.615	48%	0.481	S	S	*	.	H	α-helix	trans	-59.3	-42.5	172.8	-72.2	165.3	177.2	-112.8	8.1	111.2	E190 I191 M197 E198	E190-R194 WeakPolarHBondContact O-CB 3.34Å; E190-R194 WeakPolarHBondContact O-CD 3.26Å; E190-R194 WeakPolarHBondContact O-CG 3.35Å; E190-R194 PolarHBondContact O-N 2.76Å; E190-R194 IonicContact OE1-CZ 3.58Å; E190-R194 IonicContact OE1-NE 2.62Å; E190-R194 PolarHBondContact OE1-NE 2.99Å; E190-R194 IonicContact OE1-NH2 2.67Å; E190-R194 PolarHBondContact OE1-NH2 2.82Å; I191-R194 PolarHBondContact O-N 3.49Å; R194-M197 PolarHBondContact O-N 2.89Å; R194-E198 VanDerWaalsContact O-CB 3.23Å; R194-E198 WeakPolarHBondContact O-CB 3.41Å; R194-E198 PolarHBondContact O-N 3.3Å
195	S	92.9	Very high	94.6	Very high	61 Å²	61	96.9 Å²	96.9	43%	0.427	47%	0.474	S	S	.	.	H	α-helix	trans	-68.1	-40.2	-179.7	-57.8	0	0	0	0	112.7	I191 D192 G193 M199	I191-S195 VanDerWaalsContact O-CB 3.29Å; I191-S195 WeakPolarHBondContact O-CB 3.27Å; I191-S195 PolarHBondContact O-N 3.43Å; I191-S195 PolarHBondContact O-OG 2.86Å; D192-S195 PolarHBondContact O-N 2.84Å; G193-S195 VanDerWaalsContact C-N 3.33Å; G193-S195 PolarHBondContact O-N 3.27Å; S195-M199 PolarHBondContact O-N 3.19Å
196	R	95.7	Very high	94.7	Very high	143 Å²	143	97.7 Å²	97.7	54%	0.54	48%	0.476	S	S	.	.	H	α-helix	trans	-64.4	-47.2	172	-76.6	-176	-68.9	-94.9	-2.8	111.6	D192 G193 E198 M199 E200	D192-R196 WeakPolarHBondContact O-CB 3.43Å; D192-R196 WeakPolarHBondContact O-CG 3.17Å; D192-R196 PolarHBondContact O-N 3.48Å; G193-R196 PolarHBondContact O-N 3Å; R196-E198 VanDerWaalsContact C-N 3.31Å; R196-E198 PolarHBondContact O-N 3.47Å; R196-M199 PolarHBondContact O-N 3.38Å; R196-E200 WeakPolarHBondContact O-CB 3.43Å; R196-E200 PolarHBondContact O-N 3.47Å
197	M	94.7	Very high	94.9	Very high	137 Å²	137	98.2 Å²	98.2	68%	0.675	47%	0.473	S	S	*	.	H	α-helix	trans	-62.2	-38.2	178.4	-174.1	179.6	-68.8	0	0	112	G193 R194 E200 R201	G193-M197 VanDerWaalsContact O-CB 3.31Å; G193-M197 WeakPolarHBondContact O-CB 3.39Å; G193-M197 PolarHBondContact O-N 3.38Å; R194-M197 PolarHBondContact O-N 2.89Å; M197-E200 PolarHBondContact O-N 3.43Å; M197-R201 VanDerWaalsContact O-CB 3.31Å; M197-R201 WeakPolarHBondContact O-CB 3.41Å; M197-R201 PolarHBondContact O-N 2.95Å
198	E	95.1	Very high	95	Very high	70 Å²	70	100.3 Å²	100.3	33%	0.327	48%	0.477	S	S	.	.	H	α-helix	trans	-68.6	-42.1	175.9	176.8	57.9	-166.8	0	0	112.1	R194 R196 R201 Q202	R194-E198 VanDerWaalsContact O-CB 3.23Å; R194-E198 WeakPolarHBondContact O-CB 3.41Å; R194-E198 PolarHBondContact O-N 3.3Å; R196-E198 VanDerWaalsContact C-N 3.31Å; R196-E198 PolarHBondContact O-N 3.47Å; E198-R201 PolarHBondContact O-N 2.63Å; E198-R201 IonicContact OE1-CZ 2.67Å; E198-R201 IonicContact OE1-NE 2.71Å; E198-R201 IonicContact OE1-NH2 3.67Å; E198-R201 PolarHBondContact OE1-NH2 2.91Å; E198-R201 IonicContact OE2-CZ 3.9Å; E198-R201 IonicContact OE2-NE 3.54Å; E198-R201 PolarHBondContact OE2-NE 3.24Å; E198-R201 IonicContact OE2-NH2 2.74Å; E198-R201 PolarHBondContact OE2-NH2 2.91Å; E198-Q202 WeakPolarHBondContact O-CB 3.3Å; E198-Q202 VanDerWaalsContact O-CG 3.31Å; E198-Q202 WeakPolarHBondContact O-CG 3.3Å; E198-Q202 PolarHBondContact O-N 2.94Å; E198-Q202 PolarHBondContact OE1-NE2 3.46Å
199	M	94.7	Very high	95	Very high	123 Å²	123	100.1 Å²	100.1	61%	0.606	48%	0.481	S	S	*	.	H	α-helix	trans	-65.6	-37.4	172	-73.6	-159	-58.6	0	0	112.4	S195 R196 Q202 M203	S195-M199 PolarHBondContact O-N 3.19Å; R196-M199 PolarHBondContact O-N 3.38Å; M199-Q202 PolarHBondContact O-N 2.76Å; M199-M203 VanDerWaalsContact O-CB 3.26Å; M199-M203 WeakPolarHBondContact O-CB 3.3Å; M199-M203 VanDerWaalsContact O-CG 3.27Å; M199-M203 WeakPolarHBondContact O-CG 3.46Å; M199-M203 PolarHBondContact O-N 3.43Å
200	E	95.1	Very high	95	Very high	134 Å²	134	101.8 Å²	101.8	63%	0.626	48%	0.482	S	S	*	.	H	α-helix	trans	-68	-37.4	176.3	-175.4	165	-147.6	0	0	111.9	R196 M197 S204	R196-E200 WeakPolarHBondContact O-CB 3.43Å; R196-E200 PolarHBondContact O-N 3.47Å; M197-E200 PolarHBondContact O-N 3.43Å; E200-S204 VanDerWaalsContact O-CB 3.27Å; E200-S204 WeakPolarHBondContact O-CB 3.39Å; E200-S204 PolarHBondContact O-N 2.91Å; E200-S204 PolarHBondContact O-OG 3.45Å
201	R	95.4	Very high	95	Very high	106 Å²	106	102.4 Å²	102.4	40%	0.4	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-55.5	169.6	-173.2	-172.9	73	78.8	7	110.6	M197 E198 M203 S204 E205	M197-R201 VanDerWaalsContact O-CB 3.31Å; M197-R201 WeakPolarHBondContact O-CB 3.41Å; M197-R201 PolarHBondContact O-N 2.95Å; E198-R201 PolarHBondContact O-N 2.63Å; E198-R201 IonicContact OE1-CZ 2.67Å; E198-R201 IonicContact OE1-NE 2.71Å; E198-R201 IonicContact OE1-NH2 3.67Å; E198-R201 PolarHBondContact OE1-NH2 2.91Å; E198-R201 IonicContact OE2-CZ 3.9Å; E198-R201 IonicContact OE2-NE 3.54Å; E198-R201 PolarHBondContact OE2-NE 3.24Å; E198-R201 IonicContact OE2-NH2 2.74Å; E198-R201 PolarHBondContact OE2-NH2 2.91Å; R201-M203 PolarHBondContact O-N 2.87Å; R201-S204 PolarHBondContact O-N 2.86Å; R201-E205 VanDerWaalsContact CG-OE1 3.31Å; R201-E205 WeakPolarHBondContact CG-OE1 3.35Å; R201-E205 IonicContact CZ-OE1 3.24Å; R201-E205 IonicContact CZ-OE2 3.22Å; R201-E205 IonicContact NH1-OE1 3.27Å; R201-E205 PolarHBondContact NH1-OE1 2.86Å; R201-E205 IonicContact NH1-OE2 3.83Å; R201-E205 PolarHBondContact NH1-OE2 3.47Å; R201-E205 PolarHBondContact O-N 2.66Å
202	Q	95.7	Very high	95.1	Very high	100 Å²	100	101.2 Å²	101.2	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-59.4	-41.9	179.5	-72	179.7	17.8	0	0	112.6	E198 M199 S204 E205 F206	E198-Q202 WeakPolarHBondContact O-CB 3.3Å; E198-Q202 VanDerWaalsContact O-CG 3.31Å; E198-Q202 WeakPolarHBondContact O-CG 3.3Å; E198-Q202 PolarHBondContact O-N 2.94Å; E198-Q202 PolarHBondContact OE1-NE2 3.46Å; M199-Q202 PolarHBondContact O-N 2.76Å; Q202-S204 VanDerWaalsContact C-N 3.29Å; Q202-S204 PolarHBondContact O-N 3.39Å; Q202-E205 PolarHBondContact O-N 3.25Å; Q202-F206 VanDerWaalsContact O-CB 3.26Å; Q202-F206 WeakPolarHBondContact O-CB 3.19Å; Q202-F206 PolarHBondContact O-N 2.95Å
203	M	94.8	Very high	95.2	Very high	108 Å²	108	100.7 Å²	100.7	53%	0.532	49%	0.485	S	S	.	.	H	α-helix	trans	-66.9	-29	175.5	-78.1	-65.4	-63.6	0	0	112.9	M199 R201 R207	M199-M203 VanDerWaalsContact O-CB 3.26Å; M199-M203 WeakPolarHBondContact O-CB 3.3Å; M199-M203 VanDerWaalsContact O-CG 3.27Å; M199-M203 WeakPolarHBondContact O-CG 3.46Å; M199-M203 PolarHBondContact O-N 3.43Å; R201-M203 PolarHBondContact O-N 2.87Å; M203-R207 WeakPolarHBondContact O-CB 3.23Å; M203-R207 VanDerWaalsContact O-CG 3.22Å; M203-R207 WeakPolarHBondContact O-CG 3.37Å; M203-R207 PolarHBondContact O-N 3.38Å; M203-R207 VanDerWaalsContact O-N 3.14Å; M203-R207 PolarHBondContact O-NE 2.93Å
204	S	94.5	Very high	95.2	Very high	50 Å²	50	104.5 Å²	104.5	35%	0.35	50%	0.499	S	S	.	.	H	α-helix	trans	-80.8	-39.2	177.1	-56.6	0	0	0	0	111.6	E200 R201 Q202 R207 Q208	E200-S204 VanDerWaalsContact O-CB 3.27Å; E200-S204 WeakPolarHBondContact O-CB 3.39Å; E200-S204 PolarHBondContact O-N 2.91Å; E200-S204 PolarHBondContact O-OG 3.45Å; R201-S204 PolarHBondContact O-N 2.86Å; Q202-S204 VanDerWaalsContact C-N 3.29Å; Q202-S204 PolarHBondContact O-N 3.39Å; S204-R207 PolarHBondContact O-N 2.97Å; S204-R207 PolarHBondContact OG-NH2 2.87Å; S204-Q208 WeakPolarHBondContact O-CB 3.31Å; S204-Q208 PolarHBondContact O-N 3.22Å
205	E	96	Very high	95.3	Very high	84 Å²	84	102.8 Å²	102.8	39%	0.393	50%	0.496	S	S	.	.	H	α-helix	trans	-64.3	-41.6	170.6	-74	170.9	-168.6	0	0	111.7	R201 Q202 Q208 N209	R201-E205 VanDerWaalsContact CG-OE1 3.31Å; R201-E205 WeakPolarHBondContact CG-OE1 3.35Å; R201-E205 IonicContact CZ-OE1 3.24Å; R201-E205 IonicContact CZ-OE2 3.22Å; R201-E205 IonicContact NH1-OE1 3.27Å; R201-E205 PolarHBondContact NH1-OE1 2.86Å; R201-E205 IonicContact NH1-OE2 3.83Å; R201-E205 PolarHBondContact NH1-OE2 3.47Å; R201-E205 PolarHBondContact O-N 2.66Å; Q202-E205 PolarHBondContact O-N 3.25Å; E205-Q208 PolarHBondContact O-N 2.88Å; E205-N209 VanDerWaalsContact O-CB 3.27Å; E205-N209 WeakPolarHBondContact O-CB 3.31Å; E205-N209 PolarHBondContact O-N 3.46Å; E205-N209 PolarHBondContact O-ND2 2.94Å
206	F	96.2	Very high	95.4	Very high	115 Å²	115	103.5 Å²	103.5	50%	0.504	50%	0.501	S	S	.	.	H	α-helix	trans	-60.1	-51.1	173.3	-178.4	-100.2	0	0	0	111.4	Q202 Q208 N209 E210	Q202-F206 VanDerWaalsContact O-CB 3.26Å; Q202-F206 WeakPolarHBondContact O-CB 3.19Å; Q202-F206 PolarHBondContact O-N 2.95Å; F206-Q208 VanDerWaalsContact C-N 3.31Å; F206-Q208 PolarHBondContact O-N 3.28Å; F206-N209 PolarHBondContact O-N 3.27Å; F206-E210 HydrophobicContact CD1-CG 4.07Å; F206-E210 HydrophobicContact CD2-CG 4.46Å; F206-E210 HydrophobicContact CE1-CG 3.62Å; F206-E210 HydrophobicContact CE2-CG 4.05Å; F206-E210 HydrophobicContact CG-CG 4.46Å; F206-E210 VanDerWaalsContact CZ-CD 3.45Å; F206-E210 HydrophobicContact CZ-CG 3.6Å; F206-E210 WeakPolarHBondContact CZ-OE1 3.41Å; F206-E210 WeakPolarHBondContact O-CB 3.39Å; F206-E210 VanDerWaalsContact O-CG 3.27Å; F206-E210 WeakPolarHBondContact O-CG 3.49Å; F206-E210 PolarHBondContact O-N 3.37Å
207	R	96.7	Very high	95.4	Very high	142 Å²	142	102.4 Å²	102.4	54%	0.536	50%	0.502	S	S	.	.	H	α-helix	trans	-60	-38.4	176.5	-75.1	175.9	-65.9	179.8	4.5	112.7	M203 S204 L211	M203-R207 WeakPolarHBondContact O-CB 3.23Å; M203-R207 VanDerWaalsContact O-CG 3.22Å; M203-R207 WeakPolarHBondContact O-CG 3.37Å; M203-R207 PolarHBondContact O-N 3.38Å; M203-R207 VanDerWaalsContact O-N 3.14Å; M203-R207 PolarHBondContact O-NE 2.93Å; S204-R207 PolarHBondContact O-N 2.97Å; S204-R207 PolarHBondContact OG-NH2 2.87Å; R207-L211 VanDerWaalsContact O-CB 3.27Å; R207-L211 WeakPolarHBondContact O-CB 3.47Å; R207-L211 PolarHBondContact O-N 3.11Å
208	Q	94.8	Very high	95.5	Very high	98 Å²	98	100.5 Å²	100.5	46%	0.458	49%	0.494	S	S	.	.	H	α-helix	trans	-71.1	-37.5	177.1	-171.3	61.2	58.8	0	0	111.8	S204 E205 F206 L211 N212	S204-Q208 WeakPolarHBondContact O-CB 3.31Å; S204-Q208 PolarHBondContact O-N 3.22Å; E205-Q208 PolarHBondContact O-N 2.88Å; F206-Q208 VanDerWaalsContact C-N 3.31Å; F206-Q208 PolarHBondContact O-N 3.28Å; Q208-L211 PolarHBondContact O-N 3.43Å; Q208-N212 PolarHBondContact NE2-OD1 2.68Å; Q208-N212 VanDerWaalsContact O-CB 3.25Å; Q208-N212 WeakPolarHBondContact O-CB 3.44Å; Q208-N212 PolarHBondContact O-N 2.8Å; Q208-N212 PolarHBondContact O-ND2 2.87Å; Q208-N212 PolarHBondContact O-OD1 2.69Å
209	N	95.4	Very high	95.6	Very high	102 Å²	102	101.7 Å²	101.7	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-69.4	-41.8	176.6	-71.9	-21.6	0	0	0	111.7	E205 F206 N212 S213	E205-N209 VanDerWaalsContact O-CB 3.27Å; E205-N209 WeakPolarHBondContact O-CB 3.31Å; E205-N209 PolarHBondContact O-N 3.46Å; E205-N209 PolarHBondContact O-ND2 2.94Å; F206-N209 PolarHBondContact O-N 3.27Å; N209-N212 PolarHBondContact O-N 2.99Å; N209-S213 VanDerWaalsContact O-CB 3.3Å; N209-S213 WeakPolarHBondContact O-CB 3.37Å; N209-S213 PolarHBondContact O-N 3.11Å
210	E	94.6	Very high	95.6	Very high	101 Å²	101	101.9 Å²	101.9	47%	0.472	50%	0.499	S	S	.	.	H	α-helix	trans	-59.1	-48.1	171.1	-69	-107.7	123.6	0	0	111	F206 N212 S213 L214	F206-E210 HydrophobicContact CD1-CG 4.07Å; F206-E210 HydrophobicContact CD2-CG 4.46Å; F206-E210 HydrophobicContact CE1-CG 3.62Å; F206-E210 HydrophobicContact CE2-CG 4.05Å; F206-E210 HydrophobicContact CG-CG 4.46Å; F206-E210 VanDerWaalsContact CZ-CD 3.45Å; F206-E210 HydrophobicContact CZ-CG 3.6Å; F206-E210 WeakPolarHBondContact CZ-OE1 3.41Å; F206-E210 WeakPolarHBondContact O-CB 3.39Å; F206-E210 VanDerWaalsContact O-CG 3.27Å; F206-E210 WeakPolarHBondContact O-CG 3.49Å; F206-E210 PolarHBondContact O-N 3.37Å; E210-N212 PolarHBondContact O-N 2.94Å; E210-S213 PolarHBondContact O-N 3.24Å; E210-L214 WeakPolarHBondContact O-CB 3.25Å; E210-L214 WeakPolarHBondContact O-CG 3.49Å; E210-L214 PolarHBondContact O-N 3.01Å
211	L	95.7	Very high	95.6	Very high	103 Å²	103	98 Å²	98	54%	0.539	48%	0.481	S	S	.	.	H	α-helix	trans	-65.2	-37.5	178.7	-175.1	144	0	0	0	112.4	R207 Q208 K215	R207-L211 VanDerWaalsContact O-CB 3.27Å; R207-L211 WeakPolarHBondContact O-CB 3.47Å; R207-L211 PolarHBondContact O-N 3.11Å; Q208-L211 PolarHBondContact O-N 3.43Å; L211-K215 VanDerWaalsContact O-CB 3.24Å; L211-K215 WeakPolarHBondContact O-CB 3.36Å; L211-K215 PolarHBondContact O-N 3.09Å
212	N	95.7	Very high	95.6	Very high	77 Å²	77	98.5 Å²	98.5	41%	0.412	49%	0.486	S	S	.	.	H	α-helix	trans	-66.2	-40.8	173	-71.3	-13.5	0	0	0	111.4	Q208 N209 E210 K215 S216	Q208-N212 PolarHBondContact NE2-OD1 2.68Å; Q208-N212 VanDerWaalsContact O-CB 3.25Å; Q208-N212 WeakPolarHBondContact O-CB 3.44Å; Q208-N212 PolarHBondContact O-N 2.8Å; Q208-N212 PolarHBondContact O-ND2 2.87Å; Q208-N212 PolarHBondContact O-OD1 2.69Å; N209-N212 PolarHBondContact O-N 2.99Å; E210-N212 PolarHBondContact O-N 2.94Å; N212-K215 PolarHBondContact O-N 3.47Å; N212-S216 WeakPolarHBondContact O-CB 3.46Å; N212-S216 PolarHBondContact O-N 2.8Å
213	S	95.5	Very high	95.6	Very high	74 Å²	74	99.3 Å²	99.3	52%	0.517	49%	0.49	S	S	.	.	H	α-helix	trans	-65.2	-50.5	177.9	-167.9	0	0	0	0	111.2	N209 E210 K215 S216 E217	N209-S213 VanDerWaalsContact O-CB 3.3Å; N209-S213 WeakPolarHBondContact O-CB 3.37Å; N209-S213 PolarHBondContact O-N 3.11Å; E210-S213 PolarHBondContact O-N 3.24Å; S213-K215 VanDerWaalsContact C-N 3.3Å; S213-K215 PolarHBondContact O-N 3.48Å; S213-S216 WeakPolarHBondContact O-CB 3.48Å; S213-S216 PolarHBondContact O-N 3.1Å; S213-S216 VanDerWaalsContact O-N 3.1Å; S213-E217 WeakPolarHBondContact O-CB 3.37Å; S213-E217 PolarHBondContact O-N 2.82Å
214	L	96.2	Very high	95.7	Very high	104 Å²	104	98.8 Å²	98.8	55%	0.545	49%	0.485	S	S	.	.	H	α-helix	trans	-61.3	-37.2	176.1	-71.7	169.6	0	0	0	112	E210 L218	E210-L214 WeakPolarHBondContact O-CB 3.25Å; E210-L214 WeakPolarHBondContact O-CG 3.49Å; E210-L214 PolarHBondContact O-N 3.01Å; L214-L218 WeakPolarHBondContact O-CB 3.43Å; L214-L218 PolarHBondContact O-N 3Å
215	K	96.5	Very high	95.8	Very high	127 Å²	127	102.3 Å²	102.3	55%	0.552	49%	0.491	S	S	*	.	H	α-helix	trans	-64.4	-44.6	172.6	-173	-169.6	171.3	-163.2	0	111.2	L211 N212 S213 L218 E219	L211-K215 VanDerWaalsContact O-CB 3.24Å; L211-K215 WeakPolarHBondContact O-CB 3.36Å; L211-K215 PolarHBondContact O-N 3.09Å; N212-K215 PolarHBondContact O-N 3.47Å; S213-K215 VanDerWaalsContact C-N 3.3Å; S213-K215 PolarHBondContact O-N 3.48Å; K215-L218 PolarHBondContact O-N 3.36Å; K215-E219 VanDerWaalsContact O-CB 3.28Å; K215-E219 WeakPolarHBondContact O-CB 3.48Å; K215-E219 PolarHBondContact O-N 3.23Å
216	S	94.3	Very high	95.8	Very high	75 Å²	75	103.5 Å²	103.5	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-64.4	-43.6	179.4	-166	0	0	0	0	112.1	N212 S213 E219 E220	N212-S216 WeakPolarHBondContact O-CB 3.46Å; N212-S216 PolarHBondContact O-N 2.8Å; S213-S216 WeakPolarHBondContact O-CB 3.48Å; S213-S216 PolarHBondContact O-N 3.1Å; S213-S216 VanDerWaalsContact O-N 3.1Å; S216-E219 PolarHBondContact O-N 2.92Å; S216-E220 WeakPolarHBondContact O-CB 3.19Å; S216-E220 PolarHBondContact O-N 3.46Å
217	E	96.7	Very high	95.8	Very high	120 Å²	120	102.9 Å²	102.9	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-62.8	-44	176	-177.4	-179.5	-172.4	0	0	111.4	S213 E220 E221	S213-E217 WeakPolarHBondContact O-CB 3.37Å; S213-E217 PolarHBondContact O-N 2.82Å; E217-E220 PolarHBondContact O-N 2.96Å; E217-E221 WeakPolarHBondContact O-CB 3.3Å; E217-E221 PolarHBondContact O-N 3.45Å
218	L	96.3	Very high	95.9	Very high	97 Å²	97	100.6 Å²	100.6	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-64.6	-39.9	176	-177.2	62.2	0	0	0	112	L214 K215 F222	L214-L218 WeakPolarHBondContact O-CB 3.43Å; L214-L218 PolarHBondContact O-N 3Å; K215-L218 PolarHBondContact O-N 3.36Å; L218-F222 HydrophobicContact CD1-CD2 3.92Å; L218-F222 HydrophobicContact CD1-CE2 3.58Å; L218-F222 HydrophobicContact CD1-CZ 4.46Å; L218-F222 HydrophobicContact CD2-CE2 4.28Å; L218-F222 HydrophobicContact CG-CD2 3.87Å; L218-F222 HydrophobicContact CG-CE2 3.75Å; L218-F222 WeakPolarHBondContact O-CB 3.42Å; L218-F222 WeakPolarHBondContact O-CD2 3.48Å; L218-F222 PolarHBondContact O-N 3.37Å
219	E	96.3	Very high	95.9	Very high	95 Å²	95	99.7 Å²	99.7	44%	0.444	49%	0.494	S	S	.	.	H	α-helix	trans	-69.6	-39.5	177.9	-164.6	167.2	158.5	0	0	111.5	K215 S216 F222 Q223	K215-E219 VanDerWaalsContact O-CB 3.28Å; K215-E219 WeakPolarHBondContact O-CB 3.48Å; K215-E219 PolarHBondContact O-N 3.23Å; S216-E219 PolarHBondContact O-N 2.92Å; E219-F222 PolarHBondContact O-N 2.93Å; E219-Q223 WeakPolarHBondContact O-CB 3.34Å; E219-Q223 VanDerWaalsContact O-CG 3.28Å; E219-Q223 WeakPolarHBondContact O-CG 3.42Å; E219-Q223 PolarHBondContact O-N 3.21Å
220	E	95.8	Very high	95.9	Very high	127 Å²	127	98.9 Å²	98.9	59%	0.593	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-47	171.7	-171.8	-178.1	158.1	0	0	111.6	S216 E217 F222 Q223 K224	S216-E220 WeakPolarHBondContact O-CB 3.19Å; S216-E220 PolarHBondContact O-N 3.46Å; E217-E220 PolarHBondContact O-N 2.96Å; E220-F222 VanDerWaalsContact C-N 3.33Å; E220-F222 PolarHBondContact O-N 3.27Å; E220-Q223 PolarHBondContact O-N 3.48Å; E220-K224 WeakPolarHBondContact O-CB 3.41Å; E220-K224 PolarHBondContact O-N 3.05Å
221	E	95.5	Very high	96	Very high	54 Å²	54	98.4 Å²	98.4	25%	0.252	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-37.3	175.5	-93.8	-71.4	127.2	0	0	112.5	E217 K224 R225	E217-E221 WeakPolarHBondContact O-CB 3.3Å; E217-E221 PolarHBondContact O-N 3.45Å; E221-K224 WeakPolarHBondContact OE1-CD 3.41Å; E221-K224 WeakPolarHBondContact OE1-CE 3.2Å; E221-K224 IonicContact OE1-NZ 2.67Å; E221-K224 PolarHBondContact OE1-NZ 3.15Å; E221-R225 WeakPolarHBondContact O-CB 3.4Å; E221-R225 WeakPolarHBondContact O-CD 3.36Å; E221-R225 WeakPolarHBondContact O-CG 3.49Å; E221-R225 PolarHBondContact O-N 2.81Å; E221-R225 IonicContact OE2-CZ 3.37Å; E221-R225 VanDerWaalsContact OE2-CZ 3.23Å; E221-R225 IonicContact OE2-NE 2.62Å; E221-R225 PolarHBondContact OE2-NE 2.72Å; E221-R225 IonicContact OE2-NH2 2.79Å; E221-R225 PolarHBondContact OE2-NH2 3.03Å
222	F	94.4	Very high	96.1	Very high	115 Å²	115	100 Å²	100	50%	0.504	49%	0.489	S	S	.	.	H	α-helix	trans	-66.7	-45.3	172.6	-87.1	-60.2	0	0	0	112.3	L218 E219 E220 K224 R225 L226	L218-F222 HydrophobicContact CD1-CD2 3.92Å; L218-F222 HydrophobicContact CD1-CE2 3.58Å; L218-F222 HydrophobicContact CD1-CZ 4.46Å; L218-F222 HydrophobicContact CD2-CE2 4.28Å; L218-F222 HydrophobicContact CG-CD2 3.87Å; L218-F222 HydrophobicContact CG-CE2 3.75Å; L218-F222 WeakPolarHBondContact O-CB 3.42Å; L218-F222 WeakPolarHBondContact O-CD2 3.48Å; L218-F222 PolarHBondContact O-N 3.37Å; E219-F222 PolarHBondContact O-N 2.93Å; E220-F222 VanDerWaalsContact C-N 3.33Å; E220-F222 PolarHBondContact O-N 3.27Å; F222-K224 VanDerWaalsContact C-N 3.33Å; F222-K224 PolarHBondContact O-N 2.88Å; F222-R225 PolarHBondContact O-N 3.46Å; F222-L226 WeakPolarHBondContact O-CB 3.45Å; F222-L226 VanDerWaalsContact O-CG 3.3Å; F222-L226 WeakPolarHBondContact O-CG 3.47Å; F222-L226 PolarHBondContact O-N 2.82Å
223	Q	96.1	Very high	96.2	Very high	118 Å²	118	100.5 Å²	100.5	55%	0.551	49%	0.492	S	S	*	.	H	α-helix	trans	-60.8	-42.8	176.6	-72.9	177.7	25.5	0	0	111.5	E219 E220 L226 L227	E219-Q223 WeakPolarHBondContact O-CB 3.34Å; E219-Q223 VanDerWaalsContact O-CG 3.28Å; E219-Q223 WeakPolarHBondContact O-CG 3.42Å; E219-Q223 PolarHBondContact O-N 3.21Å; E220-Q223 PolarHBondContact O-N 3.48Å; Q223-L226 PolarHBondContact O-N 2.88Å; Q223-L227 WeakPolarHBondContact O-CB 3.49Å; Q223-L227 PolarHBondContact O-N 3.43Å
224	K	97.3	Very high	96.2	Very high	97 Å²	97	103 Å²	103	42%	0.422	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-42.6	176.2	179.7	175.8	166.8	-163.5	0	112.5	E220 E221 F222 L227 Q228	E220-K224 WeakPolarHBondContact O-CB 3.41Å; E220-K224 PolarHBondContact O-N 3.05Å; E221-K224 WeakPolarHBondContact OE1-CD 3.41Å; E221-K224 WeakPolarHBondContact OE1-CE 3.2Å; E221-K224 IonicContact OE1-NZ 2.67Å; E221-K224 PolarHBondContact OE1-NZ 3.15Å; F222-K224 VanDerWaalsContact C-N 3.33Å; F222-K224 PolarHBondContact O-N 2.88Å; K224-L227 PolarHBondContact O-N 2.86Å; K224-Q228 WeakPolarHBondContact O-CB 3.31Å; K224-Q228 VanDerWaalsContact O-CG 3.31Å; K224-Q228 WeakPolarHBondContact O-CG 3.26Å; K224-Q228 PolarHBondContact O-N 3.39Å
225	R	96.5	Very high	96.3	Very high	124 Å²	124	103.7 Å²	103.7	47%	0.468	50%	0.496	S	S	.	.	H	α-helix	trans	-68.3	-37.3	173.5	-70.1	168.6	-160.2	-172.6	7.4	112.4	E221 F222 Q228 N229	E221-R225 WeakPolarHBondContact O-CB 3.4Å; E221-R225 WeakPolarHBondContact O-CD 3.36Å; E221-R225 WeakPolarHBondContact O-CG 3.49Å; E221-R225 PolarHBondContact O-N 2.81Å; E221-R225 IonicContact OE2-CZ 3.37Å; E221-R225 VanDerWaalsContact OE2-CZ 3.23Å; E221-R225 IonicContact OE2-NE 2.62Å; E221-R225 PolarHBondContact OE2-NE 2.72Å; E221-R225 IonicContact OE2-NH2 2.79Å; E221-R225 PolarHBondContact OE2-NH2 3.03Å; F222-R225 PolarHBondContact O-N 3.46Å; R225-Q228 PolarHBondContact O-N 3.4Å; R225-N229 WeakPolarHBondContact O-CB 3.15Å; R225-N229 PolarHBondContact O-N 2.95Å; R225-N229 PolarHBondContact O-ND2 2.81Å; R225-N229 PolarHBondContact O-OD1 3Å
226	L	95.5	Very high	96.3	Very high	108 Å²	108	103.5 Å²	103.5	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-64.3	-41.6	173.4	-75.6	167.9	0	0	0	111.5	F222 Q223 N229 T230	F222-L226 WeakPolarHBondContact O-CB 3.45Å; F222-L226 VanDerWaalsContact O-CG 3.3Å; F222-L226 WeakPolarHBondContact O-CG 3.47Å; F222-L226 PolarHBondContact O-N 2.82Å; Q223-L226 PolarHBondContact O-N 2.88Å; L226-N229 PolarHBondContact O-N 3Å; L226-T230 WeakPolarHBondContact O-CB 3.38Å; L226-T230 PolarHBondContact O-N 3.32Å; L226-T230 PolarHBondContact O-OG1 3.15Å
227	L	97	Very high	96.4	Very high	102 Å²	102	105.5 Å²	105.5	53%	0.534	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-48.2	174.5	-174.6	64.5	0	0	0	111.2	Q223 K224 N229 T230 Q231	Q223-L227 WeakPolarHBondContact O-CB 3.49Å; Q223-L227 PolarHBondContact O-N 3.43Å; K224-L227 PolarHBondContact O-N 2.86Å; L227-N229 VanDerWaalsContact C-N 3.32Å; L227-N229 PolarHBondContact O-N 2.95Å; L227-T230 WeakPolarHBondContact O-CB 3.41Å; L227-T230 PolarHBondContact O-N 3.35Å; L227-T230 VanDerWaalsContact O-N 3.13Å; L227-Q231 WeakPolarHBondContact O-CB 3.32Å; L227-Q231 WeakPolarHBondContact O-CG 3.36Å; L227-Q231 PolarHBondContact O-N 2.94Å
228	Q	97	Very high	96.4	Very high	95 Å²	95	105 Å²	105	44%	0.444	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-35.9	176.1	-74.1	174.9	-12	0	0	113.1	K224 R225 R232	K224-Q228 WeakPolarHBondContact O-CB 3.31Å; K224-Q228 VanDerWaalsContact O-CG 3.31Å; K224-Q228 WeakPolarHBondContact O-CG 3.26Å; K224-Q228 PolarHBondContact O-N 3.39Å; R225-Q228 PolarHBondContact O-N 3.4Å; Q228-R232 WeakPolarHBondContact O-CB 3.31Å; Q228-R232 WeakPolarHBondContact O-CG 3.4Å; Q228-R232 PolarHBondContact O-N 2.98Å
229	N	95.3	Very high	96.5	Very high	78 Å²	78	105.7 Å²	105.7	42%	0.417	50%	0.497	S	S	.	.	H	α-helix	trans	-69	-38.6	173.7	-72.6	-8.4	0	0	0	111.5	R225 L226 L227 R232 L233	R225-N229 WeakPolarHBondContact O-CB 3.15Å; R225-N229 PolarHBondContact O-N 2.95Å; R225-N229 PolarHBondContact O-ND2 2.81Å; R225-N229 PolarHBondContact O-OD1 3Å; L226-N229 PolarHBondContact O-N 3Å; L227-N229 VanDerWaalsContact C-N 3.32Å; L227-N229 PolarHBondContact O-N 2.95Å; N229-R232 PolarHBondContact OD1-NH2 2.7Å; N229-L233 VanDerWaalsContact O-CB 3.24Å; N229-L233 WeakPolarHBondContact O-CB 3.4Å; N229-L233 PolarHBondContact O-N 2.6Å
230	T	96.6	Very high	96.5	Very high	85 Å²	85	109.4 Å²	109.4	52%	0.521	51%	0.507	S	S	.	.	H	α-helix	trans	-67.2	-42.7	177.4	-54.3	0	0	0	0	111.1	L226 L227 L233 Q234	L226-T230 WeakPolarHBondContact O-CB 3.38Å; L226-T230 PolarHBondContact O-N 3.32Å; L226-T230 PolarHBondContact O-OG1 3.15Å; L227-T230 WeakPolarHBondContact O-CB 3.41Å; L227-T230 PolarHBondContact O-N 3.35Å; L227-T230 VanDerWaalsContact O-N 3.13Å; T230-L233 PolarHBondContact O-N 3.02Å; T230-Q234 WeakPolarHBondContact O-CB 3.27Å; T230-Q234 PolarHBondContact O-N 3.16Å
231	Q	96.8	Very high	96.5	Very high	91 Å²	91	107 Å²	107	43%	0.425	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-52.4	175.1	-74.8	171.6	-28.6	0	0	111.7	L227 L233 Q234 E235	L227-Q231 WeakPolarHBondContact O-CB 3.32Å; L227-Q231 WeakPolarHBondContact O-CG 3.36Å; L227-Q231 PolarHBondContact O-N 2.94Å; Q231-L233 VanDerWaalsContact C-N 3.33Å; Q231-L233 PolarHBondContact O-N 2.95Å; Q231-Q234 WeakPolarHBondContact O-CB 3.43Å; Q231-Q234 PolarHBondContact O-N 3Å; Q231-Q234 VanDerWaalsContact O-N 3.1Å; Q231-E235 WeakPolarHBondContact O-CG 3.18Å; Q231-E235 PolarHBondContact O-N 2.99Å
232	R	97	Very high	96.5	Very high	136 Å²	136	108.7 Å²	108.7	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-60.1	-40.9	177.3	-72	-172.7	-63	146.4	-4.6	112.8	Q228 N229 Q234 E235 E236	Q228-R232 WeakPolarHBondContact O-CB 3.31Å; Q228-R232 WeakPolarHBondContact O-CG 3.4Å; Q228-R232 PolarHBondContact O-N 2.98Å; N229-R232 PolarHBondContact OD1-NH2 2.7Å; R232-Q234 VanDerWaalsContact C-N 3.32Å; R232-Q234 PolarHBondContact O-N 3.37Å; R232-E235 PolarHBondContact O-N 3.47Å; R232-E236 WeakPolarHBondContact O-CB 3.28Å; R232-E236 WeakPolarHBondContact O-CG 3.48Å; R232-E236 PolarHBondContact O-N 3.48Å
233	L	97	Very high	96.7	Very high	88 Å²	88	106.5 Å²	106.5	46%	0.461	51%	0.511	S	S	.	.	H	α-helix	trans	-65	-36.7	176.1	-177.3	61.3	0	0	0	111.9	N229 T230 Q231 F237	N229-L233 VanDerWaalsContact O-CB 3.24Å; N229-L233 WeakPolarHBondContact O-CB 3.4Å; N229-L233 PolarHBondContact O-N 2.6Å; T230-L233 PolarHBondContact O-N 3.02Å; Q231-L233 VanDerWaalsContact C-N 3.33Å; Q231-L233 PolarHBondContact O-N 2.95Å; L233-F237 HydrophobicContact CD1-CD2 3.99Å; L233-F237 HydrophobicContact CD1-CE2 3.62Å; L233-F237 HydrophobicContact CD1-CZ 4.34Å; L233-F237 HydrophobicContact CD2-CE2 4.18Å; L233-F237 HydrophobicContact CG-CD2 3.88Å; L233-F237 HydrophobicContact CG-CE2 3.67Å; L233-F237 WeakPolarHBondContact O-CB 3.44Å; L233-F237 WeakPolarHBondContact O-CD2 3.49Å; L233-F237 PolarHBondContact O-N 2.78Å
234	Q	97	Very high	96.7	Very high	127 Å²	127	105.5 Å²	105.5	59%	0.593	51%	0.509	S	S	*	.	H	α-helix	trans	-66.6	-43.3	173.6	-178.6	177.6	-23.5	0	0	111.8	T230 Q231 R232 F237 E238	T230-Q234 WeakPolarHBondContact O-CB 3.27Å; T230-Q234 PolarHBondContact O-N 3.16Å; Q231-Q234 WeakPolarHBondContact O-CB 3.43Å; Q231-Q234 PolarHBondContact O-N 3Å; Q231-Q234 VanDerWaalsContact O-N 3.1Å; R232-Q234 VanDerWaalsContact C-N 3.32Å; R232-Q234 PolarHBondContact O-N 3.37Å; Q234-F237 PolarHBondContact O-N 2.93Å; Q234-E238 WeakPolarHBondContact O-CB 3.48Å; Q234-E238 PolarHBondContact O-N 3.17Å
235	E	97	Very high	96.7	Very high	119 Å²	119	105.5 Å²	105.5	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-61.5	-44.7	174.6	-69.6	165.7	178.9	0	0	111.6	Q231 R232 E238 L239	Q231-E235 WeakPolarHBondContact O-CG 3.18Å; Q231-E235 PolarHBondContact O-N 2.99Å; R232-E235 PolarHBondContact O-N 3.47Å; E235-E238 PolarHBondContact O-N 3.45Å; E235-L239 WeakPolarHBondContact O-CB 3.45Å; E235-L239 WeakPolarHBondContact O-CG 3.4Å; E235-L239 PolarHBondContact O-N 2.83Å
236	E	96.4	Very high	96.7	Very high	123 Å²	123	105.5 Å²	105.5	58%	0.575	52%	0.518	S	S	*	.	H	α-helix	trans	-61.8	-41.6	174.4	-76.1	175.3	-160.1	0	0	112.2	R232 R240	R232-E236 WeakPolarHBondContact O-CB 3.28Å; R232-E236 WeakPolarHBondContact O-CG 3.48Å; R232-E236 PolarHBondContact O-N 3.48Å; E236-R240 VanDerWaalsContact O-CB 3.25Å; E236-R240 WeakPolarHBondContact O-CB 3.41Å; E236-R240 PolarHBondContact O-N 3.11Å
237	F	96.6	Very high	96.8	Very high	117 Å²	117	105.7 Å²	105.7	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-41.8	173.6	-85.1	-57	0	0	0	112.1	L233 Q234 R240 C241	L233-F237 HydrophobicContact CD1-CD2 3.99Å; L233-F237 HydrophobicContact CD1-CE2 3.62Å; L233-F237 HydrophobicContact CD1-CZ 4.34Å; L233-F237 HydrophobicContact CD2-CE2 4.18Å; L233-F237 HydrophobicContact CG-CD2 3.88Å; L233-F237 HydrophobicContact CG-CE2 3.67Å; L233-F237 WeakPolarHBondContact O-CB 3.44Å; L233-F237 WeakPolarHBondContact O-CD2 3.49Å; L233-F237 PolarHBondContact O-N 2.78Å; Q234-F237 PolarHBondContact O-N 2.93Å; F237-R240 PolarHBondContact O-N 3.23Å; F237-C241 WeakPolarHBondContact O-CB 3.49Å; F237-C241 PolarHBondContact O-N 3.27Å; F237-C241 PolarHBondContact O-SG 3.19Å; F237-C241 VanDerWaalsContact O-SG 3.32Å
238	E	97.4	Very high	96.8	Very high	109 Å²	109	105.2 Å²	105.2	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-47.8	179.9	-164.1	-178.4	149.3	0	0	111.4	Q234 E235 R240 C241 Q242	Q234-E238 WeakPolarHBondContact O-CB 3.48Å; Q234-E238 PolarHBondContact O-N 3.17Å; E235-E238 PolarHBondContact O-N 3.45Å; E238-R240 VanDerWaalsContact C-N 3.27Å; E238-R240 PolarHBondContact O-N 3.39Å; E238-C241 WeakPolarHBondContact O-CB 3.22Å; E238-C241 PolarHBondContact O-N 2.85Å; E238-C241 VanDerWaalsContact O-N 3.09Å; E238-Q242 WeakPolarHBondContact O-CG 3.39Å; E238-Q242 PolarHBondContact O-N 2.87Å; E238-Q242 PolarHBondContact OE1-NE2 2.76Å
239	L	97.4	Very high	96.8	Very high	111 Å²	111	104.4 Å²	104.4	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-57.7	-39.8	174.2	-71.9	169.8	0	0	0	111.9	E235 Q242 S243	E235-L239 WeakPolarHBondContact O-CB 3.45Å; E235-L239 WeakPolarHBondContact O-CG 3.4Å; E235-L239 PolarHBondContact O-N 2.83Å; L239-Q242 PolarHBondContact O-N 3.2Å; L239-S243 WeakPolarHBondContact O-CB 3.11Å; L239-S243 PolarHBondContact O-N 2.81Å
240	R	97.1	Very high	96.9	Very high	173 Å²	173	105.9 Å²	105.9	65%	0.653	52%	0.52	S	S	*	.	H	α-helix	trans	-67.2	-37.9	175.6	-172.2	173.6	-176.3	167.6	2.3	112.3	E236 F237 E238 L244	E236-R240 VanDerWaalsContact O-CB 3.25Å; E236-R240 WeakPolarHBondContact O-CB 3.41Å; E236-R240 PolarHBondContact O-N 3.11Å; F237-R240 PolarHBondContact O-N 3.23Å; E238-R240 VanDerWaalsContact C-N 3.27Å; E238-R240 PolarHBondContact O-N 3.39Å; R240-L244 HydrophobicContact CG-CD1 4.31Å; R240-L244 WeakPolarHBondContact O-CB 3.41Å; R240-L244 VanDerWaalsContact O-CG 3.29Å; R240-L244 WeakPolarHBondContact O-CG 3.26Å; R240-L244 PolarHBondContact O-N 3.04Å
241	C	94.9	Very high	96.9	Very high	78 Å²	78	106.6 Å²	106.6	53%	0.527	52%	0.52	S	S	.	.	H	α-helix	trans	-67.5	-41.6	173.7	-74.4	0	0	0	0	112	F237 E238 L244 N245	F237-C241 WeakPolarHBondContact O-CB 3.49Å; F237-C241 PolarHBondContact O-N 3.27Å; F237-C241 PolarHBondContact O-SG 3.19Å; F237-C241 VanDerWaalsContact O-SG 3.32Å; E238-C241 WeakPolarHBondContact O-CB 3.22Å; E238-C241 PolarHBondContact O-N 2.85Å; E238-C241 VanDerWaalsContact O-N 3.09Å; C241-L244 PolarHBondContact O-N 3.39Å; C241-N245 VanDerWaalsContact O-CB 3.31Å; C241-N245 WeakPolarHBondContact O-CB 3.43Å; C241-N245 PolarHBondContact O-N 3.03Å
242	Q	97	Very high	96.9	Very high	89 Å²	89	109.5 Å²	109.5	42%	0.416	53%	0.527	S	S	.	.	H	α-helix	trans	-60.2	-50	174.8	-69.7	173.9	12.7	0	0	110.7	E238 L239 L244 N245 E246	E238-Q242 WeakPolarHBondContact O-CG 3.39Å; E238-Q242 PolarHBondContact O-N 2.87Å; E238-Q242 PolarHBondContact OE1-NE2 2.76Å; L239-Q242 PolarHBondContact O-N 3.2Å; Q242-L244 PolarHBondContact O-N 3.38Å; Q242-N245 WeakPolarHBondContact O-CB 3.46Å; Q242-N245 PolarHBondContact O-N 3.02Å; Q242-N245 VanDerWaalsContact O-N 3.16Å; Q242-E246 WeakPolarHBondContact O-CG 3.44Å; Q242-E246 PolarHBondContact O-N 2.95Å
243	S	97.2	Very high	96.9	Very high	68 Å²	68	108.1 Å²	108.1	48%	0.476	53%	0.527	S	S	.	.	H	α-helix	trans	-62	-39.8	178.2	-177.3	0	0	0	0	113.4	L239 E246 Q247	L239-S243 WeakPolarHBondContact O-CB 3.11Å; L239-S243 PolarHBondContact O-N 2.81Å; S243-E246 PolarHBondContact O-N 2.92Å; S243-Q247 PolarHBondContact O-N 3.4Å
244	L	96.8	Very high	96.9	Very high	98 Å²	98	111.2 Å²	111.2	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-66.1	-38.8	173.9	-75.4	170.2	0	0	0	112.2	R240 C241 Q242 Q247 E248	R240-L244 HydrophobicContact CG-CD1 4.31Å; R240-L244 WeakPolarHBondContact O-CB 3.41Å; R240-L244 VanDerWaalsContact O-CG 3.29Å; R240-L244 WeakPolarHBondContact O-CG 3.26Å; R240-L244 PolarHBondContact O-N 3.04Å; C241-L244 PolarHBondContact O-N 3.39Å; Q242-L244 PolarHBondContact O-N 3.38Å; L244-Q247 PolarHBondContact O-N 2.62Å; L244-E248 WeakPolarHBondContact O-CB 3.42Å; L244-E248 PolarHBondContact O-N 3.42Å
245	N	97.3	Very high	97	Very high	97 Å²	97	112.3 Å²	112.3	52%	0.519	54%	0.536	S	S	.	.	H	α-helix	trans	-67.3	-40.2	176.1	176.5	79.5	0	0	0	111.9	C241 Q242 E248 V249	C241-N245 VanDerWaalsContact O-CB 3.31Å; C241-N245 WeakPolarHBondContact O-CB 3.43Å; C241-N245 PolarHBondContact O-N 3.03Å; Q242-N245 WeakPolarHBondContact O-CB 3.46Å; Q242-N245 PolarHBondContact O-N 3.02Å; Q242-N245 VanDerWaalsContact O-N 3.16Å; N245-E248 PolarHBondContact O-N 3.31Å; N245-V249 WeakPolarHBondContact O-CG2 3.38Å; N245-V249 PolarHBondContact O-N 3.49Å
246	E	96.7	Very high	97	Very high	123 Å²	123	110.5 Å²	110.5	58%	0.575	53%	0.531	S	S	*	.	H	α-helix	trans	-59.7	-45.7	171.1	-72.4	177.7	168.1	0	0	111.6	Q242 S243 E248 V249 L250	Q242-E246 WeakPolarHBondContact O-CG 3.44Å; Q242-E246 PolarHBondContact O-N 2.95Å; S243-E246 PolarHBondContact O-N 2.92Å; E246-E248 VanDerWaalsContact C-N 3.32Å; E246-E248 PolarHBondContact O-N 3.02Å; E246-V249 PolarHBondContact O-N 2.8Å; E246-L250 WeakPolarHBondContact O-CG 3.48Å; E246-L250 PolarHBondContact O-N 3.29Å
247	Q	96.8	Very high	97	Very high	112 Å²	112	109.1 Å²	109.1	52%	0.523	53%	0.527	S	S	.	.	H	α-helix	trans	-61.7	-39.4	175.2	-174.3	179.2	-7.1	0	0	111.9	S243 L244 L250 L251	S243-Q247 PolarHBondContact O-N 3.4Å; L244-Q247 PolarHBondContact O-N 2.62Å; Q247-L250 PolarHBondContact O-N 2.79Å; Q247-L251 HydrophobicContact CG-CD1 4.23Å; Q247-L251 WeakPolarHBondContact O-CB 3.48Å; Q247-L251 VanDerWaalsContact O-CG 3.28Å; Q247-L251 WeakPolarHBondContact O-CG 3.45Å; Q247-L251 PolarHBondContact O-N 2.9Å
248	E	96.8	Very high	97	Very high	93 Å²	93	109.5 Å²	109.5	44%	0.435	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-42.7	176	-163	-171.9	140.7	0	0	111.8	L244 N245 E246 L251 R252	L244-E248 WeakPolarHBondContact O-CB 3.42Å; L244-E248 PolarHBondContact O-N 3.42Å; N245-E248 PolarHBondContact O-N 3.31Å; E246-E248 VanDerWaalsContact C-N 3.32Å; E246-E248 PolarHBondContact O-N 3.02Å; E248-L251 PolarHBondContact O-N 3.38Å; E248-R252 WeakPolarHBondContact O-CB 3.42Å; E248-R252 VanDerWaalsContact O-CG 3.27Å; E248-R252 WeakPolarHBondContact O-CG 3.22Å; E248-R252 PolarHBondContact O-N 2.78Å; E248-R252 IonicContact OE1-CZ 3.87Å; E248-R252 IonicContact OE1-NE 2.66Å; E248-R252 PolarHBondContact OE1-NE 2.84Å; E248-R252 IonicContact OE1-NH2 3.44Å; E248-R252 PolarHBondContact OE1-NH2 3.03Å
249	V	97.7	Very high	97	Very high	78 Å²	78	107.8 Å²	107.8	47%	0.473	52%	0.52	S	S	.	.	H	α-helix	trans	-60.5	-45.6	175	168.6	0	0	0	0	111	N245 E246 L251 R252 E253	N245-V249 WeakPolarHBondContact O-CG2 3.38Å; N245-V249 PolarHBondContact O-N 3.49Å; E246-V249 PolarHBondContact O-N 2.8Å; V249-L251 VanDerWaalsContact C-N 3.34Å; V249-L251 PolarHBondContact O-N 3.23Å; V249-R252 PolarHBondContact O-N 3.13Å; V249-E253 WeakPolarHBondContact O-CB 3.44Å; V249-E253 PolarHBondContact O-N 3.32Å
250	L	97.5	Very high	97	Very high	109 Å²	109	106.2 Å²	106.2	57%	0.571	51%	0.51	S	S	*	.	H	α-helix	trans	-63.4	-37	176.4	-71.3	169.6	0	0	0	112.6	E246 Q247 K254	E246-L250 WeakPolarHBondContact O-CG 3.48Å; E246-L250 PolarHBondContact O-N 3.29Å; Q247-L250 PolarHBondContact O-N 2.79Å; L250-K254 VanDerWaalsContact O-CB 3.27Å; L250-K254 WeakPolarHBondContact O-CB 3.36Å; L250-K254 PolarHBondContact O-N 3.34Å
251	L	96.6	Very high	97	Very high	100 Å²	100	103.5 Å²	103.5	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-68.6	-40.8	174.5	-74.2	169	0	0	0	112	Q247 E248 V249 K254 Y255	Q247-L251 HydrophobicContact CG-CD1 4.23Å; Q247-L251 WeakPolarHBondContact O-CB 3.48Å; Q247-L251 VanDerWaalsContact O-CG 3.28Å; Q247-L251 WeakPolarHBondContact O-CG 3.45Å; Q247-L251 PolarHBondContact O-N 2.9Å; E248-L251 PolarHBondContact O-N 3.38Å; V249-L251 VanDerWaalsContact C-N 3.34Å; V249-L251 PolarHBondContact O-N 3.23Å; L251-K254 PolarHBondContact O-N 3.12Å; L251-Y255 WeakPolarHBondContact O-CB 3.46Å; L251-Y255 PolarHBondContact O-N 2.93Å
252	R	97.3	Very high	97	Very high	151 Å²	151	104.7 Å²	104.7	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-44.1	174.2	-73.4	167.7	175	-102.1	7.6	111.7	E248 V249 Y255 N256	E248-R252 WeakPolarHBondContact O-CB 3.42Å; E248-R252 VanDerWaalsContact O-CG 3.27Å; E248-R252 WeakPolarHBondContact O-CG 3.22Å; E248-R252 PolarHBondContact O-N 2.78Å; E248-R252 IonicContact OE1-CZ 3.87Å; E248-R252 IonicContact OE1-NE 2.66Å; E248-R252 PolarHBondContact OE1-NE 2.84Å; E248-R252 IonicContact OE1-NH2 3.44Å; E248-R252 PolarHBondContact OE1-NH2 3.03Å; V249-R252 PolarHBondContact O-N 3.13Å; R252-Y255 PolarHBondContact O-N 2.9Å; R252-N256 WeakPolarHBondContact O-CB 3.35Å; R252-N256 PolarHBondContact O-N 2.95Å; R252-N256 PolarHBondContact O-ND2 2.77Å; R252-N256 PolarHBondContact O-OD1 2.95Å
253	E	97	Very high	97	Very high	107 Å²	107	105.2 Å²	105.2	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-46.9	175.6	-175.4	177.1	-160.5	0	0	111.2	V249 Y255 N256 L257	V249-E253 WeakPolarHBondContact O-CB 3.44Å; V249-E253 PolarHBondContact O-N 3.32Å; E253-Y255 VanDerWaalsContact C-N 3.3Å; E253-Y255 PolarHBondContact O-N 3.01Å; E253-N256 PolarHBondContact O-N 3.49Å; E253-L257 HydrophobicContact CG-CD1 4.05Å; E253-L257 HydrophobicContact CG-CG 4.42Å; E253-L257 WeakPolarHBondContact O-CB 3.27Å; E253-L257 WeakPolarHBondContact O-CG 3.29Å; E253-L257 PolarHBondContact O-N 3.48Å
254	K	97.2	Very high	97	Very high	153 Å²	153	108.9 Å²	108.9	67%	0.665	51%	0.507	S	S	*	.	H	α-helix	trans	-59.1	-39.3	175.8	-175.8	178.7	178.7	-178.9	0	112.5	L250 L251 F258	L250-K254 VanDerWaalsContact O-CB 3.27Å; L250-K254 WeakPolarHBondContact O-CB 3.36Å; L250-K254 PolarHBondContact O-N 3.34Å; L251-K254 PolarHBondContact O-N 3.12Å; K254-F258 WeakPolarHBondContact O-CB 3.43Å; K254-F258 PolarHBondContact O-N 3.42Å
255	Y	97.3	Very high	97	Very high	151 Å²	151	107.5 Å²	107.5	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-64.6	-48.1	173.9	179.3	-95.4	0	0	0	111.7	L251 R252 E253 L257 F258 Q259	L251-Y255 WeakPolarHBondContact O-CB 3.46Å; L251-Y255 PolarHBondContact O-N 2.93Å; R252-Y255 PolarHBondContact O-N 2.9Å; E253-Y255 VanDerWaalsContact C-N 3.3Å; E253-Y255 PolarHBondContact O-N 3.01Å; Y255-L257 VanDerWaalsContact C-N 3.32Å; Y255-L257 PolarHBondContact O-N 3.41Å; Y255-F258 WeakPolarHBondContact O-CB 3.35Å; Y255-F258 PolarHBondContact O-N 3.42Å; Y255-F258 VanDerWaalsContact O-N 3.14Å; Y255-Q259 PolarHBondContact O-N 3.47Å
256	N	97.4	Very high	96.9	Very high	81 Å²	81	104.3 Å²	104.3	43%	0.433	48%	0.483	S	S	.	.	H	α-helix	trans	-60.5	-40.1	177.7	-67.1	-17.4	0	0	0	112.1	R252 E253 Q259 Q260	R252-N256 WeakPolarHBondContact O-CB 3.35Å; R252-N256 PolarHBondContact O-N 2.95Å; R252-N256 PolarHBondContact O-ND2 2.77Å; R252-N256 PolarHBondContact O-OD1 2.95Å; E253-N256 PolarHBondContact O-N 3.49Å; N256-Q259 PolarHBondContact O-N 3.4Å; N256-Q260 WeakPolarHBondContact O-CB 3.19Å; N256-Q260 VanDerWaalsContact O-CG 3.32Å; N256-Q260 WeakPolarHBondContact O-CG 3.46Å; N256-Q260 PolarHBondContact O-N 2.91Å
257	L	97.8	Very high	97	Very high	94 Å²	94	104 Å²	104	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-66.8	-37.5	175.3	-72.4	171.7	0	0	0	112.3	E253 Y255 K261	E253-L257 HydrophobicContact CG-CD1 4.05Å; E253-L257 HydrophobicContact CG-CG 4.42Å; E253-L257 WeakPolarHBondContact O-CB 3.27Å; E253-L257 WeakPolarHBondContact O-CG 3.29Å; E253-L257 PolarHBondContact O-N 3.48Å; Y255-L257 VanDerWaalsContact C-N 3.32Å; Y255-L257 PolarHBondContact O-N 3.41Å; L257-K261 WeakPolarHBondContact O-CB 3.26Å; L257-K261 PolarHBondContact O-N 3.32Å; L257-K261 VanDerWaalsContact O-N 3.09Å
258	F	96.7	Very high	97	Very high	125 Å²	125	103 Å²	103	55%	0.548	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-48.8	172.7	-179.6	-87.9	0	0	0	111.2	K254 Y255 Q260 K261 E262	K254-F258 WeakPolarHBondContact O-CB 3.43Å; K254-F258 PolarHBondContact O-N 3.42Å; Y255-F258 WeakPolarHBondContact O-CB 3.35Å; Y255-F258 PolarHBondContact O-N 3.42Å; Y255-F258 VanDerWaalsContact O-N 3.14Å; F258-Q260 PolarHBondContact O-N 3.38Å; F258-K261 WeakPolarHBondContact O-CA 3.48Å; F258-K261 WeakPolarHBondContact O-CB 3.41Å; F258-K261 PolarHBondContact O-N 3.38Å; F258-E262 WeakPolarHBondContact CE1-OE2 3.34Å; F258-E262 PolarHBondContact O-N 2.92Å
259	Q	97	Very high	97.1	Very high	73 Å²	73	104.9 Å²	104.9	34%	0.341	48%	0.484	S	S	.	.	H	α-helix	trans	-58.4	-47.7	177.7	-176.9	-179.2	-18	0	0	111.3	Y255 N256 K261 E262 E263	Y255-Q259 PolarHBondContact O-N 3.47Å; N256-Q259 PolarHBondContact O-N 3.4Å; Q259-K261 PolarHBondContact O-N 2.87Å; Q259-E262 PolarHBondContact O-N 2.96Å; Q259-E263 HydrophobicContact CG-CG 4.4Å; Q259-E263 WeakPolarHBondContact CG-OE1 3.28Å; Q259-E263 PolarHBondContact NE2-OE1 3.37Å; Q259-E263 WeakPolarHBondContact O-CB 3.5Å; Q259-E263 WeakPolarHBondContact O-CG 3.48Å; Q259-E263 PolarHBondContact O-N 3.44Å
260	Q	97	Very high	97.1	Very high	78 Å²	78	108.2 Å²	108.2	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-60	-32.8	175	-73.7	-180	28.4	0	0	113	N256 F258 R264	N256-Q260 WeakPolarHBondContact O-CB 3.19Å; N256-Q260 VanDerWaalsContact O-CG 3.32Å; N256-Q260 WeakPolarHBondContact O-CG 3.46Å; N256-Q260 PolarHBondContact O-N 2.91Å; F258-Q260 PolarHBondContact O-N 3.38Å; Q260-R264 WeakPolarHBondContact O-CB 3.29Å; Q260-R264 WeakPolarHBondContact O-CD 3.34Å; Q260-R264 WeakPolarHBondContact O-CG 3.47Å; Q260-R264 PolarHBondContact O-N 2.79Å; Q260-R264 VanDerWaalsContact O-N 3.08Å
261	K	96.9	Very high	97.1	Very high	116 Å²	116	108.9 Å²	108.9	50%	0.504	49%	0.488	S	S	.	.	H	α-helix	trans	-70.8	-44.7	175.6	-177.4	174.6	179.2	-70.7	0	111	L257 F258 Q259 R264 E265	L257-K261 WeakPolarHBondContact O-CB 3.26Å; L257-K261 PolarHBondContact O-N 3.32Å; L257-K261 VanDerWaalsContact O-N 3.09Å; F258-K261 WeakPolarHBondContact O-CA 3.48Å; F258-K261 WeakPolarHBondContact O-CB 3.41Å; F258-K261 PolarHBondContact O-N 3.38Å; Q259-K261 PolarHBondContact O-N 2.87Å; K261-R264 PolarHBondContact O-N 2.85Å; K261-E265 IonicContact NZ-OE1 2.69Å; K261-E265 PolarHBondContact NZ-OE1 3.23Å; K261-E265 WeakPolarHBondContact O-CB 3.19Å; K261-E265 WeakPolarHBondContact O-CG 3.43Å; K261-E265 PolarHBondContact O-N 2.85Å
262	E	95.4	Very high	97.1	Very high	103 Å²	103	106.3 Å²	106.3	48%	0.481	48%	0.481	S	S	.	.	H	α-helix	trans	-63.6	-40	176.3	-177.2	168.5	-156.3	0	0	112.2	F258 Q259 S266	F258-E262 WeakPolarHBondContact CE1-OE2 3.34Å; F258-E262 PolarHBondContact O-N 2.92Å; Q259-E262 PolarHBondContact O-N 2.96Å; E262-S266 WeakPolarHBondContact O-CB 3.44Å; E262-S266 PolarHBondContact O-N 2.93Å; E262-S266 PolarHBondContact O-OG 3.19Å
263	E	96.6	Very high	97.1	Very high	100 Å²	100	103.8 Å²	103.8	47%	0.467	48%	0.479	S	S	.	.	H	α-helix	trans	-64.3	-44	174.4	-75	174	-173	0	0	112.1	Q259 S266 F267	Q259-E263 HydrophobicContact CG-CG 4.4Å; Q259-E263 WeakPolarHBondContact CG-OE1 3.28Å; Q259-E263 PolarHBondContact NE2-OE1 3.37Å; Q259-E263 WeakPolarHBondContact O-CB 3.5Å; Q259-E263 WeakPolarHBondContact O-CG 3.48Å; Q259-E263 PolarHBondContact O-N 3.44Å; E263-S266 PolarHBondContact O-N 3.23Å; E263-F267 WeakPolarHBondContact O-CB 3.46Å; E263-F267 PolarHBondContact O-N 2.7Å
264	R	97.3	Very high	97.2	Very high	145 Å²	145	103.3 Å²	103.3	55%	0.547	48%	0.477	S	S	.	.	H	α-helix	trans	-63.1	-47.6	174.5	-74.7	168.5	-169.2	128.8	8.9	111.9	Q260 K261 S266 F267 V268	Q260-R264 WeakPolarHBondContact O-CB 3.29Å; Q260-R264 WeakPolarHBondContact O-CD 3.34Å; Q260-R264 WeakPolarHBondContact O-CG 3.47Å; Q260-R264 PolarHBondContact O-N 2.79Å; Q260-R264 VanDerWaalsContact O-N 3.08Å; K261-R264 PolarHBondContact O-N 2.85Å; R264-S266 VanDerWaalsContact C-N 3.32Å; R264-S266 PolarHBondContact O-N 2.93Å; R264-F267 WeakPolarHBondContact O-CB 3.28Å; R264-F267 PolarHBondContact O-N 3.06Å; R264-V268 WeakPolarHBondContact O-CG2 3.4Å; R264-V268 PolarHBondContact O-N 3.48Å
265	E	96.7	Very high	97.2	Very high	68 Å²	68	98.9 Å²	98.9	32%	0.318	47%	0.469	S	S	.	.	H	α-helix	trans	-61.9	-41.3	176.2	-74.4	179.7	-158.7	0	0	111.7	K261 F267 V268 R269	K261-E265 IonicContact NZ-OE1 2.69Å; K261-E265 PolarHBondContact NZ-OE1 3.23Å; K261-E265 WeakPolarHBondContact O-CB 3.19Å; K261-E265 WeakPolarHBondContact O-CG 3.43Å; K261-E265 PolarHBondContact O-N 2.85Å; E265-F267 VanDerWaalsContact C-N 3.32Å; E265-F267 PolarHBondContact O-N 3.42Å; E265-V268 PolarHBondContact O-N 3.27Å; E265-R269 WeakPolarHBondContact O-CB 3.36Å; E265-R269 VanDerWaalsContact O-CG 3.27Å; E265-R269 WeakPolarHBondContact O-CG 3.23Å; E265-R269 PolarHBondContact O-N 3.02Å; E265-R269 IonicContact OE2-CZ 3.91Å; E265-R269 IonicContact OE2-NH1 2.6Å; E265-R269 IonicContact OE2-NH2 3.11Å; E265-R269 PolarHBondContact OE2-NH2 3.25Å
266	S	95.5	Very high	97.2	Very high	30 Å²	30	97 Å²	97	21%	0.21	47%	0.465	C	S	.	.	H	α-helix	trans	-67.7	-32.5	176.8	-60.2	0	0	0	0	112.4	E262 E263 R264 R270	E262-S266 WeakPolarHBondContact O-CB 3.44Å; E262-S266 PolarHBondContact O-N 2.93Å; E262-S266 PolarHBondContact O-OG 3.19Å; E263-S266 PolarHBondContact O-N 3.23Å; R264-S266 VanDerWaalsContact C-N 3.32Å; R264-S266 PolarHBondContact O-N 2.93Å; S266-R270 VanDerWaalsContact O-CG 3.32Å; S266-R270 WeakPolarHBondContact O-CG 3.43Å; S266-R270 PolarHBondContact O-N 2.91Å; S266-R270 PolarHBondContact O-NE 3.45Å
267	F	98.1	Very high	97.1	Very high	118 Å²	118	97.7 Å²	97.7	52%	0.518	47%	0.468	S	S	.	.	H	α-helix	trans	-65.8	-47.6	170.5	-179.1	-87.2	0	0	0	111.5	E263 R264 E265 R269 R270 Q271	E263-F267 WeakPolarHBondContact O-CB 3.46Å; E263-F267 PolarHBondContact O-N 2.7Å; R264-F267 WeakPolarHBondContact O-CB 3.28Å; R264-F267 PolarHBondContact O-N 3.06Å; E265-F267 VanDerWaalsContact C-N 3.32Å; E265-F267 PolarHBondContact O-N 3.42Å; F267-R269 VanDerWaalsContact C-N 3.35Å; F267-R269 PolarHBondContact O-N 2.98Å; F267-R270 PolarHBondContact O-N 3.07Å; F267-Q271 PolarHBondContact O-N 3.47Å
268	V	97.5	Very high	97.1	Very high	91 Å²	91	97 Å²	97	55%	0.552	47%	0.465	S	S	*	.	H	α-helix	trans	-61.6	-41.8	177	172.8	0	0	0	0	111.4	R264 E265 R270 Q271 A272	R264-V268 WeakPolarHBondContact O-CG2 3.4Å; R264-V268 PolarHBondContact O-N 3.48Å; E265-V268 PolarHBondContact O-N 3.27Å; V268-R270 PolarHBondContact O-N 3.45Å; V268-Q271 PolarHBondContact O-N 2.62Å; V268-A272 WeakPolarHBondContact O-CB 3.48Å; V268-A272 PolarHBondContact O-N 3.1Å
269	R	97.6	Very high	97.1	Very high	131 Å²	131	93.5 Å²	93.5	49%	0.494	46%	0.459	S	S	.	.	H	α-helix	trans	-58.9	-45.6	173	-71.5	169.8	-169.8	122.8	10.4	111.9	E265 F267 A272 L273	E265-R269 WeakPolarHBondContact O-CB 3.36Å; E265-R269 VanDerWaalsContact O-CG 3.27Å; E265-R269 WeakPolarHBondContact O-CG 3.23Å; E265-R269 PolarHBondContact O-N 3.02Å; E265-R269 IonicContact OE2-CZ 3.91Å; E265-R269 IonicContact OE2-NH1 2.6Å; E265-R269 IonicContact OE2-NH2 3.11Å; E265-R269 PolarHBondContact OE2-NH2 3.25Å; F267-R269 VanDerWaalsContact C-N 3.35Å; F267-R269 PolarHBondContact O-N 2.98Å; R269-A272 PolarHBondContact O-N 3.03Å; R269-L273 WeakPolarHBondContact O-CG 3.43Å; R269-L273 PolarHBondContact O-N 3.45Å
270	R	98.2	Very high	97.1	Very high	148 Å²	148	95.3 Å²	95.3	56%	0.558	47%	0.47	S	S	*	.	H	α-helix	trans	-63	-40.6	175.6	-75.3	-178.1	-64	-103.2	3.1	112.3	S266 F267 V268 L273 Q274	S266-R270 VanDerWaalsContact O-CG 3.32Å; S266-R270 WeakPolarHBondContact O-CG 3.43Å; S266-R270 PolarHBondContact O-N 2.91Å; S266-R270 PolarHBondContact O-NE 3.45Å; F267-R270 PolarHBondContact O-N 3.07Å; V268-R270 PolarHBondContact O-N 3.45Å; R270-L273 PolarHBondContact O-N 3.1Å; R270-Q274 PolarHBondContact O-N 3.16Å
271	Q	97.2	Very high	97	Very high	123 Å²	123	97.1 Å²	97.1	58%	0.575	48%	0.479	S	S	*	.	H	α-helix	trans	-67.9	-38.9	179	-169.5	175.7	13.7	0	0	112.2	F267 V268 Q274 A275	F267-Q271 PolarHBondContact O-N 3.47Å; V268-Q271 PolarHBondContact O-N 2.62Å; Q271-Q274 PolarHBondContact O-N 3.21Å; Q271-A275 PolarHBondContact O-N 2.67Å; Q271-A275 VanDerWaalsContact O-N 3.08Å
272	A	97.3	Very high	97	Very high	46 Å²	46	97.3 Å²	97.3	38%	0.38	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-48.6	172.9	0	0	0	0	0	111.5	V268 R269 Q274 A275 E276	V268-A272 WeakPolarHBondContact O-CB 3.48Å; V268-A272 PolarHBondContact O-N 3.1Å; R269-A272 PolarHBondContact O-N 3.03Å; A272-Q274 VanDerWaalsContact C-N 3.29Å; A272-Q274 PolarHBondContact O-N 3.36Å; A272-A275 PolarHBondContact O-N 3.12Å; A272-A275 VanDerWaalsContact O-N 3.13Å; A272-E276 WeakPolarHBondContact O-CG 3.37Å; A272-E276 PolarHBondContact O-N 2.62Å
273	L	97.8	Very high	97	Very high	99 Å²	99	96.6 Å²	96.6	52%	0.518	49%	0.487	S	S	.	.	H	α-helix	trans	-60.7	-35.9	176.6	-72.3	169.1	0	0	0	112.7	R269 R270 E276 L277	R269-L273 WeakPolarHBondContact O-CG 3.43Å; R269-L273 PolarHBondContact O-N 3.45Å; R270-L273 PolarHBondContact O-N 3.1Å; L273-E276 PolarHBondContact O-N 2.95Å; L273-L277 WeakPolarHBondContact O-CB 3.13Å; L273-L277 VanDerWaalsContact O-CG 3.27Å; L273-L277 WeakPolarHBondContact O-CG 3.4Å; L273-L277 PolarHBondContact O-N 3.18Å
274	Q	97.8	Very high	97.1	Very high	97 Å²	97	98 Å²	98	45%	0.453	49%	0.491	S	S	.	.	H	α-helix	trans	-64.6	-46.6	173.3	-173.8	62.8	51.4	0	0	111.3	R270 Q271 A272 E276 L277 D278	R270-Q274 PolarHBondContact O-N 3.16Å; Q271-Q274 PolarHBondContact O-N 3.21Å; A272-Q274 VanDerWaalsContact C-N 3.29Å; A272-Q274 PolarHBondContact O-N 3.36Å; Q274-E276 VanDerWaalsContact C-N 3.3Å; Q274-E276 PolarHBondContact O-N 2.86Å; Q274-L277 PolarHBondContact O-N 3.16Å; Q274-D278 PolarHBondContact NE2-OD1 2.87Å; Q274-D278 PolarHBondContact NE2-OD2 3.5Å; Q274-D278 WeakPolarHBondContact O-CB 3.28Å; Q274-D278 PolarHBondContact O-N 3.24Å
275	A	97.5	Very high	97	Very high	60 Å²	60	94.2 Å²	94.2	50%	0.496	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-35.7	177.5	0	0	0	0	0	112.6	Q271 A272 A279	Q271-A275 PolarHBondContact O-N 2.67Å; Q271-A275 VanDerWaalsContact O-N 3.08Å; A272-A275 PolarHBondContact O-N 3.12Å; A272-A275 VanDerWaalsContact O-N 3.13Å; A275-A279 VanDerWaalsContact O-CB 3.3Å; A275-A279 WeakPolarHBondContact O-CB 3.09Å; A275-A279 PolarHBondContact O-N 2.86Å
276	E	97	Very high	97	Very high	112 Å²	112	95.1 Å²	95.1	52%	0.523	49%	0.489	S	S	.	.	H	α-helix	trans	-65.6	-44.3	171.9	-72.7	172.7	-167.7	0	0	111.8	A272 L273 Q274 A279 I280	A272-E276 WeakPolarHBondContact O-CG 3.37Å; A272-E276 PolarHBondContact O-N 2.62Å; L273-E276 PolarHBondContact O-N 2.95Å; Q274-E276 VanDerWaalsContact C-N 3.3Å; Q274-E276 PolarHBondContact O-N 2.86Å; E276-A279 PolarHBondContact O-N 2.96Å; E276-I280 WeakPolarHBondContact O-CB 3.48Å; E276-I280 WeakPolarHBondContact O-CD1 3.45Å; E276-I280 WeakPolarHBondContact O-CG1 3.24Å; E276-I280 PolarHBondContact O-N 2.89Å
277	L	96.8	Very high	97	Very high	94 Å²	94	98.5 Å²	98.5	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-63.2	-40.6	175.4	-75.1	169.8	0	0	0	112.4	L273 Q274 I280 Q281	L273-L277 WeakPolarHBondContact O-CB 3.13Å; L273-L277 VanDerWaalsContact O-CG 3.27Å; L273-L277 WeakPolarHBondContact O-CG 3.4Å; L273-L277 PolarHBondContact O-N 3.18Å; Q274-L277 PolarHBondContact O-N 3.16Å; L277-I280 PolarHBondContact O-N 3.16Å; L277-Q281 WeakPolarHBondContact O-CB 3.44Å; L277-Q281 VanDerWaalsContact O-CG 3.3Å; L277-Q281 WeakPolarHBondContact O-CG 3.49Å; L277-Q281 PolarHBondContact O-N 3.12Å; L277-Q281 PolarHBondContact O-NE2 3.36Å
278	D	97.5	Very high	96.9	Very high	79 Å²	79	96.5 Å²	96.5	42%	0.422	50%	0.499	S	S	.	.	H	α-helix	trans	-68	-39.5	177.9	-64.3	-21.2	0	0	0	111	Q274 Q281 L282	Q274-D278 PolarHBondContact NE2-OD1 2.87Å; Q274-D278 PolarHBondContact NE2-OD2 3.5Å; Q274-D278 WeakPolarHBondContact O-CB 3.28Å; Q274-D278 PolarHBondContact O-N 3.24Å; D278-Q281 PolarHBondContact O-N 3.06Å; D278-L282 WeakPolarHBondContact O-CB 3.29Å; D278-L282 PolarHBondContact O-N 2.93Å
279	A	96.6	Very high	96.8	Very high	52 Å²	52	98 Å²	98	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-41.8	173.4	0	0	0	0	0	112.4	A275 E276 L282 V283	A275-A279 VanDerWaalsContact O-CB 3.3Å; A275-A279 WeakPolarHBondContact O-CB 3.09Å; A275-A279 PolarHBondContact O-N 2.86Å; E276-A279 PolarHBondContact O-N 2.96Å; A279-L282 PolarHBondContact O-N 3.46Å; A279-V283 WeakPolarHBondContact O-CG2 3.43Å; A279-V283 PolarHBondContact O-N 2.96Å
280	I	96.2	Very high	96.7	Very high	112 Å²	112	96 Å²	96	57%	0.574	49%	0.494	S	S	*	.	H	α-helix	trans	-64.1	-40.5	175	-71.5	164.1	0	0	0	110.7	E276 L277 K284	E276-I280 WeakPolarHBondContact O-CB 3.48Å; E276-I280 WeakPolarHBondContact O-CD1 3.45Å; E276-I280 WeakPolarHBondContact O-CG1 3.24Å; E276-I280 PolarHBondContact O-N 2.89Å; L277-I280 PolarHBondContact O-N 3.16Å; I280-K284 VanDerWaalsContact O-CB 3.29Å; I280-K284 WeakPolarHBondContact O-CB 3.28Å; I280-K284 PolarHBondContact O-N 3.23Å
281	Q	95.9	Very high	96.5	Very high	115 Å²	115	95 Å²	95	54%	0.537	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-44.6	173.3	-77.2	175.8	68.2	0	0	111.7	L277 D278 K284 T285	L277-Q281 WeakPolarHBondContact O-CB 3.44Å; L277-Q281 VanDerWaalsContact O-CG 3.3Å; L277-Q281 WeakPolarHBondContact O-CG 3.49Å; L277-Q281 PolarHBondContact O-N 3.12Å; L277-Q281 PolarHBondContact O-NE2 3.36Å; D278-Q281 PolarHBondContact O-N 3.06Å; Q281-K284 PolarHBondContact O-N 3.15Å; Q281-T285 WeakPolarHBondContact O-CG2 3.42Å; Q281-T285 PolarHBondContact O-N 2.82Å
282	L	96.4	Very high	96.4	Very high	121 Å²	121	95.2 Å²	95.2	63%	0.634	50%	0.498	S	S	*	.	H	α-helix	trans	-59.1	-51.2	176.5	-178.6	62.1	0	0	0	111.4	D278 A279 K284 T285 Q286	D278-L282 WeakPolarHBondContact O-CB 3.29Å; D278-L282 PolarHBondContact O-N 2.93Å; A279-L282 PolarHBondContact O-N 3.46Å; L282-K284 VanDerWaalsContact C-N 3.32Å; L282-K284 PolarHBondContact O-N 2.83Å; L282-T285 PolarHBondContact O-N 3.43Å; L282-T285 PolarHBondContact O-OG1 3.37Å; L282-Q286 PolarHBondContact O-N 2.88Å
283	V	96.4	Very high	96.3	Very high	87 Å²	87	97.8 Å²	97.8	53%	0.527	50%	0.502	S	S	.	.	H	α-helix	trans	-59.5	-41.8	176.9	171.9	0	0	0	0	111.3	A279 Q286 L287	A279-V283 WeakPolarHBondContact O-CG2 3.43Å; A279-V283 PolarHBondContact O-N 2.96Å; V283-Q286 PolarHBondContact O-N 2.67Å; V283-L287 HydrophobicContact CG1-CD1 4.03Å; V283-L287 HydrophobicContact CG1-CG 4.44Å; V283-L287 WeakPolarHBondContact O-CG 3.31Å; V283-L287 PolarHBondContact O-N 3.29Å
284	K	97.2	Very high	96.1	Very high	129 Å²	129	97.3 Å²	97.3	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-59.5	-49.6	174.7	-176.1	-172.3	171.6	-171.3	0	111.6	I280 Q281 L282 Q286 L287 D288	I280-K284 VanDerWaalsContact O-CB 3.29Å; I280-K284 WeakPolarHBondContact O-CB 3.28Å; I280-K284 PolarHBondContact O-N 3.23Å; Q281-K284 PolarHBondContact O-N 3.15Å; L282-K284 VanDerWaalsContact C-N 3.32Å; L282-K284 PolarHBondContact O-N 2.83Å; K284-Q286 PolarHBondContact O-N 2.86Å; K284-L287 PolarHBondContact O-N 2.96Å; K284-L287 VanDerWaalsContact O-N 3.16Å; K284-D288 WeakPolarHBondContact CE-OD2 3.2Å; K284-D288 PolarHBondContact O-N 3.45Å
285	T	95.7	Very high	96	Very high	67 Å²	67	96 Å²	96	41%	0.411	50%	0.495	S	S	.	.	H	α-helix	trans	-64.8	-23	178.9	64.8	0	0	0	0	113.2	Q281 L282 K289	Q281-T285 WeakPolarHBondContact O-CG2 3.42Å; Q281-T285 PolarHBondContact O-N 2.82Å; L282-T285 PolarHBondContact O-N 3.43Å; L282-T285 PolarHBondContact O-OG1 3.37Å; T285-K289 WeakPolarHBondContact O-CD 3.39Å; T285-K289 WeakPolarHBondContact O-CE 3.47Å; T285-K289 VanDerWaalsContact O-CG 3.22Å; T285-K289 WeakPolarHBondContact O-CG 3.48Å; T285-K289 PolarHBondContact O-N 3.18Å
286	Q	96.3	Very high	95.9	Very high	87 Å²	87	97 Å²	97	41%	0.407	49%	0.492	S	S	.	.	H	α-helix	trans	-76	-46.2	172	-177.1	58	23.5	0	0	111.4	L282 V283 K284 D288 K289 E290	L282-Q286 PolarHBondContact O-N 2.88Å; V283-Q286 PolarHBondContact O-N 2.67Å; K284-Q286 PolarHBondContact O-N 2.86Å; Q286-D288 VanDerWaalsContact C-N 3.33Å; Q286-D288 PolarHBondContact O-N 2.88Å; Q286-K289 WeakPolarHBondContact O-CB 3.29Å; Q286-K289 PolarHBondContact O-N 3.38Å; Q286-K289 VanDerWaalsContact O-N 3.17Å; Q286-E290 WeakPolarHBondContact CG-OE1 3.45Å; Q286-E290 PolarHBondContact NE2-OE1 3.4Å; Q286-E290 WeakPolarHBondContact O-CG 3.48Å; Q286-E290 PolarHBondContact O-N 2.85Å
287	L	96.2	Very high	95.9	Very high	100 Å²	100	95.4 Å²	95.4	52%	0.524	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-37.5	174.6	-70.5	170.9	0	0	0	112.6	V283 K284 K289 E290 K291	V283-L287 HydrophobicContact CG1-CD1 4.03Å; V283-L287 HydrophobicContact CG1-CG 4.44Å; V283-L287 WeakPolarHBondContact O-CG 3.31Å; V283-L287 PolarHBondContact O-N 3.29Å; K284-L287 PolarHBondContact O-N 2.96Å; K284-L287 VanDerWaalsContact O-N 3.16Å; L287-K289 VanDerWaalsContact C-N 3.34Å; L287-K289 PolarHBondContact O-N 2.89Å; L287-E290 PolarHBondContact O-N 3.23Å; L287-K291 VanDerWaalsContact O-CB 3.24Å; L287-K291 WeakPolarHBondContact O-CB 3.5Å; L287-K291 PolarHBondContact O-N 3.49Å
288	D	95.8	Very high	95.8	Very high	77 Å²	77	96.8 Å²	96.8	41%	0.412	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-36.4	175.4	-74.2	-33.9	0	0	0	111.4	K284 Q286 L292	K284-D288 WeakPolarHBondContact CE-OD2 3.2Å; K284-D288 PolarHBondContact O-N 3.45Å; Q286-D288 VanDerWaalsContact C-N 3.33Å; Q286-D288 PolarHBondContact O-N 2.88Å; D288-L292 VanDerWaalsContact O-CG 3.31Å; D288-L292 WeakPolarHBondContact O-CG 3.32Å; D288-L292 PolarHBondContact O-N 3.22Å; D288-L292 VanDerWaalsContact O-N 3.08Å
289	K	95.4	Very high	95.7	Very high	123 Å²	123	97.2 Å²	97.2	54%	0.535	49%	0.492	S	S	.	.	H	α-helix	trans	-69.1	-46.1	172.3	-69.5	163	-167.4	164.5	0	112.2	T285 Q286 L287 K291 L292 Q293	T285-K289 WeakPolarHBondContact O-CD 3.39Å; T285-K289 WeakPolarHBondContact O-CE 3.47Å; T285-K289 VanDerWaalsContact O-CG 3.22Å; T285-K289 WeakPolarHBondContact O-CG 3.48Å; T285-K289 PolarHBondContact O-N 3.18Å; Q286-K289 WeakPolarHBondContact O-CB 3.29Å; Q286-K289 PolarHBondContact O-N 3.38Å; Q286-K289 VanDerWaalsContact O-N 3.17Å; L287-K289 VanDerWaalsContact C-N 3.34Å; L287-K289 PolarHBondContact O-N 2.89Å; K289-K291 VanDerWaalsContact C-N 3.3Å; K289-K291 PolarHBondContact O-N 3.43Å; K289-L292 PolarHBondContact O-N 2.88Å; K289-Q293 WeakPolarHBondContact O-CB 3.33Å; K289-Q293 PolarHBondContact O-N 3.08Å
290	E	94.7	Very high	95.6	Very high	88 Å²	88	99.3 Å²	99.3	41%	0.411	49%	0.493	S	S	.	.	H	α-helix	trans	-62.7	-38.9	179	-74.5	170.5	-166.9	0	0	111.1	Q286 L287 Q293 I294	Q286-E290 WeakPolarHBondContact CG-OE1 3.45Å; Q286-E290 PolarHBondContact NE2-OE1 3.4Å; Q286-E290 WeakPolarHBondContact O-CG 3.48Å; Q286-E290 PolarHBondContact O-N 2.85Å; L287-E290 PolarHBondContact O-N 3.23Å; E290-Q293 PolarHBondContact O-N 3.21Å; E290-I294 WeakPolarHBondContact O-CB 3.16Å; E290-I294 WeakPolarHBondContact O-CD1 3.23Å; E290-I294 VanDerWaalsContact O-CG1 3.23Å; E290-I294 WeakPolarHBondContact O-CG1 3.3Å; E290-I294 PolarHBondContact O-N 3.16Å
291	K	95.3	Very high	95.5	Very high	128 Å²	128	100 Å²	100	56%	0.557	50%	0.497	S	S	*	.	H	α-helix	trans	-62.7	-47.1	172.4	-175.6	-177.3	175.4	-171.1	0	112.1	L287 K289 Q293 I294 D295	L287-K291 VanDerWaalsContact O-CB 3.24Å; L287-K291 WeakPolarHBondContact O-CB 3.5Å; L287-K291 PolarHBondContact O-N 3.49Å; K289-K291 VanDerWaalsContact C-N 3.3Å; K289-K291 PolarHBondContact O-N 3.43Å; K291-Q293 VanDerWaalsContact C-N 3.3Å; K291-Q293 PolarHBondContact O-N 3.38Å; K291-I294 PolarHBondContact O-N 2.85Å; K291-D295 WeakPolarHBondContact O-CB 3.49Å; K291-D295 PolarHBondContact O-N 3.43Å
292	L	95.3	Very high	95.5	Very high	126 Å²	126	99.4 Å²	99.4	66%	0.66	49%	0.494	S	S	*	.	H	α-helix	trans	-60.6	-39	175.9	-77.3	168.5	0	0	0	112.2	D288 K289 N296	D288-L292 VanDerWaalsContact O-CG 3.31Å; D288-L292 WeakPolarHBondContact O-CG 3.32Å; D288-L292 PolarHBondContact O-N 3.22Å; D288-L292 VanDerWaalsContact O-N 3.08Å; K289-L292 PolarHBondContact O-N 2.88Å; L292-N296 VanDerWaalsContact O-CB 3.3Å; L292-N296 WeakPolarHBondContact O-CB 3.44Å; L292-N296 PolarHBondContact O-N 3.03Å
293	Q	94.4	Very high	95.4	Very high	100 Å²	100	98.5 Å²	98.5	47%	0.467	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-50.5	174.1	-178.9	59.1	42.6	0	0	111	K289 E290 K291 D295 N296 D297	K289-Q293 WeakPolarHBondContact O-CB 3.33Å; K289-Q293 PolarHBondContact O-N 3.08Å; E290-Q293 PolarHBondContact O-N 3.21Å; K291-Q293 VanDerWaalsContact C-N 3.3Å; K291-Q293 PolarHBondContact O-N 3.38Å; Q293-D295 VanDerWaalsContact C-N 3.32Å; Q293-D295 PolarHBondContact O-N 3.21Å; Q293-N296 WeakPolarHBondContact O-CB 3.49Å; Q293-N296 PolarHBondContact O-N 3.17Å; Q293-D297 PolarHBondContact NE2-OD1 3.33Å; Q293-D297 PolarHBondContact NE2-OD2 2.89Å; Q293-D297 WeakPolarHBondContact O-CB 3.28Å; Q293-D297 VanDerWaalsContact O-CG 3.25Å; Q293-D297 PolarHBondContact O-N 2.93Å
294	I	94.4	Very high	95.3	Very high	90 Å²	90	97.3 Å²	97.3	46%	0.462	48%	0.475	S	S	.	.	H	α-helix	trans	-59.2	-41	177.8	-73.4	164.9	0	0	0	111.8	E290 K291 D297 K298	E290-I294 WeakPolarHBondContact O-CB 3.16Å; E290-I294 WeakPolarHBondContact O-CD1 3.23Å; E290-I294 VanDerWaalsContact O-CG1 3.23Å; E290-I294 WeakPolarHBondContact O-CG1 3.3Å; E290-I294 PolarHBondContact O-N 3.16Å; K291-I294 PolarHBondContact O-N 2.85Å; I294-D297 PolarHBondContact O-N 2.76Å; I294-K298 HydrophobicContact CG2-CD 4.45Å; I294-K298 VanDerWaalsContact CG2-CE 3.48Å; I294-K298 VanDerWaalsContact O-CG 3.28Å; I294-K298 WeakPolarHBondContact O-CG 3.39Å; I294-K298 PolarHBondContact O-N 2.86Å
295	D	95.1	Very high	95.2	Very high	68 Å²	68	98.2 Å²	98.2	36%	0.364	48%	0.476	S	S	.	.	H	α-helix	trans	-73.8	-30.5	179.2	-70.1	-23.1	0	0	0	112	K291 Q293 K298 L299	K291-D295 WeakPolarHBondContact O-CB 3.49Å; K291-D295 PolarHBondContact O-N 3.43Å; Q293-D295 VanDerWaalsContact C-N 3.32Å; Q293-D295 PolarHBondContact O-N 3.21Å; D295-K298 IonicContact OD1-NZ 3.17Å; D295-K298 PolarHBondContact OD1-NZ 2.91Å; D295-L299 WeakPolarHBondContact O-CB 3.31Å; D295-L299 PolarHBondContact O-N 3.3Å; D295-L299 VanDerWaalsContact O-N 3.12Å
296	N	95	Very high	95.1	Very high	81 Å²	81	99.9 Å²	99.9	43%	0.433	48%	0.479	S	S	.	.	H	α-helix	trans	-69	-41.7	168.7	-176.3	57.7	0	0	0	112.2	L292 Q293 L299 Q300	L292-N296 VanDerWaalsContact O-CB 3.3Å; L292-N296 WeakPolarHBondContact O-CB 3.44Å; L292-N296 PolarHBondContact O-N 3.03Å; Q293-N296 WeakPolarHBondContact O-CB 3.49Å; Q293-N296 PolarHBondContact O-N 3.17Å; N296-L299 WeakPolarHBondContact O-CB 3.49Å; N296-L299 PolarHBondContact O-N 2.92Å; N296-L299 VanDerWaalsContact O-N 3.15Å; N296-Q300 WeakPolarHBondContact O-CB 3.24Å; N296-Q300 PolarHBondContact O-N 3.28Å
297	D	96.9	Very high	95.1	Very high	79 Å²	79	101.5 Å²	101.5	42%	0.422	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-37	177.7	-68.6	-30.2	0	0	0	111.8	Q293 I294 Q300 L301	Q293-D297 PolarHBondContact NE2-OD1 3.33Å; Q293-D297 PolarHBondContact NE2-OD2 2.89Å; Q293-D297 WeakPolarHBondContact O-CB 3.28Å; Q293-D297 VanDerWaalsContact O-CG 3.25Å; Q293-D297 PolarHBondContact O-N 2.93Å; I294-D297 PolarHBondContact O-N 2.76Å; D297-Q300 PolarHBondContact O-N 2.9Å; D297-L301 VanDerWaalsContact O-CB 3.32Å; D297-L301 WeakPolarHBondContact O-CB 3.43Å; D297-L301 PolarHBondContact O-N 2.94Å
298	K	95.3	Very high	95	Very high	124 Å²	124	100.3 Å²	100.3	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-60.8	-44.5	168.4	-72.6	168.9	-163.3	158.5	0	111.9	I294 D295 Q300 L301 H302	I294-K298 HydrophobicContact CG2-CD 4.45Å; I294-K298 VanDerWaalsContact CG2-CE 3.48Å; I294-K298 VanDerWaalsContact O-CG 3.28Å; I294-K298 WeakPolarHBondContact O-CG 3.39Å; I294-K298 PolarHBondContact O-N 2.86Å; D295-K298 IonicContact OD1-NZ 3.17Å; D295-K298 PolarHBondContact OD1-NZ 2.91Å; K298-Q300 VanDerWaalsContact C-N 3.35Å; K298-L301 PolarHBondContact O-N 3.4Å; K298-H302 WeakPolarHBondContact O-CB 3.46Å; K298-H302 PolarHBondContact O-N 2.97Å
299	L	95.8	Very high	94.8	Very high	88 Å²	88	99.9 Å²	99.9	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-67.5	-36	180	179.9	62.3	0	0	0	111.9	D295 N296 K303	D295-L299 WeakPolarHBondContact O-CB 3.31Å; D295-L299 PolarHBondContact O-N 3.3Å; D295-L299 VanDerWaalsContact O-N 3.12Å; N296-L299 WeakPolarHBondContact O-CB 3.49Å; N296-L299 PolarHBondContact O-N 2.92Å; N296-L299 VanDerWaalsContact O-N 3.15Å; L299-K303 WeakPolarHBondContact O-CD 3.45Å; L299-K303 VanDerWaalsContact O-CG 3.28Å; L299-K303 WeakPolarHBondContact O-CG 3.22Å; L299-K303 PolarHBondContact O-N 3.01Å; L299-K303 VanDerWaalsContact O-N 3.16Å
300	Q	94.3	Very high	94.8	Very high	96 Å²	96	98.7 Å²	98.7	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-61.4	-52.8	170.9	-175.6	69.7	32	0	0	110.2	N296 D297 K298 H302 K303 D304	N296-Q300 WeakPolarHBondContact O-CB 3.24Å; N296-Q300 PolarHBondContact O-N 3.28Å; D297-Q300 PolarHBondContact O-N 2.9Å; K298-Q300 VanDerWaalsContact C-N 3.35Å; Q300-H302 VanDerWaalsContact C-N 3.32Å; Q300-H302 PolarHBondContact O-N 3.43Å; Q300-K303 PolarHBondContact O-N 3.22Å; Q300-D304 PolarHBondContact NE2-OD2 2.87Å; Q300-D304 PolarHBondContact O-N 2.74Å
301	L	94.3	Very high	94.7	Very high	126 Å²	126	100.2 Å²	100.2	66%	0.66	48%	0.481	S	S	*	.	H	α-helix	trans	-63.1	-34.6	-179.8	-168.8	150.4	0	0	0	112.7	D297 K298 Y305	D297-L301 VanDerWaalsContact O-CB 3.32Å; D297-L301 WeakPolarHBondContact O-CB 3.43Å; D297-L301 PolarHBondContact O-N 2.94Å; K298-L301 PolarHBondContact O-N 3.4Å; L301-Y305 VanDerWaalsContact O-CB 3.29Å; L301-Y305 WeakPolarHBondContact O-CB 3.23Å; L301-Y305 PolarHBondContact O-N 2.72Å
302	H	94.4	Very high	94.6	Very high	102 Å²	102	100.7 Å²	100.7	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-47.5	172.9	-167.8	-76.7	0	0	0	111.8	K298 Q300 D304 Y305 E306	K298-H302 WeakPolarHBondContact O-CB 3.46Å; K298-H302 PolarHBondContact O-N 2.97Å; Q300-H302 VanDerWaalsContact C-N 3.32Å; Q300-H302 PolarHBondContact O-N 3.43Å; H302-D304 VanDerWaalsContact C-N 3.33Å; H302-D304 PolarHBondContact O-N 3.43Å; H302-Y305 WeakPolarHBondContact O-CB 3.46Å; H302-Y305 PolarHBondContact O-N 2.93Å; H302-E306 IonicContact CE1-OE1 2.72Å; H302-E306 PolarHBondContact CE1-OE1 3.48Å; H302-E306 IonicContact CE1-OE2 2.63Å; H302-E306 PolarHBondContact CE1-OE2 3.08Å; H302-E306 IonicContact ND1-OE1 2.77Å; H302-E306 IonicContact ND1-OE2 3.76Å; H302-E306 PolarHBondContact ND1-OE2 2.93Å; H302-E306 WeakPolarHBondContact O-CG 3.46Å; H302-E306 PolarHBondContact O-N 3.41Å
303	K	94.8	Very high	94.6	Very high	102 Å²	102	99.6 Å²	99.6	44%	0.443	47%	0.473	S	S	.	.	H	α-helix	trans	-62.1	-41	177	-70.2	163.6	-177	167.6	0	112	L299 Q300 K307	L299-K303 WeakPolarHBondContact O-CD 3.45Å; L299-K303 VanDerWaalsContact O-CG 3.28Å; L299-K303 WeakPolarHBondContact O-CG 3.22Å; L299-K303 PolarHBondContact O-N 3.01Å; L299-K303 VanDerWaalsContact O-N 3.16Å; Q300-K303 PolarHBondContact O-N 3.22Å; K303-K307 WeakPolarHBondContact O-CB 3.33Å; K303-K307 PolarHBondContact O-N 3.43Å
304	D	95	Very high	94.6	Very high	62 Å²	62	101 Å²	101	33%	0.332	48%	0.478	S	S	.	.	H	α-helix	trans	-68.9	-35.8	176.8	-75	-42.2	0	0	0	111.3	Q300 H302 N308	Q300-D304 PolarHBondContact NE2-OD2 2.87Å; Q300-D304 PolarHBondContact O-N 2.74Å; H302-D304 VanDerWaalsContact C-N 3.33Å; H302-D304 PolarHBondContact O-N 3.43Å; D304-N308 VanDerWaalsContact O-CB 3.29Å; D304-N308 WeakPolarHBondContact O-CB 3.29Å; D304-N308 PolarHBondContact O-N 2.98Å; D304-N308 PolarHBondContact O-ND2 3.5Å; D304-N308 VanDerWaalsContact O-ND2 3.12Å; D304-N308 PolarHBondContact O-OD1 2.8Å
305	Y	94.4	Very high	94.6	Very high	149 Å²	149	104.8 Å²	104.8	58%	0.584	49%	0.486	S	S	*	.	H	α-helix	trans	-63.9	-50.6	171	179.1	-100.8	0	0	0	112.2	L301 H302 K307 N308 E309	L301-Y305 VanDerWaalsContact O-CB 3.29Å; L301-Y305 WeakPolarHBondContact O-CB 3.23Å; L301-Y305 PolarHBondContact O-N 2.72Å; H302-Y305 WeakPolarHBondContact O-CB 3.46Å; H302-Y305 PolarHBondContact O-N 2.93Å; Y305-K307 VanDerWaalsContact C-N 3.31Å; Y305-K307 PolarHBondContact O-N 2.87Å; Y305-N308 PolarHBondContact O-N 2.86Å; Y305-E309 VanDerWaalsContact O-CB 3.28Å; Y305-E309 WeakPolarHBondContact O-CB 3.47Å; Y305-E309 PolarHBondContact O-N 3.17Å
306	E	94.6	Very high	94.6	Very high	101 Å²	101	107.2 Å²	107.2	47%	0.472	50%	0.495	S	S	.	.	H	α-helix	trans	-58.2	-42.3	176.2	-73	174	117.1	0	0	112.1	H302 L310	H302-E306 IonicContact CE1-OE1 2.72Å; H302-E306 PolarHBondContact CE1-OE1 3.48Å; H302-E306 IonicContact CE1-OE2 2.63Å; H302-E306 PolarHBondContact CE1-OE2 3.08Å; H302-E306 IonicContact ND1-OE1 2.77Å; H302-E306 IonicContact ND1-OE2 3.76Å; H302-E306 PolarHBondContact ND1-OE2 2.93Å; H302-E306 WeakPolarHBondContact O-CG 3.46Å; H302-E306 PolarHBondContact O-N 3.41Å; E306-L310 WeakPolarHBondContact O-CB 3.39Å; E306-L310 PolarHBondContact O-N 3Å
307	K	95.4	Very high	94.7	Very high	122 Å²	122	107.4 Å²	107.4	53%	0.53	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-47.4	176	177.6	-169	166.8	-158	0	111.5	K303 Y305 L310 E311	K303-K307 WeakPolarHBondContact O-CB 3.33Å; K303-K307 PolarHBondContact O-N 3.43Å; Y305-K307 VanDerWaalsContact C-N 3.31Å; Y305-K307 PolarHBondContact O-N 2.87Å; K307-L310 PolarHBondContact O-N 3.38Å; K307-E311 PolarHBondContact O-N 3.38Å
308	N	93.6	Very high	94.6	Very high	75 Å²	75	109.4 Å²	109.4	40%	0.401	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-43	179.1	-70.2	-19.9	0	0	0	111.1	D304 Y305 L310 E311 F312	D304-N308 VanDerWaalsContact O-CB 3.29Å; D304-N308 WeakPolarHBondContact O-CB 3.29Å; D304-N308 PolarHBondContact O-N 2.98Å; D304-N308 PolarHBondContact O-ND2 3.5Å; D304-N308 VanDerWaalsContact O-ND2 3.12Å; D304-N308 PolarHBondContact O-OD1 2.8Å; Y305-N308 PolarHBondContact O-N 2.86Å; N308-L310 VanDerWaalsContact C-N 3.31Å; N308-L310 PolarHBondContact O-N 2.92Å; N308-E311 CarbonylContact O-C 3.6Å; N308-E311 PolarHBondContact O-N 3.43Å; N308-E311 VanDerWaalsContact O-N 3.12Å; N308-F312 HydrophobicContact CB-CD2 4.43Å; N308-F312 HydrophobicContact CB-CE2 4.25Å; N308-F312 WeakPolarHBondContact O-CD2 3.41Å; N308-F312 PolarHBondContact O-N 2.87Å
309	E	93.6	Very high	94.6	Very high	67 Å²	67	108 Å²	108	31%	0.313	50%	0.504	S	S	.	.	H	α-helix	trans	-58	-41.8	174.6	177.4	64.9	-174.2	0	0	112	Y305 F312 K313	Y305-E309 VanDerWaalsContact O-CB 3.28Å; Y305-E309 WeakPolarHBondContact O-CB 3.47Å; Y305-E309 PolarHBondContact O-N 3.17Å; E309-F312 PolarHBondContact O-N 3.12Å; E309-K313 HydrophobicContact CG-CD 4.41Å; E309-K313 WeakPolarHBondContact O-CB 3.4Å; E309-K313 PolarHBondContact O-N 2.8Å; E309-K313 WeakPolarHBondContact OE1-CE 3.42Å; E309-K313 IonicContact OE1-NZ 2.67Å; E309-K313 PolarHBondContact OE1-NZ 3.39Å
310	L	94.2	Very high	94.6	Very high	98 Å²	98	107.7 Å²	107.7	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-71.3	-31	176.2	-145.2	169	0	0	0	111.8	E306 K307 N308 K314	E306-L310 WeakPolarHBondContact O-CB 3.39Å; E306-L310 PolarHBondContact O-N 3Å; K307-L310 PolarHBondContact O-N 3.38Å; N308-L310 VanDerWaalsContact C-N 3.31Å; N308-L310 PolarHBondContact O-N 2.92Å; L310-K314 HydrophobicContact CD2-CD 4.04Å; L310-K314 HydrophobicContact CD2-CG 4.37Å; L310-K314 WeakPolarHBondContact O-CD 3.4Å; L310-K314 VanDerWaalsContact O-CG 3.28Å; L310-K314 WeakPolarHBondContact O-CG 3.44Å; L310-K314 PolarHBondContact O-N 3.44Å; L310-K314 VanDerWaalsContact O-N 3.13Å
311	E	93.6	Very high	94.6	Very high	120 Å²	120	108.1 Å²	108.1	56%	0.561	51%	0.505	S	S	*	.	H	α-helix	trans	-73.3	-40.5	172.4	-167.8	170.7	151.1	0	0	112.3	K307 N308 K314 R315	K307-E311 PolarHBondContact O-N 3.38Å; N308-E311 CarbonylContact O-C 3.6Å; N308-E311 PolarHBondContact O-N 3.43Å; N308-E311 VanDerWaalsContact O-N 3.12Å; E311-K314 PolarHBondContact O-N 3.44Å; E311-R315 WeakPolarHBondContact O-CB 3.3Å; E311-R315 PolarHBondContact O-N 3.08Å
312	F	92.6	Very high	94.8	Very high	138 Å²	138	109.9 Å²	109.9	61%	0.605	50%	0.503	S	S	*	.	H	α-helix	trans	-60.6	-49.3	172.4	-76.4	-58.3	0	0	0	111	N308 E309 K314 R315 E316	N308-F312 HydrophobicContact CB-CD2 4.43Å; N308-F312 HydrophobicContact CB-CE2 4.25Å; N308-F312 WeakPolarHBondContact O-CD2 3.41Å; N308-F312 PolarHBondContact O-N 2.87Å; E309-F312 PolarHBondContact O-N 3.12Å; F312-K314 VanDerWaalsContact C-N 3.31Å; F312-K314 PolarHBondContact O-N 2.95Å; F312-R315 CarbonylContact O-C 3.51Å; F312-R315 WeakPolarHBondContact O-CA 3.49Å; F312-R315 WeakPolarHBondContact O-CB 3.44Å; F312-R315 PolarHBondContact O-N 3.46Å; F312-E316 WeakPolarHBondContact O-CB 3.43Å; F312-E316 PolarHBondContact O-N 2.91Å
313	K	95.2	Very high	94.8	Very high	104 Å²	104	110.7 Å²	110.7	45%	0.452	51%	0.507	S	S	.	.	H	α-helix	trans	-59	-38.6	175.5	-81.5	165.7	167.8	154.6	0	113.1	E309 N317	E309-K313 HydrophobicContact CG-CD 4.41Å; E309-K313 WeakPolarHBondContact O-CB 3.4Å; E309-K313 PolarHBondContact O-N 2.8Å; E309-K313 WeakPolarHBondContact OE1-CE 3.42Å; E309-K313 IonicContact OE1-NZ 2.67Å; E309-K313 PolarHBondContact OE1-NZ 3.39Å; K313-N317 WeakPolarHBondContact O-CB 3.45Å; K313-N317 PolarHBondContact O-N 2.95Å; K313-N317 PolarHBondContact O-ND2 3.02Å
314	K	95	Very high	94.9	Very high	130 Å²	130	111.3 Å²	111.3	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-63.4	-43.3	171.8	-78.4	167.2	177.4	168.3	0	112.1	L310 E311 F312 L318	L310-K314 HydrophobicContact CD2-CD 4.04Å; L310-K314 HydrophobicContact CD2-CG 4.37Å; L310-K314 WeakPolarHBondContact O-CD 3.4Å; L310-K314 VanDerWaalsContact O-CG 3.28Å; L310-K314 WeakPolarHBondContact O-CG 3.44Å; L310-K314 PolarHBondContact O-N 3.44Å; L310-K314 VanDerWaalsContact O-N 3.13Å; E311-K314 PolarHBondContact O-N 3.44Å; F312-K314 VanDerWaalsContact C-N 3.31Å; F312-K314 PolarHBondContact O-N 2.95Å; K314-L318 WeakPolarHBondContact O-CB 3.11Å; K314-L318 VanDerWaalsContact O-CG 3.26Å; K314-L318 WeakPolarHBondContact O-CG 3.49Å; K314-L318 PolarHBondContact O-N 3.34Å
315	R	94.4	Very high	94.9	Very high	168 Å²	168	111.6 Å²	111.6	63%	0.634	51%	0.513	S	S	*	.	H	α-helix	trans	-66.6	-40.4	178.8	-172.1	-178.7	-177.4	109.1	0.8	112	E311 F312 L318 L319	E311-R315 WeakPolarHBondContact O-CB 3.3Å; E311-R315 PolarHBondContact O-N 3.08Å; F312-R315 CarbonylContact O-C 3.51Å; F312-R315 WeakPolarHBondContact O-CA 3.49Å; F312-R315 WeakPolarHBondContact O-CB 3.44Å; F312-R315 PolarHBondContact O-N 3.46Å; R315-L318 PolarHBondContact O-N 3.45Å; R315-L319 HydrophobicContact CG-CD1 4.23Å; R315-L319 WeakPolarHBondContact O-CB 3.21Å; R315-L319 VanDerWaalsContact O-CG 3.28Å; R315-L319 WeakPolarHBondContact O-CG 3.27Å; R315-L319 PolarHBondContact O-N 3.15Å
316	E	94.5	Very high	95	Very high	120 Å²	120	108.2 Å²	108.2	56%	0.561	51%	0.505	S	S	*	.	H	α-helix	trans	-61	-53.8	175.5	-178	174.7	-132.8	0	0	111	F312 L318 L319 E320	F312-E316 WeakPolarHBondContact O-CB 3.43Å; F312-E316 PolarHBondContact O-N 2.91Å; E316-L318 VanDerWaalsContact C-N 3.29Å; E316-L318 PolarHBondContact O-N 2.87Å; E316-L319 WeakPolarHBondContact O-CB 3.3Å; E316-L319 PolarHBondContact O-N 2.92Å; E316-E320 PolarHBondContact O-N 3.36Å
317	N	96	Very high	95	Very high	85 Å²	85	109 Å²	109	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-57.7	-40	175.3	-82	-102.7	0	0	0	112.2	K313 L319 E320 I321	K313-N317 WeakPolarHBondContact O-CB 3.45Å; K313-N317 PolarHBondContact O-N 2.95Å; K313-N317 PolarHBondContact O-ND2 3.02Å; N317-L319 VanDerWaalsContact C-N 3.35Å; N317-E320 PolarHBondContact O-N 3.13Å; N317-I321 WeakPolarHBondContact O-CB 3.28Å; N317-I321 WeakPolarHBondContact O-CD1 3.36Å; N317-I321 WeakPolarHBondContact O-CG1 3.3Å; N317-I321 PolarHBondContact O-N 3.36Å
318	L	95.9	Very high	95	Very high	120 Å²	120	105.5 Å²	105.5	63%	0.628	50%	0.5	S	S	*	.	H	α-helix	trans	-68	-32	176	-75.8	169.7	0	0	0	113.2	K314 R315 E316 R322	K314-L318 WeakPolarHBondContact O-CB 3.11Å; K314-L318 VanDerWaalsContact O-CG 3.26Å; K314-L318 WeakPolarHBondContact O-CG 3.49Å; K314-L318 PolarHBondContact O-N 3.34Å; R315-L318 PolarHBondContact O-N 3.45Å; E316-L318 VanDerWaalsContact C-N 3.29Å; E316-L318 PolarHBondContact O-N 2.87Å; L318-R322 WeakPolarHBondContact O-CB 3.45Å; L318-R322 PolarHBondContact O-N 2.81Å
319	L	95.2	Very high	95.1	Very high	96 Å²	96	107 Å²	107	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-73.5	-44.1	173.8	-74.2	169.2	0	0	0	110.9	R315 E316 N317 I321 R322 E323	R315-L319 HydrophobicContact CG-CD1 4.23Å; R315-L319 WeakPolarHBondContact O-CB 3.21Å; R315-L319 VanDerWaalsContact O-CG 3.28Å; R315-L319 WeakPolarHBondContact O-CG 3.27Å; R315-L319 PolarHBondContact O-N 3.15Å; E316-L319 WeakPolarHBondContact O-CB 3.3Å; E316-L319 PolarHBondContact O-N 2.92Å; N317-L319 VanDerWaalsContact C-N 3.35Å; L319-I321 PolarHBondContact O-N 2.89Å; L319-R322 CarbonylContact O-C 3.59Å; L319-R322 WeakPolarHBondContact O-CB 3.36Å; L319-R322 PolarHBondContact O-N 3.4Å; L319-R322 VanDerWaalsContact O-N 3.11Å; L319-E323 WeakPolarHBondContact O-CB 3.42Å; L319-E323 PolarHBondContact O-N 3.07Å
320	E	95.5	Very high	95.2	Very high	80 Å²	80	109 Å²	109	37%	0.374	52%	0.516	S	S	.	.	H	α-helix	trans	-60.7	-43.5	177	-169.1	-164.7	159.5	0	0	112	E316 N317 R322 E323 K324	E316-E320 PolarHBondContact O-N 3.36Å; N317-E320 PolarHBondContact O-N 3.13Å; E320-R322 VanDerWaalsContact C-N 3.31Å; E320-R322 PolarHBondContact O-N 3.07Å; E320-E323 PolarHBondContact O-N 3.19Å; E320-K324 HydrophobicContact CG-CD 4.27Å; E320-K324 WeakPolarHBondContact O-CB 3.29Å; E320-K324 WeakPolarHBondContact O-CG 3.32Å; E320-K324 PolarHBondContact O-N 3.45Å; E320-K324 WeakPolarHBondContact OE1-CE 3.48Å; E320-K324 IonicContact OE1-NZ 2.71Å; E320-K324 PolarHBondContact OE1-NZ 2.94Å
321	I	95.5	Very high	95.2	Very high	105 Å²	105	110 Å²	110	54%	0.538	52%	0.518	S	S	.	.	H	α-helix	trans	-61.9	-40.9	173.9	-70.2	165.1	0	0	0	110.8	N317 L319 T325	N317-I321 WeakPolarHBondContact O-CB 3.28Å; N317-I321 WeakPolarHBondContact O-CD1 3.36Å; N317-I321 WeakPolarHBondContact O-CG1 3.3Å; N317-I321 PolarHBondContact O-N 3.36Å; L319-I321 PolarHBondContact O-N 2.89Å; I321-T325 WeakPolarHBondContact O-CB 3.34Å; I321-T325 PolarHBondContact O-N 2.95Å; I321-T325 PolarHBondContact O-OG1 3.42Å
322	R	96.8	Very high	95.3	Very high	164 Å²	164	110.4 Å²	110.4	62%	0.619	52%	0.518	S	S	*	.	H	α-helix	trans	-69.7	-39.7	178.6	-176.2	179.3	-179.3	-174.3	-0.2	112.1	L318 L319 E320 T325 L326	L318-R322 WeakPolarHBondContact O-CB 3.45Å; L318-R322 PolarHBondContact O-N 2.81Å; L319-R322 CarbonylContact O-C 3.59Å; L319-R322 WeakPolarHBondContact O-CB 3.36Å; L319-R322 PolarHBondContact O-N 3.4Å; L319-R322 VanDerWaalsContact O-N 3.11Å; E320-R322 VanDerWaalsContact C-N 3.31Å; E320-R322 PolarHBondContact O-N 3.07Å; R322-T325 WeakPolarHBondContact O-CB 3.48Å; R322-T325 PolarHBondContact O-N 3.02Å; R322-L326 HydrophobicContact CG-CD1 4.21Å; R322-L326 WeakPolarHBondContact O-CG 3.32Å; R322-L326 PolarHBondContact O-N 3.17Å
323	E	95.6	Very high	95.4	Very high	119 Å²	119	109.6 Å²	109.6	56%	0.556	52%	0.516	S	S	*	.	H	α-helix	trans	-60.9	-55.1	175.7	-176.5	162.6	-138.1	0	0	109.9	L319 E320 T325 L326 E327	L319-E323 WeakPolarHBondContact O-CB 3.42Å; L319-E323 PolarHBondContact O-N 3.07Å; E320-E323 PolarHBondContact O-N 3.19Å; E323-T325 PolarHBondContact O-N 3.48Å; E323-T325 VanDerWaalsContact O-N 3.15Å; E323-L326 CarbonylContact O-C 3.56Å; E323-L326 WeakPolarHBondContact O-CA 3.46Å; E323-L326 PolarHBondContact O-N 3.44Å; E323-E327 WeakPolarHBondContact O-CG 3.25Å; E323-E327 PolarHBondContact O-N 3.36Å
324	K	95.9	Very high	95.4	Very high	115 Å²	115	108.6 Å²	108.6	50%	0.5	52%	0.518	S	S	.	.	H	α-helix	trans	-57.9	-30.9	175.1	-71.8	172.4	175.3	176.1	0	113.6	E320 S328	E320-K324 HydrophobicContact CG-CD 4.27Å; E320-K324 WeakPolarHBondContact O-CB 3.29Å; E320-K324 WeakPolarHBondContact O-CG 3.32Å; E320-K324 PolarHBondContact O-N 3.45Å; E320-K324 WeakPolarHBondContact OE1-CE 3.48Å; E320-K324 IonicContact OE1-NZ 2.71Å; E320-K324 PolarHBondContact OE1-NZ 2.94Å; K324-S328 WeakPolarHBondContact O-CB 3.33Å; K324-S328 PolarHBondContact O-N 2.88Å
325	T	96.2	Very high	95.4	Very high	68 Å²	68	104.3 Å²	104.3	42%	0.417	50%	0.501	S	S	.	.	H	α-helix	trans	-68.2	-48.9	172.6	-58.1	0	0	0	0	111.2	I321 R322 E323 S328 E329	I321-T325 WeakPolarHBondContact O-CB 3.34Å; I321-T325 PolarHBondContact O-N 2.95Å; I321-T325 PolarHBondContact O-OG1 3.42Å; R322-T325 WeakPolarHBondContact O-CB 3.48Å; R322-T325 PolarHBondContact O-N 3.02Å; E323-T325 PolarHBondContact O-N 3.48Å; E323-T325 VanDerWaalsContact O-N 3.15Å; T325-S328 WeakPolarHBondContact O-CB 3.46Å; T325-S328 PolarHBondContact O-N 3.27Å; T325-E329 WeakPolarHBondContact O-CG 3.5Å; T325-E329 PolarHBondContact O-N 3.04Å
326	L	95	Very high	95.4	Very high	78 Å²	78	100.9 Å²	100.9	41%	0.408	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-39.4	177.7	-70.5	169.6	0	0	0	112.2	R322 E323 S328 E329 I330	R322-L326 HydrophobicContact CG-CD1 4.21Å; R322-L326 WeakPolarHBondContact O-CG 3.32Å; R322-L326 PolarHBondContact O-N 3.17Å; E323-L326 CarbonylContact O-C 3.56Å; E323-L326 WeakPolarHBondContact O-CA 3.46Å; E323-L326 PolarHBondContact O-N 3.44Å; L326-S328 VanDerWaalsContact C-N 3.33Å; L326-S328 PolarHBondContact O-N 2.73Å; L326-E329 PolarHBondContact O-N 3.49Å; L326-I330 WeakPolarHBondContact O-CB 3.43Å; L326-I330 WeakPolarHBondContact O-CD1 3.45Å; L326-I330 WeakPolarHBondContact O-CG1 3.4Å; L326-I330 PolarHBondContact O-N 2.88Å
327	E	94.9	Very high	95.4	Very high	116 Å²	116	98.5 Å²	98.5	54%	0.542	48%	0.483	S	S	.	.	H	α-helix	trans	-58.5	-44.6	171	-70.9	-177	131.8	0	0	111.1	E323 I330 H331	E323-E327 WeakPolarHBondContact O-CG 3.25Å; E323-E327 PolarHBondContact O-N 3.36Å; E327-I330 PolarHBondContact O-N 3.31Å; E327-H331 WeakPolarHBondContact O-CB 3.31Å; E327-H331 PolarHBondContact O-N 2.95Å
328	S	95.3	Very high	95.4	Very high	50 Å²	50	100.9 Å²	100.9	35%	0.35	49%	0.485	S	S	.	.	H	α-helix	trans	-63.5	-40.7	176.3	-166.7	0	0	0	0	112.2	K324 T325 L326 K332	K324-S328 WeakPolarHBondContact O-CB 3.33Å; K324-S328 PolarHBondContact O-N 2.88Å; T325-S328 WeakPolarHBondContact O-CB 3.46Å; T325-S328 PolarHBondContact O-N 3.27Å; L326-S328 VanDerWaalsContact C-N 3.33Å; L326-S328 PolarHBondContact O-N 2.73Å; S328-K332 WeakPolarHBondContact O-CB 3.44Å; S328-K332 VanDerWaalsContact O-CD 3.26Å; S328-K332 WeakPolarHBondContact O-CD 3.18Å; S328-K332 WeakPolarHBondContact O-CG 3.41Å; S328-K332 PolarHBondContact O-N 3.24Å; S328-K332 WeakPolarHBondContact OG-CE 3.49Å; S328-K332 PolarHBondContact OG-NZ 2.85Å
329	E	95.9	Very high	95.2	Very high	105 Å²	105	99.8 Å²	99.8	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-67	-45.2	176.1	-73.7	175.7	-177	0	0	112.2	T325 L326 K332 H333	T325-E329 WeakPolarHBondContact O-CG 3.5Å; T325-E329 PolarHBondContact O-N 3.04Å; L326-E329 PolarHBondContact O-N 3.49Å; E329-K332 PolarHBondContact O-N 2.84Å; E329-H333 WeakPolarHBondContact O-CB 3.27Å; E329-H333 PolarHBondContact O-N 2.92Å
330	I	95.1	Very high	95.2	Very high	109 Å²	109	99 Å²	99	56%	0.559	47%	0.472	S	S	*	.	H	α-helix	trans	-62.6	-46	175.3	-69.6	164.4	0	0	0	110.1	L326 E327 K332 H333 V334	L326-I330 WeakPolarHBondContact O-CB 3.43Å; L326-I330 WeakPolarHBondContact O-CD1 3.45Å; L326-I330 WeakPolarHBondContact O-CG1 3.4Å; L326-I330 PolarHBondContact O-N 2.88Å; E327-I330 PolarHBondContact O-N 3.31Å; I330-K332 PolarHBondContact O-N 3.46Å; I330-H333 PolarHBondContact O-N 2.71Å; I330-H333 VanDerWaalsContact O-N 3.15Å; I330-V334 HydrophobicContact CG2-CG2 4.18Å; I330-V334 WeakPolarHBondContact O-CB 3.34Å; I330-V334 VanDerWaalsContact O-CG2 3.31Å; I330-V334 WeakPolarHBondContact O-CG2 3.44Å; I330-V334 PolarHBondContact O-N 2.96Å
331	H	95.9	Very high	95.1	Very high	120 Å²	120	98.6 Å²	98.6	56%	0.556	47%	0.472	S	S	*	.	H	α-helix	trans	-62.6	-41.3	178.1	-173.4	85.8	0	0	0	111.9	E327 N335	E327-H331 WeakPolarHBondContact O-CB 3.31Å; E327-H331 PolarHBondContact O-N 2.95Å; H331-N335 PolarHBondContact CD2-ND2 3.05Å; H331-N335 PolarHBondContact NE2-ND2 2.91Å; H331-N335 WeakPolarHBondContact O-CB 3.46Å; H331-N335 VanDerWaalsContact O-CG 3.29Å; H331-N335 PolarHBondContact O-N 3.49Å; H331-N335 PolarHBondContact O-ND2 2.67Å; H331-N335 VanDerWaalsContact O-ND2 3.09Å
332	K	95.2	Very high	95.1	Very high	129 Å²	129	99 Å²	99	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-59.8	-46.3	171	-74.5	160	-175.3	142.7	0	111.5	S328 E329 I330 N335 Q336	S328-K332 WeakPolarHBondContact O-CB 3.44Å; S328-K332 VanDerWaalsContact O-CD 3.26Å; S328-K332 WeakPolarHBondContact O-CD 3.18Å; S328-K332 WeakPolarHBondContact O-CG 3.41Å; S328-K332 PolarHBondContact O-N 3.24Å; S328-K332 WeakPolarHBondContact OG-CE 3.49Å; S328-K332 PolarHBondContact OG-NZ 2.85Å; E329-K332 PolarHBondContact O-N 2.84Å; I330-K332 PolarHBondContact O-N 3.46Å; K332-N335 PolarHBondContact O-N 3.41Å; K332-Q336 WeakPolarHBondContact O-CB 3.42Å; K332-Q336 PolarHBondContact O-N 3.37Å
333	H	94.6	Very high	95	Very high	121 Å²	121	95.2 Å²	95.2	56%	0.56	46%	0.463	S	S	*	.	H	α-helix	trans	-70.3	-38.6	-177.2	-162.5	50.5	0	0	0	112.7	E329 I330 Q336 I337	E329-H333 WeakPolarHBondContact O-CB 3.27Å; E329-H333 PolarHBondContact O-N 2.92Å; I330-H333 PolarHBondContact O-N 2.71Å; I330-H333 VanDerWaalsContact O-N 3.15Å; H333-Q336 WeakPolarHBondContact O-CB 3.38Å; H333-Q336 PolarHBondContact O-N 2.84Å; H333-I337 VanDerWaalsContact O-CG1 3.31Å; H333-I337 WeakPolarHBondContact O-CG1 3.38Å; H333-I337 PolarHBondContact O-N 2.9Å
334	V	95	Very high	95	Very high	82 Å²	82	93.9 Å²	93.9	50%	0.497	46%	0.456	S	S	.	.	H	α-helix	trans	-64.4	-42.9	173	169.7	0	0	0	0	111.2	I330 I337 R338	I330-V334 HydrophobicContact CG2-CG2 4.18Å; I330-V334 WeakPolarHBondContact O-CB 3.34Å; I330-V334 VanDerWaalsContact O-CG2 3.31Å; I330-V334 WeakPolarHBondContact O-CG2 3.44Å; I330-V334 PolarHBondContact O-N 2.96Å; V334-I337 PolarHBondContact O-N 3.25Å; V334-R338 WeakPolarHBondContact O-CB 3.38Å; V334-R338 PolarHBondContact O-N 3.14Å
335	N	94.5	Very high	94.8	Very high	40 Å²	40	93.6 Å²	93.6	21%	0.214	46%	0.459	C	S	.	.	H	α-helix	trans	-63	-40.9	173	-76.7	-37.4	0	0	0	111.9	H331 K332 R338 M339	H331-N335 PolarHBondContact CD2-ND2 3.05Å; H331-N335 PolarHBondContact NE2-ND2 2.91Å; H331-N335 WeakPolarHBondContact O-CB 3.46Å; H331-N335 VanDerWaalsContact O-CG 3.29Å; H331-N335 PolarHBondContact O-N 3.49Å; H331-N335 PolarHBondContact O-ND2 2.67Å; H331-N335 VanDerWaalsContact O-ND2 3.09Å; K332-N335 PolarHBondContact O-N 3.41Å; N335-R338 PolarHBondContact O-N 3.25Å; N335-R338 PolarHBondContact OD1-NH1 2.81Å; N335-R338 PolarHBondContact OD1-NH2 3.08Å; N335-M339 VanDerWaalsContact O-CG 3.31Å; N335-M339 WeakPolarHBondContact O-CG 3.36Å; N335-M339 PolarHBondContact O-N 3.48Å
336	Q	95.9	Very high	94.7	Very high	97 Å²	97	94.7 Å²	94.7	45%	0.453	46%	0.46	S	S	.	.	H	α-helix	trans	-61.8	-48.5	176.2	178	63	24.4	0	0	111.5	K332 H333 R338 M339 E340	K332-Q336 WeakPolarHBondContact O-CB 3.42Å; K332-Q336 PolarHBondContact O-N 3.37Å; H333-Q336 WeakPolarHBondContact O-CB 3.38Å; H333-Q336 PolarHBondContact O-N 2.84Å; Q336-R338 VanDerWaalsContact C-N 3.35Å; Q336-R338 PolarHBondContact O-N 3.26Å; Q336-M339 PolarHBondContact O-N 3.18Å; Q336-E340 PolarHBondContact NE2-OE1 2.9Å; Q336-E340 WeakPolarHBondContact O-CB 3.43Å; Q336-E340 WeakPolarHBondContact O-CG 3.5Å; Q336-E340 PolarHBondContact O-N 2.93Å
337	I	94.1	Very high	94.7	Very high	70 Å²	70	97.9 Å²	97.9	36%	0.359	47%	0.471	S	S	.	.	H	α-helix	trans	-60.2	-44.7	176.4	-68.9	164.4	0	0	0	110.5	H333 V334 M339 E340 D341	H333-I337 VanDerWaalsContact O-CG1 3.31Å; H333-I337 WeakPolarHBondContact O-CG1 3.38Å; H333-I337 PolarHBondContact O-N 2.9Å; V334-I337 PolarHBondContact O-N 3.25Å; I337-M339 PolarHBondContact O-N 2.85Å; I337-E340 PolarHBondContact O-N 2.91Å; I337-D341 WeakPolarHBondContact O-CB 3.48Å; I337-D341 PolarHBondContact O-N 2.62Å
338	R	94.9	Very high	94.6	Very high	135 Å²	135	97.9 Å²	97.9	51%	0.509	47%	0.471	S	S	.	.	H	α-helix	trans	-58.4	-46	176.4	-171.7	-178.9	70.5	-122.3	-7.5	111.9	V334 N335 Q336 D341 E342	V334-R338 WeakPolarHBondContact O-CB 3.38Å; V334-R338 PolarHBondContact O-N 3.14Å; N335-R338 PolarHBondContact O-N 3.25Å; N335-R338 PolarHBondContact OD1-NH1 2.81Å; N335-R338 PolarHBondContact OD1-NH2 3.08Å; Q336-R338 VanDerWaalsContact C-N 3.35Å; Q336-R338 PolarHBondContact O-N 3.26Å; R338-D341 PolarHBondContact O-N 3.29Å; R338-E342 WeakPolarHBondContact O-CB 3.46Å; R338-E342 PolarHBondContact O-N 3.4Å
339	M	93.4	Very high	94.6	Very high	97 Å²	97	104.2 Å²	104.2	48%	0.478	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-41.5	176.8	-72.1	-65.8	-163	0	0	112	N335 Q336 I337 E342 I343	N335-M339 VanDerWaalsContact O-CG 3.31Å; N335-M339 WeakPolarHBondContact O-CG 3.36Å; N335-M339 PolarHBondContact O-N 3.48Å; Q336-M339 PolarHBondContact O-N 3.18Å; I337-M339 PolarHBondContact O-N 2.85Å; M339-E342 PolarHBondContact O-N 3.42Å; M339-I343 WeakPolarHBondContact O-CB 3.29Å; M339-I343 WeakPolarHBondContact O-CD1 3.33Å; M339-I343 WeakPolarHBondContact O-CG1 3.36Å; M339-I343 PolarHBondContact O-N 2.91Å
340	E	93.8	Very high	94.5	Very high	79 Å²	79	105.1 Å²	105.1	37%	0.369	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-41.2	176.6	-77.8	-177.9	-155.1	0	0	112.6	Q336 I337 I343 K344	Q336-E340 PolarHBondContact NE2-OE1 2.9Å; Q336-E340 WeakPolarHBondContact O-CB 3.43Å; Q336-E340 WeakPolarHBondContact O-CG 3.5Å; Q336-E340 PolarHBondContact O-N 2.93Å; I337-E340 PolarHBondContact O-N 2.91Å; E340-I343 PolarHBondContact O-N 3.37Å; E340-K344 WeakPolarHBondContact O-CD 3.38Å; E340-K344 WeakPolarHBondContact O-CE 3.39Å; E340-K344 WeakPolarHBondContact O-CG 3.43Å; E340-K344 PolarHBondContact O-N 3.46Å; E340-K344 IonicContact OE2-NZ 3.64Å
341	D	94.5	Very high	94.5	Very high	71 Å²	71	104.4 Å²	104.4	38%	0.38	48%	0.484	S	S	.	.	H	α-helix	trans	-71.9	-36.7	177.7	-72.6	-13.6	0	0	0	111.8	I337 R338 I343 K344 L345	I337-D341 WeakPolarHBondContact O-CB 3.48Å; I337-D341 PolarHBondContact O-N 2.62Å; R338-D341 PolarHBondContact O-N 3.29Å; D341-I343 VanDerWaalsContact C-N 3.34Å; D341-I343 PolarHBondContact O-N 2.89Å; D341-K344 PolarHBondContact O-N 2.93Å; D341-K344 WeakPolarHBondContact OD1-CD 3.5Å; D341-K344 WeakPolarHBondContact OD1-CE 3.32Å; D341-K344 IonicContact OD1-NZ 3.63Å; D341-K344 PolarHBondContact OD1-NZ 3.44Å; D341-L345 WeakPolarHBondContact O-CB 3.46Å; D341-L345 VanDerWaalsContact O-CG 3.25Å; D341-L345 WeakPolarHBondContact O-CG 3.4Å; D341-L345 PolarHBondContact O-N 3.45Å
342	E	94.8	Very high	94.3	Very high	115 Å²	115	104.1 Å²	104.1	54%	0.537	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-41.5	169.3	-174.1	171.9	-178	0	0	111.6	R338 M339 L345 M346	R338-E342 WeakPolarHBondContact O-CB 3.46Å; R338-E342 PolarHBondContact O-N 3.4Å; M339-E342 PolarHBondContact O-N 3.42Å; E342-L345 PolarHBondContact O-N 3.45Å; E342-M346 WeakPolarHBondContact O-CB 3.38Å; E342-M346 PolarHBondContact O-N 2.86Å
343	I	95	Very high	94.1	Very high	83 Å²	83	103.8 Å²	103.8	43%	0.426	49%	0.486	S	S	.	.	H	α-helix	trans	-65.9	-40.3	174.3	-71.2	164.2	0	0	0	111.6	M339 E340 D341 M346 K347	M339-I343 WeakPolarHBondContact O-CB 3.29Å; M339-I343 WeakPolarHBondContact O-CD1 3.33Å; M339-I343 WeakPolarHBondContact O-CG1 3.36Å; M339-I343 PolarHBondContact O-N 2.91Å; E340-I343 PolarHBondContact O-N 3.37Å; D341-I343 VanDerWaalsContact C-N 3.34Å; D341-I343 PolarHBondContact O-N 2.89Å; I343-M346 PolarHBondContact O-N 3.44Å; I343-K347 HydrophobicContact CG2-CD 4.18Å; I343-K347 WeakPolarHBondContact O-CB 3.46Å; I343-K347 VanDerWaalsContact O-CG 3.3Å; I343-K347 WeakPolarHBondContact O-CG 3.48Å; I343-K347 PolarHBondContact O-N 2.95Å
344	K	94.3	Very high	94	Very high	92 Å²	92	102.2 Å²	102.2	40%	0.4	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-47.2	174.7	-71	160.4	-146.7	159.5	0	110.6	E340 D341 K347 Q348	E340-K344 WeakPolarHBondContact O-CD 3.38Å; E340-K344 WeakPolarHBondContact O-CE 3.39Å; E340-K344 WeakPolarHBondContact O-CG 3.43Å; E340-K344 PolarHBondContact O-N 3.46Å; E340-K344 IonicContact OE2-NZ 3.64Å; D341-K344 PolarHBondContact O-N 2.93Å; D341-K344 WeakPolarHBondContact OD1-CD 3.5Å; D341-K344 WeakPolarHBondContact OD1-CE 3.32Å; D341-K344 IonicContact OD1-NZ 3.63Å; D341-K344 PolarHBondContact OD1-NZ 3.44Å; K344-K347 PolarHBondContact O-N 3.14Å; K344-Q348 WeakPolarHBondContact O-CB 3.48Å; K344-Q348 WeakPolarHBondContact O-CG 3.39Å; K344-Q348 PolarHBondContact O-N 3.19Å
345	L	93.6	Very high	93.9	Very high	109 Å²	109	102.1 Å²	102.1	57%	0.571	48%	0.476	S	S	*	.	H	α-helix	trans	-65.7	-38.1	177.9	-71.1	169.8	0	0	0	112.3	D341 E342 R349	D341-L345 WeakPolarHBondContact O-CB 3.46Å; D341-L345 VanDerWaalsContact O-CG 3.25Å; D341-L345 WeakPolarHBondContact O-CG 3.4Å; D341-L345 PolarHBondContact O-N 3.45Å; E342-L345 PolarHBondContact O-N 3.45Å; L345-R349 VanDerWaalsContact O-CB 3.26Å; L345-R349 WeakPolarHBondContact O-CB 3.45Å; L345-R349 PolarHBondContact O-N 3.04Å
346	M	93.5	Very high	93.7	Very high	91 Å²	91	103.9 Å²	103.9	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-42.1	173.9	-168.6	-148	-63.5	0	0	111.5	E342 I343 R349 K350	E342-M346 WeakPolarHBondContact O-CB 3.38Å; E342-M346 PolarHBondContact O-N 2.86Å; I343-M346 PolarHBondContact O-N 3.44Å; M346-R349 PolarHBondContact O-N 3.09Å; M346-K350 HydrophobicContact CG-CD 4.39Å; M346-K350 WeakPolarHBondContact O-CG 3.48Å; M346-K350 PolarHBondContact O-N 3.45Å; M346-K350 HydrophobicContact SD-CD 4.41Å; M346-K350 PolarHBondContact SD-NZ 3.23Å
347	K	94.6	Very high	93.5	Very high	144 Å²	144	103.4 Å²	103.4	63%	0.626	49%	0.494	S	S	*	.	H	α-helix	trans	-63.4	-48.3	175.4	-75	172.3	179.3	178.2	0	111.3	I343 K344 R349 K350 E351	I343-K347 HydrophobicContact CG2-CD 4.18Å; I343-K347 WeakPolarHBondContact O-CB 3.46Å; I343-K347 VanDerWaalsContact O-CG 3.3Å; I343-K347 WeakPolarHBondContact O-CG 3.48Å; I343-K347 PolarHBondContact O-N 2.95Å; K344-K347 PolarHBondContact O-N 3.14Å; K347-R349 VanDerWaalsContact C-N 3.33Å; K347-R349 PolarHBondContact O-N 3.5Å; K347-K350 PolarHBondContact O-N 2.82Å; K347-E351 WeakPolarHBondContact O-CB 3.15Å; K347-E351 PolarHBondContact O-N 3.02Å
348	Q	93.8	Very high	93.3	Very high	117 Å²	117	104.5 Å²	104.5	55%	0.547	50%	0.498	S	S	.	.	H	α-helix	trans	-60.7	-40.3	176.1	-74.6	176.3	-17.5	0	0	112.2	K344 E351 L352	K344-Q348 WeakPolarHBondContact O-CB 3.48Å; K344-Q348 WeakPolarHBondContact O-CG 3.39Å; K344-Q348 PolarHBondContact O-N 3.19Å; Q348-E351 PolarHBondContact O-N 2.91Å; Q348-L352 WeakPolarHBondContact O-CB 3.42Å; Q348-L352 VanDerWaalsContact O-CG 3.27Å; Q348-L352 WeakPolarHBondContact O-CG 3.45Å; Q348-L352 PolarHBondContact O-N 3.38Å
349	R	94	Very high	93.1	Very high	182 Å²	182	103.9 Å²	103.9	69%	0.687	50%	0.504	S	S	*	.	H	α-helix	trans	-61	-48	175.3	-176.9	-179.2	-63.7	-85	0.7	111.7	L345 M346 K347 L352 E353	L345-R349 VanDerWaalsContact O-CB 3.26Å; L345-R349 WeakPolarHBondContact O-CB 3.45Å; L345-R349 PolarHBondContact O-N 3.04Å; M346-R349 PolarHBondContact O-N 3.09Å; K347-R349 VanDerWaalsContact C-N 3.33Å; K347-R349 PolarHBondContact O-N 3.5Å; R349-L352 PolarHBondContact O-N 2.85Å; R349-E353 VanDerWaalsContact O-CB 3.27Å; R349-E353 WeakPolarHBondContact O-CB 3.29Å; R349-E353 PolarHBondContact O-N 3.38Å
350	K	94.3	Very high	93	Very high	124 Å²	124	101.6 Å²	101.6	54%	0.539	50%	0.498	S	S	.	.	H	α-helix	trans	-65.4	-36.7	178.5	-74.8	174.9	174.1	174.4	0	112.7	M346 K347 E353 L354	M346-K350 HydrophobicContact CG-CD 4.39Å; M346-K350 WeakPolarHBondContact O-CG 3.48Å; M346-K350 PolarHBondContact O-N 3.45Å; M346-K350 HydrophobicContact SD-CD 4.41Å; M346-K350 PolarHBondContact SD-NZ 3.23Å; K347-K350 PolarHBondContact O-N 2.82Å; K350-E353 PolarHBondContact O-N 2.86Å; K350-L354 WeakPolarHBondContact O-CB 3.4Å; K350-L354 PolarHBondContact O-N 3.11Å
351	E	94.3	Very high	92.9	Very high	95 Å²	95	104.3 Å²	104.3	44%	0.444	51%	0.511	S	S	.	.	H	α-helix	trans	-66	-46.5	174.3	-176.7	59.6	-149.9	0	0	111.3	K347 Q348 E353 L354 Q355	K347-E351 WeakPolarHBondContact O-CB 3.15Å; K347-E351 PolarHBondContact O-N 3.02Å; Q348-E351 PolarHBondContact O-N 2.91Å; E351-E353 VanDerWaalsContact C-N 3.32Å; E351-E353 PolarHBondContact O-N 3.31Å; E351-L354 PolarHBondContact O-N 3.35Å; E351-Q355 WeakPolarHBondContact O-CB 3.43Å; E351-Q355 VanDerWaalsContact O-CG 3.3Å; E351-Q355 WeakPolarHBondContact O-CG 3.47Å; E351-Q355 PolarHBondContact O-N 2.75Å; E351-Q355 PolarHBondContact OE1-NE2 2.84Å
352	L	92.1	Very high	92.8	Very high	113 Å²	113	105 Å²	105	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-64.9	-34.6	175.7	-72.1	169.3	0	0	0	112.6	Q348 R349 S356	Q348-L352 WeakPolarHBondContact O-CB 3.42Å; Q348-L352 VanDerWaalsContact O-CG 3.27Å; Q348-L352 WeakPolarHBondContact O-CG 3.45Å; Q348-L352 PolarHBondContact O-N 3.38Å; R349-L352 PolarHBondContact O-N 2.85Å; L352-S356 WeakPolarHBondContact O-CB 3.27Å; L352-S356 PolarHBondContact O-N 3.11Å
353	E	92.2	Very high	92.7	Very high	123 Å²	123	104.9 Å²	104.9	58%	0.575	51%	0.514	S	S	*	.	H	α-helix	trans	-66	-46.2	173.8	-175.2	171	-159.7	0	0	111.1	R349 K350 E351 S356 V357	R349-E353 VanDerWaalsContact O-CB 3.27Å; R349-E353 WeakPolarHBondContact O-CB 3.29Å; R349-E353 PolarHBondContact O-N 3.38Å; K350-E353 PolarHBondContact O-N 2.86Å; E351-E353 VanDerWaalsContact C-N 3.32Å; E351-E353 PolarHBondContact O-N 3.31Å; E353-S356 PolarHBondContact O-N 2.89Å; E353-V357 WeakPolarHBondContact O-CG2 3.43Å; E353-V357 PolarHBondContact O-N 3.33Å
354	L	92.5	Very high	92.5	Very high	88 Å²	88	106.9 Å²	106.9	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-61.3	-46.5	174.1	-179.5	62.6	0	0	0	112	K350 E351 S356 V357 Q358	K350-L354 WeakPolarHBondContact O-CB 3.4Å; K350-L354 PolarHBondContact O-N 3.11Å; E351-L354 PolarHBondContact O-N 3.35Å; L354-S356 VanDerWaalsContact C-N 3.33Å; L354-S356 PolarHBondContact O-N 2.66Å; L354-V357 PolarHBondContact O-N 3.26Å; L354-Q358 WeakPolarHBondContact O-CB 3.36Å; L354-Q358 WeakPolarHBondContact O-CG 3.48Å; L354-Q358 PolarHBondContact O-N 2.86Å
355	Q	92	Very high	92.2	Very high	80 Å²	80	105.8 Å²	105.8	37%	0.374	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-36.9	176	-71	178.6	16	0	0	111.9	E351 Q358 L359	E351-Q355 WeakPolarHBondContact O-CB 3.43Å; E351-Q355 VanDerWaalsContact O-CG 3.3Å; E351-Q355 WeakPolarHBondContact O-CG 3.47Å; E351-Q355 PolarHBondContact O-N 2.75Å; E351-Q355 PolarHBondContact OE1-NE2 2.84Å; Q355-Q358 PolarHBondContact O-N 3.36Å; Q355-L359 VanDerWaalsContact O-CB 3.32Å; Q355-L359 WeakPolarHBondContact O-CB 3.26Å; Q355-L359 VanDerWaalsContact O-CG 3.24Å; Q355-L359 WeakPolarHBondContact O-CG 3.48Å; Q355-L359 PolarHBondContact O-N 2.94Å
356	S	90.2	Very high	92	Very high	76 Å²	76	105.6 Å²	105.6	53%	0.531	52%	0.515	S	S	.	.	H	α-helix	trans	-65.5	-42.4	175.5	-177.4	0	0	0	0	112.1	L352 E353 L354 L359 S360	L352-S356 WeakPolarHBondContact O-CB 3.27Å; L352-S356 PolarHBondContact O-N 3.11Å; E353-S356 PolarHBondContact O-N 2.89Å; L354-S356 VanDerWaalsContact C-N 3.33Å; L354-S356 PolarHBondContact O-N 2.66Å; S356-L359 PolarHBondContact O-N 2.98Å; S356-S360 WeakPolarHBondContact O-CB 3.28Å; S356-S360 PolarHBondContact O-N 3.27Å
357	V	90.6	Very high	91.8	Very high	87 Å²	87	106 Å²	106	53%	0.527	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-48	173.5	171.3	0	0	0	0	110.8	E353 L354 L359 S360 E361	E353-V357 WeakPolarHBondContact O-CG2 3.43Å; E353-V357 PolarHBondContact O-N 3.33Å; L354-V357 PolarHBondContact O-N 3.26Å; V357-L359 VanDerWaalsContact C-N 3.34Å; V357-L359 PolarHBondContact O-N 3.47Å; V357-S360 PolarHBondContact O-N 2.86Å; V357-E361 PolarHBondContact O-N 2.87Å
358	Q	91.3	Very high	91.5	Very high	94 Å²	94	105.5 Å²	105.5	44%	0.439	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-39.4	177.1	-73.3	177	1	0	0	112.5	L354 Q355 N362	L354-Q358 WeakPolarHBondContact O-CB 3.36Å; L354-Q358 WeakPolarHBondContact O-CG 3.48Å; L354-Q358 PolarHBondContact O-N 2.86Å; Q355-Q358 PolarHBondContact O-N 3.36Å; Q358-N362 VanDerWaalsContact O-CB 3.31Å; Q358-N362 WeakPolarHBondContact O-CB 3.37Å; Q358-N362 PolarHBondContact O-N 2.86Å; Q358-N362 PolarHBondContact O-ND2 3.46Å
359	L	90	Very high	91.4	Very high	121 Å²	121	105.8 Å²	105.8	63%	0.634	52%	0.516	S	S	*	.	H	α-helix	trans	-67.9	-38.3	175.4	-75.2	169.6	0	0	0	111.7	Q355 S356 V357 Q363	Q355-L359 VanDerWaalsContact O-CB 3.32Å; Q355-L359 WeakPolarHBondContact O-CB 3.26Å; Q355-L359 VanDerWaalsContact O-CG 3.24Å; Q355-L359 WeakPolarHBondContact O-CG 3.48Å; Q355-L359 PolarHBondContact O-N 2.94Å; S356-L359 PolarHBondContact O-N 2.98Å; V357-L359 VanDerWaalsContact C-N 3.34Å; V357-L359 PolarHBondContact O-N 3.47Å; L359-Q363 VanDerWaalsContact O-CB 3.28Å; L359-Q363 WeakPolarHBondContact O-CB 3.47Å; L359-Q363 PolarHBondContact O-N 3.49Å
360	S	91.4	Very high	91.2	Very high	50 Å²	50	102.2 Å²	102.2	35%	0.35	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-39.2	175.2	-171.6	0	0	0	0	112.5	S356 V357 Q363 K364	S356-S360 WeakPolarHBondContact O-CB 3.28Å; S356-S360 PolarHBondContact O-N 3.27Å; V357-S360 PolarHBondContact O-N 2.86Å; S360-Q363 PolarHBondContact O-N 2.82Å; S360-K364 WeakPolarHBondContact O-CG 3.46Å; S360-K364 PolarHBondContact O-N 3.28Å
361	E	91.5	Very high	91	Very high	136 Å²	136	103.1 Å²	103.1	64%	0.636	51%	0.513	S	S	*	.	H	α-helix	trans	-67.9	-44.9	174.8	-174.4	169.4	-148.2	0	0	111.6	V357 Q363 K364 M365	V357-E361 PolarHBondContact O-N 2.87Å; E361-Q363 VanDerWaalsContact C-N 3.32Å; E361-Q363 PolarHBondContact O-N 2.92Å; E361-K364 PolarHBondContact O-N 3.44Å; E361-M365 WeakPolarHBondContact O-CB 3.27Å; E361-M365 PolarHBondContact O-N 2.88Å
362	N	92.1	Very high	90.6	Very high	85 Å²	85	102 Å²	102	46%	0.455	51%	0.513	S	S	.	.	H	α-helix	trans	-60.8	-39.7	173	-81.3	-63.9	0	0	0	112.1	Q358 M365 L366	Q358-N362 VanDerWaalsContact O-CB 3.31Å; Q358-N362 WeakPolarHBondContact O-CB 3.37Å; Q358-N362 PolarHBondContact O-N 2.86Å; Q358-N362 PolarHBondContact O-ND2 3.46Å; N362-M365 PolarHBondContact O-N 3.37Å; N362-M365 WeakPolarHBondContact OD1-CE 3.14Å; N362-L366 WeakPolarHBondContact O-CB 3.36Å; N362-L366 PolarHBondContact O-N 3.36Å
363	Q	92.5	Very high	90.4	Very high	113 Å²	113	102.9 Å²	102.9	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-50.7	175	178.9	-177.7	-20.1	0	0	111.1	L359 S360 E361 M365 L366 E367	L359-Q363 VanDerWaalsContact O-CB 3.28Å; L359-Q363 WeakPolarHBondContact O-CB 3.47Å; L359-Q363 PolarHBondContact O-N 3.49Å; S360-Q363 PolarHBondContact O-N 2.82Å; E361-Q363 VanDerWaalsContact C-N 3.32Å; E361-Q363 PolarHBondContact O-N 2.92Å; Q363-M365 VanDerWaalsContact C-N 3.31Å; Q363-M365 PolarHBondContact O-N 2.88Å; Q363-L366 CarbonylContact O-C 3.57Å; Q363-L366 WeakPolarHBondContact O-CA 3.47Å; Q363-L366 WeakPolarHBondContact O-CB 3.37Å; Q363-L366 PolarHBondContact O-N 3.32Å; Q363-E367 HydrophobicContact CG-CG 4.45Å; Q363-E367 WeakPolarHBondContact CG-OE1 3.46Å; Q363-E367 PolarHBondContact NE2-OE1 3.29Å; Q363-E367 WeakPolarHBondContact O-CG 3.28Å; Q363-E367 PolarHBondContact O-N 3.32Å
364	K	90.9	Very high	90.2	Very high	125 Å²	125	100.4 Å²	100.4	54%	0.543	50%	0.501	S	S	.	.	H	α-helix	trans	-57.7	-44.3	176.9	-73.8	171	-178.2	173.6	0	111.9	S360 E361 L366 E367 E368	S360-K364 WeakPolarHBondContact O-CG 3.46Å; S360-K364 PolarHBondContact O-N 3.28Å; E361-K364 PolarHBondContact O-N 3.44Å; K364-L366 VanDerWaalsContact C-N 3.27Å; K364-L366 PolarHBondContact O-N 3.19Å; K364-E367 PolarHBondContact O-N 3.13Å; K364-E368 WeakPolarHBondContact O-CG 3.5Å; K364-E368 PolarHBondContact O-N 2.9Å
365	M	89.3	Confident	90	Very high	68 Å²	68	101.7 Å²	101.7	34%	0.335	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-30.8	176.4	179	-92.3	-66.7	0	0	112.4	E361 N362 Q363 K369	E361-M365 WeakPolarHBondContact O-CB 3.27Å; E361-M365 PolarHBondContact O-N 2.88Å; N362-M365 PolarHBondContact O-N 3.37Å; N362-M365 WeakPolarHBondContact OD1-CE 3.14Å; Q363-M365 VanDerWaalsContact C-N 3.31Å; Q363-M365 PolarHBondContact O-N 2.88Å; M365-K369 WeakPolarHBondContact O-CB 3.39Å; M365-K369 VanDerWaalsContact O-CG 3.27Å; M365-K369 WeakPolarHBondContact O-CG 3.33Å; M365-K369 PolarHBondContact O-N 2.85Å; M365-K369 VanDerWaalsContact O-N 3.1Å; M365-K369 HydrophobicContact SD-CD 3.72Å; M365-K369 WeakPolarHBondContact SD-CE 3.38Å; M365-K369 PolarHBondContact SD-NZ 3.02Å
366	L	89.2	Confident	89.8	Confident	106 Å²	106	103.7 Å²	103.7	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-72.9	-40.3	171.3	-144.3	84.8	0	0	0	112.2	N362 Q363 K364 K369 L370	N362-L366 WeakPolarHBondContact O-CB 3.36Å; N362-L366 PolarHBondContact O-N 3.36Å; Q363-L366 CarbonylContact O-C 3.57Å; Q363-L366 WeakPolarHBondContact O-CA 3.47Å; Q363-L366 WeakPolarHBondContact O-CB 3.37Å; Q363-L366 PolarHBondContact O-N 3.32Å; K364-L366 VanDerWaalsContact C-N 3.27Å; K364-L366 PolarHBondContact O-N 3.19Å; L366-K369 PolarHBondContact O-N 3.44Å; L366-L370 WeakPolarHBondContact O-CB 3.15Å; L366-L370 WeakPolarHBondContact O-CG 3.47Å; L366-L370 PolarHBondContact O-N 3.3Å
367	E	89.4	Confident	89.8	Confident	100 Å²	100	104.5 Å²	104.5	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-65	-40.5	176	-72.6	171.7	-171.8	0	0	111.7	Q363 K364 L370 K371	Q363-E367 HydrophobicContact CG-CG 4.45Å; Q363-E367 WeakPolarHBondContact CG-OE1 3.46Å; Q363-E367 PolarHBondContact NE2-OE1 3.29Å; Q363-E367 WeakPolarHBondContact O-CG 3.28Å; Q363-E367 PolarHBondContact O-N 3.32Å; K364-E367 PolarHBondContact O-N 3.13Å; E367-L370 PolarHBondContact O-N 2.71Å; E367-K371 VanDerWaalsContact O-CB 3.3Å; E367-K371 WeakPolarHBondContact O-CB 3.23Å; E367-K371 PolarHBondContact O-N 3.14Å
368	E	88.8	Confident	89.6	Confident	133 Å²	133	105.5 Å²	105.5	62%	0.621	51%	0.51	S	S	*	.	H	α-helix	trans	-65.8	-39.3	172	-73	-176.3	165.8	0	0	112.2	K364 K371 T372	K364-E368 WeakPolarHBondContact O-CG 3.5Å; K364-E368 PolarHBondContact O-N 2.9Å; E368-K371 PolarHBondContact O-N 3.36Å; E368-T372 WeakPolarHBondContact O-CB 3.49Å; E368-T372 WeakPolarHBondContact O-CG2 3.48Å; E368-T372 PolarHBondContact O-N 2.88Å; E368-T372 PolarHBondContact O-OG1 2.9Å
369	K	91	Very high	89.3	Confident	123 Å²	123	104.5 Å²	104.5	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-40.4	172.2	-79.9	174	178.4	174.2	0	112.4	M365 L366 T372 F373	M365-K369 WeakPolarHBondContact O-CB 3.39Å; M365-K369 VanDerWaalsContact O-CG 3.27Å; M365-K369 WeakPolarHBondContact O-CG 3.33Å; M365-K369 PolarHBondContact O-N 2.85Å; M365-K369 VanDerWaalsContact O-N 3.1Å; M365-K369 HydrophobicContact SD-CD 3.72Å; M365-K369 WeakPolarHBondContact SD-CE 3.38Å; M365-K369 PolarHBondContact SD-NZ 3.02Å; L366-K369 PolarHBondContact O-N 3.44Å; K369-T372 WeakPolarHBondContact CA-OG1 3.36Å; K369-T372 PolarHBondContact O-OG1 3.26Å; K369-T372 VanDerWaalsContact O-OG1 3.12Å; K369-F373 WeakPolarHBondContact O-CB 3.28Å; K369-F373 PolarHBondContact O-N 2.88Å
370	L	90.4	Very high	89.1	Confident	107 Å²	107	104.4 Å²	104.4	56%	0.56	51%	0.505	S	S	*	.	H	α-helix	trans	-65	-41.6	173.9	-77.3	166.8	0	0	0	111.5	L366 E367 F373 E374	L366-L370 WeakPolarHBondContact O-CB 3.15Å; L366-L370 WeakPolarHBondContact O-CG 3.47Å; L366-L370 PolarHBondContact O-N 3.3Å; E367-L370 PolarHBondContact O-N 2.71Å; L370-F373 PolarHBondContact O-N 2.99Å; L370-E374 WeakPolarHBondContact O-CB 3.29Å; L370-E374 PolarHBondContact O-N 3.49Å
371	K	90	Very high	88.8	Confident	143 Å²	143	106.4 Å²	106.4	62%	0.622	51%	0.511	S	S	*	.	H	α-helix	trans	-65.4	-43.3	178	-172.2	176.9	-178.3	-179.7	0	112.4	E367 E368 Q375	E367-K371 VanDerWaalsContact O-CB 3.3Å; E367-K371 WeakPolarHBondContact O-CB 3.23Å; E367-K371 PolarHBondContact O-N 3.14Å; E368-K371 PolarHBondContact O-N 3.36Å; K371-Q375 VanDerWaalsContact O-CG 3.3Å; K371-Q375 WeakPolarHBondContact O-CG 3.48Å; K371-Q375 PolarHBondContact O-N 3.01Å
372	T	85.5	Confident	88.3	Confident	71 Å²	71	105.1 Å²	105.1	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-70.8	-36.1	175.2	48.8	0	0	0	0	112.2	E368 K369 Q375 L376	E368-T372 WeakPolarHBondContact O-CB 3.49Å; E368-T372 WeakPolarHBondContact O-CG2 3.48Å; E368-T372 PolarHBondContact O-N 2.88Å; E368-T372 PolarHBondContact O-OG1 2.9Å; K369-T372 WeakPolarHBondContact CA-OG1 3.36Å; K369-T372 PolarHBondContact O-OG1 3.26Å; K369-T372 VanDerWaalsContact O-OG1 3.12Å; T372-Q375 PolarHBondContact O-N 3.44Å; T372-L376 WeakPolarHBondContact O-CB 3.43Å; T372-L376 WeakPolarHBondContact O-CG 3.47Å; T372-L376 PolarHBondContact O-N 2.95Å
373	F	87.9	Confident	87.9	Confident	131 Å²	131	104.9 Å²	104.9	58%	0.575	50%	0.5	S	S	*	.	H	α-helix	trans	-64.1	-42.8	171.9	-177.2	-96.4	0	0	0	112.2	K369 L370 L376 K377	K369-F373 WeakPolarHBondContact O-CB 3.28Å; K369-F373 PolarHBondContact O-N 2.88Å; L370-F373 PolarHBondContact O-N 2.99Å; F373-L376 PolarHBondContact O-N 3.33Å; F373-K377 HydrophobicContact CE1-CD 4.34Å; F373-K377 VanDerWaalsContact O-CB 3.25Å; F373-K377 WeakPolarHBondContact O-CB 3.4Å; F373-K377 PolarHBondContact O-N 2.84Å
374	E	87.5	Confident	87.5	Confident	71 Å²	71	105.2 Å²	105.2	33%	0.332	50%	0.501	S	S	.	.	H	α-helix	trans	-67.7	-35.8	176.7	-171	57.8	-143.4	0	0	111.8	L370 K377 Q378	L370-E374 WeakPolarHBondContact O-CB 3.29Å; L370-E374 PolarHBondContact O-N 3.49Å; E374-K377 PolarHBondContact O-N 3.12Å; E374-K377 IonicContact OE1-NZ 3.42Å; E374-K377 PolarHBondContact OE1-NZ 3.37Å; E374-K377 IonicContact OE2-NZ 2.67Å; E374-K377 PolarHBondContact OE2-NZ 2.82Å; E374-Q378 WeakPolarHBondContact O-CB 3.37Å; E374-Q378 WeakPolarHBondContact O-CG 3.43Å; E374-Q378 PolarHBondContact O-N 3.18Å
375	Q	87.8	Confident	87	Confident	115 Å²	115	103.3 Å²	103.3	54%	0.537	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-46.3	170.4	-76	173.8	-23.6	0	0	112.1	K371 T372 K377 Q378 E379	K371-Q375 VanDerWaalsContact O-CG 3.3Å; K371-Q375 WeakPolarHBondContact O-CG 3.48Å; K371-Q375 PolarHBondContact O-N 3.01Å; T372-Q375 PolarHBondContact O-N 3.44Å; Q375-K377 VanDerWaalsContact C-N 3.34Å; Q375-K377 PolarHBondContact O-N 3.2Å; Q375-Q378 PolarHBondContact O-N 3.06Å; Q375-E379 PolarHBondContact O-N 3.32Å
376	L	88.3	Confident	86.6	Confident	123 Å²	123	105.6 Å²	105.6	64%	0.644	51%	0.505	S	S	*	.	H	α-helix	trans	-62.8	-39.6	175.4	-77.4	167.4	0	0	0	111.9	T372 F373 E379 L380	T372-L376 WeakPolarHBondContact O-CB 3.43Å; T372-L376 WeakPolarHBondContact O-CG 3.47Å; T372-L376 PolarHBondContact O-N 2.95Å; F373-L376 PolarHBondContact O-N 3.33Å; L376-E379 PolarHBondContact O-N 3.18Å; L376-L380 VanDerWaalsContact O-CB 3.3Å; L376-L380 WeakPolarHBondContact O-CB 3.4Å; L376-L380 PolarHBondContact O-N 2.77Å
377	K	90.2	Very high	85.9	Confident	92 Å²	92	106.3 Å²	106.3	40%	0.4	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-42.5	175	167.3	166.1	158.9	-86.5	0	112.1	F373 E374 Q375 L381	F373-K377 HydrophobicContact CE1-CD 4.34Å; F373-K377 VanDerWaalsContact O-CB 3.25Å; F373-K377 WeakPolarHBondContact O-CB 3.4Å; F373-K377 PolarHBondContact O-N 2.84Å; E374-K377 PolarHBondContact O-N 3.12Å; E374-K377 IonicContact OE1-NZ 3.42Å; E374-K377 PolarHBondContact OE1-NZ 3.37Å; E374-K377 IonicContact OE2-NZ 2.67Å; E374-K377 PolarHBondContact OE2-NZ 2.82Å; Q375-K377 VanDerWaalsContact C-N 3.34Å; Q375-K377 PolarHBondContact O-N 3.2Å; K377-L381 WeakPolarHBondContact O-CB 3.47Å; K377-L381 PolarHBondContact O-N 3.44Å
378	Q	86.4	Confident	85.4	Confident	109 Å²	109	104.6 Å²	104.6	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-66.6	-37	174	-74.5	-176.8	16.5	0	0	112.6	E374 Q375 K382	E374-Q378 WeakPolarHBondContact O-CB 3.37Å; E374-Q378 WeakPolarHBondContact O-CG 3.43Å; E374-Q378 PolarHBondContact O-N 3.18Å; Q375-Q378 PolarHBondContact O-N 3.06Å; Q378-K382 WeakPolarHBondContact O-CG 3.4Å; Q378-K382 PolarHBondContact O-N 3.31Å
379	E	84.8	Confident	84.6	Confident	72 Å²	72	104.4 Å²	104.4	34%	0.336	50%	0.499	S	S	.	.	H	α-helix	trans	-71.5	-42	175.4	-168.1	56.1	-146.9	0	0	111.5	Q375 L376 L381 K382 Q383	Q375-E379 PolarHBondContact O-N 3.32Å; L376-E379 PolarHBondContact O-N 3.18Å; E379-L381 VanDerWaalsContact C-N 3.27Å; E379-L381 PolarHBondContact O-N 3.19Å; E379-K382 WeakPolarHBondContact O-CB 3.34Å; E379-K382 PolarHBondContact O-N 3.08Å; E379-K382 VanDerWaalsContact O-N 3.13Å; E379-K382 WeakPolarHBondContact OE2-CE 3.4Å; E379-K382 IonicContact OE2-NZ 2.66Å; E379-K382 PolarHBondContact OE2-NZ 2.9Å; E379-Q383 HydrophobicContact CG-CG 4.45Å; E379-Q383 VanDerWaalsContact O-CG 3.3Å; E379-Q383 WeakPolarHBondContact O-CG 3.37Å; E379-Q383 PolarHBondContact O-N 2.73Å; E379-Q383 PolarHBondContact OE1-NE2 3.32Å
380	L	85.4	Confident	83.9	Confident	120 Å²	120	104 Å²	104	63%	0.628	50%	0.501	S	S	*	.	H	α-helix	trans	-54	-45	171.7	-171.8	83.2	0	0	0	111.1	L376 Q383 Q384	L376-L380 VanDerWaalsContact O-CB 3.3Å; L376-L380 WeakPolarHBondContact O-CB 3.4Å; L376-L380 PolarHBondContact O-N 2.77Å; L380-Q383 PolarHBondContact O-N 3.21Å; L380-Q384 WeakPolarHBondContact O-CB 3.43Å; L380-Q384 PolarHBondContact O-N 2.83Å
381	L	85.2	Confident	83.1	Confident	91 Å²	91	105.2 Å²	105.2	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-67.3	-36.6	179.7	-153.2	158	0	0	0	111.7	K377 E379 N385	K377-L381 WeakPolarHBondContact O-CB 3.47Å; K377-L381 PolarHBondContact O-N 3.44Å; E379-L381 VanDerWaalsContact C-N 3.27Å; E379-L381 PolarHBondContact O-N 3.19Å; L381-N385 WeakPolarHBondContact O-CB 3.35Å; L381-N385 PolarHBondContact O-N 3.5Å; L381-N385 PolarHBondContact O-OD1 3.48Å
382	K	82.8	Confident	82.4	Confident	109 Å²	109	103 Å²	103	47%	0.474	50%	0.498	S	S	.	.	H	α-helix	trans	-64	-42.9	169.6	-76.1	178.8	-117.8	156	0	112.8	Q378 E379 N385 K386	Q378-K382 WeakPolarHBondContact O-CG 3.4Å; Q378-K382 PolarHBondContact O-N 3.31Å; E379-K382 WeakPolarHBondContact O-CB 3.34Å; E379-K382 PolarHBondContact O-N 3.08Å; E379-K382 VanDerWaalsContact O-N 3.13Å; E379-K382 WeakPolarHBondContact OE2-CE 3.4Å; E379-K382 IonicContact OE2-NZ 2.66Å; E379-K382 PolarHBondContact OE2-NZ 2.9Å; K382-N385 PolarHBondContact O-N 3.41Å; K382-K386 WeakPolarHBondContact O-CG 3.47Å; K382-K386 PolarHBondContact O-N 2.88Å
383	Q	83.1	Confident	81.9	Confident	81 Å²	81	104.2 Å²	104.2	38%	0.379	50%	0.504	S	S	.	.	H	α-helix	trans	-69.6	-37.5	179.2	-62.5	-63.5	-25	0	0	111.2	E379 L380 K386 F387	E379-Q383 HydrophobicContact CG-CG 4.45Å; E379-Q383 VanDerWaalsContact O-CG 3.3Å; E379-Q383 WeakPolarHBondContact O-CG 3.37Å; E379-Q383 PolarHBondContact O-N 2.73Å; E379-Q383 PolarHBondContact OE1-NE2 3.32Å; L380-Q383 PolarHBondContact O-N 3.21Å; Q383-K386 PolarHBondContact O-N 3.29Å; Q383-F387 PolarHBondContact O-N 3.31Å
384	Q	83.9	Confident	81.2	Confident	120 Å²	120	99.4 Å²	99.4	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-61.2	-49.4	171.9	-175.9	172.7	-2	0	0	111	L380 K386 F387 T388	L380-Q384 WeakPolarHBondContact O-CB 3.43Å; L380-Q384 PolarHBondContact O-N 2.83Å; Q384-K386 VanDerWaalsContact C-N 3.33Å; Q384-K386 PolarHBondContact O-N 3.24Å; Q384-F387 WeakPolarHBondContact O-CA 3.36Å; Q384-F387 WeakPolarHBondContact O-CB 3.33Å; Q384-F387 PolarHBondContact O-N 2.96Å; Q384-T388 PolarHBondContact O-N 2.94Å; Q384-T388 PolarHBondContact O-OG1 3.45Å
385	N	80.3	Confident	80.7	Confident	85 Å²	85	103.5 Å²	103.5	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-59.3	-41.9	176.8	-71.5	0.8	0	0	0	112.2	L381 K382 F387 T388 E389	L381-N385 WeakPolarHBondContact O-CB 3.35Å; L381-N385 PolarHBondContact O-N 3.5Å; L381-N385 PolarHBondContact O-OD1 3.48Å; K382-N385 PolarHBondContact O-N 3.41Å; N385-F387 VanDerWaalsContact C-N 3.33Å; N385-F387 PolarHBondContact O-N 3.11Å; N385-T388 PolarHBondContact O-N 3.25Å; N385-T388 VanDerWaalsContact O-N 3.17Å; N385-E389 WeakPolarHBondContact O-CG 3.44Å; N385-E389 PolarHBondContact O-N 2.85Å
386	K	80.8	Confident	80.2	Confident	115 Å²	115	101.8 Å²	101.8	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-60.8	-39.4	173.1	-78	175.6	176.7	174.9	0	112.8	K382 Q383 Q384 M390	K382-K386 WeakPolarHBondContact O-CG 3.47Å; K382-K386 PolarHBondContact O-N 2.88Å; Q383-K386 PolarHBondContact O-N 3.29Å; Q384-K386 VanDerWaalsContact C-N 3.33Å; Q384-K386 PolarHBondContact O-N 3.24Å; K386-M390 WeakPolarHBondContact O-CB 3.49Å; K386-M390 PolarHBondContact O-N 3.49Å
387	F	75.1	Confident	79.7	Confident	122 Å²	122	99 Å²	99	54%	0.535	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-43.5	173.1	-101.3	-83.2	0	0	0	111	Q383 Q384 N385 M390 E391	Q383-F387 PolarHBondContact O-N 3.31Å; Q384-F387 WeakPolarHBondContact O-CA 3.36Å; Q384-F387 WeakPolarHBondContact O-CB 3.33Å; Q384-F387 PolarHBondContact O-N 2.96Å; N385-F387 VanDerWaalsContact C-N 3.33Å; N385-F387 PolarHBondContact O-N 3.11Å; F387-M390 HydrophobicContact CD1-CE 3.93Å; F387-M390 HydrophobicContact CE1-CE 3.87Å; F387-M390 HydrophobicContact CG-CE 4.31Å; F387-M390 HydrophobicContact CZ-CE 4.21Å; F387-M390 PolarHBondContact O-N 3.32Å; F387-E391 WeakPolarHBondContact O-CB 3.05Å; F387-E391 WeakPolarHBondContact O-CG 3.42Å; F387-E391 PolarHBondContact O-N 3.31Å
388	T	78.9	Confident	79.2	Confident	64 Å²	64	99.4 Å²	99.4	39%	0.393	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-42.6	177	-42	0	0	0	0	112.2	Q384 N385 M390 E391 I392	Q384-T388 PolarHBondContact O-N 2.94Å; Q384-T388 PolarHBondContact O-OG1 3.45Å; N385-T388 PolarHBondContact O-N 3.25Å; N385-T388 VanDerWaalsContact O-N 3.17Å; T388-M390 VanDerWaalsContact C-N 3.35Å; T388-M390 PolarHBondContact O-N 3.16Å; T388-E391 PolarHBondContact O-N 2.95Å; T388-I392 HydrophobicContact CG2-CD1 4.16Å; T388-I392 WeakPolarHBondContact O-CB 3.28Å; T388-I392 WeakPolarHBondContact O-CD1 3.46Å; T388-I392 VanDerWaalsContact O-CG1 3.22Å; T388-I392 WeakPolarHBondContact O-CG1 3.47Å; T388-I392 PolarHBondContact O-N 2.88Å
389	E	72	Confident	79.1	Confident	129 Å²	129	98.7 Å²	98.7	60%	0.603	49%	0.489	S	S	*	.	H	α-helix	trans	-60.7	-43	173	-73	179.9	148.9	0	0	111.7	N385 I392 V393	N385-E389 WeakPolarHBondContact O-CG 3.44Å; N385-E389 PolarHBondContact O-N 2.85Å; E389-I392 PolarHBondContact O-N 3.28Å; E389-V393 WeakPolarHBondContact O-CG2 3.45Å; E389-V393 PolarHBondContact O-N 3.43Å
390	M	75.7	Confident	78.8	Confident	115 Å²	115	98.9 Å²	98.9	57%	0.567	50%	0.495	S	S	*	.	H	α-helix	trans	-70.1	-34.9	179.3	-175	166.4	56	0	0	112.9	K386 F387 T388 G394	K386-M390 WeakPolarHBondContact O-CB 3.49Å; K386-M390 PolarHBondContact O-N 3.49Å; F387-M390 HydrophobicContact CD1-CE 3.93Å; F387-M390 HydrophobicContact CE1-CE 3.87Å; F387-M390 HydrophobicContact CG-CE 4.31Å; F387-M390 HydrophobicContact CZ-CE 4.21Å; F387-M390 PolarHBondContact O-N 3.32Å; T388-M390 VanDerWaalsContact C-N 3.35Å; T388-M390 PolarHBondContact O-N 3.16Å; M390-G394 PolarHBondContact O-N 2.94Å
391	E	73.7	Confident	78.5	Confident	131 Å²	131	98.1 Å²	98.1	61%	0.612	49%	0.488	S	S	*	.	H	α-helix	trans	-67.3	-40.7	171.5	-76.7	-178.4	147.4	0	0	111.6	F387 T388 G394 Y395	F387-E391 WeakPolarHBondContact O-CB 3.05Å; F387-E391 WeakPolarHBondContact O-CG 3.42Å; F387-E391 PolarHBondContact O-N 3.31Å; T388-E391 PolarHBondContact O-N 2.95Å; E391-G394 PolarHBondContact O-N 2.82Å; E391-Y395 VanDerWaalsContact O-CB 3.27Å; E391-Y395 WeakPolarHBondContact O-CB 3.31Å; E391-Y395 PolarHBondContact O-N 3.43Å
392	I	75.4	Confident	78.4	Confident	98 Å²	98	98.3 Å²	98.3	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-63.4	-50	175.2	-70.6	163.9	0	0	0	110.7	T388 E389 G394 Y395 D396	T388-I392 HydrophobicContact CG2-CD1 4.16Å; T388-I392 WeakPolarHBondContact O-CB 3.28Å; T388-I392 WeakPolarHBondContact O-CD1 3.46Å; T388-I392 VanDerWaalsContact O-CG1 3.22Å; T388-I392 WeakPolarHBondContact O-CG1 3.47Å; T388-I392 PolarHBondContact O-N 2.88Å; E389-I392 PolarHBondContact O-N 3.28Å; I392-G394 VanDerWaalsContact C-N 3.32Å; I392-G394 PolarHBondContact O-N 3.45Å; I392-Y395 PolarHBondContact O-N 2.88Å; I392-D396 PolarHBondContact O-N 3.04Å
393	V	74	Confident	78.3	Confident	95 Å²	95	98.6 Å²	98.6	58%	0.576	49%	0.493	S	S	*	.	H	α-helix	trans	-63.3	-38.8	177.7	171.9	0	0	0	0	111.4	E389 T397	E389-V393 WeakPolarHBondContact O-CG2 3.45Å; E389-V393 PolarHBondContact O-N 3.43Å; V393-T397 WeakPolarHBondContact O-CB 3.4Å; V393-T397 PolarHBondContact O-N 2.84Å; V393-T397 PolarHBondContact O-OG1 3.42Å
394	G	74.2	Confident	78.3	Confident	30 Å²	30	99.3 Å²	99.3	31%	0.309	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-45	173	0	0	0	0	0	112.3	M390 E391 I392 T397 I398	M390-G394 PolarHBondContact O-N 2.94Å; E391-G394 PolarHBondContact O-N 2.82Å; I392-G394 VanDerWaalsContact C-N 3.32Å; I392-G394 PolarHBondContact O-N 3.45Å; G394-T397 PolarHBondContact O-N 2.85Å; G394-I398 WeakPolarHBondContact O-CB 3.25Å; G394-I398 VanDerWaalsContact O-CG1 3.29Å; G394-I398 WeakPolarHBondContact O-CG1 3.33Å; G394-I398 PolarHBondContact O-N 3.47Å
395	Y	76.9	Confident	78.3	Confident	158 Å²	158	98.8 Å²	98.8	62%	0.62	50%	0.498	S	S	*	.	H	α-helix	trans	-62.8	-47.6	177.7	-177.1	-94.4	0	0	0	112.2	E391 I392 T397 I398 K399	E391-Y395 VanDerWaalsContact O-CB 3.27Å; E391-Y395 WeakPolarHBondContact O-CB 3.31Å; E391-Y395 PolarHBondContact O-N 3.43Å; I392-Y395 PolarHBondContact O-N 2.88Å; Y395-T397 VanDerWaalsContact C-N 3.31Å; Y395-T397 PolarHBondContact O-N 3.46Å; Y395-I398 PolarHBondContact O-N 2.88Å; Y395-K399 HydrophobicContact CE1-CD 4.25Å; Y395-K399 WeakPolarHBondContact O-CB 3.42Å; Y395-K399 PolarHBondContact O-N 3.34Å
396	D	77.4	Confident	78.5	Confident	79 Å²	79	102.3 Å²	102.3	42%	0.422	51%	0.51	S	S	.	.	H	α-helix	trans	-66.5	-32.4	177.9	-82.2	-33.4	0	0	0	112.5	I392 T400	I392-D396 PolarHBondContact O-N 3.04Å; D396-T400 WeakPolarHBondContact O-CB 3.41Å; D396-T400 WeakPolarHBondContact O-CG2 3.26Å; D396-T400 PolarHBondContact O-N 3.44Å; D396-T400 PolarHBondContact O-OG1 3.49Å
397	T	77.9	Confident	78.4	Confident	65 Å²	65	99.7 Å²	99.7	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-44.6	172.6	-54.7	0	0	0	0	111.4	V393 G394 Y395 K399 T400 Q401	V393-T397 WeakPolarHBondContact O-CB 3.4Å; V393-T397 PolarHBondContact O-N 2.84Å; V393-T397 PolarHBondContact O-OG1 3.42Å; G394-T397 PolarHBondContact O-N 2.85Å; Y395-T397 VanDerWaalsContact C-N 3.31Å; Y395-T397 PolarHBondContact O-N 3.46Å; T397-K399 VanDerWaalsContact C-N 3.35Å; T397-T400 PolarHBondContact O-OG1 3.21Å; T397-T400 VanDerWaalsContact O-OG1 3.06Å; T397-Q401 WeakPolarHBondContact O-CB 3.27Å; T397-Q401 VanDerWaalsContact O-CG 3.31Å; T397-Q401 WeakPolarHBondContact O-CG 3.3Å; T397-Q401 PolarHBondContact O-N 2.9Å
398	I	80	Confident	78.8	Confident	100 Å²	100	98.8 Å²	98.8	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-67.2	-37	176.6	-70.5	166.2	0	0	0	111	G394 Y395 N402	G394-I398 WeakPolarHBondContact O-CB 3.25Å; G394-I398 VanDerWaalsContact O-CG1 3.29Å; G394-I398 WeakPolarHBondContact O-CG1 3.33Å; G394-I398 PolarHBondContact O-N 3.47Å; Y395-I398 PolarHBondContact O-N 2.88Å; I398-N402 WeakPolarHBondContact CG2-ND2 3.29Å; I398-N402 WeakPolarHBondContact O-CB 3.37Å; I398-N402 PolarHBondContact O-N 3.43Å; I398-N402 PolarHBondContact O-ND2 3.24Å
399	K	83	Confident	78.9	Confident	93 Å²	93	100.1 Å²	100.1	40%	0.404	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-48.8	177.3	178.9	-175.5	168.3	-164.5	0	111.6	Y395 T397 Q401 N402 E403	Y395-K399 HydrophobicContact CE1-CD 4.25Å; Y395-K399 WeakPolarHBondContact O-CB 3.42Å; Y395-K399 PolarHBondContact O-N 3.34Å; T397-K399 VanDerWaalsContact C-N 3.35Å; K399-Q401 PolarHBondContact O-N 3.49Å; K399-N402 PolarHBondContact O-N 2.83Å; K399-N402 VanDerWaalsContact O-N 3.16Å; K399-E403 WeakPolarHBondContact CE-OE1 3.42Å; K399-E403 PolarHBondContact O-N 3.09Å
400	T	78.4	Confident	79.2	Confident	77 Å²	77	97.4 Å²	97.4	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-39.1	177	46.7	0	0	0	0	112.1	D396 T397 E403 V404	D396-T400 WeakPolarHBondContact O-CB 3.41Å; D396-T400 WeakPolarHBondContact O-CG2 3.26Å; D396-T400 PolarHBondContact O-N 3.44Å; D396-T400 PolarHBondContact O-OG1 3.49Å; T397-T400 PolarHBondContact O-OG1 3.21Å; T397-T400 VanDerWaalsContact O-OG1 3.06Å; T400-E403 PolarHBondContact O-N 3.32Å; T400-V404 WeakPolarHBondContact O-CG2 3.34Å; T400-V404 PolarHBondContact O-N 2.92Å
401	Q	80.9	Confident	79.4	Confident	104 Å²	104	95.8 Å²	95.8	49%	0.486	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-43.5	170.5	-73.7	177.4	3.4	0	0	112.5	T397 K399 E403 V404 F405	T397-Q401 WeakPolarHBondContact O-CB 3.27Å; T397-Q401 VanDerWaalsContact O-CG 3.31Å; T397-Q401 WeakPolarHBondContact O-CG 3.3Å; T397-Q401 PolarHBondContact O-N 2.9Å; K399-Q401 PolarHBondContact O-N 3.49Å; Q401-E403 PolarHBondContact O-N 3.29Å; Q401-V404 PolarHBondContact O-N 2.64Å; Q401-F405 HydrophobicContact CB-CE2 4.25Å; Q401-F405 WeakPolarHBondContact O-CD2 3.12Å; Q401-F405 WeakPolarHBondContact O-CG 3.48Å; Q401-F405 PolarHBondContact O-N 3.14Å
402	N	81.6	Confident	79.7	Confident	94 Å²	94	94 Å²	94	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-64.4	-36.5	176	-86.5	-74.2	0	0	0	113	I398 K399 K406	I398-N402 WeakPolarHBondContact CG2-ND2 3.29Å; I398-N402 WeakPolarHBondContact O-CB 3.37Å; I398-N402 PolarHBondContact O-N 3.43Å; I398-N402 PolarHBondContact O-ND2 3.24Å; K399-N402 PolarHBondContact O-N 2.83Å; K399-N402 VanDerWaalsContact O-N 3.16Å; N402-K406 WeakPolarHBondContact O-CB 3.28Å; N402-K406 PolarHBondContact O-N 2.86Å
403	E	82.2	Confident	79.8	Confident	115 Å²	115	95 Å²	95	54%	0.537	50%	0.5	S	S	.	.	H	α-helix	trans	-66.4	-38.9	174.6	-73.7	177.2	-164	0	0	111.7	K399 T400 Q401 K406 A407	K399-E403 WeakPolarHBondContact CE-OE1 3.42Å; K399-E403 PolarHBondContact O-N 3.09Å; T400-E403 PolarHBondContact O-N 3.32Å; Q401-E403 PolarHBondContact O-N 3.29Å; E403-K406 PolarHBondContact O-N 3.3Å; E403-A407 PolarHBondContact O-N 2.8Å
404	V	82	Confident	80	Confident	96 Å²	96	97.4 Å²	97.4	58%	0.582	50%	0.502	S	S	*	.	H	α-helix	trans	-63	-51.8	172.1	171.4	0	0	0	0	111.5	T400 Q401 K406 A407 E408	T400-V404 WeakPolarHBondContact O-CG2 3.34Å; T400-V404 PolarHBondContact O-N 2.92Å; Q401-V404 PolarHBondContact O-N 2.64Å; V404-K406 VanDerWaalsContact C-N 3.27Å; V404-K406 PolarHBondContact O-N 3.29Å; V404-A407 WeakPolarHBondContact O-CB 3.41Å; V404-A407 PolarHBondContact O-N 3.41Å; V404-A407 VanDerWaalsContact O-N 3.14Å; V404-E408 PolarHBondContact O-N 3.21Å
405	F	84.3	Confident	80.2	Confident	109 Å²	109	101.6 Å²	101.6	48%	0.478	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-35.2	177.7	-67.6	-48.5	0	0	0	112.3	Q401 E408 I409	Q401-F405 HydrophobicContact CB-CE2 4.25Å; Q401-F405 WeakPolarHBondContact O-CD2 3.12Å; Q401-F405 WeakPolarHBondContact O-CG 3.48Å; Q401-F405 PolarHBondContact O-N 3.14Å; F405-E408 PolarHBondContact O-N 3.23Å; F405-I409 WeakPolarHBondContact O-CB 3.25Å; F405-I409 WeakPolarHBondContact O-CD1 3.34Å; F405-I409 WeakPolarHBondContact O-CG1 2.91Å; F405-I409 PolarHBondContact O-N 3.23Å
406	K	83.5	Confident	80.3	Confident	160 Å²	160	99.4 Å²	99.4	70%	0.696	51%	0.512	S	S	*	.	H	α-helix	trans	-67.5	-36.2	176.2	-171.7	175.3	-176.6	179.5	0	112.2	N402 E403 V404 S410	N402-K406 WeakPolarHBondContact O-CB 3.28Å; N402-K406 PolarHBondContact O-N 2.86Å; E403-K406 PolarHBondContact O-N 3.3Å; V404-K406 VanDerWaalsContact C-N 3.27Å; V404-K406 PolarHBondContact O-N 3.29Å; K406-S410 WeakPolarHBondContact O-CB 3.46Å; K406-S410 PolarHBondContact O-N 3.21Å; K406-S410 VanDerWaalsContact O-N 3.15Å
407	A	80.3	Confident	80.4	Confident	59 Å²	59	102.9 Å²	102.9	49%	0.488	52%	0.524	S	S	.	.	H	α-helix	trans	-66.6	-46.4	171.2	0	0	0	0	0	111.4	E403 V404 S410 T411	E403-A407 PolarHBondContact O-N 2.8Å; V404-A407 WeakPolarHBondContact O-CB 3.41Å; V404-A407 PolarHBondContact O-N 3.41Å; V404-A407 VanDerWaalsContact O-N 3.14Å; A407-S410 WeakPolarHBondContact O-CB 3.43Å; A407-S410 PolarHBondContact O-N 2.83Å; A407-S410 VanDerWaalsContact O-N 3.11Å; A407-T411 PolarHBondContact O-N 3.3Å; A407-T411 PolarHBondContact O-OG1 2.92Å
408	E	82.6	Confident	80.4	Confident	103 Å²	103	104.1 Å²	104.1	48%	0.481	53%	0.527	S	S	.	.	H	α-helix	trans	-60.7	-47.8	179.1	-173.9	172.2	-149.8	0	0	112.2	V404 F405 S410 T411 L412	V404-E408 PolarHBondContact O-N 3.21Å; F405-E408 PolarHBondContact O-N 3.23Å; E408-S410 VanDerWaalsContact C-N 3.26Å; E408-S410 PolarHBondContact O-N 3.02Å; E408-T411 WeakPolarHBondContact CA-OG1 3.44Å; E408-T411 PolarHBondContact O-N 3.33Å; E408-T411 VanDerWaalsContact O-N 3.15Å; E408-T411 PolarHBondContact O-OG1 3.48Å; E408-L412 HydrophobicContact CG-CD1 4.15Å; E408-L412 WeakPolarHBondContact O-CG 3.35Å; E408-L412 PolarHBondContact O-N 3.03Å
409	I	80.1	Confident	80.1	Confident	92 Å²	92	102 Å²	102	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-57.8	-39.4	173.3	-70.9	165.4	0	0	0	110.9	F405 L412 Q413	F405-I409 WeakPolarHBondContact O-CB 3.25Å; F405-I409 WeakPolarHBondContact O-CD1 3.34Å; F405-I409 WeakPolarHBondContact O-CG1 2.91Å; F405-I409 PolarHBondContact O-N 3.23Å; I409-L412 PolarHBondContact O-N 3.09Å; I409-Q413 HydrophobicContact CG2-CG 4.38Å; I409-Q413 WeakPolarHBondContact O-CB 3.37Å; I409-Q413 VanDerWaalsContact O-CG 3.3Å; I409-Q413 WeakPolarHBondContact O-CG 3.33Å; I409-Q413 PolarHBondContact O-N 3.01Å
410	S	78.6	Confident	79.8	Confident	73 Å²	73	102.6 Å²	102.6	51%	0.51	53%	0.529	S	S	.	.	H	α-helix	trans	-66.8	-40	177.3	-163.2	0	0	0	0	112.1	K406 A407 E408 K414	K406-S410 WeakPolarHBondContact O-CB 3.46Å; K406-S410 PolarHBondContact O-N 3.21Å; K406-S410 VanDerWaalsContact O-N 3.15Å; A407-S410 WeakPolarHBondContact O-CB 3.43Å; A407-S410 PolarHBondContact O-N 2.83Å; A407-S410 VanDerWaalsContact O-N 3.11Å; E408-S410 VanDerWaalsContact C-N 3.26Å; E408-S410 PolarHBondContact O-N 3.02Å; S410-K414 WeakPolarHBondContact O-CB 3.42Å; S410-K414 PolarHBondContact O-N 2.91Å
411	T	80.9	Confident	79.8	Confident	80 Å²	80	102.8 Å²	102.8	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-65.7	-41.3	172.5	39.9	0	0	0	0	112.9	A407 E408 K414 Q415	A407-T411 PolarHBondContact O-N 3.3Å; A407-T411 PolarHBondContact O-OG1 2.92Å; E408-T411 WeakPolarHBondContact CA-OG1 3.44Å; E408-T411 PolarHBondContact O-N 3.33Å; E408-T411 VanDerWaalsContact O-N 3.15Å; E408-T411 PolarHBondContact O-OG1 3.48Å; T411-K414 WeakPolarHBondContact O-CB 3.2Å; T411-K414 PolarHBondContact O-N 2.83Å; T411-Q415 WeakPolarHBondContact O-CG 3.34Å; T411-Q415 PolarHBondContact O-N 2.91Å
412	L	79.7	Confident	79.5	Confident	94 Å²	94	103 Å²	103	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-65	-42	176.4	-71.2	168.7	0	0	0	111.7	E408 I409 K414 Q415 L416	E408-L412 HydrophobicContact CG-CD1 4.15Å; E408-L412 WeakPolarHBondContact O-CG 3.35Å; E408-L412 PolarHBondContact O-N 3.03Å; I409-L412 PolarHBondContact O-N 3.09Å; L412-K414 VanDerWaalsContact C-N 3.28Å; L412-K414 PolarHBondContact O-N 3.33Å; L412-Q415 PolarHBondContact O-N 2.86Å; L412-L416 WeakPolarHBondContact O-CB 3.24Å; L412-L416 PolarHBondContact O-N 3.32Å
413	Q	78	Confident	79.1	Confident	120 Å²	120	103.6 Å²	103.6	56%	0.561	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-34.1	173	-76.4	-179.7	-5.5	0	0	112.5	I409 K417	I409-Q413 HydrophobicContact CG2-CG 4.38Å; I409-Q413 WeakPolarHBondContact O-CB 3.37Å; I409-Q413 VanDerWaalsContact O-CG 3.3Å; I409-Q413 WeakPolarHBondContact O-CG 3.33Å; I409-Q413 PolarHBondContact O-N 3.01Å; Q413-K417 WeakPolarHBondContact O-CB 3.39Å; Q413-K417 WeakPolarHBondContact O-CG 3.29Å; Q413-K417 PolarHBondContact O-N 3.47Å
414	K	78.7	Confident	78.7	Confident	145 Å²	145	101.8 Å²	101.8	63%	0.63	53%	0.525	S	S	*	.	H	α-helix	trans	-71.3	-43	176.2	-164.1	174.2	-175.7	179.7	0	111.7	S410 T411 L412 K417 N418	S410-K414 WeakPolarHBondContact O-CB 3.42Å; S410-K414 PolarHBondContact O-N 2.91Å; T411-K414 WeakPolarHBondContact O-CB 3.2Å; T411-K414 PolarHBondContact O-N 2.83Å; L412-K414 VanDerWaalsContact C-N 3.28Å; L412-K414 PolarHBondContact O-N 3.33Å; K414-K417 PolarHBondContact O-N 3.1Å; K414-N418 PolarHBondContact O-N 2.93Å; K414-N418 PolarHBondContact O-OD1 2.95Å
415	Q	78.2	Confident	78.2	Confident	118 Å²	118	102.7 Å²	102.7	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-60.1	-47.3	172	-73.7	173.1	-21.9	0	0	111.4	T411 L412 K417 N418 S419	T411-Q415 WeakPolarHBondContact O-CG 3.34Å; T411-Q415 PolarHBondContact O-N 2.91Å; L412-Q415 PolarHBondContact O-N 2.86Å; Q415-K417 VanDerWaalsContact C-N 3.33Å; Q415-K417 PolarHBondContact O-N 3.27Å; Q415-N418 PolarHBondContact O-N 3.04Å; Q415-N418 VanDerWaalsContact O-N 3.17Å; Q415-S419 PolarHBondContact O-N 2.86Å; Q415-S419 PolarHBondContact O-OG 3.32Å; Q415-S419 VanDerWaalsContact O-OG 3.09Å
416	L	78.8	Confident	77.7	Confident	112 Å²	112	103.5 Å²	103.5	59%	0.586	53%	0.528	S	S	*	.	H	α-helix	trans	-60.2	-39.7	177.4	-176.2	64.8	0	0	0	112.5	L412 L420	L412-L416 WeakPolarHBondContact O-CB 3.24Å; L412-L416 PolarHBondContact O-N 3.32Å; L416-L420 HydrophobicContact CG-CD1 4.39Å; L416-L420 WeakPolarHBondContact O-CB 3.3Å; L416-L420 WeakPolarHBondContact O-CG 3.43Å; L416-L420 PolarHBondContact O-N 2.84Å
417	K	79.4	Confident	77.3	Confident	152 Å²	152	101.8 Å²	101.8	66%	0.661	52%	0.52	S	S	*	.	H	α-helix	trans	-64.1	-44.9	173.4	-84.7	-171.9	173.1	-174.4	0	112.4	Q413 K414 Q415 L420 V421	Q413-K417 WeakPolarHBondContact O-CB 3.39Å; Q413-K417 WeakPolarHBondContact O-CG 3.29Å; Q413-K417 PolarHBondContact O-N 3.47Å; K414-K417 PolarHBondContact O-N 3.1Å; Q415-K417 VanDerWaalsContact C-N 3.33Å; Q415-K417 PolarHBondContact O-N 3.27Å; K417-L420 PolarHBondContact O-N 2.79Å; K417-V421 WeakPolarHBondContact O-CG2 3.44Å; K417-V421 PolarHBondContact O-N 3.12Å
418	N	77.9	Confident	76.9	Confident	90 Å²	90	105 Å²	105	48%	0.481	53%	0.525	S	S	.	.	H	α-helix	trans	-60.4	-48.5	176.6	-73.4	21.6	0	0	0	110.9	K414 Q415 L420 V421 E422	K414-N418 PolarHBondContact O-N 2.93Å; K414-N418 PolarHBondContact O-OD1 2.95Å; Q415-N418 PolarHBondContact O-N 3.04Å; Q415-N418 VanDerWaalsContact O-N 3.17Å; N418-L420 VanDerWaalsContact C-N 3.26Å; N418-L420 PolarHBondContact O-N 2.97Å; N418-V421 PolarHBondContact O-N 3.24Å; N418-E422 WeakPolarHBondContact O-CG 3.47Å; N418-E422 PolarHBondContact O-N 2.8Å
419	S	73.2	Confident	76.4	Confident	57 Å²	57	105.8 Å²	105.8	40%	0.399	53%	0.532	S	S	.	.	H	α-helix	trans	-60.4	-32.9	177.6	-55.4	0	0	0	0	113.3	Q415 L423	Q415-S419 PolarHBondContact O-N 2.86Å; Q415-S419 PolarHBondContact O-OG 3.32Å; Q415-S419 VanDerWaalsContact O-OG 3.09Å; S419-L423 WeakPolarHBondContact O-CB 3.22Å; S419-L423 VanDerWaalsContact O-CG 3.28Å; S419-L423 WeakPolarHBondContact O-CG 3.39Å; S419-L423 PolarHBondContact O-N 3.34Å
420	L	77.5	Confident	75.6	Confident	104 Å²	104	103.9 Å²	103.9	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-70.9	-35.9	173.8	-86.3	165.3	0	0	0	113.1	L416 K417 N418 E424	L416-L420 HydrophobicContact CG-CD1 4.39Å; L416-L420 WeakPolarHBondContact O-CB 3.3Å; L416-L420 WeakPolarHBondContact O-CG 3.43Å; L416-L420 PolarHBondContact O-N 2.84Å; K417-L420 PolarHBondContact O-N 2.79Å; N418-L420 VanDerWaalsContact C-N 3.26Å; N418-L420 PolarHBondContact O-N 2.97Å; L420-E424 PolarHBondContact O-N 2.99Å
421	V	78.4	Confident	75.1	Confident	81 Å²	81	102.9 Å²	102.9	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-67.7	-48.5	173.9	173.3	0	0	0	0	110.2	K417 N418 L423 E424 E425	K417-V421 WeakPolarHBondContact O-CG2 3.44Å; K417-V421 PolarHBondContact O-N 3.12Å; N418-V421 PolarHBondContact O-N 3.24Å; V421-L423 VanDerWaalsContact C-N 3.28Å; V421-L423 PolarHBondContact O-N 3.42Å; V421-E424 PolarHBondContact O-N 3.4Å; V421-E424 VanDerWaalsContact O-N 3.11Å; V421-E425 HydrophobicContact CG1-CG 4.45Å; V421-E425 WeakPolarHBondContact O-CG 3.45Å; V421-E425 PolarHBondContact O-N 3.36Å
422	E	74.2	Confident	74.6	Confident	109 Å²	109	101.9 Å²	101.9	51%	0.509	52%	0.522	S	S	.	.	H	α-helix	trans	-57.9	-39	176.6	-70.3	168.9	-158.1	0	0	112.2	N418 Q426	N418-E422 WeakPolarHBondContact O-CG 3.47Å; N418-E422 PolarHBondContact O-N 2.8Å; E422-Q426 WeakPolarHBondContact O-CB 3.24Å; E422-Q426 WeakPolarHBondContact O-CG 3.41Å; E422-Q426 PolarHBondContact O-N 3.17Å
423	L	71.9	Confident	73.9	Confident	106 Å²	106	99.9 Å²	99.9	56%	0.555	52%	0.519	S	S	*	.	H	α-helix	trans	-68.7	-38.4	175	-81.3	169.3	0	0	0	113.3	S419 V421 K427	S419-L423 WeakPolarHBondContact O-CB 3.22Å; S419-L423 VanDerWaalsContact O-CG 3.28Å; S419-L423 WeakPolarHBondContact O-CG 3.39Å; S419-L423 PolarHBondContact O-N 3.34Å; V421-L423 VanDerWaalsContact C-N 3.28Å; V421-L423 PolarHBondContact O-N 3.42Å; L423-K427 WeakPolarHBondContact O-CB 3.38Å; L423-K427 PolarHBondContact O-N 2.99Å
424	E	74.3	Confident	73.3	Confident	78 Å²	78	98.1 Å²	98.1	36%	0.364	52%	0.517	S	S	.	.	H	α-helix	trans	-73.3	-35.5	178.2	-169.2	59	-143.9	0	0	111.6	L420 V421 K427 Q428	L420-E424 PolarHBondContact O-N 2.99Å; V421-E424 PolarHBondContact O-N 3.4Å; V421-E424 VanDerWaalsContact O-N 3.11Å; E424-K427 WeakPolarHBondContact O-CB 3.35Å; E424-K427 PolarHBondContact O-N 3.43Å; E424-K427 IonicContact OE1-NZ 3.42Å; E424-K427 PolarHBondContact OE1-NZ 3.36Å; E424-K427 IonicContact OE2-NZ 3.66Å; E424-K427 PolarHBondContact OE2-NZ 3.23Å; E424-Q428 WeakPolarHBondContact O-CG 3.37Å; E424-Q428 PolarHBondContact O-N 3.34Å
425	E	72.6	Confident	72.8	Confident	114 Å²	114	95.4 Å²	95.4	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-63.5	-48.4	170.4	-73.1	-177.3	172.7	0	0	111.5	V421 K427 Q428 I429	V421-E425 HydrophobicContact CG1-CG 4.45Å; V421-E425 WeakPolarHBondContact O-CG 3.45Å; V421-E425 PolarHBondContact O-N 3.36Å; E425-K427 PolarHBondContact O-N 3.13Å; E425-Q428 PolarHBondContact O-N 3.45Å; E425-Q428 VanDerWaalsContact O-N 3.14Å; E425-I429 VanDerWaalsContact O-CG1 3.32Å; E425-I429 WeakPolarHBondContact O-CG1 3.3Å; E425-I429 PolarHBondContact O-N 3.48Å
426	Q	72.3	Confident	72.2	Confident	127 Å²	127	95.6 Å²	95.6	59%	0.593	51%	0.513	S	S	*	.	H	α-helix	trans	-58.6	-37	173.8	-76.8	-175.9	26.3	0	0	112.3	E422 I429 A430	E422-Q426 WeakPolarHBondContact O-CB 3.24Å; E422-Q426 WeakPolarHBondContact O-CG 3.41Å; E422-Q426 PolarHBondContact O-N 3.17Å; Q426-I429 PolarHBondContact O-N 3.14Å; Q426-A430 VanDerWaalsContact O-CB 3.27Å; Q426-A430 WeakPolarHBondContact O-CB 3.49Å; Q426-A430 PolarHBondContact O-N 3.27Å
427	K	74.8	Confident	71.6	Confident	123 Å²	123	94.8 Å²	94.8	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-67.8	-36.2	176.3	170.9	163.7	157.9	-86.6	0	112.7	L423 E424 E425 A431	L423-K427 WeakPolarHBondContact O-CB 3.38Å; L423-K427 PolarHBondContact O-N 2.99Å; E424-K427 WeakPolarHBondContact O-CB 3.35Å; E424-K427 PolarHBondContact O-N 3.43Å; E424-K427 IonicContact OE1-NZ 3.42Å; E424-K427 PolarHBondContact OE1-NZ 3.36Å; E424-K427 IonicContact OE2-NZ 3.66Å; E424-K427 PolarHBondContact OE2-NZ 3.23Å; E425-K427 PolarHBondContact O-N 3.13Å; K427-A431 WeakPolarHBondContact O-CB 3.43Å; K427-A431 PolarHBondContact O-N 2.88Å
428	Q	72.7	Confident	71	Confident	126 Å²	126	91.6 Å²	91.6	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-72.4	-39.9	172.6	-71.4	-177	11.2	0	0	112.5	E424 E425 A431 S432	E424-Q428 WeakPolarHBondContact O-CG 3.37Å; E424-Q428 PolarHBondContact O-N 3.34Å; E425-Q428 PolarHBondContact O-N 3.45Å; E425-Q428 VanDerWaalsContact O-N 3.14Å; Q428-A431 WeakPolarHBondContact O-CB 3.32Å; Q428-A431 PolarHBondContact O-N 3.17Å; Q428-S432 PolarHBondContact O-N 3.23Å
429	I	71.4	Confident	70.6	Confident	120 Å²	120	91.9 Å²	91.9	62%	0.615	50%	0.504	S	S	*	.	H	α-helix	trans	-60.9	-45.1	173.1	-67.4	164.3	0	0	0	110.3	E425 Q426 A431 S432 A433	E425-I429 VanDerWaalsContact O-CG1 3.32Å; E425-I429 WeakPolarHBondContact O-CG1 3.3Å; E425-I429 PolarHBondContact O-N 3.48Å; Q426-I429 PolarHBondContact O-N 3.14Å; I429-A431 VanDerWaalsContact C-N 3.35Å; I429-A431 PolarHBondContact O-N 3.1Å; I429-S432 PolarHBondContact O-N 2.91Å; I429-A433 PolarHBondContact O-N 3.5Å
430	A	65	Low	70.2	Confident	53 Å²	53	94.6 Å²	94.6	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-40.2	175.2	0	0	0	0	0	112.2	Q426 A433 T434	Q426-A430 VanDerWaalsContact O-CB 3.27Å; Q426-A430 WeakPolarHBondContact O-CB 3.49Å; Q426-A430 PolarHBondContact O-N 3.27Å; A430-A433 PolarHBondContact O-N 2.99Å; A430-T434 WeakPolarHBondContact O-CG2 3.41Å; A430-T434 PolarHBondContact O-N 3Å; A430-T434 PolarHBondContact O-OG1 3.49Å
431	A	66.8	Low	69.7	Low	51 Å²	51	95.1 Å²	95.1	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-60.5	-46.3	174.6	0	0	0	0	0	111.8	K427 Q428 I429 T434 T435	K427-A431 WeakPolarHBondContact O-CB 3.43Å; K427-A431 PolarHBondContact O-N 2.88Å; Q428-A431 WeakPolarHBondContact O-CB 3.32Å; Q428-A431 PolarHBondContact O-N 3.17Å; I429-A431 VanDerWaalsContact C-N 3.35Å; I429-A431 PolarHBondContact O-N 3.1Å; A431-T434 PolarHBondContact O-N 3.04Å; A431-T434 PolarHBondContact O-OG1 3.2Å; A431-T435 PolarHBondContact O-N 2.84Å
432	S	70.6	Confident	69.4	Low	60 Å²	60	95.4 Å²	95.4	42%	0.42	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-43.8	175.4	-158.9	0	0	0	0	112.2	Q428 I429 T434 T435 E436	Q428-S432 PolarHBondContact O-N 3.23Å; I429-S432 PolarHBondContact O-N 2.91Å; S432-T434 VanDerWaalsContact C-N 3.26Å; S432-T434 PolarHBondContact O-N 3.46Å; S432-T435 PolarHBondContact O-N 3.34Å; S432-T435 PolarHBondContact O-OG1 3.22Å; S432-E436 PolarHBondContact O-N 2.72Å; S432-E436 VanDerWaalsContact O-N 3.11Å
433	A	64.7	Low	69.1	Low	52 Å²	52	93.8 Å²	93.8	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-34.6	175.7	0	0	0	0	0	112.3	I429 A430 L437	I429-A433 PolarHBondContact O-N 3.5Å; A430-A433 PolarHBondContact O-N 2.99Å; A433-L437 WeakPolarHBondContact O-CB 3.49Å; A433-L437 PolarHBondContact O-N 3.11Å
434	T	65.9	Low	69.1	Low	83 Å²	83	94.3 Å²	94.3	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-73.8	-28.8	176.8	59.6	0	0	0	0	114.4	A430 A431 S432 N438	A430-T434 WeakPolarHBondContact O-CG2 3.41Å; A430-T434 PolarHBondContact O-N 3Å; A430-T434 PolarHBondContact O-OG1 3.49Å; A431-T434 PolarHBondContact O-N 3.04Å; A431-T434 PolarHBondContact O-OG1 3.2Å; S432-T434 VanDerWaalsContact C-N 3.26Å; S432-T434 PolarHBondContact O-N 3.46Å; T434-N438 PolarHBondContact O-N 2.88Å; T434-N438 PolarHBondContact O-ND2 3.4Å; T434-N438 VanDerWaalsContact O-ND2 3.12Å
435	T	67.9	Low	68.9	Low	87 Å²	87	96.3 Å²	96.3	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-74	-44.3	173.8	53.3	0	0	0	0	110.8	A431 S432 L437 N438 V439	A431-T435 PolarHBondContact O-N 2.84Å; S432-T435 PolarHBondContact O-N 3.34Å; S432-T435 PolarHBondContact O-OG1 3.22Å; T435-L437 PolarHBondContact O-N 3.47Å; T435-N438 PolarHBondContact O-N 3.37Å; T435-V439 PolarHBondContact O-N 3.05Å; T435-V439 VanDerWaalsContact O-N 3.08Å
436	E	65.1	Low	68.8	Low	122 Å²	122	95.4 Å²	95.4	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-59.9	-43.7	173.4	-71	177.6	-166.5	0	0	112.4	S432 N438 V439 L440	S432-E436 PolarHBondContact O-N 2.72Å; S432-E436 VanDerWaalsContact O-N 3.11Å; E436-N438 PolarHBondContact O-N 2.99Å; E436-V439 PolarHBondContact O-N 2.9Å; E436-V439 VanDerWaalsContact O-N 3.12Å; E436-L440 PolarHBondContact O-N 3.4Å
437	L	67.3	Low	68.7	Low	95 Å²	95	94.1 Å²	94.1	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-26.8	177.9	-171.8	137.5	0	0	0	112.9	A433 T435 K441	A433-L437 WeakPolarHBondContact O-CB 3.49Å; A433-L437 PolarHBondContact O-N 3.11Å; T435-L437 PolarHBondContact O-N 3.47Å; L437-K441 HydrophobicContact CD2-CD 4.42Å; L437-K441 WeakPolarHBondContact O-CG 3.29Å; L437-K441 PolarHBondContact O-N 3.32Å
438	N	67.1	Low	68.3	Low	85 Å²	85	92 Å²	92	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-76.7	-35.7	171.8	-75.3	-31.3	0	0	0	112.4	T434 T435 E436 K441 V442	T434-N438 PolarHBondContact O-N 2.88Å; T434-N438 PolarHBondContact O-ND2 3.4Å; T434-N438 VanDerWaalsContact O-ND2 3.12Å; T435-N438 PolarHBondContact O-N 3.37Å; E436-N438 PolarHBondContact O-N 2.99Å; N438-K441 PolarHBondContact O-N 3.25Å; N438-V442 PolarHBondContact O-N 2.77Å
439	V	69.8	Low	68.3	Low	96 Å²	96	91.5 Å²	91.5	58%	0.582	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-45.4	169.7	175.7	0	0	0	0	110.5	T435 E436 K441 V442 V443	T435-V439 PolarHBondContact O-N 3.05Å; T435-V439 VanDerWaalsContact O-N 3.08Å; E436-V439 PolarHBondContact O-N 2.9Å; E436-V439 VanDerWaalsContact O-N 3.12Å; V439-K441 VanDerWaalsContact C-N 3.31Å; V439-K441 PolarHBondContact O-N 3.12Å; V439-V442 PolarHBondContact O-N 3.32Å; V439-V442 VanDerWaalsContact O-N 3.14Å; V439-V443 PolarHBondContact O-N 3.27Å
440	L	62.9	Low	68.1	Low	115 Å²	115	91.3 Å²	91.3	60%	0.602	50%	0.497	S	S	*	.	H	α-helix	trans	-62.7	-32.6	176.4	-75.5	168.3	0	0	0	113	E436 K444	E436-L440 PolarHBondContact O-N 3.4Å; L440-K444 VanDerWaalsContact O-CB 3.28Å; L440-K444 WeakPolarHBondContact O-CB 3.5Å; L440-K444 PolarHBondContact O-N 3.33Å
441	K	68.9	Low	68.3	Low	114 Å²	114	93.6 Å²	93.6	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-43.3	171.3	-82.9	173.9	-177.1	165.6	0	112.5	L437 N438 V439 K444 Q445	L437-K441 HydrophobicContact CD2-CD 4.42Å; L437-K441 WeakPolarHBondContact O-CG 3.29Å; L437-K441 PolarHBondContact O-N 3.32Å; N438-K441 PolarHBondContact O-N 3.25Å; V439-K441 VanDerWaalsContact C-N 3.31Å; V439-K441 PolarHBondContact O-N 3.12Å; K441-K444 PolarHBondContact O-N 2.9Å; K441-Q445 WeakPolarHBondContact O-CG 3.41Å; K441-Q445 PolarHBondContact O-N 3.38Å
442	V	70.2	Confident	68.2	Low	88 Å²	88	95.6 Å²	95.6	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-47.8	177.9	176.4	0	0	0	0	110.2	N438 V439 K444 Q445 E446	N438-V442 PolarHBondContact O-N 2.77Å; V439-V442 PolarHBondContact O-N 3.32Å; V439-V442 VanDerWaalsContact O-N 3.14Å; V442-K444 VanDerWaalsContact C-N 3.31Å; V442-K444 PolarHBondContact O-N 3.4Å; V442-Q445 PolarHBondContact O-N 2.96Å; V442-E446 PolarHBondContact O-N 3.36Å; V442-E446 VanDerWaalsContact O-N 3.07Å
443	V	69.7	Low	68.1	Low	75 Å²	75	96.5 Å²	96.5	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-60	-41.2	175.9	176.1	0	0	0	0	111.4	V439 E446 I447	V439-V443 PolarHBondContact O-N 3.27Å; V443-E446 PolarHBondContact O-N 3.02Å; V443-I447 HydrophobicContact CG1-CD1 3.96Å; V443-I447 WeakPolarHBondContact O-CG1 3.36Å; V443-I447 PolarHBondContact O-N 3.18Å
444	K	71.3	Confident	68.1	Low	117 Å²	117	99.5 Å²	99.5	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-46.3	175.2	-168.4	-164.4	173	-125.2	0	111.4	L440 K441 V442 E446 I447 E448	L440-K444 VanDerWaalsContact O-CB 3.28Å; L440-K444 WeakPolarHBondContact O-CB 3.5Å; L440-K444 PolarHBondContact O-N 3.33Å; K441-K444 PolarHBondContact O-N 2.9Å; V442-K444 VanDerWaalsContact C-N 3.31Å; V442-K444 PolarHBondContact O-N 3.4Å; K444-E446 VanDerWaalsContact C-N 3.26Å; K444-E446 PolarHBondContact O-N 3.28Å; K444-I447 PolarHBondContact O-N 2.99Å; K444-E448 IonicContact NZ-OE1 2.69Å; K444-E448 PolarHBondContact NZ-OE1 3.25Å; K444-E448 IonicContact NZ-OE2 2.6Å; K444-E448 PolarHBondContact NZ-OE2 3.11Å; K444-E448 VanDerWaalsContact O-CB 3.31Å; K444-E448 WeakPolarHBondContact O-CB 3.41Å; K444-E448 PolarHBondContact O-N 3.28Å
445	Q	70.6	Confident	68.1	Low	120 Å²	120	99.8 Å²	99.8	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-61.9	-34.1	178.8	-75.9	-179.8	-29.5	0	0	112.4	K441 V442 E448 K449	K441-Q445 WeakPolarHBondContact O-CG 3.41Å; K441-Q445 PolarHBondContact O-N 3.38Å; V442-Q445 PolarHBondContact O-N 2.96Å; Q445-E448 PolarHBondContact O-N 2.7Å; Q445-K449 WeakPolarHBondContact O-CG 3.45Å; Q445-K449 PolarHBondContact O-N 2.75Å
446	E	69.1	Low	68	Low	94 Å²	94	101 Å²	101	44%	0.439	52%	0.517	S	S	.	.	H	α-helix	trans	-71.2	-38.9	175.2	-132	58.8	-146.2	0	0	112.5	V442 V443 K444 E448 K449 L450	V442-E446 PolarHBondContact O-N 3.36Å; V442-E446 VanDerWaalsContact O-N 3.07Å; V443-E446 PolarHBondContact O-N 3.02Å; K444-E446 VanDerWaalsContact C-N 3.26Å; K444-E446 PolarHBondContact O-N 3.28Å; E446-E448 VanDerWaalsContact C-N 3.34Å; E446-K449 PolarHBondContact O-N 3.34Å; E446-K449 VanDerWaalsContact OE1-CD 3.29Å; E446-K449 WeakPolarHBondContact OE1-CD 3.35Å; E446-K449 IonicContact OE1-NZ 2.74Å; E446-K449 PolarHBondContact OE1-NZ 2.68Å; E446-K449 IonicContact OE2-NZ 3.97Å; E446-K449 PolarHBondContact OE2-NZ 2.65Å; E446-L450 WeakPolarHBondContact O-CG 3.45Å; E446-L450 PolarHBondContact O-N 3.16Å; E446-L450 VanDerWaalsContact O-N 3.09Å
447	I	71.4	Confident	68	Low	101 Å²	101	99.9 Å²	99.9	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-39.6	170.6	-66.8	166.7	0	0	0	111	V443 K444 L450 M451	V443-I447 HydrophobicContact CG1-CD1 3.96Å; V443-I447 WeakPolarHBondContact O-CG1 3.36Å; V443-I447 PolarHBondContact O-N 3.18Å; K444-I447 PolarHBondContact O-N 2.99Å; I447-L450 PolarHBondContact O-N 3.31Å; I447-M451 WeakPolarHBondContact O-CB 3.36Å; I447-M451 PolarHBondContact O-N 3.43Å
448	E	66.3	Low	67.7	Low	78 Å²	78	100.7 Å²	100.7	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-69.2	-34.8	-179	-153.1	155.1	-125.4	0	0	111.2	K444 Q445 E446 N452	K444-E448 IonicContact NZ-OE1 2.69Å; K444-E448 PolarHBondContact NZ-OE1 3.25Å; K444-E448 IonicContact NZ-OE2 2.6Å; K444-E448 PolarHBondContact NZ-OE2 3.11Å; K444-E448 VanDerWaalsContact O-CB 3.31Å; K444-E448 WeakPolarHBondContact O-CB 3.41Å; K444-E448 PolarHBondContact O-N 3.28Å; Q445-E448 PolarHBondContact O-N 2.7Å; E446-E448 VanDerWaalsContact C-N 3.34Å; E448-N452 WeakPolarHBondContact O-CB 3.49Å; E448-N452 VanDerWaalsContact O-CG 3.26Å; E448-N452 PolarHBondContact O-N 2.95Å; E448-N452 VanDerWaalsContact O-N 3.09Å; E448-N452 PolarHBondContact O-ND2 3.13Å
449	K	72.2	Confident	67.4	Low	116 Å²	116	99 Å²	99	50%	0.504	51%	0.513	S	S	.	.	H	α-helix	trans	-61.3	-50.8	166.3	-72	166.1	-177.4	163	0	111.8	Q445 E446 M451 N452 T453	Q445-K449 WeakPolarHBondContact O-CG 3.45Å; Q445-K449 PolarHBondContact O-N 2.75Å; E446-K449 PolarHBondContact O-N 3.34Å; E446-K449 VanDerWaalsContact OE1-CD 3.29Å; E446-K449 WeakPolarHBondContact OE1-CD 3.35Å; E446-K449 IonicContact OE1-NZ 2.74Å; E446-K449 PolarHBondContact OE1-NZ 2.68Å; E446-K449 IonicContact OE2-NZ 3.97Å; E446-K449 PolarHBondContact OE2-NZ 2.65Å; K449-M451 VanDerWaalsContact C-N 3.32Å; K449-M451 PolarHBondContact O-N 2.85Å; K449-N452 PolarHBondContact O-N 3.4Å; K449-N452 VanDerWaalsContact O-N 3.15Å; K449-T453 PolarHBondContact O-N 3.26Å; K449-T453 PolarHBondContact O-OG1 3.47Å
450	L	68.3	Low	67.2	Low	115 Å²	115	98.3 Å²	98.3	60%	0.602	51%	0.509	S	S	*	.	H	α-helix	trans	-61.7	-39.2	-178.6	-75.8	166.7	0	0	0	112.3	E446 I447 T453 L454	E446-L450 WeakPolarHBondContact O-CG 3.45Å; E446-L450 PolarHBondContact O-N 3.16Å; E446-L450 VanDerWaalsContact O-N 3.09Å; I447-L450 PolarHBondContact O-N 3.31Å; L450-T453 WeakPolarHBondContact CA-OG1 3.46Å; L450-T453 PolarHBondContact O-N 2.88Å; L450-T453 PolarHBondContact O-OG1 3.33Å; L450-L454 WeakPolarHBondContact O-CB 3.31Å; L450-L454 PolarHBondContact O-N 2.86Å
451	M	68.6	Low	67.2	Low	102 Å²	102	97.6 Å²	97.6	50%	0.502	51%	0.505	S	S	.	.	H	α-helix	trans	-69.7	-32.8	176.3	-164.1	168.7	73.2	0	0	112.1	I447 K449 N455	I447-M451 WeakPolarHBondContact O-CB 3.36Å; I447-M451 PolarHBondContact O-N 3.43Å; K449-M451 VanDerWaalsContact C-N 3.32Å; K449-M451 PolarHBondContact O-N 2.85Å; M451-N455 VanDerWaalsContact O-CB 3.28Å; M451-N455 WeakPolarHBondContact O-CB 3.48Å; M451-N455 VanDerWaalsContact O-CG 3.28Å; M451-N455 PolarHBondContact O-N 3.47Å; M451-N455 PolarHBondContact O-ND2 3.41Å
452	N	64.9	Low	67	Low	93 Å²	93	96.5 Å²	96.5	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-72.2	-36.2	173.6	-75.9	-35.9	0	0	0	113.1	E448 K449 N456	E448-N452 WeakPolarHBondContact O-CB 3.49Å; E448-N452 VanDerWaalsContact O-CG 3.26Å; E448-N452 PolarHBondContact O-N 2.95Å; E448-N452 VanDerWaalsContact O-N 3.09Å; E448-N452 PolarHBondContact O-ND2 3.13Å; K449-N452 PolarHBondContact O-N 3.4Å; K449-N452 VanDerWaalsContact O-N 3.15Å; N452-N456 PolarHBondContact O-N 2.74Å
453	T	68.7	Low	66.7	Low	78 Å²	78	98.8 Å²	98.8	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-45.9	170.1	39.6	0	0	0	0	111.5	K449 L450 N455 N456 D457	K449-T453 PolarHBondContact O-N 3.26Å; K449-T453 PolarHBondContact O-OG1 3.47Å; L450-T453 WeakPolarHBondContact CA-OG1 3.46Å; L450-T453 PolarHBondContact O-N 2.88Å; L450-T453 PolarHBondContact O-OG1 3.33Å; T453-N455 VanDerWaalsContact C-N 3.32Å; T453-N455 PolarHBondContact O-N 3.46Å; T453-N456 WeakPolarHBondContact O-CB 3.47Å; T453-N456 PolarHBondContact O-N 2.87Å; T453-N456 VanDerWaalsContact O-N 3.1Å; T453-D457 PolarHBondContact O-N 3.3Å
454	L	64.8	Low	66.3	Low	116 Å²	116	101 Å²	101	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-62.4	-38	177.7	-168.3	71.4	0	0	0	112.1	L450 D457 H458	L450-L454 WeakPolarHBondContact O-CB 3.31Å; L450-L454 PolarHBondContact O-N 2.86Å; L454-D457 PolarHBondContact O-N 3.33Å; L454-H458 VanDerWaalsContact O-CB 3.28Å; L454-H458 WeakPolarHBondContact O-CB 3.48Å; L454-H458 PolarHBondContact O-N 2.96Å
455	N	65.6	Low	65.8	Low	89 Å²	89	102.2 Å²	102.2	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-67.6	-33.2	174.3	-81.9	-28.9	0	0	0	112.9	M451 T453 A459	M451-N455 VanDerWaalsContact O-CB 3.28Å; M451-N455 WeakPolarHBondContact O-CB 3.48Å; M451-N455 VanDerWaalsContact O-CG 3.28Å; M451-N455 PolarHBondContact O-N 3.47Å; M451-N455 PolarHBondContact O-ND2 3.41Å; T453-N455 VanDerWaalsContact C-N 3.32Å; T453-N455 PolarHBondContact O-N 3.46Å; N455-A459 VanDerWaalsContact O-CB 3.23Å; N455-A459 WeakPolarHBondContact O-CB 3.28Å; N455-A459 PolarHBondContact O-N 2.84Å
456	N	65.7	Low	65.5	Low	113 Å²	113	103.5 Å²	103.5	60%	0.604	52%	0.523	S	S	*	.	H	α-helix	trans	-66.5	-46.4	172	-88.1	-11.1	0	0	0	111.3	N452 T453 H458 A459 V460	N452-N456 PolarHBondContact O-N 2.74Å; T453-N456 WeakPolarHBondContact O-CB 3.47Å; T453-N456 PolarHBondContact O-N 2.87Å; T453-N456 VanDerWaalsContact O-N 3.1Å; N456-H458 VanDerWaalsContact C-N 3.3Å; N456-H458 PolarHBondContact O-N 3.49Å; N456-A459 WeakPolarHBondContact O-CB 3.35Å; N456-A459 PolarHBondContact O-N 2.88Å; N456-A459 VanDerWaalsContact O-N 3.13Å; N456-V460 WeakPolarHBondContact O-CG2 3.39Å; N456-V460 PolarHBondContact O-N 3.1Å
457	D	64.4	Low	65.1	Low	97 Å²	97	102.5 Å²	102.5	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-43.6	175.9	-64.1	-25.3	0	0	0	110.7	T453 L454 A459 V460 I461	T453-D457 PolarHBondContact O-N 3.3Å; L454-D457 PolarHBondContact O-N 3.33Å; D457-A459 VanDerWaalsContact C-N 3.33Å; D457-A459 PolarHBondContact O-N 3.43Å; D457-V460 PolarHBondContact O-N 3.38Å; D457-I461 WeakPolarHBondContact O-CB 3.19Å; D457-I461 VanDerWaalsContact O-CG1 3.27Å; D457-I461 WeakPolarHBondContact O-CG1 3.48Å; D457-I461 PolarHBondContact O-N 3.37Å
458	H	61.8	Low	64.5	Low	112 Å²	112	103.3 Å²	103.3	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-67	-31.8	176.5	-153.6	-90.3	0	0	0	112.7	L454 N456 I462	L454-H458 VanDerWaalsContact O-CB 3.28Å; L454-H458 WeakPolarHBondContact O-CB 3.48Å; L454-H458 PolarHBondContact O-N 2.96Å; N456-H458 VanDerWaalsContact C-N 3.3Å; N456-H458 PolarHBondContact O-N 3.49Å; H458-I462 WeakPolarHBondContact ND1-CD1 3.43Å; H458-I462 WeakPolarHBondContact O-CB 3.43Å; H458-I462 WeakPolarHBondContact O-CD1 3.28Å; H458-I462 WeakPolarHBondContact O-CG1 3.31Å; H458-I462 PolarHBondContact O-N 3.19Å
459	A	60.8	Low	64	Low	49 Å²	49	103.6 Å²	103.6	41%	0.405	53%	0.529	S	S	.	.	H	α-helix	trans	-70.4	-40.7	173.6	0	0	0	0	0	112.2	N455 N456 D457 I462 Q463	N455-A459 VanDerWaalsContact O-CB 3.23Å; N455-A459 WeakPolarHBondContact O-CB 3.28Å; N455-A459 PolarHBondContact O-N 2.84Å; N456-A459 WeakPolarHBondContact O-CB 3.35Å; N456-A459 PolarHBondContact O-N 2.88Å; N456-A459 VanDerWaalsContact O-N 3.13Å; D457-A459 VanDerWaalsContact C-N 3.33Å; D457-A459 PolarHBondContact O-N 3.43Å; A459-I462 PolarHBondContact O-N 3.15Å; A459-Q463 WeakPolarHBondContact O-CB 3.15Å; A459-Q463 PolarHBondContact O-N 3.42Å
460	V	64.6	Low	63.5	Low	82 Å²	82	103.2 Å²	103.2	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-46.8	172.8	172.7	0	0	0	0	110.3	N456 D457 I462 Q463 E464	N456-V460 WeakPolarHBondContact O-CG2 3.39Å; N456-V460 PolarHBondContact O-N 3.1Å; D457-V460 PolarHBondContact O-N 3.38Å; V460-I462 VanDerWaalsContact C-N 3.32Å; V460-I462 PolarHBondContact O-N 3.35Å; V460-Q463 PolarHBondContact O-N 3.37Å; V460-E464 PolarHBondContact O-N 2.92Å
461	I	64	Low	62.9	Low	101 Å²	101	104.4 Å²	104.4	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-61.1	-39.4	175.7	-69	164.9	0	0	0	111.4	D457 K465	D457-I461 WeakPolarHBondContact O-CB 3.19Å; D457-I461 VanDerWaalsContact O-CG1 3.27Å; D457-I461 WeakPolarHBondContact O-CG1 3.48Å; D457-I461 PolarHBondContact O-N 3.37Å; I461-K465 WeakPolarHBondContact O-CB 3.45Å; I461-K465 PolarHBondContact O-N 3.43Å
462	I	65	Low	62.2	Low	91 Å²	91	103.6 Å²	103.6	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-39.4	172.9	-76.1	166.6	0	0	0	111.1	H458 A459 V460 K465 F466	H458-I462 WeakPolarHBondContact ND1-CD1 3.43Å; H458-I462 WeakPolarHBondContact O-CB 3.43Å; H458-I462 WeakPolarHBondContact O-CD1 3.28Å; H458-I462 WeakPolarHBondContact O-CG1 3.31Å; H458-I462 PolarHBondContact O-N 3.19Å; A459-I462 PolarHBondContact O-N 3.15Å; V460-I462 VanDerWaalsContact C-N 3.32Å; V460-I462 PolarHBondContact O-N 3.35Å; I462-K465 PolarHBondContact O-N 2.87Å; I462-F466 VanDerWaalsContact O-CB 3.27Å; I462-F466 WeakPolarHBondContact O-CB 3.46Å; I462-F466 PolarHBondContact O-N 2.87Å
463	Q	63.6	Low	61.6	Low	135 Å²	135	102.5 Å²	102.5	63%	0.631	52%	0.519	S	S	*	.	H	α-helix	trans	-72.2	-38.4	-179.1	-166.7	173.5	12.7	0	0	112.6	A459 V460 F466 T467	A459-Q463 WeakPolarHBondContact O-CB 3.15Å; A459-Q463 PolarHBondContact O-N 3.42Å; V460-Q463 PolarHBondContact O-N 3.37Å; Q463-F466 PolarHBondContact O-N 2.7Å; Q463-T467 WeakPolarHBondContact O-CG2 3.17Å; Q463-T467 PolarHBondContact O-N 2.82Å; Q463-T467 PolarHBondContact O-OG1 2.93Å
464	E	61.3	Low	61	Low	122 Å²	122	103 Å²	103	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-64.7	-45.9	168.7	-72	-159.5	126.4	0	0	111.1	V460 F466 T467 L468	V460-E464 PolarHBondContact O-N 2.92Å; E464-F466 VanDerWaalsContact C-N 3.28Å; E464-F466 PolarHBondContact O-N 2.91Å; E464-T467 WeakPolarHBondContact CA-OG1 3.18Å; E464-T467 PolarHBondContact O-N 2.96Å; E464-T467 PolarHBondContact O-OG1 3.44Å; E464-T467 VanDerWaalsContact O-OG1 3.05Å; E464-L468 WeakPolarHBondContact O-CB 3.2Å; E464-L468 VanDerWaalsContact O-CG 3.32Å; E464-L468 WeakPolarHBondContact O-CG 3.42Å; E464-L468 PolarHBondContact O-N 3.45Å
465	K	60.9	Low	60.5	Low	142 Å²	142	103.5 Å²	103.5	62%	0.617	52%	0.516	S	S	*	.	H	α-helix	trans	-58.4	-40.1	174	-174.7	176.9	179.9	-179.8	0	111.7	I461 I462 Q469	I461-K465 WeakPolarHBondContact O-CB 3.45Å; I461-K465 PolarHBondContact O-N 3.43Å; I462-K465 PolarHBondContact O-N 2.87Å; K465-Q469 WeakPolarHBondContact O-CB 3.41Å; K465-Q469 PolarHBondContact O-N 2.9Å
466	F	63.7	Low	59.7	Low	147 Å²	147	104.3 Å²	104.3	65%	0.645	52%	0.517	S	S	*	.	H	α-helix	trans	-72	-34.4	179.6	-156	-83.4	0	0	0	112.4	I462 Q463 E464 K470	I462-F466 VanDerWaalsContact O-CB 3.27Å; I462-F466 WeakPolarHBondContact O-CB 3.46Å; I462-F466 PolarHBondContact O-N 2.87Å; Q463-F466 PolarHBondContact O-N 2.7Å; E464-F466 VanDerWaalsContact C-N 3.28Å; E464-F466 PolarHBondContact O-N 2.91Å; F466-K470 VanDerWaalsContact O-CB 3.27Å; F466-K470 WeakPolarHBondContact O-CB 3.4Å; F466-K470 PolarHBondContact O-N 2.85Å
467	T	61.3	Low	58.9	Low	74 Å²	74	102.5 Å²	102.5	45%	0.454	51%	0.513	S	S	.	.	H	α-helix	trans	-75.8	-33.3	175.1	47.6	0	0	0	0	112.6	Q463 E464 K471	Q463-T467 WeakPolarHBondContact O-CG2 3.17Å; Q463-T467 PolarHBondContact O-N 2.82Å; Q463-T467 PolarHBondContact O-OG1 2.93Å; E464-T467 WeakPolarHBondContact CA-OG1 3.18Å; E464-T467 PolarHBondContact O-N 2.96Å; E464-T467 PolarHBondContact O-OG1 3.44Å; E464-T467 VanDerWaalsContact O-OG1 3.05Å; T467-K471 WeakPolarHBondContact O-CG 3.24Å; T467-K471 PolarHBondContact O-N 3.39Å; T467-K471 VanDerWaalsContact O-N 3.08Å
468	L	58.6	Low	58.3	Low	118 Å²	118	104.5 Å²	104.5	62%	0.618	52%	0.519	S	S	*	.	H	α-helix	trans	-65.9	-45.6	167.5	-70.5	170	0	0	0	111.3	E464 K470 K471 L472	E464-L468 WeakPolarHBondContact O-CB 3.2Å; E464-L468 VanDerWaalsContact O-CG 3.32Å; E464-L468 WeakPolarHBondContact O-CG 3.42Å; E464-L468 PolarHBondContact O-N 3.45Å; L468-K470 VanDerWaalsContact C-N 3.33Å; L468-K470 PolarHBondContact O-N 3.1Å; L468-K471 PolarHBondContact O-N 2.69Å; L468-L472 WeakPolarHBondContact O-CB 3.48Å; L468-L472 PolarHBondContact O-N 2.89Å
469	Q	55.2	Low	57.8	Low	83 Å²	83	103.5 Å²	103.5	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-38.1	175.2	-168.3	72.5	60.7	0	0	111.6	K465 L472 N473	K465-Q469 WeakPolarHBondContact O-CB 3.41Å; K465-Q469 PolarHBondContact O-N 2.9Å; Q469-L472 PolarHBondContact O-N 3.35Å; Q469-N473 PolarHBondContact NE2-OD1 3.38Å; Q469-N473 VanDerWaalsContact O-CB 3.26Å; Q469-N473 WeakPolarHBondContact O-CB 3.35Å; Q469-N473 PolarHBondContact O-N 2.83Å; Q469-N473 PolarHBondContact O-OD1 3.46Å; Q469-N473 VanDerWaalsContact O-OD1 3.04Å
470	K	60.9	Low	57	Low	109 Å²	109	106.8 Å²	106.8	47%	0.474	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-47.5	175.3	-172.4	172	-175.7	-73.6	0	111.2	F466 L468 L472 N473 E474	F466-K470 VanDerWaalsContact O-CB 3.27Å; F466-K470 WeakPolarHBondContact O-CB 3.4Å; F466-K470 PolarHBondContact O-N 2.85Å; L468-K470 VanDerWaalsContact C-N 3.33Å; L468-K470 PolarHBondContact O-N 3.1Å; K470-L472 VanDerWaalsContact C-N 3.34Å; K470-L472 PolarHBondContact O-N 3.28Å; K470-N473 PolarHBondContact O-N 3.21Å; K470-E474 IonicContact NZ-OE1 2.91Å; K470-E474 PolarHBondContact NZ-OE1 3.32Å; K470-E474 IonicContact NZ-OE2 3.83Å; K470-E474 WeakPolarHBondContact O-CB 3.48Å; K470-E474 VanDerWaalsContact O-CG 3.24Å; K470-E474 WeakPolarHBondContact O-CG 3.25Å; K470-E474 PolarHBondContact O-N 2.95Å
471	K	56.7	Low	56.4	Low	140 Å²	140	109 Å²	109	61%	0.609	53%	0.525	S	S	*	.	H	α-helix	trans	-62.5	-38.4	175.3	-73.7	177	177.2	178.4	0	112.8	T467 L468 E474 Q475	T467-K471 WeakPolarHBondContact O-CG 3.24Å; T467-K471 PolarHBondContact O-N 3.39Å; T467-K471 VanDerWaalsContact O-N 3.08Å; L468-K471 PolarHBondContact O-N 2.69Å; K471-E474 PolarHBondContact O-N 2.99Å; K471-Q475 WeakPolarHBondContact O-CG 3.32Å; K471-Q475 PolarHBondContact O-N 3.23Å
472	L	54.9	Low	55.7	Low	84 Å²	84	109.6 Å²	109.6	44%	0.44	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-42.7	175.5	-170.7	68.7	0	0	0	111.6	L468 Q469 K470 Q475 Q476	L468-L472 WeakPolarHBondContact O-CB 3.48Å; L468-L472 PolarHBondContact O-N 2.89Å; Q469-L472 PolarHBondContact O-N 3.35Å; K470-L472 VanDerWaalsContact C-N 3.34Å; K470-L472 PolarHBondContact O-N 3.28Å; L472-Q475 PolarHBondContact O-N 3.47Å; L472-Q476 WeakPolarHBondContact O-CG 3.44Å; L472-Q476 PolarHBondContact O-N 2.66Å
473	N	52.1	Low	54.5	Low	70 Å²	70	106 Å²	106	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-71.2	-31.2	177.2	-70.9	19.4	0	0	0	112	Q469 K470 Q476 S477	Q469-N473 PolarHBondContact NE2-OD1 3.38Å; Q469-N473 VanDerWaalsContact O-CB 3.26Å; Q469-N473 WeakPolarHBondContact O-CB 3.35Å; Q469-N473 PolarHBondContact O-N 2.83Å; Q469-N473 PolarHBondContact O-OD1 3.46Å; Q469-N473 VanDerWaalsContact O-OD1 3.04Å; K470-N473 PolarHBondContact O-N 3.21Å; N473-Q476 PolarHBondContact O-N 2.83Å; N473-S477 VanDerWaalsContact O-CB 3.25Å; N473-S477 WeakPolarHBondContact O-CB 3.27Å; N473-S477 PolarHBondContact O-N 3.19Å; N473-S477 PolarHBondContact O-OG 3.36Å
474	E	55.8	Low	53.5	Low	90 Å²	90	104.5 Å²	104.5	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-49.8	170.7	-76.8	164.7	157.2	0	0	109.8	K470 K471 Q476 S477 E478	K470-E474 IonicContact NZ-OE1 2.91Å; K470-E474 PolarHBondContact NZ-OE1 3.32Å; K470-E474 IonicContact NZ-OE2 3.83Å; K470-E474 WeakPolarHBondContact O-CB 3.48Å; K470-E474 VanDerWaalsContact O-CG 3.24Å; K470-E474 WeakPolarHBondContact O-CG 3.25Å; K470-E474 PolarHBondContact O-N 2.95Å; K471-E474 PolarHBondContact O-N 2.99Å; E474-Q476 VanDerWaalsContact C-N 3.32Å; E474-Q476 PolarHBondContact O-N 2.85Å; E474-S477 PolarHBondContact O-N 2.82Å; E474-E478 WeakPolarHBondContact O-CB 3.3Å; E474-E478 PolarHBondContact O-N 3.35Å
475	Q	54.3	Low	52.9	Low	126 Å²	126	107.4 Å²	107.4	59%	0.589	51%	0.508	S	S	*	.	H	α-helix	trans	-59.4	-37.9	173	-73.6	-173.7	-32.5	0	0	113	K471 L472 I479	K471-Q475 WeakPolarHBondContact O-CG 3.32Å; K471-Q475 PolarHBondContact O-N 3.23Å; L472-Q475 PolarHBondContact O-N 3.47Å; Q475-I479 WeakPolarHBondContact O-CB 3.5Å; Q475-I479 WeakPolarHBondContact O-CD1 3.22Å; Q475-I479 WeakPolarHBondContact O-CG1 3.27Å; Q475-I479 PolarHBondContact O-N 2.88Å
476	Q	48.1	Very low	51.8	Low	105 Å²	105	103.1 Å²	103.1	49%	0.491	49%	0.492	S	S	.	.	H	α-helix	trans	-71.7	-35.7	175.3	-76.4	-176.9	-28	0	0	113.6	L472 N473 E474 I479 Y480	L472-Q476 WeakPolarHBondContact O-CG 3.44Å; L472-Q476 PolarHBondContact O-N 2.66Å; N473-Q476 PolarHBondContact O-N 2.83Å; E474-Q476 VanDerWaalsContact C-N 3.32Å; E474-Q476 PolarHBondContact O-N 2.85Å; Q476-I479 PolarHBondContact O-N 3.47Å; Q476-Y480 PolarHBondContact O-N 2.84Å
477	S	48.9	Very low	50.6	Low	76 Å²	76	104.4 Å²	104.4	53%	0.531	49%	0.492	S	S	.	.	H	α-helix	trans	-74.3	-38.6	-179.5	-57.5	0	0	0	0	111.5	N473 E474 I479 Y480 E481	N473-S477 VanDerWaalsContact O-CB 3.25Å; N473-S477 WeakPolarHBondContact O-CB 3.27Å; N473-S477 PolarHBondContact O-N 3.19Å; N473-S477 PolarHBondContact O-OG 3.36Å; E474-S477 PolarHBondContact O-N 2.82Å; S477-I479 VanDerWaalsContact C-N 3.32Å; S477-Y480 PolarHBondContact O-N 2.86Å; S477-Y480 VanDerWaalsContact O-N 3.08Å; S477-E481 PolarHBondContact O-N 2.68Å
478	E	52.4	Low	49.5	Very low	139 Å²	139	106 Å²	106	65%	0.65	51%	0.507	S	S	*	.	H	α-helix	trans	-63.1	-39.6	172.7	-163.8	166.5	-126.6	0	0	110.6	E474 Y480 L482	E474-E478 WeakPolarHBondContact O-CB 3.3Å; E474-E478 PolarHBondContact O-N 3.35Å; E478-Y480 VanDerWaalsContact C-N 3.34Å; E478-Y480 PolarHBondContact O-N 3.01Å; E478-L482 VanDerWaalsContact O-CB 3.27Å; E478-L482 WeakPolarHBondContact O-CB 3.31Å; E478-L482 WeakPolarHBondContact O-CD1 3.27Å; E478-L482 VanDerWaalsContact O-CG 3.22Å; E478-L482 WeakPolarHBondContact O-CG 3.27Å; E478-L482 PolarHBondContact O-N 2.89Å; E478-L482 VanDerWaalsContact O-N 3.08Å
479	I	50.5	Low	48.9	Very low	91 Å²	91	109.4 Å²	109.4	47%	0.467	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-33.2	169.8	-73.4	169.1	0	0	0	112.7	Q475 Q476 S477 L482	Q475-I479 WeakPolarHBondContact O-CB 3.5Å; Q475-I479 WeakPolarHBondContact O-CD1 3.22Å; Q475-I479 WeakPolarHBondContact O-CG1 3.27Å; Q475-I479 PolarHBondContact O-N 2.88Å; Q476-I479 PolarHBondContact O-N 3.47Å; S477-I479 VanDerWaalsContact C-N 3.32Å; I479-L482 WeakPolarHBondContact O-CB 3.37Å
480	Y	44.5	Very low	48	Very low	118 Å²	118	114.1 Å²	114.1	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-80.5	-35.4	178.8	-108.1	-88.1	0	0	0	114.2	Q476 S477 E478 L482 M483 E484	Q476-Y480 PolarHBondContact O-N 2.84Å; S477-Y480 PolarHBondContact O-N 2.86Å; S477-Y480 VanDerWaalsContact O-N 3.08Å; E478-Y480 VanDerWaalsContact C-N 3.34Å; E478-Y480 PolarHBondContact O-N 3.01Å; Y480-L482 VanDerWaalsContact C-N 3.28Å; Y480-M483 HydrophobicContact CD1-CE 3.58Å; Y480-M483 HydrophobicContact CD2-CE 3.83Å; Y480-M483 HydrophobicContact CE1-CE 3.47Å; Y480-M483 VanDerWaalsContact CE1-CE 3.47Å; Y480-M483 HydrophobicContact CE1-SD 4.34Å; Y480-M483 HydrophobicContact CE2-CE 3.74Å; Y480-M483 HydrophobicContact CG-CE 3.75Å; Y480-M483 WeakPolarHBondContact O-CB 3.31Å; Y480-M483 PolarHBondContact O-N 2.87Å; Y480-E484 PolarHBondContact O-N 3.14Å
481	E	52.4	Low	46.7	Very low	129 Å²	129	111.9 Å²	111.9	60%	0.603	54%	0.543	S	S	*	.	H	α-helix	trans	-70.3	-30	171.7	-153.9	-174.7	176.2	0	0	111.1	S477 M483 R485	S477-E481 PolarHBondContact O-N 2.68Å; E481-M483 PolarHBondContact O-N 3.45Å; E481-M483 VanDerWaalsContact O-N 3.17Å; E481-R485 IonicContact OE1-CZ 2.66Å; E481-R485 IonicContact OE1-NH1 3.22Å; E481-R485 PolarHBondContact OE1-NH1 2.71Å
482	L	47.9	Very low	46	Very low	112 Å²	112	107 Å²	107	59%	0.586	53%	0.532	S	S	*	.	H	α-helix	trans	-64.8	-2.3	164.5	-79.2	170.8	0	0	0	114.4	E478 I479 Y480 L486	E478-L482 VanDerWaalsContact O-CB 3.27Å; E478-L482 WeakPolarHBondContact O-CB 3.31Å; E478-L482 WeakPolarHBondContact O-CD1 3.27Å; E478-L482 VanDerWaalsContact O-CG 3.22Å; E478-L482 WeakPolarHBondContact O-CG 3.27Å; E478-L482 PolarHBondContact O-N 2.89Å; E478-L482 VanDerWaalsContact O-N 3.08Å; I479-L482 WeakPolarHBondContact O-CB 3.37Å; Y480-L482 VanDerWaalsContact C-N 3.28Å; L482-L486 WeakPolarHBondContact O-CD1 3.41Å
483	M	41.2	Very low	45.4	Very low	15 Å²	15	107.6 Å²	107.6	7%	0.074	54%	0.535	C	S	.	.	H	α-helix	trans	-110.9	-54.1	-175	-164	-168.5	-28.4	0	0	114.5	Y480 E481 L486 N493 K494 L495	Y480-M483 HydrophobicContact CD1-CE 3.58Å; Y480-M483 HydrophobicContact CD2-CE 3.83Å; Y480-M483 HydrophobicContact CE1-CE 3.47Å; Y480-M483 VanDerWaalsContact CE1-CE 3.47Å; Y480-M483 HydrophobicContact CE1-SD 4.34Å; Y480-M483 HydrophobicContact CE2-CE 3.74Å; Y480-M483 HydrophobicContact CG-CE 3.75Å; Y480-M483 WeakPolarHBondContact O-CB 3.31Å; Y480-M483 PolarHBondContact O-N 2.87Å; E481-M483 PolarHBondContact O-N 3.45Å; E481-M483 VanDerWaalsContact O-N 3.17Å; M483-L486 WeakPolarHBondContact O-CB 3.45Å; M483-L486 PolarHBondContact O-N 2.72Å; M483-N493 WeakPolarHBondContact CA-O 3.31Å; M483-N493 WeakPolarHBondContact CG-O 3.26Å; M483-K494 WeakPolarHBondContact CE-O 3.31Å; M483-K494 WeakPolarHBondContact CG-O 3.36Å; M483-K494 VanDerWaalsContact SD-C 3.57Å; M483-L495 WeakPolarHBondContact CE-O 3.26Å; M483-L495 PolarHBondContact SD-N 3.45Å; M483-L495 VanDerWaalsContact SD-N 3.42Å
484	E	42	Very low	45.1	Very low	105 Å²	105	112 Å²	112	49%	0.491	55%	0.551	S	S	.	*	H	α-helix	trans	-86.9	-21.1	-168	-154.4	57.6	-155.8	0	0	113.2	Y480 L486 R487	Y480-E484 PolarHBondContact O-N 3.14Å; E484-L486 PolarHBondContact O-N 2.77Å; E484-R487 PolarHBondContact O-N 2.88Å; E484-R487 WeakPolarHBondContact OE1-CD 3.27Å; E484-R487 IonicContact OE1-NE 2.7Å; E484-R487 PolarHBondContact OE1-NE 3.24Å; E484-R487 VanDerWaalsContact OE1-NE 3.12Å; E484-R487 IonicContact OE2-CZ 3.12Å; E484-R487 IonicContact OE2-NE 3.78Å; E484-R487 PolarHBondContact OE2-NE 3.42Å; E484-R487 IonicContact OE2-NH2 3.97Å
485	R	49.4	Very low	44.6	Very low	182 Å²	182	113.6 Å²	113.6	69%	0.687	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-4.2	168.7	-143.4	-170.2	-144.2	102.8	2.1	113.4	E481	E481-R485 IonicContact OE1-CZ 2.66Å; E481-R485 IonicContact OE1-NH1 3.22Å; E481-R485 PolarHBondContact OE1-NH1 2.71Å
486	L	37.2	Very low	44.3	Very low	52 Å²	52	112.4 Å²	112.4	27%	0.272	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114	12.5	-172.5	-64.6	-173.2	0	0	0	113	L482 M483 E484 G492 N493	L482-L486 WeakPolarHBondContact O-CD1 3.41Å; M483-L486 WeakPolarHBondContact O-CB 3.45Å; M483-L486 PolarHBondContact O-N 2.72Å; E484-L486 PolarHBondContact O-N 2.77Å; L486-G492 VanDerWaalsContact CD1-C 3.46Å; L486-G492 VanDerWaalsContact O-CA 3.26Å; L486-G492 WeakPolarHBondContact O-CA 3.4Å; L486-G492 PolarHBondContact O-N 3.41Å; L486-N493 HydrophobicContact CD1-CB 3.95Å
487	R	38.4	Very low	44.5	Very low	174 Å²	174	115.2 Å²	115.2	66%	0.657	57%	0.573	S	S	*	*	S	Bend	trans	-108.6	-33.5	-174.6	-166.8	179.5	-64	-87.2	-0.8	116.9	E484	E484-R487 PolarHBondContact O-N 2.88Å; E484-R487 WeakPolarHBondContact OE1-CD 3.27Å; E484-R487 IonicContact OE1-NE 2.7Å; E484-R487 PolarHBondContact OE1-NE 3.24Å; E484-R487 VanDerWaalsContact OE1-NE 3.12Å; E484-R487 IonicContact OE2-CZ 3.12Å; E484-R487 IonicContact OE2-NE 3.78Å; E484-R487 PolarHBondContact OE2-NE 3.42Å; E484-R487 IonicContact OE2-NH2 3.97Å
488	S	38.6	Very low	44.7	Very low	108 Å²	108	115 Å²	115	76%	0.755	58%	0.575	S	S	*	*	S	Bend	trans	-120.1	-15.4	-171.3	58.4	0	0	0	0	116.5
489	Y	46.5	Very low	44.4	Very low	189 Å²	189	117 Å²	117	74%	0.741	59%	0.585	S	S	*	*	S	Bend	trans	-129.2	130.2	152.9	-82	-92	0	0	0	108.2	G491	Y489-G491 PolarHBondContact O-N 2.81Å
490	E	35.1	Very low	44.4	Very low	183 Å²	183	118.2 Å²	118.2	86%	0.855	60%	0.596	S	S	*	*	S	Bend	trans	44.6	71.2	146.4	-59.8	165.9	116.3	0	0	118.2
491	G	33.6	Very low	44.6	Very low	62 Å²	62	117.9 Å²	117.9	64%	0.639	61%	0.606	S	S	*	*			trans	173.5	-36.1	157.6	0	0	0	0	0	125.3	Y489	Y489-G491 PolarHBondContact O-N 2.81Å
492	G	42.8	Very low	43.9	Very low	37 Å²	37	120 Å²	120	38%	0.381	62%	0.616	S	S	.	*			trans	64.4	123.7	176.4	0	0	0	0	0	122.6	L486	L486-G492 VanDerWaalsContact CD1-C 3.46Å; L486-G492 VanDerWaalsContact O-CA 3.26Å; L486-G492 WeakPolarHBondContact O-CA 3.4Å; L486-G492 PolarHBondContact O-N 3.41Å
493	N	42.1	Very low	43.1	Very low	96 Å²	96	120.9 Å²	120.9	51%	0.513	63%	0.626	S	S	.	*			trans	173.1	121.9	145.6	-95.7	-60.9	0	0	0	118.6	M483 L486	M483-N493 WeakPolarHBondContact CA-O 3.31Å; M483-N493 WeakPolarHBondContact CG-O 3.26Å; L486-N493 HydrophobicContact CD1-CB 3.95Å
494	K	44.4	Very low	42.7	Very low	162 Å²	162	125.7 Å²	125.7	70%	0.704	66%	0.661	S	S	*	*			trans	61.4	117.5	136.2	-58.6	171.2	-179.1	170.6	0	129.3	M483	M483-K494 WeakPolarHBondContact CE-O 3.31Å; M483-K494 WeakPolarHBondContact CG-O 3.36Å; M483-K494 VanDerWaalsContact SD-C 3.57Å
495	L	45.7	Very low	42.7	Very low	125 Å²	125	125.4 Å²	125.4	65%	0.654	67%	0.671	S	S	*	*			trans	43.1	154.5	134.9	-108.9	69.6	0	0	0	125.1	M483	M483-L495 WeakPolarHBondContact CE-O 3.26Å; M483-L495 PolarHBondContact SD-N 3.45Å; M483-L495 VanDerWaalsContact SD-N 3.42Å
496	N	48.2	Very low	41.9	Very low	101 Å²	101	123.4 Å²	123.4	54%	0.54	68%	0.679	S	S	.	*			cis	-170.1	137.4	14	-165.7	77.1	0	0	0	111.6
497	H	52.9	Low	41.6	Very low	164 Å²	164	124.3 Å²	124.3	76%	0.759	70%	0.701	S	S	*	*				56.5	145	86.4	-114.6	55.1	0	0	0	119.4
498	A	52.3	Low	41.2	Very low	70 Å²	70	123.8 Å²	123.8	58%	0.579	71%	0.705	S	S	*	*			cis	-175.4	-174.3	-18.3	0	0	0	0	0	113.9
499	Q	47.7	Very low	40.8	Very low	183 Å²	183	129.1 Å²	129.1	86%	0.855	71%	0.709	S	S	*	*			trans	78.4	163.3	164.4	-63.5	-174.7	-73.9	0	0	120.1
500	T	48.7	Very low	40.1	Very low	115 Å²	115	124.5 Å²	124.5	71%	0.706	70%	0.704	S	S	*	*			cis	-176.4	176.8	-14.6	33.4	0	0	0	0	110.1
501	T	49.6	Very low	40.1	Very low	111 Å²	111	122.3 Å²	122.3	68%	0.681	70%	0.703	S	S	*	*			cis	-179.8	143.2	-36.7	-71.3	0	0	0	0	113.1
502	E	38.5	Very low	40.1	Very low	174 Å²	174	126.3 Å²	126.3	81%	0.813	72%	0.715	S	S	*	*			trans	56.7	175.2	168.6	-69	174.6	-175.9	0	0	120.1
503	V	30.8	Very low	39.6	Very low	130 Å²	130	131 Å²	131	79%	0.788	73%	0.732	S	S	*	*			cis	-155.1	163.4	12.8	-145.8	0	0	0	0	114.3
504	S	31.4	Very low	39.3	Very low	116 Å²	116	134.3 Å²	134.3	81%	0.811	74%	0.744	S	S	*	*			trans	95.6	165.7	141.1	-146.4	0	0	0	0	124.2
505	S	42.9	Very low	38.8	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	75%	0.745	S	S	*	*			trans	-162.7	177.6	-167.1	67.9	0	0	0	0	115.6
506	V	33.6	Very low	38.2	Very low	141 Å²	141	134.4 Å²	134.4	86%	0.855	75%	0.752	S	S	*	*			trans	77.5	141	162.1	173.5	0	0	0	0	119.9
507	G	30.2	Very low	37.7	Very low	71 Å²	71	136.9 Å²	136.9	73%	0.732	77%	0.765	S	S	*	*			trans	163.4	90.4	158.1	0	0	0	0	0	122.7
508	H	30.1	Very low	36.9	Very low	163 Å²	163	136.3 Å²	136.3	76%	0.755	77%	0.768	S	S	*	*			trans	48.9	115.4	134.9	-90	-110.9	0	0	0	127.8
509	W	29.9	Very low	36.3	Very low	219 Å²	219	137.1 Å²	137.1	83%	0.83	77%	0.767	S	S	*	*				53.3	142.3	105.5	-75.4	101.8	0	0	0	126.9
510	S	31.4	Very low	35.6	Very low	93 Å²	93	136.5 Å²	136.5	65%	0.65	76%	0.764	S	S	*	*			trans	107.6	113.2	132.1	-74	0	0	0	0	125.3
511	T	34.6	Very low	34.7	Very low	136 Å²	136	138.3 Å²	138.3	83%	0.834	77%	0.768	S	S	*	*				70.6	132.9	121	-48.5	0	0	0	0	124.6
512	V	34.5	Very low	33.7	Very low	146 Å²	146	139.6 Å²	139.6	89%	0.885	77%	0.77	S	S	*	*			trans	-149.5	179.2	164.1	79.6	0	0	0	0	111.9
513	N	32.3	Very low	33.9	Very low	136 Å²	136	137.1 Å²	137.1	73%	0.727	77%	0.767	S	S	*	*			trans	-159.4	170.1	-166.8	-170.4	18.2	0	0	0	115.2
514	Q	36.1	Very low	34	Very low	166 Å²	166	139.3 Å²	139.3	78%	0.776	77%	0.769	S	S	*	*			trans	125.1	113.2	149.6	-63.8	-175	13	0	0	121.3
515	N	33.4	Very low	34.2	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	76%	0.763	S	S	*	*			trans	22.9	143.3	136	-47.5	-20.8	0	0	0	125.8
516	L	34.3	Very low	33.8	Very low	152 Å²	152	139.7 Å²	139.7	80%	0.796	76%	0.761	S	S	*	*				161.4	133.2	112.1	-87.2	157	0	0	0	118.6
517	N	37.4	Very low	33.8	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	75%	0.753	S	S	*	*			trans	68.3	162.9	142	-70.3	1.5	0	0	0	126.8
518	N	35.8	Very low	34	Very low	152 Å²	152	149.1 Å²	149.1	81%	0.813	76%	0.759	S	S	*	*			trans	-167.3	-167.1	-174.6	-144.6	-2.2	0	0	0	106.8
519	P	40.2	Very low	34.2	Very low	88 Å²	88	146.7 Å²	146.7	57%	0.571	76%	0.76	S	S	*	*			cis	-138.4	-159.7	-13.5	43.5	-22.8	0	0	0	115.6
520	Q	31.6	Very low	34.3	Very low	169 Å²	169	143.2 Å²	143.2	79%	0.79	76%	0.756	S	S	*	*			trans	76.7	167.4	161	-74.9	172.3	-115.3	0	0	117.9
521	I	31.1	Very low	34.3	Very low	154 Å²	154	147.9 Å²	147.9	79%	0.79	76%	0.761	S	S	*	*			cis	-134.4	-143.7	15.4	-158.5	153.3	0	0	0	115.7
522	L	27.7	Very low	34.5	Very low	138 Å²	138	150.4 Å²	150.4	72%	0.723	76%	0.763	S	S	*	*			trans	-157.9	134.5	-143.7	-141.6	162.1	0	0	0	115.3
523	T	43.7	Very low	34.4	Very low	121 Å²	121	150.8 Å²	150.8	74%	0.742	76%	0.756	S	S	*	*			trans	36	145.3	164.3	51.5	0	0	0	0	124.1
524	E	32.2	Very low	34.4	Very low	177 Å²	177	149.5 Å²	149.5	83%	0.827	76%	0.756	S	S	*	*			trans	-162	153.7	140.2	-156.6	54.8	-88.6	0	0	113.7
525	A	34.9	Very low	34.5	Very low	83 Å²	83	149.3 Å²	149.3	69%	0.686	76%	0.76	S	S	*	*			trans	59.7	166.3	157.9	0	0	0	0	0	122.7
526	E	34.1	Very low	34.8	Very low	140 Å²	140	150.8 Å²	150.8	65%	0.654	77%	0.767	S	S	*	*				179.2	140.1	-61.5	-107.1	-162.4	152.7	0	0	112.1
527	R	33.9	Very low	34.6	Very low	181 Å²	181	148.9 Å²	148.9	68%	0.683	77%	0.766	S	S	*	*			trans	63.6	144.3	151.7	-56.9	171.4	-153.4	-118.2	-3.9	121.9
528	R	35.2	Very low	34.5	Very low	229 Å²	229	149.2 Å²	149.2	86%	0.864	77%	0.767	S	S	*	*			trans	72.3	156.2	149.1	-77.8	168	-175.1	178.5	0.1	118
529	S	34.3	Very low	34.5	Very low	111 Å²	111	147.1 Å²	147.1	78%	0.776	76%	0.764	S	S	*	*			cis	-153	168.8	-10.5	-170.6	0	0	0	0	111.4
530	I	32.5	Very low	34.4	Very low	146 Å²	146	147 Å²	147	75%	0.749	77%	0.765	S	S	*	*			trans	-72.9	141.4	170.8	-58.1	151.9	0	0	0	111.7
531	Y	31.1	Very low	34.4	Very low	192 Å²	192	145.7 Å²	145.7	75%	0.753	76%	0.764	S	S	*	*				-179.5	-173.3	127	-115	-90.9	0	0	0	111.7
532	E	37.9	Very low	34.4	Very low	189 Å²	189	145.6 Å²	145.6	88%	0.883	76%	0.764	S	S	*	*			trans	72.2	106.5	-176.1	-57	-174.7	160.5	0	0	114.9
533	E	33.3	Very low	34.6	Very low	154 Å²	154	143.4 Å²	143.4	72%	0.72	76%	0.76	S	S	*	*			cis	104	118	8.7	-156.5	166.6	-161.2	0	0	117.2
534	C	32.1	Very low	34.1	Very low	109 Å²	109	145.4 Å²	145.4	74%	0.736	76%	0.761	S	S	*	*			trans	36.7	123.1	157.1	-62.8	0	0	0	0	122.1
535	N	37.3	Very low	34	Very low	161 Å²	161	142.9 Å²	142.9	86%	0.861	76%	0.757	S	S	*	*			trans	-154.7	157.3	145.6	-110.8	-63.8	0	0	0	112.4
536	L	39.6	Very low	34	Very low	168 Å²	168	144.7 Å²	144.7	88%	0.88	77%	0.765	S	S	*	*			trans	75.3	121.5	178.4	-57.6	172.6	0	0	0	118.1
537	S	30.6	Very low	33.9	Very low	111 Å²	111	145.9 Å²	145.9	78%	0.776	77%	0.772	S	S	*	*			trans	-137.9	-175.3	175.7	-61.5	0	0	0	0	109.1
538	I	35.4	Very low	34.2	Very low	161 Å²	161	145.2 Å²	145.2	83%	0.826	78%	0.781	S	S	*	*			trans	99.7	140.6	159.7	-55.2	154.6	0	0	0	117
539	S	35.7	Very low	34.2	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	77%	0.773	S	S	*	*			trans	74.4	147.3	162.5	-93.7	0	0	0	0	120.5
540	S	37.8	Very low	34.4	Very low	87 Å²	87	141.9 Å²	141.9	61%	0.608	78%	0.776	S	S	*	*			cis	-173.6	140	-24.8	39.9	0	0	0	0	112.4
541	D	32.7	Very low	34.7	Very low	140 Å²	140	143.7 Å²	143.7	75%	0.749	78%	0.779	S	S	*	*			trans	64.7	129.6	134.5	-59.5	-25.8	0	0	0	124.8
542	L	31.3	Very low	35.1	Very low	153 Å²	153	142.4 Å²	142.4	80%	0.801	79%	0.785	S	S	*	*				29.2	152.2	114.7	-75.6	83.8	0	0	0	119.9
543	S	30.8	Very low	35	Very low	92 Å²	92	139 Å²	139	64%	0.643	78%	0.782	S	S	*	*			cis	-174.7	-148.3	-6.2	56.8	0	0	0	0	109.6
544	H	33.8	Very low	35.1	Very low	163 Å²	163	135.2 Å²	135.2	76%	0.755	78%	0.784	S	S	*	*			trans	67.7	135.2	178	-85.4	-94.9	0	0	0	116.8
545	V	30.7	Very low	35.5	Very low	124 Å²	124	139.6 Å²	139.6	75%	0.752	79%	0.791	S	S	*	*			cis	75.2	95.7	14.8	-166	0	0	0	0	116.4
546	S	32.9	Very low	35.3	Very low	121 Å²	121	137.1 Å²	137.1	85%	0.846	79%	0.786	S	S	*	*			trans	-168.2	161.8	131.8	50.2	0	0	0	0	112.7
547	M	32.6	Very low	35.1	Very low	165 Å²	165	138.8 Å²	138.8	81%	0.813	79%	0.787	S	S	*	*			trans	-80.3	161.8	-179	-53.3	159.6	71.5	0	0	111.9
548	I	40.7	Very low	35.4	Very low	167 Å²	167	139.7 Å²	139.7	86%	0.856	79%	0.788	S	S	*	*			trans	-165.7	143.2	131.2	-101.1	152.1	0	0	0	109.6
549	D	34.3	Very low	35.5	Very low	132 Å²	132	137.7 Å²	137.7	71%	0.706	78%	0.783	S	S	*	*			trans	-70.4	151.4	178.6	-65.1	-92.1	0	0	0	113.9
550	T	40.2	Very low	35.7	Very low	137 Å²	137	138 Å²	138	84%	0.84	78%	0.782	S	S	*	*				-162.7	114.9	119.4	8.4	0	0	0	0	114.6
551	K	37.7	Very low	35.8	Very low	185 Å²	185	140.8 Å²	140.8	80%	0.804	79%	0.789	S	S	*	*			trans	-2.7	124.4	153	-55.9	166.1	-175.3	172.7	0	117.7
552	N	40.3	Very low	36	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	80%	0.797	S	S	*	*				-166.4	159.7	106	-95.2	-24.7	0	0	0	114.4
553	S	35.9	Very low	36.5	Very low	119 Å²	119	143.4 Å²	143.4	83%	0.832	80%	0.797	S	S	*	*			trans	-66.2	150.9	-167.5	46.4	0	0	0	0	116.8
554	G	34.4	Very low	37	Very low	74 Å²	74	143.9 Å²	143.9	76%	0.763	80%	0.8	S	S	*	*			trans	-173.5	24.7	179.5	0	0	0	0	0	122.7
555	K	41.3	Very low	37.4	Very low	201 Å²	201	143.1 Å²	143.1	87%	0.874	81%	0.807	S	S	*	*			trans	52.4	95.8	167.1	-62.9	179.6	-179.8	177.1	0	118.7
556	S	33.5	Very low	38.1	Very low	109 Å²	109	141 Å²	141	76%	0.762	79%	0.791	S	S	*	*			trans	32.7	109.5	137.8	60	0	0	0	0	120.2
557	F	35.5	Very low	39.4	Very low	202 Å²	202	140.3 Å²	140.3	89%	0.886	78%	0.784	S	S	*	*			trans	-128.6	121	152.2	-129.9	-92.2	0	0	0	108.8
558	T	36.4	Very low	40.8	Very low	131 Å²	131	139.7 Å²	139.7	80%	0.804	78%	0.776	S	S	*	*			trans	-104.8	111	-178.5	-56	0	0	0	0	109.2	P560	T558-P560 WeakPolarHBondContact O-CD 3.49Å
559	V	36.8	Very low	41.6	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.715	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-89.1	120.1	179.1	178.6	0	0	0	0	110.1
560	P	39.6	Very low	43.4	Very low	113 Å²	113	136.8 Å²	136.8	73%	0.734	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-76.3	136.1	166.7	-10.9	28.7	0	0	0	110.2	T558	T558-P560 WeakPolarHBondContact O-CD 3.49Å
561	I	41	Very low	45	Very low	146 Å²	146	135 Å²	135	75%	0.749	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-70.3	129.9	178.4	-64.7	165.5	0	0	0	109.7	L563	I561-L563 HydrophobicContact CG2-CD1 4.21Å; I561-L563 HydrophobicContact CG2-CG 4.25Å; I561-L563 PolarHBondContact O-N 3.05Å
562	Q	35.9	Very low	47	Very low	196 Å²	196	134 Å²	134	92%	0.916	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-70.7	124.7	167.5	-72.3	-173.1	-8.3	0	0	110
563	L	42.2	Very low	48.6	Very low	153 Å²	153	129.1 Å²	129.1	80%	0.801	71%	0.708	S	S	*	*			trans	-137.8	110.1	174.9	-101.4	163.4	0	0	0	110.9	I561	I561-L563 HydrophobicContact CG2-CD1 4.21Å; I561-L563 HydrophobicContact CG2-CG 4.25Å; I561-L563 PolarHBondContact O-N 3.05Å
564	S	41	Very low	50.8	Low	101 Å²	101	129.9 Å²	129.9	71%	0.706	70%	0.696	S	S	*	*			trans	27.7	118.1	156.3	-162.3	0	0	0	0	119.4	D566	S564-D566 VanDerWaalsContact C-N 3.33Å; S564-D566 PolarHBondContact O-N 3.39Å
565	T	42.7	Very low	53	Low	147 Å²	147	133.2 Å²	133.2	90%	0.902	69%	0.685	S	S	*	*			trans	-70.9	79	166.4	50.2	0	0	0	0	112.2
566	D	44.7	Very low	54.9	Low	80 Å²	80	128.4 Å²	128.4	43%	0.428	67%	0.668	S	S	.	*			trans	-97.5	116.1	163.4	-174.4	-21.1	0	0	0	109.9	S564 K568 F569	S564-D566 VanDerWaalsContact C-N 3.33Å; S564-D566 PolarHBondContact O-N 3.39Å; D566-K568 PolarHBondContact O-N 3.42Å; D566-K568 VanDerWaalsContact O-N 3.08Å; D566-K568 VanDerWaalsContact OD1-CB 3.3Å; D566-K568 WeakPolarHBondContact OD1-CB 3.2Å; D566-K568 PolarHBondContact OD1-N 2.86Å; D566-F569 WeakPolarHBondContact O-CB 3.23Å; D566-F569 PolarHBondContact O-N 2.85Å
567	P	60.9	Low	57.3	Low	106 Å²	106	126.5 Å²	126.5	69%	0.688	65%	0.647	S	S	*	*	H	α-helix	trans	-61.8	-16.7	-179.7	25.5	-34.4	0	0	0	114.1	F569	P567-F569 VanDerWaalsContact C-N 3.33Å
568	K	61.3	Low	59.6	Low	152 Å²	152	121.2 Å²	121.2	66%	0.661	63%	0.628	S	S	*	*	H	α-helix	trans	-69.3	-29.7	172.8	-66.6	175	178.9	172	0	112.6	D566 W572	D566-K568 PolarHBondContact O-N 3.42Å; D566-K568 VanDerWaalsContact O-N 3.08Å; D566-K568 VanDerWaalsContact OD1-CB 3.3Å; D566-K568 WeakPolarHBondContact OD1-CB 3.2Å; D566-K568 PolarHBondContact OD1-N 2.86Å; K568-W572 VanDerWaalsContact O-CD1 3.31Å; K568-W572 PolarHBondContact O-N 2.66Å
569	F	58.8	Low	61.8	Low	160 Å²	160	118.2 Å²	118.2	70%	0.702	61%	0.612	S	S	*	*	H	α-helix	trans	-68.7	-39.8	179.4	-166.7	-97.1	0	0	0	111.4	D566 P567 H571 W572 S573	D566-F569 WeakPolarHBondContact O-CB 3.23Å; D566-F569 PolarHBondContact O-N 2.85Å; P567-F569 VanDerWaalsContact C-N 3.33Å; F569-H571 PolarHBondContact O-N 2.94Å; F569-W572 PolarHBondContact O-N 2.86Å; F569-S573 WeakPolarHBondContact O-CB 3.45Å; F569-S573 PolarHBondContact O-N 3.43Å
570	D	72.2	Confident	64.1	Low	79 Å²	79	119.6 Å²	119.6	42%	0.422	61%	0.605	S	S	.	*	H	α-helix	trans	-66.8	-35.6	-179.6	-170.6	52.4	0	0	0	112.6	S573 K574	D570-S573 PolarHBondContact O-N 2.84Å; D570-K574 WeakPolarHBondContact O-CB 3.33Å; D570-K574 WeakPolarHBondContact O-CG 3.45Å; D570-K574 PolarHBondContact O-N 3.42Å; D570-K574 IonicContact OD1-NZ 2.66Å; D570-K574 VanDerWaalsContact OD2-CE 3.23Å; D570-K574 WeakPolarHBondContact OD2-CE 3.22Å; D570-K574 IonicContact OD2-NZ 2.69Å; D570-K574 PolarHBondContact OD2-NZ 2.81Å
571	H	73.6	Confident	66.3	Low	99 Å²	99	121.6 Å²	121.6	46%	0.458	60%	0.598	S	S	.	*	H	α-helix	trans	-60.2	-47.1	169.4	164.8	-94.7	0	0	0	112.2	F569 K574 R575	F569-H571 PolarHBondContact O-N 2.94Å; H571-K574 PolarHBondContact O-N 3Å; H571-R575 VanDerWaalsContact O-CB 3.31Å; H571-R575 WeakPolarHBondContact O-CB 3.39Å; H571-R575 PolarHBondContact O-N 2.83Å
572	W	78.1	Confident	68.3	Low	164 Å²	164	122 Å²	122	62%	0.621	59%	0.59	S	S	*	*	H	α-helix	trans	-67.5	-36.6	178.2	-79	110.1	0	0	0	112.6	K568 F569 R575 L576	K568-W572 VanDerWaalsContact O-CD1 3.31Å; K568-W572 PolarHBondContact O-N 2.66Å; F569-W572 PolarHBondContact O-N 2.86Å; W572-R575 PolarHBondContact O-N 3.48Å; W572-L576 VanDerWaalsContact O-CB 3.3Å; W572-L576 WeakPolarHBondContact O-CB 3.4Å; W572-L576 PolarHBondContact O-N 3.46Å
573	S	74.6	Confident	70.5	Confident	62 Å²	62	118.2 Å²	118.2	43%	0.434	57%	0.574	S	S	.	*	H	α-helix	trans	-59.3	-52.6	173	-171.7	0	0	0	0	111.3	F569 D570 R575 L576 E577	F569-S573 WeakPolarHBondContact O-CB 3.45Å; F569-S573 PolarHBondContact O-N 3.43Å; D570-S573 PolarHBondContact O-N 2.84Å; S573-R575 VanDerWaalsContact C-N 3.33Å; S573-R575 PolarHBondContact O-N 2.84Å; S573-L576 PolarHBondContact O-N 3.43Å; S573-E577 WeakPolarHBondContact O-CB 3.29Å; S573-E577 PolarHBondContact O-N 2.75Å
574	K	82.4	Confident	72.6	Confident	134 Å²	134	112.7 Å²	112.7	58%	0.583	55%	0.546	S	S	*	.	H	α-helix	trans	-60.2	-39.4	176.5	-73.7	165.9	177.6	167	0	112.6	D570 H571 L578	D570-K574 WeakPolarHBondContact O-CB 3.33Å; D570-K574 WeakPolarHBondContact O-CG 3.45Å; D570-K574 PolarHBondContact O-N 3.42Å; D570-K574 IonicContact OD1-NZ 2.66Å; D570-K574 VanDerWaalsContact OD2-CE 3.23Å; D570-K574 WeakPolarHBondContact OD2-CE 3.22Å; D570-K574 IonicContact OD2-NZ 2.69Å; D570-K574 PolarHBondContact OD2-NZ 2.81Å; H571-K574 PolarHBondContact O-N 3Å; K574-L578 WeakPolarHBondContact O-CB 3.48Å; K574-L578 PolarHBondContact O-N 3.32Å
575	R	80.2	Confident	74.4	Confident	145 Å²	145	111.2 Å²	111.2	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-69	-38.9	177.1	-172	172.2	179	136.8	-3.5	112.7	H571 W572 S573 S579	H571-R575 VanDerWaalsContact O-CB 3.31Å; H571-R575 WeakPolarHBondContact O-CB 3.39Å; H571-R575 PolarHBondContact O-N 2.83Å; W572-R575 PolarHBondContact O-N 3.48Å; S573-R575 VanDerWaalsContact C-N 3.33Å; S573-R575 PolarHBondContact O-N 2.84Å; R575-S579 PolarHBondContact O-N 2.92Å; R575-S579 VanDerWaalsContact O-N 3.1Å; R575-S579 PolarHBondContact O-OG 3.39Å
576	L	82.1	Confident	76.4	Confident	99 Å²	99	110 Å²	110	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-66.9	-41.9	175.3	-177.4	64.7	0	0	0	111.3	W572 S573 S579 R580	W572-L576 VanDerWaalsContact O-CB 3.3Å; W572-L576 WeakPolarHBondContact O-CB 3.4Å; W572-L576 PolarHBondContact O-N 3.46Å; S573-L576 PolarHBondContact O-N 3.43Å; L576-S579 WeakPolarHBondContact O-CB 3.26Å; L576-S579 PolarHBondContact O-N 3.11Å; L576-R580 WeakPolarHBondContact O-CG 3.44Å; L576-R580 PolarHBondContact O-N 3.3Å
577	E	82.3	Confident	78.2	Confident	69 Å²	69	111.8 Å²	111.8	32%	0.322	52%	0.519	S	S	.	.	H	α-helix	trans	-68.6	-36.8	178.5	-166.8	56.2	-154.5	0	0	112	S573 S579 R580 R581	S573-E577 WeakPolarHBondContact O-CB 3.29Å; S573-E577 PolarHBondContact O-N 2.75Å; E577-S579 VanDerWaalsContact C-N 3.35Å; E577-S579 PolarHBondContact O-N 3.03Å; E577-R580 PolarHBondContact O-N 2.88Å; E577-R580 WeakPolarHBondContact OE2-CD 3.05Å; E577-R580 IonicContact OE2-NH1 3.24Å; E577-R580 PolarHBondContact OE2-NH1 2.85Å; E577-R580 VanDerWaalsContact OE2-NH1 3.11Å; E577-R581 WeakPolarHBondContact O-CG 3.36Å; E577-R581 PolarHBondContact O-N 3.26Å; E577-R581 IonicContact OE1-NE 2.69Å
578	L	84.8	Confident	79.3	Confident	91 Å²	91	107.5 Å²	107.5	48%	0.476	49%	0.49	S	S	.	.	H	α-helix	trans	-61.8	-40.9	169.8	-169.9	70.3	0	0	0	112	K574 R581 R582	K574-L578 WeakPolarHBondContact O-CB 3.48Å; K574-L578 PolarHBondContact O-N 3.32Å; L578-R581 PolarHBondContact O-N 2.88Å; L578-R582 WeakPolarHBondContact O-CG 3.46Å; L578-R582 PolarHBondContact O-N 3.25Å
579	S	82.2	Confident	80.3	Confident	68 Å²	68	103.1 Å²	103.1	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-64.9	-37.7	173.3	-76	0	0	0	0	112.8	R575 L576 E577 R581 R582 M583	R575-S579 PolarHBondContact O-N 2.92Å; R575-S579 VanDerWaalsContact O-N 3.1Å; R575-S579 PolarHBondContact O-OG 3.39Å; L576-S579 WeakPolarHBondContact O-CB 3.26Å; L576-S579 PolarHBondContact O-N 3.11Å; E577-S579 VanDerWaalsContact C-N 3.35Å; E577-S579 PolarHBondContact O-N 3.03Å; S579-R581 VanDerWaalsContact C-N 3.34Å; S579-R582 PolarHBondContact O-N 3.45Å; S579-M583 VanDerWaalsContact O-CB 3.27Å; S579-M583 WeakPolarHBondContact O-CB 3.21Å; S579-M583 PolarHBondContact O-N 2.89Å
580	R	85.9	Confident	81.4	Confident	147 Å²	147	99.8 Å²	99.8	56%	0.555	47%	0.466	S	S	*	.	H	α-helix	trans	-64.5	-36.3	174.4	-75.6	169.3	167	-179.3	-3.5	112.8	L576 E577 T584	L576-R580 WeakPolarHBondContact O-CG 3.44Å; L576-R580 PolarHBondContact O-N 3.3Å; E577-R580 PolarHBondContact O-N 2.88Å; E577-R580 WeakPolarHBondContact OE2-CD 3.05Å; E577-R580 IonicContact OE2-NH1 3.24Å; E577-R580 PolarHBondContact OE2-NH1 2.85Å; E577-R580 VanDerWaalsContact OE2-NH1 3.11Å; R580-T584 WeakPolarHBondContact O-CB 3.3Å; R580-T584 PolarHBondContact O-N 3.44Å; R580-T584 PolarHBondContact O-OG1 2.77Å
581	R	86.2	Confident	82.1	Confident	156 Å²	156	100.4 Å²	100.4	59%	0.589	47%	0.466	S	S	*	.	H	α-helix	trans	-68.6	-45.6	173.7	-68.1	174.8	-168.9	-167.5	1.1	111.5	E577 L578 S579 M583 T584 Q585	E577-R581 WeakPolarHBondContact O-CG 3.36Å; E577-R581 PolarHBondContact O-N 3.26Å; E577-R581 IonicContact OE1-NE 2.69Å; L578-R581 PolarHBondContact O-N 2.88Å; S579-R581 VanDerWaalsContact C-N 3.34Å; R581-M583 PolarHBondContact O-N 2.91Å; R581-T584 WeakPolarHBondContact O-CA 3.44Å; R581-T584 VanDerWaalsContact O-CB 3.28Å; R581-T584 WeakPolarHBondContact O-CB 3.39Å; R581-T584 PolarHBondContact O-N 2.69Å; R581-Q585 PolarHBondContact O-N 2.8Å
582	R	82.7	Confident	82.6	Confident	154 Å²	154	101.6 Å²	101.6	58%	0.581	47%	0.472	S	S	*	.	H	α-helix	trans	-61.9	-39.8	173.7	-71.6	178.5	176.6	-174.7	-1.5	113.3	L578 S579 T584 Q585 L586	L578-R582 WeakPolarHBondContact O-CG 3.46Å; L578-R582 PolarHBondContact O-N 3.25Å; S579-R582 PolarHBondContact O-N 3.45Å; R582-T584 PolarHBondContact O-N 3.43Å; R582-Q585 PolarHBondContact O-N 3.04Å; R582-L586 WeakPolarHBondContact O-CG 3.24Å; R582-L586 PolarHBondContact O-N 3.41Å
583	M	81.9	Confident	82.7	Confident	117 Å²	117	100.4 Å²	100.4	58%	0.576	47%	0.471	S	S	*	.	H	α-helix	trans	-71.2	-15.9	173.6	-174.2	61.4	75.8	0	0	112.7	S579 R581 K587	S579-M583 VanDerWaalsContact O-CB 3.27Å; S579-M583 WeakPolarHBondContact O-CB 3.21Å; S579-M583 PolarHBondContact O-N 2.89Å; R581-M583 PolarHBondContact O-N 2.91Å; M583-K587 WeakPolarHBondContact O-CG 3.39Å
584	T	85.4	Confident	83.1	Confident	36 Å²	36	101.5 Å²	101.5	22%	0.221	47%	0.472	C	S	.	.	H	α-helix	trans	-78.7	-51	168	-65.7	0	0	0	0	110.1	R580 R581 R582 L586 K587 L588 K684	R580-T584 WeakPolarHBondContact O-CB 3.3Å; R580-T584 PolarHBondContact O-N 3.44Å; R580-T584 PolarHBondContact O-OG1 2.77Å; R581-T584 WeakPolarHBondContact O-CA 3.44Å; R581-T584 VanDerWaalsContact O-CB 3.28Å; R581-T584 WeakPolarHBondContact O-CB 3.39Å; R581-T584 PolarHBondContact O-N 2.69Å; R582-T584 PolarHBondContact O-N 3.43Å; T584-L586 PolarHBondContact O-N 3.24Å; T584-K587 WeakPolarHBondContact O-CB 3.47Å; T584-K587 PolarHBondContact O-N 3.26Å; T584-L588 HydrophobicContact CG2-CD1 3.82Å; T584-L588 WeakPolarHBondContact O-CD1 3.34Å; T584-L588 PolarHBondContact O-N 3.47Å; T584-L588 VanDerWaalsContact O-N 3.16Å; T584-K684 HydrophobicContact CG2-CD 3.92Å; T584-K684 PolarHBondContact OG1-NZ 2.87Å
585	Q	80.3	Confident	83	Confident	70 Å²	70	98.8 Å²	98.8	33%	0.327	47%	0.471	S	S	.	.	H	α-helix	trans	-54.4	-50	176.9	-69.9	166.1	-18.2	0	0	112.7	R581 R582 K587 L588 V589 N680 E682	R581-Q585 PolarHBondContact O-N 2.8Å; R582-Q585 PolarHBondContact O-N 3.04Å; Q585-K587 PolarHBondContact O-N 3.48Å; Q585-L588 PolarHBondContact O-N 2.69Å; Q585-V589 WeakPolarHBondContact O-CB 3.1Å; Q585-V589 WeakPolarHBondContact O-CG2 3.1Å; Q585-V589 PolarHBondContact O-N 2.87Å; Q585-N680 PolarHBondContact NE2-OD1 3.25Å; Q585-E682 VanDerWaalsContact CA-OE1 3.26Å; Q585-E682 WeakPolarHBondContact CA-OE1 3.28Å; Q585-E682 WeakPolarHBondContact CA-OE2 3.45Å; Q585-E682 WeakPolarHBondContact CG-OE1 3.42Å
586	L	83.2	Confident	83	Confident	121 Å²	121	95.7 Å²	95.7	63%	0.634	46%	0.464	S	S	*	.	H	α-helix	trans	-62.5	-24.5	178.8	-72	169.8	0	0	0	113.8	R582 T584 N590	R582-L586 WeakPolarHBondContact O-CG 3.24Å; R582-L586 PolarHBondContact O-N 3.41Å; T584-L586 PolarHBondContact O-N 3.24Å; L586-N590 WeakPolarHBondContact O-CB 3.12Å; L586-N590 PolarHBondContact O-N 3.22Å
587	K	83	Confident	82.8	Confident	118 Å²	118	98 Å²	98	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-78.1	-41.1	174.7	-82.7	-166.8	170.1	-149.9	0	112.5	M583 T584 Q585 N590 E591	M583-K587 WeakPolarHBondContact O-CG 3.39Å; T584-K587 WeakPolarHBondContact O-CB 3.47Å; T584-K587 PolarHBondContact O-N 3.26Å; Q585-K587 PolarHBondContact O-N 3.48Å; K587-N590 WeakPolarHBondContact O-CB 3.44Å; K587-N590 PolarHBondContact O-N 3.44Å; K587-E591 WeakPolarHBondContact O-CG 3.23Å; K587-E591 PolarHBondContact O-N 2.85Å
588	L	83.8	Confident	82.7	Confident	16 Å²	16	99.4 Å²	99.4	8%	0.084	47%	0.473	C	S	.	.	H	α-helix	trans	-79.6	-31.4	-177.9	-80.2	116	0	0	0	113.1	T584 Q585 N590 E591 E592 E682 S683 K684	T584-L588 HydrophobicContact CG2-CD1 3.82Å; T584-L588 WeakPolarHBondContact O-CD1 3.34Å; T584-L588 PolarHBondContact O-N 3.47Å; T584-L588 VanDerWaalsContact O-N 3.16Å; Q585-L588 PolarHBondContact O-N 2.69Å; L588-N590 PolarHBondContact O-N 2.75Å; L588-E591 PolarHBondContact O-N 2.83Å; L588-E592 VanDerWaalsContact O-CB 3.29Å; L588-E592 WeakPolarHBondContact O-CB 3.37Å; L588-E592 PolarHBondContact O-N 3.12Å; L588-E682 HydrophobicContact CB-CG 3.64Å; L588-E682 HydrophobicContact CD1-CB 3.99Å; L588-E682 HydrophobicContact CD1-CG 3.94Å; L588-E682 HydrophobicContact CD2-CB 4.16Å; L588-E682 HydrophobicContact CD2-CG 4.12Å; L588-E682 HydrophobicContact CG-CB 4.42Å; L588-E682 HydrophobicContact CG-CG 4.09Å; L588-S683 WeakPolarHBondContact CD1-O 3.24Å; L588-S683 WeakPolarHBondContact CD2-O 3.35Å; L588-S683 VanDerWaalsContact CD2-OG 3.27Å; L588-S683 WeakPolarHBondContact CD2-OG 3.25Å; L588-K684 HydrophobicContact CD1-CD 4.34Å; L588-K684 HydrophobicContact CD1-CG 4.31Å
589	V	82.1	Confident	82.3	Confident	60 Å²	60	101 Å²	101	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-34.5	163.9	172.4	0	0	0	0	110.7	Q585 F593	Q585-V589 WeakPolarHBondContact O-CB 3.1Å; Q585-V589 WeakPolarHBondContact O-CG2 3.1Å; Q585-V589 PolarHBondContact O-N 2.87Å; V589-F593 HydrophobicContact CG1-CD2 3.78Å; V589-F593 HydrophobicContact CG1-CE2 3.76Å; V589-F593 WeakPolarHBondContact O-CB 3.45Å; V589-F593 WeakPolarHBondContact O-CD2 3.4Å; V589-F593 PolarHBondContact O-N 3.43Å
590	N	83.7	Confident	81.8	Confident	90 Å²	90	105.9 Å²	105.9	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-70.9	-44.3	173.1	-156	111.3	0	0	0	112.2	L586 K587 L588 E592 F593 D594	L586-N590 WeakPolarHBondContact O-CB 3.12Å; L586-N590 PolarHBondContact O-N 3.22Å; K587-N590 WeakPolarHBondContact O-CB 3.44Å; K587-N590 PolarHBondContact O-N 3.44Å; L588-N590 PolarHBondContact O-N 2.75Å; N590-E592 VanDerWaalsContact C-N 3.26Å; N590-E592 PolarHBondContact O-N 3.47Å; N590-F593 PolarHBondContact O-N 2.79Å; N590-D594 PolarHBondContact ND2-OD1 3.25Å; N590-D594 PolarHBondContact ND2-OD2 2.76Å; N590-D594 WeakPolarHBondContact O-CB 3.43Å; N590-D594 PolarHBondContact O-N 2.89Å
591	E	86	Confident	81.4	Confident	92 Å²	92	105 Å²	105	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-61.3	-34.8	175.7	-70.7	168.6	-163.7	0	0	111.4	K587 L588 S595	K587-E591 WeakPolarHBondContact O-CG 3.23Å; K587-E591 PolarHBondContact O-N 2.85Å; L588-E591 PolarHBondContact O-N 2.83Å; E591-S595 WeakPolarHBondContact O-CB 3.26Å; E591-S595 PolarHBondContact O-N 2.66Å
592	E	83.7	Confident	80.6	Confident	125 Å²	125	101.9 Å²	101.9	58%	0.584	49%	0.489	S	S	*	.	H	α-helix	trans	-69.5	-44.8	172.8	-172.5	171	-139.9	0	0	111.9	L588 N590 S595 I596	L588-E592 VanDerWaalsContact O-CB 3.29Å; L588-E592 WeakPolarHBondContact O-CB 3.37Å; L588-E592 PolarHBondContact O-N 3.12Å; N590-E592 VanDerWaalsContact C-N 3.26Å; N590-E592 PolarHBondContact O-N 3.47Å; E592-S595 PolarHBondContact O-N 3.26Å; E592-I596 HydrophobicContact CG-CD1 4.1Å; E592-I596 VanDerWaalsContact O-CG1 3.29Å; E592-I596 WeakPolarHBondContact O-CG1 3.18Å; E592-I596 PolarHBondContact O-N 2.82Å
593	F	80.4	Confident	80	Confident	138 Å²	138	97.5 Å²	97.5	61%	0.605	48%	0.479	S	S	*	.	H	α-helix	trans	-62.8	-40.2	172.7	-90	-62.4	0	0	0	113.1	V589 N590 S595 I596 Y597	V589-F593 HydrophobicContact CG1-CD2 3.78Å; V589-F593 HydrophobicContact CG1-CE2 3.76Å; V589-F593 WeakPolarHBondContact O-CB 3.45Å; V589-F593 WeakPolarHBondContact O-CD2 3.4Å; V589-F593 PolarHBondContact O-N 3.43Å; N590-F593 PolarHBondContact O-N 2.79Å; F593-S595 VanDerWaalsContact C-N 3.34Å; F593-I596 PolarHBondContact O-N 3.46Å; F593-Y597 VanDerWaalsContact O-CB 3.23Å; F593-Y597 WeakPolarHBondContact O-CB 3.4Å; F593-Y597 PolarHBondContact O-N 2.74Å
594	D	83.3	Confident	79.5	Confident	85 Å²	85	96.6 Å²	96.6	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-64.8	-39.4	176.1	-69.1	-35.7	0	0	0	110.7	N590 Y597 E598	N590-D594 PolarHBondContact ND2-OD1 3.25Å; N590-D594 PolarHBondContact ND2-OD2 2.76Å; N590-D594 WeakPolarHBondContact O-CB 3.43Å; N590-D594 PolarHBondContact O-N 2.89Å; D594-Y597 PolarHBondContact O-N 2.87Å; D594-E598 PolarHBondContact O-N 2.72Å
595	S	81	Confident	78.6	Confident	78 Å²	78	100.8 Å²	100.8	55%	0.545	50%	0.497	S	S	.	.	H	α-helix	trans	-64.9	-46.8	174.5	-169.2	0	0	0	0	112	E591 E592 F593 Y597 E598 E599	E591-S595 WeakPolarHBondContact O-CB 3.26Å; E591-S595 PolarHBondContact O-N 2.66Å; E592-S595 PolarHBondContact O-N 3.26Å; F593-S595 VanDerWaalsContact C-N 3.34Å; S595-Y597 VanDerWaalsContact C-N 3.27Å; S595-Y597 PolarHBondContact O-N 3.35Å; S595-E598 PolarHBondContact O-N 3.18Å; S595-E599 WeakPolarHBondContact O-CB 3.08Å; S595-E599 PolarHBondContact O-N 3.4Å
596	I	79.5	Confident	77.9	Confident	79 Å²	79	105 Å²	105	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-36.8	175.8	-69.1	164.9	0	0	0	110.6	E592 F593 E599 W600	E592-I596 HydrophobicContact CG-CD1 4.1Å; E592-I596 VanDerWaalsContact O-CG1 3.29Å; E592-I596 WeakPolarHBondContact O-CG1 3.18Å; E592-I596 PolarHBondContact O-N 2.82Å; F593-I596 PolarHBondContact O-N 3.46Å; I596-E599 PolarHBondContact O-N 2.75Å; I596-W600 WeakPolarHBondContact O-CB 3.14Å; I596-W600 PolarHBondContact O-N 2.71Å
597	Y	78.2	Confident	77.1	Confident	148 Å²	148	105.6 Å²	105.6	58%	0.58	51%	0.514	S	S	*	.	H	α-helix	trans	-69.2	-43.5	178.6	-179.4	-98.6	0	0	0	112.5	F593 D594 S595 E599 W600 K601	F593-Y597 VanDerWaalsContact O-CB 3.23Å; F593-Y597 WeakPolarHBondContact O-CB 3.4Å; F593-Y597 PolarHBondContact O-N 2.74Å; D594-Y597 PolarHBondContact O-N 2.87Å; S595-Y597 VanDerWaalsContact C-N 3.27Å; S595-Y597 PolarHBondContact O-N 3.35Å; Y597-E599 VanDerWaalsContact C-N 3.35Å; Y597-W600 PolarHBondContact O-N 2.99Å; Y597-K601 HydrophobicContact CE1-CD 3.95Å; Y597-K601 WeakPolarHBondContact O-CB 3.33Å; Y597-K601 PolarHBondContact O-N 3.39Å
598	E	79	Confident	76.2	Confident	99 Å²	99	103.5 Å²	103.5	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-68.2	-33	174.1	-71.9	-62.6	139.2	0	0	112.3	D594 S595 K601 S602	D594-E598 PolarHBondContact O-N 2.72Å; S595-E598 PolarHBondContact O-N 3.18Å; E598-K601 PolarHBondContact O-N 3.02Å; E598-K601 IonicContact OE1-NZ 2.66Å; E598-K601 PolarHBondContact OE1-NZ 3.46Å; E598-K601 IonicContact OE2-NZ 3.86Å; E598-K601 PolarHBondContact OE2-NZ 2.75Å; E598-S602 WeakPolarHBondContact O-CB 3.29Å; E598-S602 PolarHBondContact O-N 2.83Å
599	E	77.6	Confident	75.4	Confident	125 Å²	125	107.7 Å²	107.7	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-62	-53.1	169	-173.3	177.2	-176.4	0	0	111	S595 I596 Y597 K601 S602 V603	S595-E599 WeakPolarHBondContact O-CB 3.08Å; S595-E599 PolarHBondContact O-N 3.4Å; I596-E599 PolarHBondContact O-N 2.75Å; Y597-E599 VanDerWaalsContact C-N 3.35Å; E599-K601 PolarHBondContact O-N 2.81Å; E599-S602 WeakPolarHBondContact O-CB 3.37Å; E599-S602 PolarHBondContact O-N 2.8Å; E599-S602 PolarHBondContact O-OG 3.24Å; E599-V603 PolarHBondContact O-N 2.98Å
600	W	71.5	Confident	74.6	Confident	170 Å²	170	108 Å²	108	64%	0.644	53%	0.531	S	S	*	.	H	α-helix	trans	-53.1	-37.6	174.7	-113.2	60.1	0	0	0	113.3	I596 Y597 S602 F608	I596-W600 WeakPolarHBondContact O-CB 3.14Å; I596-W600 PolarHBondContact O-N 2.71Å; Y597-W600 PolarHBondContact O-N 2.99Å; W600-S602 VanDerWaalsContact C-N 3.32Å; W600-F608 HydrophobicContact CH2-CE1 4.41Å; W600-F608 HydrophobicContact CH2-CZ 4.47Å; W600-F608 HydrophobicContact CZ2-CE1 4.19Å; W600-F608 AromaticContact CZ2-CZ 3.81Å; W600-F608 HydrophobicContact CZ2-CZ 3.81Å
601	K	77.7	Confident	73.8	Confident	127 Å²	127	110.1 Å²	110.1	55%	0.552	54%	0.537	S	S	*	.	H	α-helix	trans	-78.5	-13.4	179.6	174.3	166.6	158.5	-99.8	0	113.3	Y597 E598 E599	Y597-K601 HydrophobicContact CE1-CD 3.95Å; Y597-K601 WeakPolarHBondContact O-CB 3.33Å; Y597-K601 PolarHBondContact O-N 3.39Å; E598-K601 PolarHBondContact O-N 3.02Å; E598-K601 IonicContact OE1-NZ 2.66Å; E598-K601 PolarHBondContact OE1-NZ 3.46Å; E598-K601 IonicContact OE2-NZ 3.86Å; E598-K601 PolarHBondContact OE2-NZ 2.75Å; E599-K601 PolarHBondContact O-N 2.81Å
602	S	68.4	Low	72.8	Confident	92 Å²	92	110.3 Å²	110.3	64%	0.643	54%	0.539	S	S	*	.	H	α-helix	trans	-94.4	-24.4	176	76.5	0	0	0	0	114.1	E598 E599 W600	E598-S602 WeakPolarHBondContact O-CB 3.29Å; E598-S602 PolarHBondContact O-N 2.83Å; E599-S602 WeakPolarHBondContact O-CB 3.37Å; E599-S602 PolarHBondContact O-N 2.8Å; E599-S602 PolarHBondContact O-OG 3.24Å; W600-S602 VanDerWaalsContact C-N 3.32Å
603	V	71	Confident	71.7	Confident	62 Å²	62	111.9 Å²	111.9	38%	0.376	55%	0.546	S	S	.	.	S	Bend	trans	-74.3	132.8	177.6	176.8	0	0	0	0	110.3	E599 L605 F608	E599-V603 PolarHBondContact O-N 2.98Å; V603-L605 PolarHBondContact O-N 3.49Å; V603-L605 VanDerWaalsContact O-N 3.16Å; V603-F608 HydrophobicContact CG1-CB 3.98Å
604	D	71.7	Confident	70.7	Confident	98 Å²	98	111.3 Å²	111.3	52%	0.524	55%	0.55	S	S	.	.			trans	-64.1	118.7	171.4	-173.8	-17.8	0	0	0	109	K606 E607 F608	D604-K606 PolarHBondContact O-N 2.78Å; D604-K606 WeakPolarHBondContact OD1-CB 3.1Å; D604-K606 PolarHBondContact OD1-N 3.35Å; D604-E607 HydrophobicContact CB-CB 4.3Å; D604-E607 WeakPolarHBondContact O-CB 3.44Å; D604-E607 PolarHBondContact O-N 3.41Å; D604-F608 PolarHBondContact O-N 2.86Å
605	L	66.3	Low	69.4	Low	124 Å²	124	112.6 Å²	112.6	65%	0.649	56%	0.557	S	S	*	*	H	α-helix	trans	-49.5	-30.2	178	-157.8	82	0	0	0	112.3	V603 L609	V603-L605 PolarHBondContact O-N 3.49Å; V603-L605 VanDerWaalsContact O-N 3.16Å; L605-L609 HydrophobicContact CG-CD1 4.45Å; L605-L609 WeakPolarHBondContact O-CB 3.33Å; L605-L609 WeakPolarHBondContact O-CD1 3.21Å; L605-L609 VanDerWaalsContact O-CG 3.23Å; L605-L609 WeakPolarHBondContact O-CG 3.26Å; L605-L609 PolarHBondContact O-N 2.75Å; L605-L609 VanDerWaalsContact O-N 3.1Å
606	K	65.6	Low	67.5	Low	159 Å²	159	113.8 Å²	113.8	69%	0.691	56%	0.556	S	S	*	*	H	α-helix	trans	-73.9	-33.1	179.2	-157.5	177.9	-174.9	-175.5	0	113	D604 S610	D604-K606 PolarHBondContact O-N 2.78Å; D604-K606 WeakPolarHBondContact OD1-CB 3.1Å; D604-K606 PolarHBondContact OD1-N 3.35Å; K606-S610 WeakPolarHBondContact O-CB 3.27Å; K606-S610 PolarHBondContact O-N 2.85Å; K606-S610 PolarHBondContact O-OG 3.17Å
607	E	66.7	Low	65.5	Low	133 Å²	133	116.2 Å²	116.2	62%	0.621	58%	0.577	S	S	*	*	H	α-helix	trans	-77.7	-43	175.6	-170.1	168.8	-138.9	0	0	110.6	D604 L609 S610 K611	D604-E607 HydrophobicContact CB-CB 4.3Å; D604-E607 WeakPolarHBondContact O-CB 3.44Å; D604-E607 PolarHBondContact O-N 3.41Å; E607-L609 PolarHBondContact O-N 3.28Å; E607-S610 PolarHBondContact O-N 2.8Å; E607-S610 VanDerWaalsContact O-N 3.16Å; E607-K611 WeakPolarHBondContact O-CB 3.26Å; E607-K611 PolarHBondContact O-N 2.78Å
608	F	62.2	Low	63.7	Low	74 Å²	74	113.7 Å²	113.7	33%	0.325	58%	0.581	S	S	.	*	H	α-helix	trans	-56.3	-48.7	173.4	-174.9	-109.6	0	0	0	112.5	W600 V603 D604 S610 K611 I612	W600-F608 HydrophobicContact CH2-CE1 4.41Å; W600-F608 HydrophobicContact CH2-CZ 4.47Å; W600-F608 HydrophobicContact CZ2-CE1 4.19Å; W600-F608 AromaticContact CZ2-CZ 3.81Å; W600-F608 HydrophobicContact CZ2-CZ 3.81Å; V603-F608 HydrophobicContact CG1-CB 3.98Å; D604-F608 PolarHBondContact O-N 2.86Å; F608-S610 VanDerWaalsContact C-N 3.33Å; F608-S610 PolarHBondContact O-N 3.37Å; F608-K611 PolarHBondContact O-N 2.66Å; F608-I612 HydrophobicContact CD1-CD1 3.91Å; F608-I612 HydrophobicContact CD2-CD1 4.48Å; F608-I612 HydrophobicContact CE1-CD1 3.44Å; F608-I612 VanDerWaalsContact CE1-CD1 3.44Å; F608-I612 HydrophobicContact CE2-CD1 4.07Å; F608-I612 HydrophobicContact CG-CD1 4.42Å; F608-I612 HydrophobicContact CZ-CD1 3.54Å; F608-I612 PolarHBondContact O-N 2.8Å
609	L	67	Low	61.7	Low	104 Å²	104	117.6 Å²	117.6	55%	0.545	60%	0.597	S	S	.	*	H	α-helix	trans	-65.3	-35.5	176.8	-73.6	170.9	0	0	0	112.6	L605 E607 K611 H613	L605-L609 HydrophobicContact CG-CD1 4.45Å; L605-L609 WeakPolarHBondContact O-CB 3.33Å; L605-L609 WeakPolarHBondContact O-CD1 3.21Å; L605-L609 VanDerWaalsContact O-CG 3.23Å; L605-L609 WeakPolarHBondContact O-CG 3.26Å; L605-L609 PolarHBondContact O-N 2.75Å; L605-L609 VanDerWaalsContact O-N 3.1Å; E607-L609 PolarHBondContact O-N 3.28Å; L609-K611 VanDerWaalsContact C-N 3.32Å; L609-H613 VanDerWaalsContact O-CB 3.31Å; L609-H613 WeakPolarHBondContact O-CB 3.24Å; L609-H613 PolarHBondContact O-N 3.3Å; L609-H613 VanDerWaalsContact O-N 3.1Å
610	S	66.7	Low	59.7	Low	65 Å²	65	117.5 Å²	117.5	46%	0.455	61%	0.605	S	S	.	*	H	α-helix	trans	-69.4	-30.7	176.9	-60.3	0	0	0	0	111.9	K606 E607 F608 N614	K606-S610 WeakPolarHBondContact O-CB 3.27Å; K606-S610 PolarHBondContact O-N 2.85Å; K606-S610 PolarHBondContact O-OG 3.17Å; E607-S610 PolarHBondContact O-N 2.8Å; E607-S610 VanDerWaalsContact O-N 3.16Å; F608-S610 VanDerWaalsContact C-N 3.33Å; F608-S610 PolarHBondContact O-N 3.37Å; S610-N614 VanDerWaalsContact O-CG 3.29Å; S610-N614 PolarHBondContact O-N 3.4Å; S610-N614 PolarHBondContact O-ND2 2.85Å
611	K	66.8	Low	58.2	Low	136 Å²	136	116.7 Å²	116.7	59%	0.591	61%	0.613	S	S	*	*	H	α-helix	trans	-75.7	-48	177	-156.3	157.6	-171.8	174.3	0	111.9	E607 F608 L609 H613 N614 D615	E607-K611 WeakPolarHBondContact O-CB 3.26Å; E607-K611 PolarHBondContact O-N 2.78Å; F608-K611 PolarHBondContact O-N 2.66Å; L609-K611 VanDerWaalsContact C-N 3.32Å; K611-H613 VanDerWaalsContact C-N 3.25Å; K611-H613 PolarHBondContact O-N 2.65Å; K611-N614 PolarHBondContact O-N 3.36Å; K611-D615 VanDerWaalsContact CG-OD2 3.24Å; K611-D615 WeakPolarHBondContact CG-OD2 3.42Å; K611-D615 PolarHBondContact O-N 3.32Å
612	I	64.3	Low	56.1	Low	95 Å²	95	116.1 Å²	116.1	49%	0.487	62%	0.62	S	S	.	*	H	α-helix	trans	-58.5	-35.9	174.4	-70.7	175.8	0	0	0	112.3	F608 N614	F608-I612 HydrophobicContact CD1-CD1 3.91Å; F608-I612 HydrophobicContact CD2-CD1 4.48Å; F608-I612 HydrophobicContact CE1-CD1 3.44Å; F608-I612 VanDerWaalsContact CE1-CD1 3.44Å; F608-I612 HydrophobicContact CE2-CD1 4.07Å; F608-I612 HydrophobicContact CG-CD1 4.42Å; F608-I612 HydrophobicContact CZ-CD1 3.54Å; F608-I612 PolarHBondContact O-N 2.8Å; I612-N614 VanDerWaalsContact C-N 3.31Å; I612-N614 PolarHBondContact O-N 2.77Å
613	H	60.1	Low	54.6	Low	158 Å²	158	119.1 Å²	119.1	73%	0.731	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-15.6	179.5	-159	-50.8	0	0	0	113.6	L609 K611	L609-H613 VanDerWaalsContact O-CB 3.31Å; L609-H613 WeakPolarHBondContact O-CB 3.24Å; L609-H613 PolarHBondContact O-N 3.3Å; L609-H613 VanDerWaalsContact O-N 3.1Å; K611-H613 VanDerWaalsContact C-N 3.25Å; K611-H613 PolarHBondContact O-N 2.65Å
614	N	60.9	Low	52.9	Low	127 Å²	127	124 Å²	124	68%	0.679	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-33.9	179.3	-72.4	-26.4	0	0	0	113	S610 K611 I612 L616	S610-N614 VanDerWaalsContact O-CG 3.29Å; S610-N614 PolarHBondContact O-N 3.4Å; S610-N614 PolarHBondContact O-ND2 2.85Å; K611-N614 PolarHBondContact O-N 3.36Å; I612-N614 VanDerWaalsContact C-N 3.31Å; I612-N614 PolarHBondContact O-N 2.77Å; N614-L616 PolarHBondContact O-N 3.48Å
615	D	55.1	Low	51	Low	112 Å²	112	127.5 Å²	127.5	60%	0.599	66%	0.66	S	S	*	*	S	Bend	trans	-89.2	5.1	-171.2	-65.8	-23.8	0	0	0	114.4	K611	K611-D615 VanDerWaalsContact CG-OD2 3.24Å; K611-D615 WeakPolarHBondContact CG-OD2 3.42Å; K611-D615 PolarHBondContact O-N 3.32Å
616	L	40.9	Very low	49.5	Very low	103 Å²	103	128.8 Å²	128.8	54%	0.539	67%	0.667	S	S	.	*			trans	-140.2	105.1	179.3	-143.9	72.8	0	0	0	111.4	N614	N614-L616 PolarHBondContact O-N 3.48Å
617	P	38.3	Very low	48.1	Very low	130 Å²	130	130.3 Å²	130.3	84%	0.844	68%	0.677	S	S	*	*	S	Bend		-143.8	104.5	92.3	35.1	-18.3	0	0	0	114.6
618	S	40.9	Very low	46.5	Very low	94 Å²	94	129 Å²	129	66%	0.657	68%	0.68	S	S	*	*	S	Bend	trans	-134.9	-9.1	164.8	55.3	0	0	0	0	114.3
619	F	35.8	Very low	45.1	Very low	182 Å²	182	133.3 Å²	133.3	80%	0.798	70%	0.704	S	S	*	*	S	Bend	trans	-125.6	40.4	-172.1	-81.9	-79.9	0	0	0	114.6
620	V	36.5	Very low	43.7	Very low	123 Å²	123	137.4 Å²	137.4	75%	0.745	72%	0.718	S	S	*	*			trans	-136.7	81	167.6	-170.4	0	0	0	0	110.9
621	N	40	Very low	42	Very low	153 Å²	153	142 Å²	142	82%	0.818	74%	0.737	S	S	*	*			trans	-162.6	111.6	151.9	-106.1	-25.2	0	0	0	112.6
622	V	34.2	Very low	40.6	Very low	115 Å²	115	145.2 Å²	145.2	70%	0.697	75%	0.751	S	S	*	*			trans	42	107.2	145.7	-152	0	0	0	0	118.8
623	H	35.7	Very low	39.2	Very low	155 Å²	155	149 Å²	149	72%	0.718	77%	0.766	S	S	*	*				-165.3	153.7	103.6	-114	-99.1	0	0	0	113.6
624	E	34.9	Very low	38.2	Very low	164 Å²	164	148 Å²	148	77%	0.766	77%	0.766	S	S	*	*			trans	44.3	90.6	159.3	-78.8	153.4	-124.5	0	0	120.9
625	L	31.6	Very low	37.1	Very low	171 Å²	171	149 Å²	149	90%	0.895	77%	0.771	S	S	*	*			trans	-124.9	82.9	155.6	-141	174.1	0	0	0	108.9
626	N	34.7	Very low	36.2	Very low	152 Å²	152	151.3 Å²	151.3	81%	0.813	78%	0.783	S	S	*	*			trans	-155.6	67.5	-171.2	-120.2	-20.6	0	0	0	115.2
627	Q	37.9	Very low	36	Very low	191 Å²	191	152 Å²	152	89%	0.893	80%	0.796	S	S	*	*			trans	-166.8	153.1	139.7	-109.2	174.9	89.5	0	0	112
628	P	32.7	Very low	35.8	Very low	104 Å²	104	153 Å²	153	68%	0.675	80%	0.795	S	S	*	*			trans	-94	145.1	-166.1	35.7	-33.9	0	0	0	114.1	K630	P628-K630 PolarHBondContact O-N 3.33Å
629	I	33.2	Very low	35.6	Very low	165 Å²	165	158 Å²	158	85%	0.846	81%	0.808	S	S	*	*			trans	-68.8	112.8	171.6	-60.7	173.6	0	0	0	109.3
630	K	35.7	Very low	35.4	Very low	190 Å²	190	156.8 Å²	156.8	83%	0.826	81%	0.808	S	S	*	*			trans	-85.5	110.1	167.8	-75.6	-179.9	177.9	172	0	110	P628	P628-K630 PolarHBondContact O-N 3.33Å
631	L	31.5	Very low	35.4	Very low	162 Å²	162	157.8 Å²	157.8	85%	0.848	81%	0.814	S	S	*	*			trans	-67.3	145.5	157.5	-69.4	167.6	0	0	0	109.4
632	K	38.8	Very low	35.1	Very low	204 Å²	204	157.7 Å²	157.7	89%	0.887	81%	0.811	S	S	*	*			trans	-139	132.4	161.7	-94.7	-162	167.9	-163.2	0	109
633	E	34.5	Very low	35.2	Very low	173 Å²	173	157.6 Å²	157.6	81%	0.808	81%	0.81	S	S	*	*			trans	-91.5	-176.5	171.6	-66.8	167.5	112.2	0	0	110.1
634	D	38.2	Very low	35.4	Very low	138 Å²	138	156.6 Å²	156.6	74%	0.738	81%	0.81	S	S	*	*			trans	64.1	113.4	166.8	-45	-35.7	0	0	0	117.2
635	N	38.4	Very low	35.4	Very low	147 Å²	147	154.1 Å²	154.1	79%	0.786	80%	0.802	S	S	*	*				-163.4	169.3	62.6	-95.1	-78.2	0	0	0	115.5
636	L	35.4	Very low	35.7	Very low	161 Å²	161	152.3 Å²	152.3	84%	0.843	79%	0.793	S	S	*	*			trans	-75.2	157.7	-178.9	-45.9	91.3	0	0	0	113.8
637	S	36.7	Very low	36	Very low	117 Å²	117	151 Å²	151	82%	0.818	79%	0.791	S	S	*	*				175.2	146.1	105.3	-168.3	0	0	0	0	112.2
638	D	35.3	Very low	36	Very low	153 Å²	153	151 Å²	151	82%	0.818	79%	0.788	S	S	*	*			trans	-77	142.1	166.9	-55.1	-78.4	0	0	0	111.6
639	Q	35.5	Very low	36.3	Very low	199 Å²	199	151 Å²	151	93%	0.93	79%	0.79	S	S	*	*				-165.6	160.3	128.2	-113.8	178.9	15.2	0	0	114.4
640	I	31.6	Very low	36.6	Very low	156 Å²	156	149.5 Å²	149.5	80%	0.8	78%	0.784	S	S	*	*			trans	-106.5	141.3	-177.5	-62	157.8	0	0	0	108.8
641	V	37.1	Very low	36.8	Very low	144 Å²	144	147.3 Å²	147.3	87%	0.873	78%	0.777	S	S	*	*			trans	-172.9	158.4	139.6	137.6	0	0	0	0	110.1
642	M	33.9	Very low	37.1	Very low	151 Å²	151	145 Å²	145	74%	0.744	77%	0.769	S	S	*	*			trans	-110.1	-176.3	-171.9	-57.2	-158.1	-48.8	0	0	113.6
643	T	36.9	Very low	37.2	Very low	113 Å²	113	142.7 Å²	142.7	69%	0.693	76%	0.759	S	S	*	*			trans	82.9	147	158.6	73.5	0	0	0	0	118.2
644	N	38.7	Very low	37.4	Very low	134 Å²	134	142.1 Å²	142.1	72%	0.717	76%	0.756	S	S	*	*			cis	-166.3	159.7	-24.9	-108.6	1.9	0	0	0	111
645	N	36.2	Very low	37.5	Very low	111 Å²	111	142.7 Å²	142.7	59%	0.594	75%	0.754	S	S	*	*			trans	64.1	131.9	142.5	-76.4	55.1	0	0	0	124.2
646	D	37.3	Very low	37.5	Very low	133 Å²	133	143.4 Å²	143.4	71%	0.711	75%	0.752	S	S	*	*			trans	66.2	156	136.7	-50.8	-28.5	0	0	0	119.7
647	T	40.2	Very low	37.8	Very low	125 Å²	125	140 Å²	140	77%	0.767	74%	0.74	S	S	*	*			cis	-148.6	159.7	15.4	-31.8	0	0	0	0	114
648	K	38.5	Very low	37.7	Very low	190 Å²	190	141.7 Å²	141.7	83%	0.826	74%	0.739	S	S	*	*			trans	-35	157.5	167.6	-45.8	162.3	-177.3	173.1	0	118.1
649	S	39.1	Very low	37.9	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	73%	0.732	S	S	*	*				-167	132.9	106.3	69	0	0	0	0	114.7
650	D	38.2	Very low	37.8	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	72%	0.72	S	S	*	*			trans	37.3	152.2	131.6	-68.9	-86.2	0	0	0	124.2
651	H	40.5	Very low	37.8	Very low	144 Å²	144	138.6 Å²	138.6	67%	0.667	72%	0.72	S	S	*	*			cis	-143.4	-171.9	10.1	-157.4	58.5	0	0	0	112.9	K653	H651-K653 PolarHBondContact NE2-NZ 2.8Å
652	V	38.9	Very low	37.6	Very low	113 Å²	113	137.6 Å²	137.6	69%	0.685	71%	0.714	S	S	*	*			trans	-142	146.8	-176.7	69.3	0	0	0	0	114
653	K	40.2	Very low	37.5	Very low	156 Å²	156	138.7 Å²	138.7	68%	0.678	72%	0.717	S	S	*	*			trans	166.6	142.9	159	-87.7	143.7	-165.9	157	0	107.9	H651	H651-K653 PolarHBondContact NE2-NZ 2.8Å
654	H	39.3	Very low	37.5	Very low	161 Å²	161	141.2 Å²	141.2	75%	0.745	73%	0.726	S	S	*	*			cis	-155	-174.5	-0	-116.7	-34	0	0	0	107.4
655	H	39.8	Very low	37.4	Very low	150 Å²	150	141.9 Å²	141.9	69%	0.694	73%	0.73	S	S	*	*			cis	-138.4	-118.2	13.4	-168.3	-110.7	0	0	0	112.6
656	H	37.4	Very low	37.6	Very low	162 Å²	162	142 Å²	142	75%	0.75	74%	0.736	S	S	*	*			trans	-178.3	171.3	-163.8	-109.5	-28.2	0	0	0	109.2
657	P	42.5	Very low	37.2	Very low	89 Å²	89	141.1 Å²	141.1	58%	0.578	74%	0.739	S	S	*	*			cis	-137	174.7	-20.8	40.3	-24.7	0	0	0	114.4
658	L	35.3	Very low	36.8	Very low	153 Å²	153	142.6 Å²	142.6	80%	0.801	74%	0.737	S	S	*	*			trans	54.9	130.5	155.7	-64.8	153.5	0	0	0	118
659	D	37.8	Very low	36.5	Very low	127 Å²	127	140.5 Å²	140.5	68%	0.679	73%	0.731	S	S	*	*			cis	-158	166.6	37.5	-128.2	-36.9	0	0	0	114.2
660	Q	34.9	Very low	36.3	Very low	145 Å²	145	142 Å²	142	68%	0.678	73%	0.73	S	S	*	*			trans	22.9	114.7	161.9	-70.3	172.2	40.1	0	0	124.7
661	Q	31.9	Very low	36.1	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	73%	0.729	S	S	*	*				79.2	155.8	125.3	-62.4	-177.4	5.2	0	0	123.3
662	V	32.8	Very low	35.8	Very low	124 Å²	124	144.9 Å²	144.9	75%	0.752	73%	0.733	S	S	*	*			trans	75	83.4	167.4	-161	0	0	0	0	119
663	E	30.8	Very low	35.5	Very low	173 Å²	173	146.1 Å²	146.1	81%	0.808	74%	0.735	S	S	*	*				25.9	107.7	115.6	-95.6	177.5	156.8	0	0	119.6
664	L	36.5	Very low	35.2	Very low	166 Å²	166	144.1 Å²	144.1	87%	0.869	74%	0.736	S	S	*	*				176.4	164.6	95.2	-94.2	165.4	0	0	0	114
665	N	36.5	Very low	35.1	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	73%	0.734	S	S	*	*			trans	-117.3	177.5	-170.2	-90.7	-35.3	0	0	0	111.3
666	P	40.9	Very low	34.7	Very low	113 Å²	113	143 Å²	143	73%	0.734	74%	0.74	S	S	*	*			cis	-137.1	-166.8	-37.1	39.2	-21.8	0	0	0	112.5
667	C	28.8	Very low	34.5	Very low	114 Å²	114	140.5 Å²	140.5	77%	0.77	74%	0.736	S	S	*	*			trans	-117.5	156.4	166.4	-60.6	0	0	0	0	112.7
668	Q	32.8	Very low	34	Very low	156 Å²	156	145.3 Å²	145.3	73%	0.729	75%	0.748	S	S	*	*			trans	48.7	125.1	149.7	-69.7	178.4	-87.5	0	0	122.9
669	E	31.1	Very low	33.9	Very low	147 Å²	147	142.1 Å²	142.1	69%	0.687	74%	0.744	S	S	*	*			trans	70.4	143	130.5	-68.2	162	-141	0	0	122.4
670	N	35.2	Very low	33.7	Very low	135 Å²	135	140.8 Å²	140.8	72%	0.722	74%	0.737	S	S	*	*			trans	68.5	142.3	163.2	-57.8	-16.3	0	0	0	118.5
671	E	33.8	Very low	33.8	Very low	146 Å²	146	137.7 Å²	137.7	68%	0.682	74%	0.736	S	S	*	*			cis	-160.3	154.4	-19.5	-125.6	-176.5	176.3	0	0	110.8
672	Y	33.5	Very low	33.9	Very low	193 Å²	193	133 Å²	133	76%	0.757	71%	0.714	S	S	*	*			trans	58.3	145.2	153.2	-77.3	-59	0	0	0	126
673	L	33.7	Very low	34.1	Very low	139 Å²	139	131.2 Å²	131.2	73%	0.728	71%	0.707	S	S	*	*			trans	72.5	97	154.7	-94.9	76.1	0	0	0	121.8
674	T	34.7	Very low	34.4	Very low	114 Å²	114	128.8 Å²	128.8	70%	0.699	69%	0.694	S	S	*	*				41.4	129.3	120.1	61.9	0	0	0	0	119.4
675	S	36.9	Very low	34.3	Very low	101 Å²	101	127.5 Å²	127.5	71%	0.706	69%	0.688	S	S	*	*				-169	148.5	61.1	-61.5	0	0	0	0	115.6
676	F	30.9	Very low	34.2	Very low	185 Å²	185	128.6 Å²	128.6	81%	0.811	69%	0.69	S	S	*	*			trans	63.4	105.5	139.6	-91	-108.4	0	0	0	123.3
677	T	33.8	Very low	33.8	Very low	110 Å²	110	132.8 Å²	132.8	68%	0.675	70%	0.697	S	S	*	*				80.1	108.5	124.6	51.6	0	0	0	0	123.3
678	K	32.3	Very low	34.2	Very low	191 Å²	191	134.9 Å²	134.9	83%	0.83	70%	0.698	S	S	*	*				85.3	89.5	108.2	-162.7	172.1	-176.3	170.6	0	118.8
679	A	33	Very low	34.1	Very low	86 Å²	86	130.2 Å²	130.2	71%	0.711	69%	0.691	S	S	*	*				41.6	129.2	121	0	0	0	0	0	120.4
680	N	32.7	Very low	34.5	Very low	98 Å²	98	133.3 Å²	133.3	52%	0.524	70%	0.703	S	S	.	*				-138.6	128.3	121.9	-138.5	54.7	0	0	0	109.5	Q585 E682	Q585-N680 PolarHBondContact NE2-OD1 3.25Å; N680-E682 VanDerWaalsContact ND2-CD 3.33Å; N680-E682 PolarHBondContact ND2-OE2 2.89Å
681	A	37	Very low	34.4	Very low	81 Å²	81	135.4 Å²	135.4	67%	0.669	71%	0.708	S	S	*	*			trans	-73.7	176.5	147.8	0	0	0	0	0	108.3
682	E	34	Very low	34.7	Very low	71 Å²	71	137.4 Å²	137.4	33%	0.332	71%	0.714	S	S	.	*			trans	150.9	125.7	143.6	-82.7	155.8	-159.1	0	0	111.9	Q585 L588 N680	Q585-E682 VanDerWaalsContact CA-OE1 3.26Å; Q585-E682 WeakPolarHBondContact CA-OE1 3.28Å; Q585-E682 WeakPolarHBondContact CA-OE2 3.45Å; Q585-E682 WeakPolarHBondContact CG-OE1 3.42Å; L588-E682 HydrophobicContact CB-CG 3.64Å; L588-E682 HydrophobicContact CD1-CB 3.99Å; L588-E682 HydrophobicContact CD1-CG 3.94Å; L588-E682 HydrophobicContact CD2-CB 4.16Å; L588-E682 HydrophobicContact CD2-CG 4.12Å; L588-E682 HydrophobicContact CG-CB 4.42Å; L588-E682 HydrophobicContact CG-CG 4.09Å; N680-E682 VanDerWaalsContact ND2-CD 3.33Å; N680-E682 PolarHBondContact ND2-OE2 2.89Å
683	S	38	Very low	34.9	Very low	87 Å²	87	132.8 Å²	132.8	61%	0.608	71%	0.706	S	S	*	*			trans	-72.5	162.8	166.7	48.2	0	0	0	0	110.9	L588	L588-S683 WeakPolarHBondContact CD1-O 3.24Å; L588-S683 WeakPolarHBondContact CD2-O 3.35Å; L588-S683 VanDerWaalsContact CD2-OG 3.27Å; L588-S683 WeakPolarHBondContact CD2-OG 3.25Å
684	K	37.2	Very low	35	Very low	123 Å²	123	132.5 Å²	132.5	54%	0.535	71%	0.705	S	S	.	*			trans	-156	130.2	155.9	-125.8	168.8	-169.2	-175.3	0	113.9	T584 L588	T584-K684 HydrophobicContact CG2-CD 3.92Å; T584-K684 PolarHBondContact OG1-NZ 2.87Å; L588-K684 HydrophobicContact CD1-CD 4.34Å; L588-K684 HydrophobicContact CD1-CG 4.31Å
685	N	34	Very low	35.1	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	71%	0.708	S	S	*	*			trans	-61.7	149.4	171.3	-66.1	-75.4	0	0	0	111.9
686	M	33	Very low	35.1	Very low	173 Å²	173	136.8 Å²	136.8	85%	0.852	71%	0.711	S	S	*	*			trans	-149.7	136	136	-119.1	179.5	82.6	0	0	113.6	M688	M686-M688 HydrophobicContact CE-CG 4.48Å; M686-M688 HydrophobicContact CE-SD 4.33Å
687	K	33.3	Very low	35.4	Very low	201 Å²	201	132 Å²	132	87%	0.874	71%	0.706	S	S	*	*			trans	-103.6	116.9	-176.2	174.6	-179.3	178.2	178.1	0	108.9
688	M	36.6	Very low	35.4	Very low	158 Å²	158	134.6 Å²	134.6	78%	0.778	71%	0.71	S	S	*	*			trans	-131.1	139.9	167.1	-64.2	-72.4	-75.7	0	0	107.1	M686	M686-M688 HydrophobicContact CE-CG 4.48Å; M686-M688 HydrophobicContact CE-SD 4.33Å
689	G	32.1	Very low	35.4	Very low	57 Å²	57	131.6 Å²	131.6	59%	0.588	70%	0.702	S	S	*	*			cis	134.1	49.8	4.8	0	0	0	0	0	112
690	F	38.1	Very low	35.7	Very low	213 Å²	213	135.4 Å²	135.4	93%	0.934	71%	0.705	S	S	*	*			trans	-133.3	114.2	170	-94.7	-71.5	0	0	0	111.8
691	E	33.6	Very low	35.8	Very low	178 Å²	178	135.5 Å²	135.5	83%	0.832	71%	0.713	S	S	*	*			trans	-92.8	131.7	171.7	170.1	179.8	-138.9	0	0	108.7
692	K	39.4	Very low	35.8	Very low	188 Å²	188	139.3 Å²	139.3	82%	0.817	72%	0.723	S	S	*	*			trans	-165.1	97.8	152.1	-114.2	171.3	-176.6	-179.2	0	112.4
693	T	37.8	Very low	35.9	Very low	96 Å²	96	139.5 Å²	139.5	59%	0.589	74%	0.737	S	S	*	*			trans	35.1	122	130.7	59.8	0	0	0	0	118.8
694	D	35.8	Very low	35.9	Very low	133 Å²	133	146 Å²	146	71%	0.711	75%	0.748	S	S	*	*				52.4	122.1	120.8	-45.3	-25.1	0	0	0	117.6
695	Q	38.4	Very low	35.9	Very low	161 Å²	161	146.6 Å²	146.6	75%	0.752	76%	0.756	S	S	*	*				-172.4	152.7	56.1	-130.7	156.4	66.1	0	0	112.8
696	N	36	Very low	36.2	Very low	145 Å²	145	146.1 Å²	146.1	78%	0.775	75%	0.751	S	S	*	*			trans	56.3	143.5	143.9	-71.8	-13.8	0	0	0	123.7
697	A	36.3	Very low	36.5	Very low	84 Å²	84	147.4 Å²	147.4	69%	0.694	75%	0.747	S	S	*	*			trans	89.2	88.5	139.2	0	0	0	0	0	120.8
698	Q	34.4	Very low	36.8	Very low	164 Å²	164	143.3 Å²	143.3	77%	0.766	74%	0.735	S	S	*	*				76.1	112.7	100.6	-167.6	171.2	5.3	0	0	119.6
699	L	32.9	Very low	37	Very low	128 Å²	128	145.4 Å²	145.4	67%	0.67	74%	0.74	S	S	*	*			trans	47.5	122.6	144.1	-54.8	170.3	0	0	0	119
700	H	38.9	Very low	37.4	Very low	167 Å²	167	147.8 Å²	147.8	77%	0.773	75%	0.747	S	S	*	*				-175.5	142.9	87.8	-100.8	-74.6	0	0	0	112.8
701	S	35.5	Very low	37.9	Very low	99 Å²	99	143.6 Å²	143.6	69%	0.692	74%	0.742	S	S	*	*			trans	-83.4	133	160.7	48	0	0	0	0	110.3
702	N	36.3	Very low	38.3	Very low	161 Å²	161	140.8 Å²	140.8	86%	0.861	74%	0.741	S	S	*	*			trans	168.1	162.3	156.9	-88.7	-28.8	0	0	0	109
703	A	35.5	Very low	38.4	Very low	76 Å²	76	136.5 Å²	136.5	63%	0.628	74%	0.735	S	S	*	*			cis	-174.4	145.3	-35.5	0	0	0	0	0	109.2
704	R	38.7	Very low	38.7	Very low	222 Å²	222	137.1 Å²	137.1	84%	0.838	74%	0.744	S	S	*	*			trans	61.6	118.1	144.4	-76.9	-175	165.6	-175.6	-2.8	123.4
705	I	37.7	Very low	39.3	Very low	137 Å²	137	135.6 Å²	135.6	70%	0.703	74%	0.743	S	S	*	*				63.9	133.6	130	-37.5	155.2	0	0	0	119.4
706	I	39.1	Very low	39.7	Very low	127 Å²	127	135.1 Å²	135.1	65%	0.651	74%	0.744	S	S	*	*				157.9	112.5	123.8	-81.7	176.8	0	0	0	112.4
707	R	39.8	Very low	40.1	Very low	200 Å²	200	134.5 Å²	134.5	76%	0.755	74%	0.741	S	S	*	*			trans	53.7	160.2	137.4	-61	-171.6	177.1	119.3	1	121.7
708	D	39.4	Very low	40.4	Very low	116 Å²	116	136.2 Å²	136.2	62%	0.62	74%	0.743	S	S	*	*			cis	-165.3	-162.7	-20.3	-93.9	-15.7	0	0	0	106.9
709	F	41.2	Very low	41.1	Very low	201 Å²	201	133 Å²	133	88%	0.882	74%	0.736	S	S	*	*			trans	79.5	139.6	172.2	-51.2	-80.6	0	0	0	117.4
710	S	41.2	Very low	41.7	Very low	107 Å²	107	136 Å²	136	75%	0.748	74%	0.744	S	S	*	*			cis	-165.6	151.4	-27.5	-108.6	0	0	0	0	110.5
711	P	48.7	Very low	41.8	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	74%	0.74	S	S	*	*			trans	-114.3	164.4	-171.3	41.3	-34.1	0	0	0	116.9
712	S	40.9	Very low	42.2	Very low	118 Å²	118	135.7 Å²	135.7	83%	0.825	75%	0.748	S	S	*	*			trans	-166.3	154.9	164.8	48.1	0	0	0	0	109.4
713	S	40.8	Very low	42.5	Very low	99 Å²	99	136.1 Å²	136.1	69%	0.692	74%	0.742	S	S	*	*			cis	-163.6	157	-4.5	43.8	0	0	0	0	112.5
714	S	45.2	Very low	42.8	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	75%	0.749	S	S	*	*			trans	66	146.9	155.6	61.1	0	0	0	0	120.1
715	S	47.4	Very low	42.8	Very low	100 Å²	100	135.4 Å²	135.4	70%	0.699	74%	0.74	S	S	*	*			cis	-167.8	157.3	-4.9	-110.9	0	0	0	0	113.8
716	I	48.6	Very low	43	Very low	152 Å²	152	134.7 Å²	134.7	78%	0.779	74%	0.736	S	S	*	*			trans	68	131.3	144.1	-68.9	167.4	0	0	0	117.9
717	D	44.1	Very low	43.1	Very low	132 Å²	132	138 Å²	138	71%	0.706	75%	0.746	S	S	*	*			cis	-151.2	-168.5	-4.6	-136.4	-42.8	0	0	0	114.4
718	T	41.2	Very low	43.2	Very low	119 Å²	119	137 Å²	137	73%	0.73	75%	0.747	S	S	*	*			trans	-134.2	-146.8	-151.8	55.5	0	0	0	0	115.6
719	P	49.8	Very low	43.3	Very low	97 Å²	97	136.6 Å²	136.6	63%	0.63	75%	0.753	S	S	*	*				-130.9	173.7	-86.1	34.7	-15.8	0	0	0	117
720	K	46.2	Very low	43.2	Very low	190 Å²	190	132 Å²	132	83%	0.826	75%	0.746	S	S	*	*				163	113.4	122.3	-88.4	161	-175.8	173.7	0	119.1
721	S	40.1	Very low	43.3	Very low	100 Å²	100	134.1 Å²	134.1	70%	0.699	75%	0.749	S	S	*	*			trans	14.4	129.7	136.2	60.2	0	0	0	0	125
722	N	44.5	Very low	42.7	Very low	160 Å²	160	135.9 Å²	135.9	86%	0.856	75%	0.746	S	S	*	*			trans	-172.5	126.2	130.6	-87.8	-28.6	0	0	0	106.2
723	K	42.3	Very low	42.6	Very low	171 Å²	171	135.4 Å²	135.4	74%	0.743	74%	0.739	S	S	*	*			cis	82.2	129.7	41.6	-163.8	-179.9	178.6	-171.3	0	114.5
724	L	41	Very low	42.3	Very low	147 Å²	147	137.9 Å²	137.9	77%	0.77	74%	0.743	S	S	*	*			trans	103.2	146.6	177.5	-61.9	164	0	0	0	115.1
725	E	39.6	Very low	41.8	Very low	136 Å²	136	136.6 Å²	136.6	64%	0.636	73%	0.734	S	S	*	*			cis	-165.4	156.8	-44.2	-124.3	177	-143.3	0	0	113.4
726	L	41.1	Very low	41.3	Very low	121 Å²	121	138.3 Å²	138.3	63%	0.634	74%	0.741	S	S	*	*			trans	48	109.4	147.2	-77.5	171.5	0	0	0	123.4
727	K	41.5	Very low	40.6	Very low	196 Å²	196	136 Å²	136	85%	0.852	74%	0.738	S	S	*	*				146.5	159.3	120	-82.3	158.7	-177	174.5	0	112.6
728	K	43	Very low	40.4	Very low	179 Å²	179	134.7 Å²	134.7	78%	0.778	74%	0.74	S	S	*	*			cis	179	166.7	-43.9	-117.3	-170.3	176.1	-171.2	0	107.6
729	S	40.3	Very low	40.4	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	74%	0.739	S	S	*	*			trans	59.9	117.4	179.2	43.7	0	0	0	0	115.3
730	S	39.8	Very low	40	Very low	104 Å²	104	140 Å²	140	73%	0.727	75%	0.745	S	S	*	*			cis	83.3	113.5	26.6	-45.1	0	0	0	0	115.4
731	N	42.3	Very low	39.4	Very low	153 Å²	153	135.8 Å²	135.8	82%	0.818	74%	0.74	S	S	*	*			trans	-167.6	125.6	140.7	-87.1	-17.6	0	0	0	104.1
732	E	37.6	Very low	39.5	Very low	162 Å²	162	138.5 Å²	138.5	76%	0.757	75%	0.745	S	S	*	*			cis	65.3	130	40.5	-59.6	-161.7	138.8	0	0	112.5
733	T	38.1	Very low	39.1	Very low	108 Å²	108	139.8 Å²	139.8	66%	0.663	74%	0.743	S	S	*	*			cis	-160.1	152.8	4	3.6	0	0	0	0	112.9
734	L	33.6	Very low	38.7	Very low	151 Å²	151	136.4 Å²	136.4	79%	0.791	74%	0.741	S	S	*	*			trans	34.9	131.9	138.7	-83.3	154.4	0	0	0	122.6
735	S	35	Very low	38.4	Very low	82 Å²	82	135 Å²	135	57%	0.573	74%	0.743	S	S	*	*				124.4	125.5	111.6	-93.4	0	0	0	0	119.9
736	T	37.8	Very low	38.3	Very low	136 Å²	136	133.1 Å²	133.1	83%	0.834	75%	0.745	S	S	*	*			trans	61.7	158.4	140.9	60.1	0	0	0	0	119.9
737	S	34.6	Very low	38.1	Very low	103 Å²	103	132.9 Å²	132.9	72%	0.72	75%	0.749	S	S	*	*			cis	177.4	171.4	-22.4	-177.9	0	0	0	0	106.4
738	S	40	Very low	38	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	74%	0.742	S	S	*	*			trans	93.3	146.1	169.5	-51.1	0	0	0	0	117.6
739	Q	39.6	Very low	37.7	Very low	154 Å²	154	126.4 Å²	126.4	72%	0.72	74%	0.741	S	S	*	*			cis	-171.1	162.2	-30.8	-136.4	-176.7	33.1	0	0	110.2
740	K	41.5	Very low	37.7	Very low	172 Å²	172	127.9 Å²	127.9	75%	0.748	74%	0.735	S	S	*	*			trans	69.6	130.3	168.5	-56.4	160.1	-173.9	173.6	0	114.9
741	S	34.6	Very low	37.6	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	74%	0.736	S	S	*	*			cis	81.5	124.6	15.7	94.4	0	0	0	0	117.6
742	I	40.9	Very low	37.5	Very low	157 Å²	157	127.1 Å²	127.1	81%	0.805	72%	0.724	S	S	*	*			trans	174.2	120.8	130	-87.9	155.5	0	0	0	113.4
743	K	37.3	Very low	37.6	Very low	186 Å²	186	127.8 Å²	127.8	81%	0.809	73%	0.725	S	S	*	*			trans	9.7	120.8	147.5	-59.7	178.7	-179.5	-179	0	122.8
744	S	33.4	Very low	37.6	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	73%	0.731	S	S	*	*				28.6	152	118.5	64.7	0	0	0	0	124.1
745	S	35.4	Very low	37.8	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	73%	0.733	S	S	*	*			trans	85.9	144.6	167.4	-64.2	0	0	0	0	116.8
746	S	36.4	Very low	38	Very low	97 Å²	97	133.8 Å²	133.8	68%	0.678	74%	0.742	S	S	*	*			cis	-168.7	-178.6	-11.8	52.7	0	0	0	0	112.2
747	T	38.1	Very low	38	Very low	117 Å²	117	132.7 Å²	132.7	72%	0.718	74%	0.74	S	S	*	*			trans	77.5	109.8	150	21.6	0	0	0	0	121.8
748	V	37.7	Very low	38.2	Very low	116 Å²	116	133.1 Å²	133.1	70%	0.703	74%	0.743	S	S	*	*				61.9	125.9	124.3	177.6	0	0	0	0	117.7
749	T	38.4	Very low	38	Very low	123 Å²	123	135.3 Å²	135.3	76%	0.755	75%	0.746	S	S	*	*				-161.6	149.6	73.5	-43	0	0	0	0	114.5
750	H	39.8	Very low	38	Very low	139 Å²	139	136.4 Å²	136.4	64%	0.644	75%	0.751	S	S	*	*			trans	-28.3	159.7	157.7	-56.9	-95.4	0	0	0	116.6
751	H	38.2	Very low	37.8	Very low	159 Å²	159	136.1 Å²	136.1	74%	0.736	76%	0.757	S	S	*	*			cis	-178.9	176.3	1.1	-106.3	-5.4	0	0	0	108.5
752	S	40	Very low	38.1	Very low	82 Å²	82	136.6 Å²	136.6	57%	0.573	76%	0.757	S	S	*	*			cis	-170.9	-170	-15.3	-106	0	0	0	0	110
753	F	38.4	Very low	38.1	Very low	175 Å²	175	134.6 Å²	134.6	77%	0.768	76%	0.757	S	S	*	*			trans	89.1	105.4	162.9	-72.9	-86.2	0	0	0	120.9
754	K	38.3	Very low	38.1	Very low	184 Å²	184	136.4 Å²	136.4	80%	0.8	76%	0.761	S	S	*	*				42.6	144.1	117.7	-68.2	-174.9	-174.3	172.3	0	120.1
755	K	39.3	Very low	38.4	Very low	191 Å²	191	142.3 Å²	142.3	83%	0.83	77%	0.768	S	S	*	*			cis	-171.2	161.9	-4.3	166.6	177.3	177.1	-173.8	0	109.2
756	A	38.4	Very low	38.5	Very low	92 Å²	92	142 Å²	142	76%	0.76	77%	0.765	S	S	*	*			trans	98.1	141.7	163.6	0	0	0	0	0	116.4
757	S	37.8	Very low	38.6	Very low	113 Å²	113	146.2 Å²	146.2	79%	0.79	77%	0.771	S	S	*	*			cis	132.5	104.5	-18.3	174	0	0	0	0	113.2
758	S	38.4	Very low	38.4	Very low	112 Å²	112	146.3 Å²	146.3	78%	0.783	78%	0.776	S	S	*	*				179.5	127.1	127.9	56.9	0	0	0	0	111.3
759	D	35.9	Very low	38.3	Very low	152 Å²	152	147.4 Å²	147.4	81%	0.813	78%	0.783	S	S	*	*			trans	-116.8	153.2	169.7	-80.2	-58.2	0	0	0	111.3
760	H	38.9	Very low	38.3	Very low	178 Å²	178	149.2 Å²	149.2	82%	0.824	79%	0.787	S	S	*	*			trans	26.3	119.6	158.4	-68.6	-73.2	0	0	0	122
761	L	39	Very low	38.1	Very low	166 Å²	166	148 Å²	148	87%	0.869	79%	0.794	S	S	*	*			trans	-175.3	170.9	144.4	-100.4	177.7	0	0	0	107.7
762	P	39.7	Very low	38.3	Very low	112 Å²	112	146.3 Å²	146.3	73%	0.727	80%	0.795	S	S	*	*			cis	-129.5	168.1	-16.1	39.9	-26	0	0	0	114.1
763	S	41.8	Very low	38.1	Very low	115 Å²	115	150.2 Å²	150.2	80%	0.804	81%	0.805	S	S	*	*			trans	-173	130.2	131.5	-168.8	0	0	0	0	111.7
764	Y	37.5	Very low	38.1	Very low	225 Å²	225	146.9 Å²	146.9	88%	0.882	80%	0.803	S	S	*	*			trans	-123	134.7	171.5	-103.4	-96.1	0	0	0	108.7
765	R	39.8	Very low	38.2	Very low	225 Å²	225	145.7 Å²	145.7	85%	0.849	80%	0.804	S	S	*	*			trans	-156.4	79.4	163.4	-148.6	-178.5	-157	-149.1	7.7	115
766	S	35.9	Very low	38.2	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	80%	0.8	S	S	*	*			trans	-94	136.7	163.5	-53.7	0	0	0	0	110.3
767	K	39.2	Very low	38.1	Very low	187 Å²	187	146.3 Å²	146.3	81%	0.813	81%	0.806	S	S	*	*			trans	-151.6	106.9	169.5	-81	-158.8	172.3	-162.5	0	110.8
768	S	33.7	Very low	38.2	Very low	118 Å²	118	145.3 Å²	145.3	83%	0.825	80%	0.804	S	S	*	*			trans	-161.1	62.4	175.5	59	0	0	0	0	112.6
769	V	36.2	Very low	38.2	Very low	139 Å²	139	149 Å²	149	84%	0.842	81%	0.809	S	S	*	*			trans	-145	124.9	164.9	-178.1	0	0	0	0	108.9
770	L	38.6	Very low	38.4	Very low	161 Å²	161	146.7 Å²	146.7	84%	0.843	81%	0.805	S	S	*	*			trans	-174.6	123	142.7	-106.1	167.4	0	0	0	108.5
771	S	35.3	Very low	38.6	Very low	113 Å²	113	145.3 Å²	145.3	79%	0.79	81%	0.809	S	S	*	*			trans	-130.2	121.2	176.4	-59.7	0	0	0	0	109
772	T	41.7	Very low	38.6	Very low	124 Å²	124	143.9 Å²	143.9	76%	0.761	80%	0.798	S	S	*	*			trans	173.2	154.5	166.3	31.3	0	0	0	0	107.4
773	E	36.8	Very low	38.6	Very low	164 Å²	164	142.4 Å²	142.4	77%	0.766	79%	0.791	S	S	*	*			cis	-167	126.8	-26.8	-176.6	165.3	-169.3	0	0	109.6
774	S	38	Very low	38.6	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	78%	0.784	S	S	*	*			trans	54.4	169.6	154.7	-60.4	0	0	0	0	122.7
775	I	40.3	Very low	38.7	Very low	159 Å²	159	140.1 Å²	140.1	82%	0.815	78%	0.782	S	S	*	*			trans	80.7	116.4	179.3	-49.6	168.7	0	0	0	113.5
776	S	38.4	Very low	38.7	Very low	107 Å²	107	134.2 Å²	134.2	75%	0.748	78%	0.775	S	S	*	*			cis	117.4	149.9	9.4	-68.1	0	0	0	0	112.8
777	Q	37.9	Very low	38.9	Very low	190 Å²	190	139.3 Å²	139.3	89%	0.888	78%	0.778	S	S	*	*			trans	79.9	118.8	-173	-57.4	179.1	-13.9	0	0	113.1
778	A	38.5	Very low	39	Very low	91 Å²	91	138.9 Å²	138.9	75%	0.752	78%	0.776	S	S	*	*				79.9	140.1	66.2	0	0	0	0	0	111.9
779	E	38.3	Very low	39.3	Very low	191 Å²	191	137.1 Å²	137.1	89%	0.893	76%	0.764	S	S	*	*			cis	-151.6	-175.1	32.8	-146.2	161.5	-134.1	0	0	114.4
780	S	41.7	Very low	39.5	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	76%	0.761	S	S	*	*			trans	-89.1	160.3	-160.8	54.2	0	0	0	0	118.9
781	T	42.8	Very low	39.5	Very low	149 Å²	149	135.6 Å²	135.6	91%	0.914	75%	0.75	S	S	*	*			trans	-155.2	172.2	156.7	-20.1	0	0	0	0	111.5
782	E	38.7	Very low	39.6	Very low	135 Å²	135	137.1 Å²	137.1	63%	0.631	75%	0.749	S	S	*	*			trans	-157	176	-167.9	-152.7	-85.9	126.5	0	0	113.8	K784	E782-K784 IonicContact OE1-NZ 2.68Å; E782-K784 PolarHBondContact OE1-NZ 2.74Å; E782-K784 IonicContact OE2-NZ 2.65Å; E782-K784 PolarHBondContact OE2-NZ 2.89Å
783	S	40	Very low	39.4	Very low	82 Å²	82	135.4 Å²	135.4	57%	0.573	74%	0.743	S	S	*	*			trans	88.8	114	165.9	-80.5	0	0	0	0	118
784	K	41.6	Very low	39.4	Very low	154 Å²	154	135.2 Å²	135.2	67%	0.67	75%	0.746	S	S	*	*				77.6	143.6	77.6	-69.3	174.2	-171.6	77.6	0	112.4	E782	E782-K784 IonicContact OE1-NZ 2.68Å; E782-K784 PolarHBondContact OE1-NZ 2.74Å; E782-K784 IonicContact OE2-NZ 2.65Å; E782-K784 PolarHBondContact OE2-NZ 2.89Å
785	T	40.2	Very low	39.3	Very low	137 Å²	137	134 Å²	134	84%	0.84	74%	0.743	S	S	*	*			cis	-156.7	160.2	25.5	-26.5	0	0	0	0	114.6
786	S	38.6	Very low	39.1	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	74%	0.743	S	S	*	*			trans	-72.4	155.3	176	172.8	0	0	0	0	116.8
787	R	40.7	Very low	39.2	Very low	216 Å²	216	136 Å²	136	82%	0.815	75%	0.746	S	S	*	*				173.8	133.4	122	-97.6	170.5	-177.5	-175.3	3.2	117.7
788	K	40.7	Very low	39.4	Very low	178 Å²	178	135.6 Å²	135.6	77%	0.774	74%	0.742	S	S	*	*			trans	57.1	153.2	130.9	-73.1	-170.9	175.6	-165.6	0	121.6
789	S	40.9	Very low	39.5	Very low	81 Å²	81	138.9 Å²	138.9	57%	0.566	75%	0.746	S	S	*	*			cis	-178.6	150.1	-7.5	47.4	0	0	0	0	113.8
790	Q	39.3	Very low	39.5	Very low	167 Å²	167	136.2 Å²	136.2	78%	0.78	74%	0.738	S	S	*	*			trans	66.7	158	146.3	-70.7	174.3	-94.9	0	0	119
791	T	38.8	Very low	39.4	Very low	100 Å²	100	139.8 Å²	139.8	61%	0.613	74%	0.743	S	S	*	*			cis	-168.8	165.8	-15.6	25.7	0	0	0	0	111.1
792	N	38.5	Very low	39.1	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	73%	0.731	S	S	*	*			trans	73.4	164.2	155.5	-62	-13.3	0	0	0	118.9
793	S	36.2	Very low	39.1	Very low	89 Å²	89	139.3 Å²	139.3	62%	0.622	74%	0.741	S	S	*	*				172.1	166.2	-55.1	55.6	0	0	0	0	110.3
794	L	36.8	Very low	38.9	Very low	159 Å²	159	140.1 Å²	140.1	83%	0.832	75%	0.747	S	S	*	*			trans	76.6	104.7	171.5	-88.2	68.4	0	0	0	120
795	A	37.5	Very low	38.7	Very low	81 Å²	81	138 Å²	138	67%	0.669	75%	0.751	S	S	*	*				51.4	136.4	108.3	0	0	0	0	0	123.1
796	N	36	Very low	38.6	Very low	153 Å²	153	139.6 Å²	139.6	82%	0.818	75%	0.748	S	S	*	*			trans	55.8	127.1	150.9	-62.9	-4.9	0	0	0	119.7
797	D	39.6	Very low	38.5	Very low	153 Å²	153	139.5 Å²	139.5	82%	0.818	75%	0.748	S	S	*	*				-162.3	174.5	85.5	-132.1	-33.4	0	0	0	114.4
798	K	41.4	Very low	38.3	Very low	183 Å²	183	136.2 Å²	136.2	80%	0.796	75%	0.746	S	S	*	*			trans	-88.5	150.9	179	-57.3	164.6	-176.5	166.8	0	112.1
799	L	41.8	Very low	38.1	Very low	159 Å²	159	136.1 Å²	136.1	83%	0.832	75%	0.746	S	S	*	*			trans	-157.3	137.1	147.5	-115	164.1	0	0	0	112.1
800	N	38.9	Very low	37.9	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	75%	0.748	S	S	*	*			trans	-109.7	130.7	-178.8	-68.8	-34.4	0	0	0	111.1
801	H	38.7	Very low	37.8	Very low	177 Å²	177	135.6 Å²	135.6	82%	0.819	74%	0.742	S	S	*	*			trans	-143.4	118.6	150.3	-79.1	-80.8	0	0	0	106.8
802	T	36.8	Very low	37.9	Very low	109 Å²	109	138.2 Å²	138.2	67%	0.669	75%	0.751	S	S	*	*			cis	78.7	91.8	35.6	-48.8	0	0	0	0	113.5
803	I	39	Very low	37.8	Very low	166 Å²	166	138.8 Å²	138.8	85%	0.851	75%	0.749	S	S	*	*			trans	172.5	105.7	153	-86.3	146.9	0	0	0	102.5
804	S	35.6	Very low	38	Very low	99 Å²	99	139.1 Å²	139.1	69%	0.692	74%	0.743	S	S	*	*			cis	81.8	147.4	32.1	-154.1	0	0	0	0	114.8
805	C	37.1	Very low	38.1	Very low	110 Å²	110	140 Å²	140	74%	0.743	74%	0.741	S	S	*	*			trans	65.8	145	-173.4	-59.4	0	0	0	0	116.9
806	Q	37.7	Very low	38.1	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	74%	0.744	S	S	*	*			cis	-176.6	167.3	-45.1	-114.2	172.2	-21.4	0	0	108.2
807	S	36.7	Very low	38.3	Very low	99 Å²	99	139.7 Å²	139.7	69%	0.692	74%	0.74	S	S	*	*			trans	40.4	112.4	155.5	54.3	0	0	0	0	119.9
808	N	35.7	Very low	38.2	Very low	148 Å²	148	137.5 Å²	137.5	79%	0.791	74%	0.737	S	S	*	*				72.2	129.9	76.2	-91.9	-24.8	0	0	0	116.5
809	K	36.5	Very low	38.1	Very low	175 Å²	175	133 Å²	133	76%	0.761	73%	0.729	S	S	*	*			trans	82	132.4	137.6	-79.6	-170.3	174.8	-170	0	121.8
810	N	37.5	Very low	38	Very low	116 Å²	116	132.8 Å²	132.8	62%	0.62	72%	0.723	S	S	*	*			trans	87.8	130.4	135	-76.9	48.9	0	0	0	121.7
811	D	38.3	Very low	38.1	Very low	122 Å²	122	133.7 Å²	133.7	65%	0.652	72%	0.723	S	S	*	*			trans	64.3	110.3	132.4	-47.3	-17.1	0	0	0	121.6
812	I	38.8	Very low	38.3	Very low	154 Å²	154	130.9 Å²	130.9	79%	0.79	71%	0.714	S	S	*	*				40.5	140.9	112.2	-53	175.8	0	0	0	118.5
813	E	37.2	Very low	38.6	Very low	158 Å²	158	132.2 Å²	132.2	74%	0.738	72%	0.716	S	S	*	*			trans	81.4	108.4	158.7	-122.8	-171.1	-108.1	0	0	119.6
814	N	39.7	Very low	39.1	Very low	95 Å²	95	131.1 Å²	131.1	51%	0.508	71%	0.712	S	S	.	*				170.2	144.1	100.7	-101.2	-84.3	0	0	0	115.1
815	K	39	Very low	39.3	Very low	178 Å²	178	133.8 Å²	133.8	77%	0.774	71%	0.713	S	S	*	*			trans	57.8	143.3	144.5	-68	164.9	179.5	111.8	0	118.9
816	S	38.2	Very low	39.8	Very low	106 Å²	106	133.9 Å²	133.9	74%	0.741	71%	0.706	S	S	*	*			cis	-166.7	-167.9	0.6	38.1	0	0	0	0	107.1
817	V	40.7	Very low	40.1	Very low	121 Å²	121	133.5 Å²	133.5	73%	0.733	70%	0.702	S	S	*	*			cis	-155.7	143.2	23.8	-176.8	0	0	0	0	109.3
818	S	36.8	Very low	40.5	Very low	108 Å²	108	136.1 Å²	136.1	76%	0.755	70%	0.703	S	S	*	*			trans	57.7	150.3	164.9	-68.3	0	0	0	0	120.5
819	S	38.6	Very low	40.8	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	70%	0.701	S	S	*	*			cis	-171.5	-174.6	-33.6	53.6	0	0	0	0	106.5
820	E	40.5	Very low	41.1	Very low	154 Å²	154	136.4 Å²	136.4	72%	0.72	70%	0.7	S	S	*	*			cis	-164.9	171.1	7.1	-143.7	153.2	110.3	0	0	110.5
821	Q	41.7	Very low	41.4	Very low	155 Å²	155	138 Å²	138	72%	0.724	70%	0.703	S	S	*	*			trans	64.8	142.2	165.8	-65.2	-173.8	14.1	0	0	117.5
822	N	42.8	Very low	41.5	Very low	117 Å²	117	139.1 Å²	139.1	63%	0.626	71%	0.709	S	S	*	*			cis	-150.9	130.5	-0.3	-99.8	-27.9	0	0	0	112.7
823	I	42.9	Very low	41.7	Very low	138 Å²	138	137.4 Å²	137.4	71%	0.708	70%	0.701	S	S	*	*			trans	66.4	142.4	131.4	-59.5	170.9	0	0	0	121.7
824	N	48.5	Very low	41.9	Very low	143 Å²	143	136.1 Å²	136.1	77%	0.765	70%	0.699	S	S	*	*			trans	74.3	151.1	169.1	-74	-3.2	0	0	0	120.5
825	E	40.7	Very low	42.3	Very low	155 Å²	155	136.5 Å²	136.5	72%	0.724	71%	0.706	S	S	*	*				-172	156.6	-54.6	-121.3	-165	-155.5	0	0	111.3
826	N	47.5	Very low	42.4	Very low	111 Å²	111	134 Å²	134	59%	0.594	70%	0.702	S	S	*	*			trans	74	114.8	159.4	-67.5	-55.1	0	0	0	123.2
827	K	42.9	Very low	42.6	Very low	162 Å²	162	136.5 Å²	136.5	70%	0.704	70%	0.702	S	S	*	*				64.8	152.9	126.7	-68.4	163.3	165.5	-96.9	0	119.9
828	E	45	Very low	42.6	Very low	154 Å²	154	136 Å²	136	72%	0.72	70%	0.699	S	S	*	*			cis	-148.1	-163.9	1.9	-140.1	139.5	-136.2	0	0	113.2
829	K	43.5	Very low	42.8	Very low	171 Å²	171	137.6 Å²	137.6	74%	0.743	70%	0.699	S	S	*	*			trans	-105.5	-162	-162.5	-32.6	164.9	-174.7	168	0	114.1
830	E	43.3	Very low	43.1	Very low	157 Å²	157	138 Å²	138	73%	0.734	70%	0.698	S	S	*	*			cis	-139.9	172.5	-0.1	-63.4	-163.3	138	0	0	108.5
831	E	43.3	Very low	43.1	Very low	149 Å²	149	138.4 Å²	138.4	70%	0.696	71%	0.705	S	S	*	*			cis	-127.6	-96.3	-0.6	-172.2	-164.2	-144.7	0	0	111.8	L833	E831-L833 VanDerWaalsContact CD-CD1 3.46Å; E831-L833 HydrophobicContact CG-CD1 4.22Å; E831-L833 VanDerWaalsContact OE2-CD1 3.28Å; E831-L833 WeakPolarHBondContact OE2-CD1 3.41Å
832	L	40.6	Very low	43	Very low	147 Å²	147	134 Å²	134	77%	0.77	70%	0.701	S	S	*	*			cis	-153.8	177.1	-7.5	-136.8	-178.5	0	0	0	109.8
833	L	42.9	Very low	43	Very low	117 Å²	117	137.2 Å²	137.2	61%	0.613	71%	0.713	S	S	*	*			trans	-126.1	177.3	-168.8	-65.1	95.4	0	0	0	113	E831	E831-L833 VanDerWaalsContact CD-CD1 3.46Å; E831-L833 HydrophobicContact CG-CD1 4.22Å; E831-L833 VanDerWaalsContact OE2-CD1 3.28Å; E831-L833 WeakPolarHBondContact OE2-CD1 3.41Å
834	N	41	Very low	43	Very low	131 Å²	131	137.3 Å²	137.3	70%	0.701	71%	0.713	S	S	*	*			cis	-162.9	144.9	19.9	-151.1	4.9	0	0	0	114.7
835	P	47.1	Very low	42.7	Very low	103 Å²	103	134.6 Å²	134.6	67%	0.669	71%	0.71	S	S	*	*			trans	-116.3	174.5	166	40.7	-31.5	0	0	0	113.7
836	N	42.2	Very low	42.8	Very low	126 Å²	126	133.6 Å²	133.6	67%	0.674	71%	0.71	S	S	*	*			trans	173.2	133.3	149.3	-91.7	-29.4	0	0	0	113.3
837	Q	41.7	Very low	42.5	Very low	159 Å²	159	133.8 Å²	133.8	74%	0.743	71%	0.711	S	S	*	*				70.1	146.6	102.9	-63.2	-175.4	41.7	0	0	116.1
838	T	40.4	Very low	42.5	Very low	111 Å²	111	132.2 Å²	132.2	68%	0.681	71%	0.71	S	S	*	*			cis	-160.2	148.7	3.5	13.4	0	0	0	0	108.4
839	N	41.1	Very low	42.4	Very low	141 Å²	141	132.5 Å²	132.5	75%	0.754	71%	0.711	S	S	*	*				59.7	139.1	90.7	-134.7	23.9	0	0	0	114.2
840	V	45.3	Very low	42.3	Very low	98 Å²	98	130.2 Å²	130.2	59%	0.594	71%	0.707	S	S	*	*			cis	-158.7	167.6	18.8	-141	0	0	0	0	111.4
841	N	41.6	Very low	42.1	Very low	161 Å²	161	129.1 Å²	129.1	86%	0.861	71%	0.707	S	S	*	*			trans	65.5	157.5	155.8	-58.5	-22.6	0	0	0	119.2
842	G	39.5	Very low	42	Very low	64 Å²	64	128.7 Å²	128.7	66%	0.66	71%	0.709	S	S	*	*			cis	165	165.3	-8.4	0	0	0	0	0	112.9
843	E	41.7	Very low	41.9	Very low	184 Å²	184	127.5 Å²	127.5	86%	0.86	71%	0.708	S	S	*	*			trans	70	152.9	166.6	-60.7	-165	154.9	0	0	118.7
844	I	42.5	Very low	41.8	Very low	139 Å²	139	128.6 Å²	128.6	71%	0.713	71%	0.713	S	S	*	*			cis	-163.1	164.1	-26.9	-113.4	165.3	0	0	0	109
845	A	43.4	Very low	41.8	Very low	86 Å²	86	129.7 Å²	129.7	71%	0.711	71%	0.714	S	S	*	*			trans	70.3	156.5	160.2	0	0	0	0	0	120.4
846	N	43.2	Very low	41.5	Very low	135 Å²	135	131.5 Å²	131.5	72%	0.722	72%	0.718	S	S	*	*			cis	-164.5	154.7	-40.5	-129.7	-8.9	0	0	0	112.1
847	N	41.4	Very low	41.3	Very low	114 Å²	114	129.3 Å²	129.3	61%	0.61	73%	0.725	S	S	*	*			trans	51.3	116.7	146.4	-67.7	-16.3	0	0	0	123.5
848	N	41.4	Very low	41.1	Very low	129 Å²	129	131.6 Å²	131.6	69%	0.69	73%	0.733	S	S	*	*				83	119.9	118.2	-62.4	-8.6	0	0	0	123.9
849	H	43.3	Very low	41.4	Very low	160 Å²	160	131.3 Å²	131.3	74%	0.741	73%	0.733	S	S	*	*				79.8	139.2	129.5	-94.8	-74.3	0	0	0	123.7
850	N	42.2	Very low	41.3	Very low	123 Å²	123	131.7 Å²	131.7	66%	0.658	73%	0.734	S	S	*	*			trans	80.2	106.2	148.2	-63.5	-13.9	0	0	0	120.6
851	N	38.8	Very low	41.1	Very low	135 Å²	135	133.4 Å²	133.4	72%	0.722	74%	0.739	S	S	*	*				57.7	158.5	117	-66.2	18.8	0	0	0	122.7
852	D	40	Very low	41	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	74%	0.739	S	S	*	*			trans	72.9	99.4	167.2	-54.6	-36.4	0	0	0	115.3
853	T	39.2	Very low	40.9	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	74%	0.741	S	S	*	*				77.5	144.3	58.7	-47.8	0	0	0	0	112.1
854	I	40.6	Very low	40.7	Very low	140 Å²	140	135.3 Å²	135.3	72%	0.718	74%	0.74	S	S	*	*			trans	97.6	110.5	165.8	-51.8	-170.8	0	0	0	117.7
855	E	40.8	Very low	40.6	Very low	154 Å²	154	134 Å²	134	72%	0.72	74%	0.743	S	S	*	*			trans	79.6	131.4	143.6	-76.2	-176.3	113.3	0	0	127.5
856	N	41.2	Very low	40.3	Very low	141 Å²	141	139.9 Å²	139.9	75%	0.754	75%	0.746	S	S	*	*			trans	65.2	134.5	132.9	-57.3	-18.5	0	0	0	122.9
857	G	37.5	Very low	40.2	Very low	79 Å²	79	144.6 Å²	144.6	81%	0.814	76%	0.756	S	S	*	*			trans	159.5	37.3	161.6	0	0	0	0	0	122.5
858	F	37.4	Very low	40	Very low	208 Å²	208	146.4 Å²	146.4	91%	0.912	76%	0.761	S	S	*	*			trans	-76.2	162.5	153.3	-88.8	-77.8	0	0	0	109
859	P	47.2	Very low	40	Very low	104 Å²	104	147.2 Å²	147.2	68%	0.675	77%	0.77	S	S	*	*			cis	-148.9	-149	34	40.8	-16.3	0	0	0	115.8
860	L	40.2	Very low	39.7	Very low	149 Å²	149	142.8 Å²	142.8	78%	0.78	77%	0.768	S	S	*	*			trans	87.2	152.8	167.7	-49.6	179.1	0	0	0	117.2
861	L	39.5	Very low	39.5	Very low	135 Å²	135	142.9 Å²	142.9	71%	0.707	78%	0.778	S	S	*	*			cis	-176.4	173.8	-47.9	-113.8	175.1	0	0	0	107.5
862	L	39.9	Very low	39.3	Very low	164 Å²	164	144.4 Å²	144.4	86%	0.859	79%	0.785	S	S	*	*			trans	89.7	108.5	-171.9	-58.4	157.8	0	0	0	113.6
863	E	36.8	Very low	39.3	Very low	150 Å²	150	147.8 Å²	147.8	70%	0.701	79%	0.793	S	S	*	*			cis	94.3	125.1	8.4	-146.1	-175.8	-175.8	0	0	117.5
864	T	39.2	Very low	39	Very low	135 Å²	135	150.8 Å²	150.8	83%	0.828	80%	0.799	S	S	*	*			trans	67.4	156.2	179.5	78.8	0	0	0	0	116.1
865	S	38.8	Very low	38.7	Very low	112 Å²	112	150.6 Å²	150.6	78%	0.783	81%	0.808	S	S	*	*			cis	-142	166.2	5.3	64.3	0	0	0	0	112.4
866	R	38.1	Very low	38.4	Very low	208 Å²	208	148.3 Å²	148.3	79%	0.785	81%	0.81	S	S	*	*			trans	-87.3	156.4	176.2	-51.9	178.4	-168.8	175.9	3.6	111.4
867	Y	39.7	Very low	38.2	Very low	235 Å²	235	149.9 Å²	149.9	92%	0.922	82%	0.817	S	S	*	*			trans	-144.3	143.2	141.8	-114.7	-82.9	0	0	0	110.9
868	E	38.6	Very low	38.1	Very low	151 Å²	151	149.6 Å²	149.6	71%	0.706	81%	0.814	S	S	*	*			trans	-109.4	-170	-178.5	-63.7	-178.6	166	0	0	111.4
869	V	40.4	Very low	38.2	Very low	147 Å²	147	146.3 Å²	146.3	89%	0.891	81%	0.806	S	S	*	*			trans	86.9	125	170.8	-169.3	0	0	0	0	114.8
870	G	36.6	Very low	37.9	Very low	67 Å²	67	147.5 Å²	147.5	69%	0.691	81%	0.807	S	S	*	*			trans	-138.4	-170.7	174.7	0	0	0	0	0	112
871	S	39.8	Very low	37.9	Very low	125 Å²	125	146 Å²	146	87%	0.874	80%	0.8	S	S	*	*			trans	-163.6	153.3	165.1	-96.4	0	0	0	0	112.2
872	L	32.9	Very low	38.1	Very low	166 Å²	166	145.9 Å²	145.9	87%	0.869	80%	0.796	S	S	*	*			trans	-69.1	143.9	167.3	-79.2	68.6	0	0	0	110.3
873	K	40.7	Very low	38.5	Very low	210 Å²	210	144.9 Å²	144.9	91%	0.913	79%	0.791	S	S	*	*			trans	-161.8	135	136.9	-112.5	161.7	-173.7	176.1	0	112.2
874	Q	32.6	Very low	38.7	Very low	186 Å²	186	146.5 Å²	146.5	87%	0.869	80%	0.796	S	S	*	*			trans	-80.7	149.8	161.7	-61.4	164.7	-52.9	0	0	109
875	C	35.1	Very low	39.4	Very low	136 Å²	136	144.6 Å²	144.6	92%	0.919	79%	0.786	S	S	*	*			trans	-171.8	168.1	136.5	-108.4	0	0	0	0	110.8
876	S	34.5	Very low	39.5	Very low	107 Å²	107	146.6 Å²	146.6	75%	0.748	79%	0.786	S	S	*	*			trans	-124.1	-179.2	-162.4	-47.5	0	0	0	0	113.2
877	L	36.3	Very low	39.7	Very low	173 Å²	173	142 Å²	142	91%	0.906	79%	0.786	S	S	*	*			trans	85.1	140.3	161.3	-60.7	150.7	0	0	0	118.1
878	G	36.6	Very low	39.8	Very low	74 Å²	74	137.6 Å²	137.6	76%	0.763	78%	0.778	S	S	*	*			trans	158	91.5	174.1	0	0	0	0	0	112.5
879	N	39.1	Very low	40	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	78%	0.777	S	S	*	*			trans	-92.1	162.9	-176.6	-54.3	-26.8	0	0	0	112.4
880	N	40.3	Very low	40.2	Very low	128 Å²	128	133.5 Å²	133.5	68%	0.684	77%	0.772	S	S	*	*				176.6	151.2	107.5	-105.3	31.3	0	0	0	116.5
881	D	41.3	Very low	40.6	Very low	118 Å²	118	137.2 Å²	137.2	63%	0.631	77%	0.774	S	S	*	*			trans	62.8	144.8	145.2	-61.7	-32.2	0	0	0	121.9
882	Q	43.3	Very low	40.6	Very low	133 Å²	133	136.1 Å²	136.1	62%	0.621	77%	0.767	S	S	*	*			cis	-162.5	179.1	-8.9	-111.6	-33.8	-49.5	0	0	111.4
883	N	46.7	Very low	41.5	Very low	142 Å²	142	133.8 Å²	133.8	76%	0.759	76%	0.761	S	S	*	*			trans	79.8	81.6	160.8	-54.1	-32.4	0	0	0	119.2
884	K	41.5	Very low	41.6	Very low	185 Å²	185	130.6 Å²	130.6	80%	0.804	76%	0.759	S	S	*	*				59.3	152.4	60.4	-95.8	-157.6	148.4	-173.1	0	116.5
885	P	53.4	Low	41.9	Very low	95 Å²	95	125.5 Å²	125.5	62%	0.617	75%	0.745	S	S	*	*			cis	-150.4	-151.3	-43.6	37.8	-13.9	0	0	0	115.4
886	I	41.4	Very low	42.1	Very low	154 Å²	154	129 Å²	129	79%	0.79	74%	0.738	S	S	*	*			trans	89	131.2	164.5	-46.4	-172.7	0	0	0	113.8
887	S	43.7	Very low	42.4	Very low	112 Å²	112	131.6 Å²	131.6	78%	0.783	74%	0.739	S	S	*	*			cis	-123.3	-155.4	22	72.9	0	0	0	0	115.6
888	N	41.1	Very low	42.5	Very low	141 Å²	141	128.3 Å²	128.3	75%	0.754	73%	0.726	S	S	*	*			trans	-167.3	135.6	-162.5	43.1	-118	0	0	0	115.2
889	G	43.7	Very low	42.8	Very low	66 Å²	66	131.1 Å²	131.1	68%	0.68	73%	0.728	S	S	*	*			trans	-176.5	123.8	164.3	0	0	0	0	0	111.9
890	N	44.1	Very low	42.6	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	73%	0.728	S	S	*	*				96	135.8	60.5	-78	-4.6	0	0	0	110.9
891	I	44	Very low	42.7	Very low	144 Å²	144	133.6 Å²	133.6	74%	0.738	74%	0.736	S	S	*	*			cis	-168.1	157.8	-2.5	-117.9	161.9	0	0	0	106.8
892	S	39.4	Very low	42.3	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	75%	0.745	S	S	*	*			cis	-165.1	159.2	-32.2	-95.1	0	0	0	0	109.7
893	P	53	Low	42.4	Very low	116 Å²	116	136.5 Å²	136.5	75%	0.753	76%	0.756	S	S	*	*			trans	-110.2	164	-164.3	40.8	-35.7	0	0	0	117.1
894	T	41.7	Very low	41.8	Very low	143 Å²	143	136.9 Å²	136.9	88%	0.877	76%	0.758	S	S	*	*			trans	-165.4	153.8	170	17.3	0	0	0	0	111.2
895	S	39.6	Very low	41.5	Very low	80 Å²	80	133.4 Å²	133.4	56%	0.559	76%	0.756	S	S	*	*			cis	-166.3	155.5	-8.9	80.8	0	0	0	0	113.6
896	R	40	Very low	40.6	Very low	208 Å²	208	136.6 Å²	136.6	79%	0.785	77%	0.768	S	S	*	*			trans	69.9	155.1	142.2	-68.7	168.1	-174.7	177.1	1.8	118.9
897	H	40.2	Very low	40.4	Very low	163 Å²	163	132.8 Å²	132.8	76%	0.755	77%	0.766	S	S	*	*			cis	-157.3	149.1	-2.9	-114.9	-36	0	0	0	112.3
898	T	39.3	Very low	40.1	Very low	104 Å²	104	136 Å²	136	64%	0.638	77%	0.774	S	S	*	*			trans	24.5	151	141.2	56.7	0	0	0	0	122.1
899	T	41.6	Very low	39.5	Very low	132 Å²	132	138.6 Å²	138.6	81%	0.81	78%	0.783	S	S	*	*			cis	-166.8	163.2	43.5	-28.1	0	0	0	0	114.2
900	T	34.8	Very low	39.1	Very low	120 Å²	120	142.2 Å²	142.2	74%	0.736	78%	0.783	S	S	*	*			trans	-84.7	146.8	-177.8	-41.3	0	0	0	0	116.2
901	K	42.9	Very low	38.9	Very low	199 Å²	199	145.1 Å²	145.1	87%	0.865	79%	0.788	S	S	*	*			trans	171.4	132.7	145.5	-93.3	155	-175	-178.5	0	107.4
902	Q	33.9	Very low	38.5	Very low	173 Å²	173	147 Å²	147	81%	0.808	79%	0.787	S	S	*	*			cis	72.6	91.9	26.9	-161.8	-174.7	7.3	0	0	116.1
903	T	43.6	Very low	38.4	Very low	139 Å²	139	149 Å²	149	85%	0.853	79%	0.789	S	S	*	*			trans	-166.8	143.3	142.4	24.5	0	0	0	0	109.5
904	D	35.6	Very low	37.5	Very low	150 Å²	150	151.6 Å²	151.6	80%	0.802	79%	0.789	S	S	*	*			trans	-72.4	152.1	173.3	-51.6	-92.4	0	0	0	112.8
905	C	35	Very low	37.1	Very low	112 Å²	112	152 Å²	152	76%	0.757	79%	0.785	S	S	*	*				177.5	125	123.2	-92.4	0	0	0	0	112.5
906	N	34.2	Very low	36.8	Very low	163 Å²	163	152.4 Å²	152.4	87%	0.872	79%	0.788	S	S	*	*			trans	31	108.8	139.5	-56.4	-21.7	0	0	0	119.8
907	G	36.9	Very low	36.4	Very low	73 Å²	73	149.7 Å²	149.7	75%	0.753	79%	0.788	S	S	*	*			trans	136.9	71.5	145.6	0	0	0	0	0	117.8
908	L	36.9	Very low	36.1	Very low	180 Å²	180	148.9 Å²	148.9	94%	0.942	79%	0.789	S	S	*	*	S	Bend	trans	-170.8	38.9	147.1	-107.1	162.5	0	0	0	113.9
909	M	30.2	Very low	35.8	Very low	195 Å²	195	148.3 Å²	148.3	96%	0.961	80%	0.795	S	S	*	*			trans	-117.6	56.1	170.2	-167.3	178.8	-79.1	0	0	111.1
910	E	33.5	Very low	35.5	Very low	143 Å²	143	147.3 Å²	147.3	67%	0.668	79%	0.794	S	S	*	*			trans	-140.8	82.8	171.5	-163.7	175.3	-176.4	0	0	112.6	Y912	E910-Y912 HydrophobicContact CG-CD2 4.4Å; E910-Y912 HydrophobicContact CG-CE2 3.77Å; E910-Y912 WeakPolarHBondContact OE1-CE2 3.31Å; E910-Y912 PolarHBondContact OE1-OH 3.08Å
911	K	40.9	Very low	35.6	Very low	207 Å²	207	146.2 Å²	146.2	90%	0.9	79%	0.791	S	S	*	*	S	Bend	trans	-144.2	68.7	145.8	-123.2	172.7	-172.7	177.9	0	112.9
912	Y	36.4	Very low	35.4	Very low	183 Å²	183	146.1 Å²	146.1	72%	0.718	79%	0.79	S	S	*	*			trans	55.8	89.7	151.5	-74	-90	0	0	0	119	E910	E910-Y912 HydrophobicContact CG-CD2 4.4Å; E910-Y912 HydrophobicContact CG-CE2 3.77Å; E910-Y912 WeakPolarHBondContact OE1-CE2 3.31Å; E910-Y912 PolarHBondContact OE1-OH 3.08Å
913	L	35.7	Very low	35.4	Very low	146 Å²	146	142.8 Å²	142.8	76%	0.764	79%	0.786	S	S	*	*			trans	-53	159.3	137.3	-84.6	165	0	0	0	112.3
914	K	35	Very low	35.4	Very low	171 Å²	171	142.2 Å²	142.2	74%	0.743	79%	0.785	S	S	*	*			trans	79.3	125.1	142.4	-85.6	173.8	180	178.5	0	121.3
915	L	33.6	Very low	35.5	Very low	150 Å²	150	140.8 Å²	140.8	79%	0.785	78%	0.781	S	S	*	*			trans	96.6	120	131.7	-71	166.2	0	0	0	121.5
916	S	32.4	Very low	35.5	Very low	90 Å²	90	141.4 Å²	141.4	63%	0.629	79%	0.787	S	S	*	*			trans	71.4	117.4	131.5	66.7	0	0	0	0	122.4
917	L	32.9	Very low	35.8	Very low	151 Å²	151	139.3 Å²	139.3	79%	0.791	78%	0.78	S	S	*	*			trans	77.7	138.8	130.6	-68	170.1	0	0	0	121.1
918	N	32.5	Very low	36.2	Very low	145 Å²	145	142.5 Å²	142.5	78%	0.775	79%	0.785	S	S	*	*			trans	81	127.6	150.2	-60.7	-19.3	0	0	0	121.6
919	A	34.4	Very low	36.1	Very low	92 Å²	92	138.1 Å²	138.1	76%	0.76	77%	0.768	S	S	*	*			trans	63.8	112.7	139.9	0	0	0	0	0	121.6
920	S	33.6	Very low	36.5	Very low	112 Å²	112	136.1 Å²	136.1	78%	0.783	76%	0.762	S	S	*	*				27.5	117.5	126	-162.5	0	0	0	0	117.7
921	S	37.4	Very low	36.7	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	77%	0.765	S	S	*	*				172.9	158	76.8	50.6	0	0	0	0	114.2
922	K	39.5	Very low	36.5	Very low	197 Å²	197	133.5 Å²	133.5	86%	0.857	76%	0.762	S	S	*	*			trans	54.2	105.4	148.4	-67.7	169.6	-178.3	178.3	0	121.4
923	S	33	Very low	36.5	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	76%	0.757	S	S	*	*				44.7	123.3	116.7	-174.8	0	0	0	0	121.6
924	P	44	Very low	36.6	Very low	127 Å²	127	128.4 Å²	128.4	83%	0.825	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-95.3	134.1	149.4	34.6	-27.5	0	0	0	112.7
925	V	37.9	Very low	36.5	Very low	119 Å²	119	128.5 Å²	128.5	72%	0.721	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-69.1	146.2	-177.2	169.5	0	0	0	0	113.4
926	S	34.7	Very low	36.6	Very low	125 Å²	125	125.1 Å²	125.1	87%	0.874	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-88.1	124	159.6	-54	0	0	0	0	111.2
927	T	40.1	Very low	36.8	Very low	119 Å²	119	129.7 Å²	129.7	73%	0.73	76%	0.764	S	S	*	*			trans	-128.7	130.7	166.8	-16	0	0	0	0	106.4
928	T	45.3	Very low	36.8	Very low	140 Å²	140	128.8 Å²	128.8	86%	0.859	76%	0.759	S	S	*	*				-156.7	145.5	86	-63.7	0	0	0	0	110.3
929	C	35.2	Very low	37.1	Very low	88 Å²	88	127.8 Å²	127.8	60%	0.595	76%	0.758	S	S	*	*			trans	-87.5	144.8	179.7	-168	0	0	0	0	111
930	N	39.7	Very low	37.2	Very low	154 Å²	154	130.6 Å²	130.6	82%	0.824	76%	0.76	S	S	*	*				-172.3	162.1	115.8	-90.4	-24.8	0	0	0	113.2
931	Q	35.7	Very low	37.4	Very low	159 Å²	159	128.2 Å²	128.2	74%	0.743	75%	0.753	S	S	*	*			trans	-93.3	177.6	-155.1	-61.1	164.2	-36.1	0	0	114.4
932	T	37.7	Very low	37.5	Very low	136 Å²	136	133.1 Å²	133.1	83%	0.834	76%	0.758	S	S	*	*			trans	84.7	144.4	162	73.4	0	0	0	0	117.5
933	A	36.2	Very low	37.6	Very low	73 Å²	73	132.6 Å²	132.6	60%	0.603	76%	0.758	S	S	*	*			cis	-172.3	156.1	-25	0	0	0	0	0	107.6
934	N	38.8	Very low	37.8	Very low	148 Å²	148	133 Å²	133	79%	0.791	76%	0.761	S	S	*	*			trans	65.8	161.7	166.4	-49.3	-14.3	0	0	0	115.2
935	E	32.7	Very low	38	Very low	173 Å²	173	133 Å²	133	81%	0.808	76%	0.761	S	S	*	*			cis	-159.7	179.4	-40.5	-115.3	-174.4	154.7	0	0	107.8
936	A	35.3	Very low	38	Very low	80 Å²	80	130.1 Å²	130.1	66%	0.661	76%	0.756	S	S	*	*			trans	44.5	106.9	149.4	0	0	0	0	0	119.8
937	K	35.4	Very low	38.4	Very low	185 Å²	185	129.6 Å²	129.6	80%	0.804	75%	0.752	S	S	*	*				98.1	119.7	75.1	-91.5	178.7	170.7	178.5	0	115.7
938	I	33.9	Very low	38.8	Very low	133 Å²	133	133.8 Å²	133.8	68%	0.682	76%	0.76	S	S	*	*			trans	74.3	158.9	136.9	-52.5	163.6	0	0	0	118
939	T	39.6	Very low	38.5	Very low	123 Å²	123	133.8 Å²	133.8	76%	0.755	75%	0.75	S	S	*	*			trans	83.7	154.1	171.7	72.8	0	0	0	0	117.3
940	N	34.6	Very low	38.8	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	76%	0.758	S	S	*	*			cis	-176.1	152.1	-46.2	-103.6	-4.6	0	0	0	108.2
941	G	37.9	Very low	38.7	Very low	63 Å²	63	140.1 Å²	140.1	65%	0.649	76%	0.755	S	S	*	*			trans	144.3	95	174.7	0	0	0	0	0	112.4
942	Y	40	Very low	38.8	Very low	200 Å²	200	138.1 Å²	138.1	78%	0.784	75%	0.749	S	S	*	*				55.9	125.4	79.1	-67	-77.7	0	0	0	112.7
943	H	42.8	Very low	38.8	Very low	185 Å²	185	140.9 Å²	140.9	86%	0.856	74%	0.744	S	S	*	*			cis	-144.6	178.9	47.4	-79.6	-92.6	0	0	0	116
944	S	37	Very low	38.9	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	75%	0.75	S	S	*	*			trans	-123.4	-170.3	-179.3	-131.8	0	0	0	0	110.2
945	P	47.6	Very low	38.8	Very low	127 Å²	127	143.8 Å²	143.8	83%	0.825	74%	0.742	S	S	*	*			cis	-119.3	-167.6	11	44.5	-30.8	0	0	0	113.4
946	G	38.4	Very low	39.2	Very low	58 Å²	58	142.4 Å²	142.4	60%	0.598	74%	0.74	S	S	*	*			cis	138.7	175.5	-10.4	0	0	0	0	0	115.3
947	S	43.4	Very low	39.1	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	74%	0.738	S	S	*	*			trans	78.3	142.5	-178.5	94.8	0	0	0	0	116
948	K	47.7	Very low	39.4	Very low	207 Å²	207	141 Å²	141	90%	0.9	74%	0.738	S	S	*	*			cis	-134.9	170.6	3.7	-71.2	-179.1	-178.2	168.9	0	112.6
949	E	38.4	Very low	39.5	Very low	139 Å²	139	143.7 Å²	143.7	65%	0.65	75%	0.748	S	S	*	*			trans	-131	143.4	-170.6	176	-127.5	159.6	0	0	111.7	R951	E949-R951 IonicContact OE1-NE 3.65Å
950	K	41.4	Very low	39.3	Very low	173 Å²	173	147.1 Å²	147.1	75%	0.752	75%	0.753	S	S	*	*			trans	167.3	126.7	143.6	-92.5	156.3	-171	178.2	0	111.2
951	R	37.8	Very low	39.3	Very low	202 Å²	202	145.2 Å²	145.2	76%	0.762	75%	0.751	S	S	*	*				72.2	141.3	78.1	-76.9	-164.3	-175.2	-147.4	-0.6	114.1	E949	E949-R951 IonicContact OE1-NE 3.65Å
952	L	37.5	Very low	39.3	Very low	118 Å²	118	147.6 Å²	147.6	62%	0.618	76%	0.758	S	S	*	*			cis	-176.2	171.6	-14.4	-150.1	176.6	0	0	0	107.1
953	W	38.4	Very low	39.2	Very low	193 Å²	193	142.3 Å²	142.3	73%	0.731	75%	0.75	S	S	*	*			trans	97.4	117.4	160.7	-58.4	86.2	0	0	0	121.2
954	F	37.7	Very low	39	Very low	168 Å²	168	142.4 Å²	142.4	74%	0.737	75%	0.751	S	S	*	*			trans	61.6	156.1	131.6	-77.8	-122.1	0	0	0	121.4
955	D	38.2	Very low	39.2	Very low	115 Å²	115	141.4 Å²	141.4	62%	0.615	74%	0.744	S	S	*	*			cis	-172.4	162.8	-27.6	-168.7	16.1	0	0	0	109.5
956	N	39.5	Very low	38.8	Very low	144 Å²	144	141.6 Å²	141.6	77%	0.77	74%	0.738	S	S	*	*			trans	65.3	151.6	177.4	-52.2	-78.3	0	0	0	116.3
957	G	34.7	Very low	38.9	Very low	60 Å²	60	145.4 Å²	145.4	62%	0.619	74%	0.743	S	S	*	*			cis	142.1	111.5	-8.6	0	0	0	0	0	112.9
958	H	41.4	Very low	38.8	Very low	175 Å²	175	146.8 Å²	146.8	81%	0.81	74%	0.74	S	S	*	*			trans	165.9	112.4	144.1	-95.9	-66.3	0	0	0	111.6	F960	H958-F960 AromaticContact ND1-CD2 3.93Å
959	H	36.1	Very low	38.4	Very low	190 Å²	190	141.3 Å²	141.3	88%	0.88	73%	0.728	S	S	*	*			trans	-89.6	139	144.7	-88.9	-92.9	0	0	0	107.8
960	F	35.8	Very low	38.4	Very low	195 Å²	195	142.2 Å²	142.2	86%	0.855	74%	0.736	S	S	*	*			trans	-148.1	136.9	151.5	-109	-76.2	0	0	0	109.5	H958	H958-F960 AromaticContact ND1-CD2 3.93Å
961	S	33	Very low	38.3	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	73%	0.733	S	S	*	*			trans	-115.9	141.4	-179.6	51.3	0	0	0	0	110
962	S	38.1	Very low	38.6	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	73%	0.726	S	S	*	*			trans	-162.8	150.7	160.6	-154.7	0	0	0	0	112.2
963	S	38.8	Very low	38.8	Very low	88 Å²	88	137.2 Å²	137.2	62%	0.615	73%	0.729	S	S	*	*			trans	47.7	126.5	154.6	57	0	0	0	0	119.5
964	E	39.1	Very low	39	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	73%	0.734	S	S	*	*				62.1	131	61.6	-61.9	178.1	141.1	0	0	112.5
965	S	40.2	Very low	39.4	Very low	91 Å²	91	135.5 Å²	135.5	64%	0.636	74%	0.737	S	S	*	*			cis	-159.5	179.5	2.6	52.3	0	0	0	0	112.6
966	D	39.6	Very low	39.4	Very low	131 Å²	131	138.9 Å²	138.9	70%	0.701	75%	0.746	S	S	*	*			trans	84.3	129.4	141.4	-71.7	-41.4	0	0	0	124.3
967	I	40.1	Very low	39.4	Very low	139 Å²	139	136.7 Å²	136.7	71%	0.713	74%	0.741	S	S	*	*				94.3	109.8	128.5	-78.4	171.7	0	0	0	121.9
968	I	40.4	Very low	39.6	Very low	143 Å²	143	141.2 Å²	141.2	73%	0.733	75%	0.746	S	S	*	*			trans	84.6	99.6	139	-71.4	-179.8	0	0	0	121.5
969	S	39.7	Very low	39.4	Very low	92 Å²	92	142.3 Å²	142.3	64%	0.643	75%	0.748	S	S	*	*				74.9	135.9	117.1	-61.5	0	0	0	0	125.3
970	L	39.4	Very low	39.6	Very low	159 Å²	159	139.3 Å²	139.3	83%	0.832	74%	0.744	S	S	*	*			trans	66.9	159	142.6	-64.7	165.2	0	0	0	118.4
971	H	39.5	Very low	39.7	Very low	149 Å²	149	136.2 Å²	136.2	69%	0.69	75%	0.746	S	S	*	*			cis	-166.8	137.1	-30.8	-173.7	-96.6	0	0	0	109.2
972	N	42.8	Very low	39.9	Very low	112 Å²	112	134.4 Å²	134.4	60%	0.599	75%	0.745	S	S	*	*			trans	62.2	132	164.8	-88.1	38	0	0	0	124
973	D	42	Very low	39.9	Very low	127 Å²	127	136.4 Å²	136.4	68%	0.679	75%	0.747	S	S	*	*				91.8	132.9	129.2	-71.7	-28.2	0	0	0	123.9
974	K	41.9	Very low	40	Very low	195 Å²	195	142 Å²	142	85%	0.848	76%	0.76	S	S	*	*			trans	74	69.7	157.1	-65.5	162	-174.1	167	0	118.9
975	T	47.4	Very low	40.1	Very low	130 Å²	130	139 Å²	139	80%	0.798	75%	0.751	S	S	*	*			trans	-120.9	119.5	144.4	46.5	0	0	0	0	111	C977	T975-C977 PolarHBondContact O-N 2.83Å
976	K	37.2	Very low	40.3	Very low	185 Å²	185	144.3 Å²	144.3	80%	0.804	76%	0.762	S	S	*	*			trans	-93	80.1	-176.5	-173.5	-173.6	176	-176.2	0	110.7
977	C	41.2	Very low	40.5	Very low	98 Å²	98	144.8 Å²	144.8	66%	0.662	77%	0.765	S	S	*	*			trans	-86.4	112	178.9	-64	0	0	0	0	111.5	T975 F979	T975-C977 PolarHBondContact O-N 2.83Å; C977-F979 HydrophobicContact CB-CE2 4.44Å; C977-F979 PolarHBondContact O-N 3.38Å
978	H	38.6	Very low	40.7	Very low	156 Å²	156	146.4 Å²	146.4	72%	0.722	77%	0.769	S	S	*	*			trans	-76.6	113.4	164.9	-82.7	-99.6	0	0	0	109.3
979	F	36.9	Very low	40.7	Very low	197 Å²	197	149.5 Å²	149.5	86%	0.864	78%	0.778	S	S	*	*			trans	-87	112	164.1	-83.2	-88.6	0	0	0	109.5	C977	C977-F979 HydrophobicContact CB-CE2 4.44Å; C977-F979 PolarHBondContact O-N 3.38Å
980	T	40.2	Very low	40.9	Very low	128 Å²	128	151.4 Å²	151.4	79%	0.785	78%	0.78	S	S	*	*			trans	-102.8	108.3	166.5	48.4	0	0	0	0	109.3
981	S	37.7	Very low	41.3	Very low	129 Å²	129	149.4 Å²	149.4	90%	0.902	78%	0.776	S	S	*	*			trans	-64.3	131.8	172.6	-54.7	0	0	0	0	110.6
982	G	36.3	Very low	41.4	Very low	73 Å²	73	148.9 Å²	148.9	75%	0.753	78%	0.778	S	S	*	*			trans	-174.3	33.7	-171.6	0	0	0	0	0	117.4
983	N	38.7	Very low	41.5	Very low	155 Å²	155	151.1 Å²	151.1	83%	0.829	79%	0.79	S	S	*	*			trans	-115.7	115.3	168.1	-91.6	-0.3	0	0	0	110.1
984	F	41.2	Very low	41.6	Very low	205 Å²	205	152.4 Å²	152.4	90%	0.899	80%	0.795	S	S	*	*			trans	-139.8	110.5	164.1	-112.9	-75.4	0	0	0	108.4
985	N	41.1	Very low	41.8	Very low	126 Å²	126	150.7 Å²	150.7	67%	0.674	80%	0.796	S	S	*	*			trans	-68.5	132.9	174.1	-63.1	13.3	0	0	0	109.5
986	K	45.1	Very low	41.7	Very low	202 Å²	202	150.9 Å²	150.9	88%	0.878	80%	0.796	S	S	*	*			trans	-141.8	104.5	147.1	-78.7	-159.5	174.2	-175	0	107.9
987	D	43.6	Very low	42.2	Very low	141 Å²	141	149.2 Å²	149.2	75%	0.754	80%	0.796	S	S	*	*			trans	-73.6	170.7	178.9	-58.3	-68.2	0	0	0	111.9
988	E	43.1	Very low	42.3	Very low	173 Å²	173	150 Å²	150	81%	0.808	80%	0.802	S	S	*	*			trans	-57.6	147.4	-174.6	-54.9	163.5	124.4	0	0	113.3
989	F	40.7	Very low	42.7	Very low	207 Å²	207	146.1 Å²	146.1	91%	0.908	81%	0.805	S	S	*	*				-155.9	122.2	128.5	-112.5	-71.7	0	0	0	110.6
990	I	43.6	Very low	42.9	Very low	133 Å²	133	141.5 Å²	141.5	68%	0.682	80%	0.797	S	S	*	*			trans	-102.7	140.7	171	-65.1	167.9	0	0	0	107.4
991	P	48.2	Very low	43.4	Very low	116 Å²	116	141.8 Å²	141.8	75%	0.753	79%	0.794	S	S	*	*			trans	-117.5	129.4	134.6	-4	23.9	0	0	0	110.5
992	N	41.4	Very low	43.6	Very low	138 Å²	138	144.8 Å²	144.8	74%	0.738	79%	0.787	S	S	*	*			trans	-82.3	136.4	147.9	-56.8	-63.7	0	0	0	105.7
993	D	46.1	Very low	44.4	Very low	159 Å²	159	147.9 Å²	147.9	85%	0.85	79%	0.785	S	S	*	*			trans	-146.9	140.4	141.1	-92.2	-44.6	0	0	0	108.1
994	I	44.5	Very low	44.5	Very low	154 Å²	154	155.5 Å²	155.5	79%	0.79	80%	0.802	S	S	*	*			trans	-118	95.5	178.4	-60.3	173.3	0	0	0	105.8	V996	I994-V996 HydrophobicContact CG2-CG2 4.38Å
995	D	45.3	Very low	44.6	Very low	160 Å²	160	153.1 Å²	153.1	86%	0.856	80%	0.797	S	S	*	*			trans	-92.9	123.5	166.7	-102.4	-38.9	0	0	0	109.9
996	V	44.5	Very low	44.8	Very low	133 Å²	133	154.5 Å²	154.5	81%	0.806	80%	0.804	S	S	*	*			trans	-99.9	99	168.7	176.2	0	0	0	0	106.1	I994	I994-V996 HydrophobicContact CG2-CG2 4.38Å
997	D	47.5	Very low	44.8	Very low	150 Å²	150	151.8 Å²	151.8	80%	0.802	80%	0.8	S	S	*	*			trans	-111.2	130.1	171	-159.4	1.1	0	0	0	111.3	G999	D997-G999 PolarHBondContact O-N 3.37Å
998	S	43.4	Very low	44.9	Very low	114 Å²	114	152.5 Å²	152.5	80%	0.797	80%	0.802	S	S	*	*			trans	-99.9	84	-173.2	54.6	0	0	0	0	110.1
999	G	47	Very low	45	Very low	75 Å²	75	151.2 Å²	151.2	77%	0.773	80%	0.802	S	S	*	*			trans	-106.5	99	178.2	0	0	0	0	0	113.1	D997	D997-G999 PolarHBondContact O-N 3.37Å
1000	S	42.3	Very low	45.3	Very low	101 Å²	101	147.5 Å²	147.5	71%	0.706	80%	0.795	S	S	*	*			trans	-79.2	124	161.1	54	0	0	0	0	109.8
1001	D	49.2	Very low	45.4	Very low	133 Å²	133	148.5 Å²	148.5	71%	0.711	80%	0.803	S	S	*	*				170.4	137.7	112.9	-88.3	-25	0	0	0	115
1002	Y	42.7	Very low	45.2	Very low	192 Å²	192	151 Å²	151	75%	0.753	81%	0.807	S	S	*	*			trans	53	110.2	146.1	-75.7	-108.9	0	0	0	122.3
1003	I	52.9	Low	45.5	Very low	138 Å²	138	152.1 Å²	152.1	71%	0.708	81%	0.812	S	S	*	*				62.4	97.5	127.9	-57.4	-176.9	0	0	0	117.8
1004	W	40.4	Very low	45.4	Very low	316 Å²	316	151.5 Å²	151.5	100%	1.197	81%	0.809	S	S	*	*				-152.3	0	91.3	-136.3	72.7	0	0	0	111

Retrieved 1,004 of 1,004 residues in 163.1 ms (Link to these results)

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