A0A061HV54_CRIGR Loading...

Short transient receptor potential channel 5

AlphaFold DB , UniProt , Accession A0A061HV54, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Trpc5, Length 974 aa.

						>A0A061HV54_CRIGR|A0A061HV54|Trpc5
MAQLYYKKVNYSPYRDRIPLQIVRAETELSAEEKAFLNAVEKGDYATVKQALQEAEIYYNVNINCMDPLGRSALLIAIENENLEIMELLLNHSVYVGDALLYAIRKEVVGAVELLLSYRKPSGEKQVPTLMMDTQFSEFTPDITPIMLAAHTNNYEIIKLLVQKRVTIPRPHQIRCNCVECVSSSEVDSLRHSRSRLNIYKALASPSLIALSSEDPILTAFRLGWELKELSKVENEFKAEYEELSQQCKLFAKDLLDQARSSRELEIILNHRDDHSEELDPQKYHDLAKLKVAIKYHQKEFVAQPNCQQLLATLWYDGFPGWRRKHWVVKLLTCMTIGFLFPMLSIAYLISPRSNLGLFIKKPFIKFICHTASYLTFLFMLLLASQHIVRTDLHVQGPPPTVVEWMILPWVLGFIWGEIKEMWDGGFTEYIHDWWNLMDFAMNSLYLATISLKIVAYVKYNGSRPREEWEMWHPTLIAEALFAISNILSSLRLISLFTANSHLGPLQISLGRMLLDILKFLFIYCLVLLAFANGLNQLYFYYETRAIDEPNNCKGIRCEKQNNAFSTLFETLQSLFWSVFGLLNLYVTNVKARHEFTEFVGATMFGTYNVISLVVLLNMLIAMMNNSYQLIADHADIEWKFARTKLWMSYFDEGGTLPPPFNIIPSPKSFLYLGNWFNKTFCPKRDPDGRRRRHNLRSFTERHADSLIQNQHYQEVIRNLVKRYVAAMIRNSKTNEGLTEENFKELKQDISSFRYEVLDLLGNRKHPRRSFSTSSAEFSQRDDTNDGSGGARAKSKSVSFNLGCKKKACHGAPLIRTMPRAGDAQGKSKAESSSKRSFMGPSFKKLGLLFSKFNGHNSEPTSEPMYTISDGIAQQHYMWQDIRYSQMERGKAEACSQSEMNLSEVELGEIRGAAGSSEGALACSSSLHGASGICSSNSKLLESSEDVFETWGEACDLLMHKWGDGQEGQVTTRL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.5	Very low	39	Very low	250 Å²	250	185.1 Å²	185.1	100%	1.232	88%	0.879	S	S	*	*				0	81.8	0	-63.2	176.4	-178.3	0	0	110.3
2	A	30.9	Very low	40.1	Very low	102 Å²	102	175.9 Å²	175.9	84%	0.843	85%	0.849	S	S	*	*			trans	-150.9	3.1	-176	0	0	0	0	0	117.4
3	Q	33.1	Very low	41.4	Very low	194 Å²	194	171.1 Å²	171.1	91%	0.907	84%	0.841	S	S	*	*	S	Bend	trans	-125	3.1	-173.6	-78.8	-174.4	-21.8	0	0	115.9
4	L	42.1	Very low	42.2	Very low	171 Å²	171	173.1 Å²	173.1	90%	0.895	84%	0.837	S	S	*	*	S	Bend	trans	-96.3	-4.5	-177.9	-74.4	168.5	0	0	0	115
5	Y	40.3	Very low	43	Very low	219 Å²	219	173.7 Å²	173.7	86%	0.859	83%	0.827	S	S	*	*	S	Bend	trans	-92.2	2.7	-167.3	-99.3	-79.3	0	0	0	117.3
6	Y	41.4	Very low	44.3	Very low	231 Å²	231	172.1 Å²	172.1	91%	0.906	82%	0.824	S	S	*	*			trans	-128.1	84.6	175.8	-89.1	-82.2	0	0	0	113
7	K	39.4	Very low	46	Very low	200 Å²	200	174.9 Å²	174.9	87%	0.87	82%	0.824	S	S	*	*			trans	-124.8	112.5	154.9	-143.9	170.7	-171.8	175.5	0	108.8	V9	K7-V9 PolarHBondContact O-N 3.4Å
8	K	39.1	Very low	47.8	Very low	189 Å²	189	173.3 Å²	173.3	82%	0.822	82%	0.821	S	S	*	*			trans	-51.6	131.1	-175.3	-90.1	178.5	169.6	177.9	0	111.7	N10	K8-N10 PolarHBondContact O-N 3.41Å; K8-N10 VanDerWaalsContact O-N 3.16Å
9	V	43.5	Very low	49.5	Very low	119 Å²	119	168.7 Å²	168.7	72%	0.721	81%	0.806	S	S	*	*			trans	-72.8	101.2	165.5	-179.8	0	0	0	0	108.2	K7 Y11	K7-V9 PolarHBondContact O-N 3.4Å; V9-Y11 HydrophobicContact CG1-CD2 4.2Å; V9-Y11 HydrophobicContact CG1-CE2 4.21Å; V9-Y11 PolarHBondContact O-N 3.45Å
10	N	39.3	Very low	51	Low	140 Å²	140	168.8 Å²	168.8	75%	0.749	81%	0.811	S	S	*	*			trans	-79.6	112	163.9	-80	-2.1	0	0	0	108.2	K8 S12	K8-N10 PolarHBondContact O-N 3.41Å; K8-N10 VanDerWaalsContact O-N 3.16Å; N10-S12 PolarHBondContact O-N 3.16Å
11	Y	44.2	Very low	52.5	Low	221 Å²	221	168.6 Å²	168.6	87%	0.867	81%	0.809	S	S	*	*			trans	-65.9	113.9	168.6	-84	-100.5	0	0	0	109.7	V9	V9-Y11 HydrophobicContact CG1-CD2 4.2Å; V9-Y11 HydrophobicContact CG1-CE2 4.21Å; V9-Y11 PolarHBondContact O-N 3.45Å
12	S	52.2	Low	54.5	Low	75 Å²	75	163.4 Å²	163.4	52%	0.524	79%	0.785	S	S	.	*			trans	-117.6	118.1	161.1	63.5	0	0	0	0	108.8	N10	N10-S12 PolarHBondContact O-N 3.16Å
13	P	57.3	Low	56.7	Low	113 Å²	113	165 Å²	165	73%	0.734	78%	0.784	S	S	*	*	S	Bend	trans	-65.5	152.3	163.1	31.4	-32.7	0	0	0	108.6
14	Y	52.3	Low	58.7	Low	200 Å²	200	165.1 Å²	165.1	78%	0.784	78%	0.776	S	S	*	*			trans	69.5	88.4	-168.7	-62.9	-88.7	0	0	0	115.5
15	R	54.6	Low	60	Low	182 Å²	182	161.5 Å²	161.5	69%	0.687	77%	0.77	S	S	*	*			trans	-113.8	96.6	144.2	-78	-165	176.7	-158.5	0.7	108.8	R17	R15-R17 PolarHBondContact O-N 3.24Å
16	D	64.1	Low	61.3	Low	148 Å²	148	157.1 Å²	157.1	79%	0.791	76%	0.758	S	S	*	*	S	Bend	trans	-68.1	4.2	173.3	-69.8	-8.9	0	0	0	113.3
17	R	72.3	Confident	62.7	Low	219 Å²	219	152.6 Å²	152.6	83%	0.826	75%	0.754	S	S	*	*	S	Bend	trans	-139.8	128.5	177	-59.7	-172.6	-174.7	-163.9	2.3	110.6	R15	R15-R17 PolarHBondContact O-N 3.24Å
18	I	79.3	Confident	64.2	Low	147 Å²	147	151.9 Å²	151.9	75%	0.754	75%	0.754	S	S	*	*			trans	-67.9	126.9	170	-59.8	172.5	0	0	0	107.9	L20	I18-L20 HydrophobicContact CG2-CD2 4.44Å; I18-L20 PolarHBondContact O-N 3.36Å; I18-L20 VanDerWaalsContact O-N 3.16Å
19	P	79.5	Confident	66.3	Low	85 Å²	85	143.9 Å²	143.9	55%	0.552	72%	0.72	S	S	*	*			trans	-73.2	105.8	175.9	30.5	-34	0	0	0	110	Q21	P19-Q21 PolarHBondContact O-N 2.99Å
20	L	80.6	Confident	68.3	Low	171 Å²	171	140.7 Å²	140.7	90%	0.895	70%	0.703	S	S	*	*			trans	-82.8	107.6	170.4	-60.9	178.8	0	0	0	108.9	I18	I18-L20 HydrophobicContact CG2-CD2 4.44Å; I18-L20 PolarHBondContact O-N 3.36Å; I18-L20 VanDerWaalsContact O-N 3.16Å
21	Q	82.7	Confident	70.5	Confident	165 Å²	165	137.8 Å²	137.8	77%	0.771	70%	0.699	S	S	*	*			trans	-117.5	145.7	171.2	179.2	176	-13.9	0	0	108.7	P19 V23	P19-Q21 PolarHBondContact O-N 2.99Å; Q21-V23 WeakPolarHBondContact O-CG2 3.27Å; Q21-V23 PolarHBondContact O-N 3.18Å
22	I	77.3	Confident	72.4	Confident	140 Å²	140	132.1 Å²	132.1	72%	0.718	68%	0.68	S	S	*	*			trans	-66.6	105.9	169.9	-60	174.3	0	0	0	107.6	R24	I22-R24 VanDerWaalsContact CG2-O 3.28Å; I22-R24 WeakPolarHBondContact CG2-O 3.46Å
23	V	75.8	Confident	74	Confident	137 Å²	137	130 Å²	130	83%	0.83	66%	0.662	S	S	*	*	S	Bend	trans	-75.3	-32.6	-173.7	-178.6	0	0	0	0	111.9	Q21	Q21-V23 WeakPolarHBondContact O-CG2 3.27Å; Q21-V23 PolarHBondContact O-N 3.18Å
24	R	76.4	Confident	75.5	Confident	196 Å²	196	129.7 Å²	129.7	74%	0.74	65%	0.649	S	S	*	*	S	Bend	trans	-102.4	95.5	175.9	-61.5	179.9	-173.3	129.1	0.9	108.2	I22	I22-R24 VanDerWaalsContact CG2-O 3.28Å; I22-R24 WeakPolarHBondContact CG2-O 3.46Å
25	A	67.6	Low	77.2	Confident	94 Å²	94	123.1 Å²	123.1	78%	0.777	64%	0.636	S	S	*	*			trans	-83.8	113.6	176.2	0	0	0	0	0	109.6
26	E	68.8	Low	78.9	Confident	128 Å²	128	114.9 Å²	114.9	60%	0.598	61%	0.605	S	S	*	*			trans	-85.4	170.8	171.5	-67.4	175.6	-176.3	0	0	110.8	E28 P68	E26-E28 PolarHBondContact O-N 3.06Å; E26-P68 WeakPolarHBondContact OE2-CA 3.37Å
27	T	70.9	Confident	80.1	Confident	136 Å²	136	108.3 Å²	108.3	83%	0.834	57%	0.57	S	S	*	*			trans	-64.5	114.8	175.4	41.5	0	0	0	0	111	L29	T27-L29 PolarHBondContact O-N 2.77Å
28	E	71	Confident	81	Confident	185 Å²	185	101 Å²	101	86%	0.864	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-68	118	177.8	-65.9	-167.7	164.5	0	0	111.6	E26	E26-E28 PolarHBondContact O-N 3.06Å
29	L	83.2	Confident	81.5	Confident	21 Å²	21	94.5 Å²	94.5	11%	0.11	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-63.4	146.2	176.5	-64.7	78.1	0	0	0	112.2	T27 E33 K34 L37 M66 P68	T27-L29 PolarHBondContact O-N 2.77Å; L29-E33 HydrophobicContact CB-CB 4.33Å; L29-E33 HydrophobicContact CD2-CB 4.45Å; L29-K34 HydrophobicContact CB-CD 4.38Å; L29-K34 HydrophobicContact CB-CG 3.93Å; L29-K34 HydrophobicContact CD2-CG 4.46Å; L29-K34 WeakPolarHBondContact O-CE 3.39Å; L29-K34 PolarHBondContact O-NZ 3.38Å; L29-L37 HydrophobicContact CD2-CD1 3.43Å; L29-L37 VanDerWaalsContact CD2-CD1 3.43Å; L29-M66 WeakPolarHBondContact CD1-O 3.15Å; L29-M66 WeakPolarHBondContact CD2-O 3.34Å; L29-P68 HydrophobicContact CD1-CG 3.99Å
30	S	85.9	Confident	82	Confident	51 Å²	51	90.5 Å²	90.5	36%	0.357	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-58	155.5	169.9	179.4	0	0	0	0	112.1	E32 E33 K34	S30-E32 PolarHBondContact O-N 3.41Å; S30-E32 PolarHBondContact OG-N 3.01Å; S30-E33 VanDerWaalsContact CB-OE2 3.27Å; S30-E33 WeakPolarHBondContact CB-OE2 3.35Å; S30-E33 PolarHBondContact N-OE2 2.9Å; S30-E33 PolarHBondContact O-N 3.36Å; S30-K34 WeakPolarHBondContact O-CB 3.42Å; S30-K34 WeakPolarHBondContact O-CG 3.49Å; S30-K34 PolarHBondContact O-N 3.37Å
31	A	84.8	Confident	82.4	Confident	80 Å²	80	86.9 Å²	86.9	66%	0.661	47%	0.468	S	S	*	.	H	α-helix	trans	-62.5	-31.4	172.9	0	0	0	0	0	112.3	A35	A31-A35 WeakPolarHBondContact O-CB 3.48Å; A31-A35 PolarHBondContact O-N 3.17Å; A31-A35 VanDerWaalsContact O-N 3.09Å
32	E	84	Confident	82.6	Confident	101 Å²	101	83.2 Å²	83.2	47%	0.472	45%	0.45	S	S	.	.	H	α-helix	trans	-74.8	-41.5	177.7	-60.5	-173.2	178.6	0	0	111.3	S30 A35 F36 N60 V61	S30-E32 PolarHBondContact O-N 3.41Å; S30-E32 PolarHBondContact OG-N 3.01Å; E32-A35 WeakPolarHBondContact O-CB 3.28Å; E32-A35 PolarHBondContact O-N 3.16Å; E32-A35 VanDerWaalsContact O-N 3.15Å; E32-F36 PolarHBondContact O-N 3.05Å; E32-N60 PolarHBondContact OE2-ND2 2.69Å; E32-V61 HydrophobicContact CB-CG2 3.87Å
33	E	86.4	Confident	83.1	Confident	32 Å²	32	76.7 Å²	76.7	15%	0.15	42%	0.416	C	S	.	.	H	α-helix	trans	-62.9	-42.8	173.1	-68.1	169.5	151.2	0	0	111.8	L29 S30 A35 F36 L37 V61 N62 C65	L29-E33 HydrophobicContact CB-CB 4.33Å; L29-E33 HydrophobicContact CD2-CB 4.45Å; S30-E33 VanDerWaalsContact CB-OE2 3.27Å; S30-E33 WeakPolarHBondContact CB-OE2 3.35Å; S30-E33 PolarHBondContact N-OE2 2.9Å; S30-E33 PolarHBondContact O-N 3.36Å; E33-A35 VanDerWaalsContact C-N 3.28Å; E33-A35 PolarHBondContact O-N 3.19Å; E33-F36 WeakPolarHBondContact O-CB 3.37Å; E33-F36 PolarHBondContact O-N 3Å; E33-L37 WeakPolarHBondContact O-CG 3.44Å; E33-L37 PolarHBondContact O-N 3.27Å; E33-V61 HydrophobicContact CG-CG1 4.04Å; E33-N62 WeakPolarHBondContact OE1-CB 3.42Å; E33-N62 PolarHBondContact OE1-N 2.88Å; E33-C65 HydrophobicContact CB-CB 4.43Å; E33-C65 HydrophobicContact CG-CB 4.28Å
34	K	87.8	Confident	83.8	Confident	106 Å²	106	71 Å²	71	46%	0.461	38%	0.381	S	S	.	.	H	α-helix	trans	-61	-35.6	172.5	-76.5	165.1	172.8	144.1	0	112.3	L29 S30 N38	L29-K34 HydrophobicContact CB-CD 4.38Å; L29-K34 HydrophobicContact CB-CG 3.93Å; L29-K34 HydrophobicContact CD2-CG 4.46Å; L29-K34 WeakPolarHBondContact O-CE 3.39Å; L29-K34 PolarHBondContact O-NZ 3.38Å; S30-K34 WeakPolarHBondContact O-CB 3.42Å; S30-K34 WeakPolarHBondContact O-CG 3.49Å; S30-K34 PolarHBondContact O-N 3.37Å; K34-N38 WeakPolarHBondContact O-CB 3.39Å; K34-N38 PolarHBondContact O-N 3.46Å
35	A	88.6	Confident	84.4	Confident	61 Å²	61	65.7 Å²	65.7	50%	0.504	36%	0.362	S	S	.	.	H	α-helix	trans	-70.7	-40.7	175.5	0	0	0	0	0	111.8	A31 E32 E33 N38 A39	A31-A35 WeakPolarHBondContact O-CB 3.48Å; A31-A35 PolarHBondContact O-N 3.17Å; A31-A35 VanDerWaalsContact O-N 3.09Å; E32-A35 WeakPolarHBondContact O-CB 3.28Å; E32-A35 PolarHBondContact O-N 3.16Å; E32-A35 VanDerWaalsContact O-N 3.15Å; E33-A35 VanDerWaalsContact C-N 3.28Å; E33-A35 PolarHBondContact O-N 3.19Å; A35-N38 PolarHBondContact O-N 3.24Å; A35-A39 PolarHBondContact O-N 3.48Å
36	F	90.1	Very high	85.3	Confident	9 Å²	9	62.3 Å²	62.3	4%	0.039	33%	0.334	C	S	.	.	H	α-helix	trans	-60.7	-54.9	175	171.5	-112.6	0	0	0	112.2	E32 E33 N38 A39 V40 V48 A51 L52 V61 I63 A73 L89	E32-F36 PolarHBondContact O-N 3.05Å; E33-F36 WeakPolarHBondContact O-CB 3.37Å; E33-F36 PolarHBondContact O-N 3Å; F36-N38 VanDerWaalsContact C-N 3.27Å; F36-N38 PolarHBondContact O-N 3.31Å; F36-A39 WeakPolarHBondContact O-CB 3.41Å; F36-A39 PolarHBondContact O-N 2.89Å; F36-V40 HydrophobicContact CE2-CG2 4.31Å; F36-V40 HydrophobicContact CZ-CG2 4.35Å; F36-V40 PolarHBondContact O-N 3.2Å; F36-V48 HydrophobicContact CE2-CG1 4.09Å; F36-A51 HydrophobicContact CD2-CB 3.75Å; F36-A51 HydrophobicContact CE2-CB 4.33Å; F36-L52 HydrophobicContact CE2-CD2 4.12Å; F36-L52 HydrophobicContact CE2-CG 4.19Å; F36-L52 HydrophobicContact CZ-CD2 4.06Å; F36-V61 HydrophobicContact CB-CG1 4.24Å; F36-V61 HydrophobicContact CD1-CG1 4.23Å; F36-V61 HydrophobicContact CG-CG1 4.26Å; F36-I63 HydrophobicContact CZ-CG2 4.48Å; F36-A73 HydrophobicContact CE1-CB 3.75Å; F36-A73 HydrophobicContact CZ-CB 4.12Å; F36-L89 HydrophobicContact CZ-CD2 4.15Å
37	L	90.3	Very high	86.2	Confident	11 Å²	11	58.4 Å²	58.4	6%	0.058	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-35.6	179.6	-66.1	177	0	0	0	112.3	L29 E33 V40 E41 D67 A73 I76	L29-L37 HydrophobicContact CD2-CD1 3.43Å; L29-L37 VanDerWaalsContact CD2-CD1 3.43Å; E33-L37 WeakPolarHBondContact O-CG 3.44Å; E33-L37 PolarHBondContact O-N 3.27Å; L37-V40 PolarHBondContact O-N 2.81Å; L37-E41 WeakPolarHBondContact O-CB 3.3Å; L37-E41 PolarHBondContact O-N 2.76Å; L37-D67 HydrophobicContact CD1-CB 4.18Å; L37-A73 HydrophobicContact CD2-CB 3.81Å; L37-I76 HydrophobicContact CD2-CD1 4.22Å
38	N	90.4	Very high	87.1	Confident	65 Å²	65	52 Å²	52	35%	0.348	28%	0.279	S	S	.	.	H	α-helix	trans	-71.8	-28.2	176.4	-165.8	-33.5	0	0	0	112.5	K34 A35 F36 K42	K34-N38 WeakPolarHBondContact O-CB 3.39Å; K34-N38 PolarHBondContact O-N 3.46Å; A35-N38 PolarHBondContact O-N 3.24Å; F36-N38 VanDerWaalsContact C-N 3.27Å; F36-N38 PolarHBondContact O-N 3.31Å; N38-K42 WeakPolarHBondContact O-CB 3.45Å; N38-K42 WeakPolarHBondContact O-CD 3.49Å; N38-K42 VanDerWaalsContact O-CG 3.29Å; N38-K42 WeakPolarHBondContact O-CG 3.45Å; N38-K42 PolarHBondContact O-N 2.92Å; N38-K42 WeakPolarHBondContact OD1-CD 3.39Å; N38-K42 WeakPolarHBondContact OD1-CE 3.36Å; N38-K42 PolarHBondContact OD1-NZ 3.24Å
39	A	89.6	Confident	88	Confident	10 Å²	10	46.8 Å²	46.8	8%	0.083	25%	0.254	C	S	.	.	H	α-helix	trans	-70.4	-40.5	170.6	0	0	0	0	0	111.6	A35 F36 K42 G43 D44 T47 V48	A35-A39 PolarHBondContact O-N 3.48Å; F36-A39 WeakPolarHBondContact O-CB 3.41Å; F36-A39 PolarHBondContact O-N 2.89Å; A39-K42 PolarHBondContact O-N 3.05Å; A39-G43 PolarHBondContact O-N 2.77Å; A39-D44 PolarHBondContact O-N 2.94Å; A39-T47 HydrophobicContact CB-CG2 4Å; A39-V48 HydrophobicContact CB-CG2 3.9Å
40	V	90.7	Very high	88.2	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-49.5	172.3	177	0	0	0	0	110.9	F36 L37 K42 G43 V48 A73 I76 A77 I85 Q748	F36-V40 HydrophobicContact CE2-CG2 4.31Å; F36-V40 HydrophobicContact CZ-CG2 4.35Å; F36-V40 PolarHBondContact O-N 3.2Å; L37-V40 PolarHBondContact O-N 2.81Å; V40-K42 PolarHBondContact O-N 3.4Å; V40-K42 VanDerWaalsContact O-N 3.15Å; V40-G43 PolarHBondContact O-N 3.15Å; V40-G43 VanDerWaalsContact O-N 3.11Å; V40-V48 HydrophobicContact CB-CG2 4.4Å; V40-V48 HydrophobicContact CG2-CG1 4.1Å; V40-V48 HydrophobicContact CG2-CG2 3.61Å; V40-A73 WeakPolarHBondContact CG1-O 3.42Å; V40-A73 HydrophobicContact CG2-CB 4.37Å; V40-I76 HydrophobicContact CG1-CB 4.21Å; V40-I76 HydrophobicContact CG1-CG2 4.01Å; V40-A77 HydrophobicContact CG1-CB 4.39Å; V40-I85 HydrophobicContact CG1-CG2 4.21Å; V40-Q748 PolarHBondContact O-NE2 2.91Å
41	E	88.7	Confident	88.2	Confident	96 Å²	96	49 Å²	49	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-59	-27.2	177.8	-170.7	-175.8	-164.1	0	0	112.7	L37 I76 Q748	L37-E41 WeakPolarHBondContact O-CB 3.3Å; L37-E41 PolarHBondContact O-N 2.76Å; E41-I76 HydrophobicContact CB-CG2 4.03Å; E41-I76 HydrophobicContact CG-CG2 4.44Å; E41-Q748 PolarHBondContact O-NE2 3.09Å; E41-Q748 PolarHBondContact O-OE1 3.12Å; E41-Q748 VanDerWaalsContact O-OE1 3.07Å
42	K	87.2	Confident	88.3	Confident	88 Å²	88	45.2 Å²	45.2	38%	0.383	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-8.5	178.4	-78.9	172.5	178.5	149.8	0	115.7	N38 A39 V40 Q748 S751 Y755	N38-K42 WeakPolarHBondContact O-CB 3.45Å; N38-K42 WeakPolarHBondContact O-CD 3.49Å; N38-K42 VanDerWaalsContact O-CG 3.29Å; N38-K42 WeakPolarHBondContact O-CG 3.45Å; N38-K42 PolarHBondContact O-N 2.92Å; N38-K42 WeakPolarHBondContact OD1-CD 3.39Å; N38-K42 WeakPolarHBondContact OD1-CE 3.36Å; N38-K42 PolarHBondContact OD1-NZ 3.24Å; A39-K42 PolarHBondContact O-N 3.05Å; V40-K42 PolarHBondContact O-N 3.4Å; V40-K42 VanDerWaalsContact O-N 3.15Å; K42-Q748 PolarHBondContact O-OE1 3.21Å; K42-S751 WeakPolarHBondContact O-CB 3.3Å; K42-S751 PolarHBondContact O-OG 3Å; K42-Y755 HydrophobicContact CB-CE2 4.04Å
43	G	87.2	Confident	88.4	Confident	2 Å²	2	44.9 Å²	44.9	2%	0.021	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	24	-176.8	0	0	0	0	0	115.1	A39 V40 Y45 S752	A39-G43 PolarHBondContact O-N 2.77Å; V40-G43 PolarHBondContact O-N 3.15Å; V40-G43 VanDerWaalsContact O-N 3.11Å; G43-Y45 PolarHBondContact O-N 3.48Å; G43-Y45 VanDerWaalsContact O-N 3.09Å; G43-S752 WeakPolarHBondContact O-CA 3.48Å
44	D	89.9	Confident	88.4	Confident	18 Å²	18	47.1 Å²	47.1	10%	0.096	24%	0.239	C	C	.	.			trans	-83.6	81	-179.9	-175.1	-12.4	0	0	0	111.5	A39 A46 T47 V48 Y755 R764	A39-D44 PolarHBondContact O-N 2.94Å; D44-A46 VanDerWaalsContact C-N 3.34Å; D44-A46 PolarHBondContact O-N 3.11Å; D44-T47 PolarHBondContact O-N 3.04Å; D44-T47 WeakPolarHBondContact OD1-CB 3.48Å; D44-T47 PolarHBondContact OD1-N 3.45Å; D44-T47 PolarHBondContact OD1-OG1 3.28Å; D44-T47 VanDerWaalsContact OD1-OG1 3.09Å; D44-T47 VanDerWaalsContact OD2-CB 3.25Å; D44-T47 WeakPolarHBondContact OD2-CB 3.49Å; D44-T47 PolarHBondContact OD2-OG1 3.11Å; D44-V48 WeakPolarHBondContact O-CG2 3.43Å; D44-V48 PolarHBondContact O-N 2.96Å; D44-Y755 HydrophobicContact CB-CD1 4.24Å; D44-Y755 HydrophobicContact CB-CD2 4.07Å; D44-Y755 HydrophobicContact CB-CE2 4.38Å; D44-Y755 HydrophobicContact CB-CG 4.02Å; D44-R764 IonicContact OD1-CZ 2.67Å; D44-R764 IonicContact OD1-NH2 2.61Å; D44-R764 PolarHBondContact OD1-NH2 3.13Å; D44-R764 IonicContact OD2-NH2 2.67Å
45	Y	88.9	Confident	88.1	Confident	85 Å²	85	42.3 Å²	42.3	33%	0.333	22%	0.219	S	C	.	.	H	α-helix	trans	-48.9	-48.7	-177.4	177.2	-89.8	0	0	0	113.5	G43 V48 K49 E84 I85 L88	G43-Y45 PolarHBondContact O-N 3.48Å; G43-Y45 VanDerWaalsContact O-N 3.09Å; Y45-V48 PolarHBondContact O-N 2.92Å; Y45-K49 HydrophobicContact CE1-CD 3.79Å; Y45-K49 VanDerWaalsContact O-CB 3.31Å; Y45-K49 WeakPolarHBondContact O-CB 3.49Å; Y45-K49 PolarHBondContact O-N 3.39Å; Y45-E84 HydrophobicContact CD2-CB 4.19Å; Y45-E84 HydrophobicContact CE2-CB 4.37Å; Y45-I85 HydrophobicContact CD2-CG1 4.25Å; Y45-L88 HydrophobicContact CD2-CD2 4.14Å; Y45-L88 HydrophobicContact CE2-CB 4.08Å; Y45-L88 HydrophobicContact CE2-CD2 3.89Å; Y45-L88 HydrophobicContact CE2-CG 4.39Å
46	A	87.5	Confident	87.6	Confident	22 Å²	22	44.3 Å²	44.3	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-73.4	-32.1	-174.4	0	0	0	0	0	112.9	D44 Q50	D44-A46 VanDerWaalsContact C-N 3.34Å; D44-A46 PolarHBondContact O-N 3.11Å; A46-Q50 WeakPolarHBondContact O-CB 3.1Å; A46-Q50 PolarHBondContact O-N 3.24Å
47	T	87.5	Confident	86.9	Confident	47 Å²	47	49.2 Å²	49.2	29%	0.288	24%	0.244	S	C	.	.	H	α-helix	trans	-70.6	-39.8	171.4	-59.7	0	0	0	0	111.7	A39 D44 Q50 A51 R764	A39-T47 HydrophobicContact CB-CG2 4Å; D44-T47 PolarHBondContact O-N 3.04Å; D44-T47 WeakPolarHBondContact OD1-CB 3.48Å; D44-T47 PolarHBondContact OD1-N 3.45Å; D44-T47 PolarHBondContact OD1-OG1 3.28Å; D44-T47 VanDerWaalsContact OD1-OG1 3.09Å; D44-T47 VanDerWaalsContact OD2-CB 3.25Å; D44-T47 WeakPolarHBondContact OD2-CB 3.49Å; D44-T47 PolarHBondContact OD2-OG1 3.11Å; T47-Q50 PolarHBondContact O-N 3.26Å; T47-A51 WeakPolarHBondContact O-CB 3.4Å; T47-A51 PolarHBondContact O-N 3.49Å; T47-R764 PolarHBondContact OG1-NH1 3.42Å; T47-R764 PolarHBondContact OG1-NH2 3.47Å
48	V	90.1	Very high	86.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-44.2	174.4	173.4	0	0	0	0	110.8	F36 A39 V40 D44 Y45 Q50 A51 L52 I85 L88	F36-V48 HydrophobicContact CE2-CG1 4.09Å; A39-V48 HydrophobicContact CB-CG2 3.9Å; V40-V48 HydrophobicContact CB-CG2 4.4Å; V40-V48 HydrophobicContact CG2-CG1 4.1Å; V40-V48 HydrophobicContact CG2-CG2 3.61Å; D44-V48 WeakPolarHBondContact O-CG2 3.43Å; D44-V48 PolarHBondContact O-N 2.96Å; Y45-V48 PolarHBondContact O-N 2.92Å; V48-Q50 PolarHBondContact O-N 2.98Å; V48-A51 PolarHBondContact O-N 3.41Å; V48-L52 HydrophobicContact CG1-CD1 3.95Å; V48-L52 HydrophobicContact CG1-CG 4.47Å; V48-L52 WeakPolarHBondContact O-CG 3.25Å; V48-L52 PolarHBondContact O-N 3.03Å; V48-I85 HydrophobicContact CG1-CG2 4.31Å; V48-L88 HydrophobicContact CB-CD2 4.47Å; V48-L88 HydrophobicContact CG1-CD2 4.01Å
49	K	89.4	Confident	85.2	Confident	77 Å²	77	63.1 Å²	63.1	34%	0.335	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-44	176.4	-174.4	168.5	-174.3	168.2	0	112.8	Y45 L52 Q53 L88	Y45-K49 HydrophobicContact CE1-CD 3.79Å; Y45-K49 VanDerWaalsContact O-CB 3.31Å; Y45-K49 WeakPolarHBondContact O-CB 3.49Å; Y45-K49 PolarHBondContact O-N 3.39Å; K49-L52 PolarHBondContact O-N 3.21Å; K49-Q53 WeakPolarHBondContact O-CG 3.45Å; K49-Q53 PolarHBondContact O-N 3.5Å; K49-Q53 VanDerWaalsContact O-N 3.11Å; K49-L88 HydrophobicContact CB-CD1 4.34Å; K49-L88 HydrophobicContact CB-CD2 3.82Å; K49-L88 HydrophobicContact CD-CD1 4.3Å; K49-L88 HydrophobicContact CG-CD1 4.09Å; K49-L88 HydrophobicContact CG-CD2 4.47Å
50	Q	87.3	Confident	84.5	Confident	97 Å²	97	65.8 Å²	65.8	45%	0.453	31%	0.306	S	S	.	.	H	α-helix	trans	-62.9	-45.2	175.3	-175.1	-179.1	-14.2	0	0	111.1	A46 T47 V48 L52 Q53 E54	A46-Q50 WeakPolarHBondContact O-CB 3.1Å; A46-Q50 PolarHBondContact O-N 3.24Å; T47-Q50 PolarHBondContact O-N 3.26Å; V48-Q50 PolarHBondContact O-N 2.98Å; Q50-L52 VanDerWaalsContact C-N 3.35Å; Q50-L52 PolarHBondContact O-N 3.29Å; Q50-Q53 PolarHBondContact O-N 3.04Å; Q50-E54 HydrophobicContact CG-CG 4.44Å; Q50-E54 WeakPolarHBondContact CG-OE1 3.29Å; Q50-E54 PolarHBondContact NE2-OE1 3.37Å; Q50-E54 WeakPolarHBondContact O-CB 3.03Å; Q50-E54 WeakPolarHBondContact O-CG 3.45Å; Q50-E54 PolarHBondContact O-N 3Å
51	A	86.1	Confident	84	Confident	22 Å²	22	66.4 Å²	66.4	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-38	179.3	0	0	0	0	0	112.9	F36 T47 V48 E54 A55	F36-A51 HydrophobicContact CD2-CB 3.75Å; F36-A51 HydrophobicContact CE2-CB 4.33Å; T47-A51 WeakPolarHBondContact O-CB 3.4Å; T47-A51 PolarHBondContact O-N 3.49Å; V48-A51 PolarHBondContact O-N 3.41Å; A51-E54 PolarHBondContact O-N 3.05Å; A51-A55 VanDerWaalsContact O-CB 3.3Å; A51-A55 WeakPolarHBondContact O-CB 3.34Å; A51-A55 PolarHBondContact O-N 3Å
52	L	87.2	Confident	83.6	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.1	-43.5	175	-70	167.8	0	0	0	112	F36 V48 K49 Q50 A55 E56 I63 L88 L89 H92	F36-L52 HydrophobicContact CE2-CD2 4.12Å; F36-L52 HydrophobicContact CE2-CG 4.19Å; F36-L52 HydrophobicContact CZ-CD2 4.06Å; V48-L52 HydrophobicContact CG1-CD1 3.95Å; V48-L52 HydrophobicContact CG1-CG 4.47Å; V48-L52 WeakPolarHBondContact O-CG 3.25Å; V48-L52 PolarHBondContact O-N 3.03Å; K49-L52 PolarHBondContact O-N 3.21Å; Q50-L52 VanDerWaalsContact C-N 3.35Å; Q50-L52 PolarHBondContact O-N 3.29Å; L52-A55 PolarHBondContact O-N 2.6Å; L52-E56 PolarHBondContact O-N 3.09Å; L52-E56 VanDerWaalsContact O-N 3.13Å; L52-I63 HydrophobicContact CD2-CD1 4.15Å; L52-I63 HydrophobicContact CD2-CG1 4.23Å; L52-I63 HydrophobicContact CD2-CG2 3.6Å; L52-L88 HydrophobicContact CD1-CD2 4.04Å; L52-L88 HydrophobicContact CD1-CG 3.85Å; L52-L89 HydrophobicContact CD1-CD2 4.09Å; L52-L89 HydrophobicContact CD2-CD2 4.2Å; L52-H92 HydrophobicContact CD2-CB 4.38Å
53	Q	86.3	Confident	83.4	Confident	93 Å²	93	63.4 Å²	63.4	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-37.7	175.6	-71	178.2	-14.4	0	0	112.5	K49 Q50 I57	K49-Q53 WeakPolarHBondContact O-CG 3.45Å; K49-Q53 PolarHBondContact O-N 3.5Å; K49-Q53 VanDerWaalsContact O-N 3.11Å; Q50-Q53 PolarHBondContact O-N 3.04Å; Q53-I57 WeakPolarHBondContact O-CD1 3.45Å; Q53-I57 WeakPolarHBondContact O-CG1 3.43Å
54	E	84.9	Confident	83.2	Confident	80 Å²	80	66.6 Å²	66.6	37%	0.374	32%	0.317	S	S	.	.	H	α-helix	trans	-68.9	-37.5	174.6	-73.2	177.9	-172.6	0	0	111.6	Q50 A51 E56 I57 Y58	Q50-E54 HydrophobicContact CG-CG 4.44Å; Q50-E54 WeakPolarHBondContact CG-OE1 3.29Å; Q50-E54 PolarHBondContact NE2-OE1 3.37Å; Q50-E54 WeakPolarHBondContact O-CB 3.03Å; Q50-E54 WeakPolarHBondContact O-CG 3.45Å; Q50-E54 PolarHBondContact O-N 3Å; A51-E54 PolarHBondContact O-N 3.05Å; E54-E56 PolarHBondContact O-N 3.49Å; E54-I57 PolarHBondContact O-N 3.25Å; E54-Y58 WeakPolarHBondContact O-CD2 3.49Å; E54-Y58 PolarHBondContact O-N 2.68Å
55	A	81.8	Confident	83	Confident	4 Å²	4	66.1 Å²	66.1	3%	0.033	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-37.3	176.7	0	0	0	0	0	113	A51 L52 I57 Y59 V61 I63	A51-A55 VanDerWaalsContact O-CB 3.3Å; A51-A55 WeakPolarHBondContact O-CB 3.34Å; A51-A55 PolarHBondContact O-N 3Å; L52-A55 PolarHBondContact O-N 2.6Å; A55-I57 VanDerWaalsContact C-N 3.26Å; A55-I57 PolarHBondContact O-N 3.07Å; A55-Y59 WeakPolarHBondContact O-CA 3.42Å; A55-Y59 PolarHBondContact O-N 2.86Å; A55-V61 HydrophobicContact CB-CB 4.49Å; A55-I63 HydrophobicContact CB-CD1 4.07Å; A55-I63 HydrophobicContact CB-CG1 3.93Å
56	E	77.8	Confident	82.7	Confident	103 Å²	103	66.3 Å²	66.3	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-29.4	173.7	-74.1	-178.1	166.1	0	0	113.4	L52 E54 H92	L52-E56 PolarHBondContact O-N 3.09Å; L52-E56 VanDerWaalsContact O-N 3.13Å; E54-E56 PolarHBondContact O-N 3.49Å; E56-H92 IonicContact OE1-CE1 3.53Å; E56-H92 PolarHBondContact OE1-CE1 2.81Å; E56-H92 IonicContact OE1-CG 2.6Å; E56-H92 IonicContact OE1-ND1 3.96Å; E56-H92 PolarHBondContact OE1-ND1 3.01Å; E56-H92 IonicContact OE2-CE1 2.6Å; E56-H92 IonicContact OE2-ND1 2.88Å
57	I	77	Confident	82.6	Confident	113 Å²	113	66.1 Å²	66.1	58%	0.579	32%	0.316	S	S	*	.	H	α-helix	trans	-93.1	-40.5	-174.8	-61	166.2	0	0	0	111.6	Q53 E54 A55	Q53-I57 WeakPolarHBondContact O-CD1 3.45Å; Q53-I57 WeakPolarHBondContact O-CG1 3.43Å; E54-I57 PolarHBondContact O-N 3.25Å; A55-I57 VanDerWaalsContact C-N 3.26Å; A55-I57 PolarHBondContact O-N 3.07Å
58	Y	72.4	Confident	82.3	Confident	170 Å²	170	67.9 Å²	67.9	67%	0.667	33%	0.328	S	S	*	.	H	α-helix	trans	-114.6	-11.6	-168.3	-62.6	-74.4	0	0	0	114.7	E54 N60	E54-Y58 WeakPolarHBondContact O-CD2 3.49Å; E54-Y58 PolarHBondContact O-N 2.68Å; Y58-N60 PolarHBondContact O-N 3.18Å
59	Y	72.2	Confident	81.8	Confident	197 Å²	197	74.4 Å²	74.4	77%	0.773	36%	0.363	S	S	*	.			trans	50.5	27.7	-177.5	-61.2	-79	0	0	0	114.6	A55	A55-Y59 WeakPolarHBondContact O-CA 3.42Å; A55-Y59 PolarHBondContact O-N 2.86Å
60	N	75.1	Confident	81.4	Confident	66 Å²	66	72.8 Å²	72.8	35%	0.353	37%	0.367	S	S	.	.			trans	-80.5	-22.9	-176.9	61.7	-46.3	0	0	0	113.9	E32 Y58	E32-N60 PolarHBondContact OE2-ND2 2.69Å; Y58-N60 PolarHBondContact O-N 3.18Å
61	V	79.4	Confident	81.3	Confident	15 Å²	15	70.2 Å²	70.2	9%	0.091	35%	0.354	C	S	.	.	S	Bend	trans	-120.5	125.6	179.4	176.5	0	0	0	0	108.9	E32 E33 F36 A55 I63	E32-V61 HydrophobicContact CB-CG2 3.87Å; E33-V61 HydrophobicContact CG-CG1 4.04Å; F36-V61 HydrophobicContact CB-CG1 4.24Å; F36-V61 HydrophobicContact CD1-CG1 4.23Å; F36-V61 HydrophobicContact CG-CG1 4.26Å; A55-V61 HydrophobicContact CB-CB 4.49Å; V61-I63 PolarHBondContact O-N 3.29Å
62	N	81.1	Confident	81.3	Confident	87 Å²	87	69.8 Å²	69.8	47%	0.465	35%	0.349	S	S	.	.			trans	-73.9	111.7	168.2	-178.6	4.3	0	0	0	109.2	E33 N64 C65	E33-N62 WeakPolarHBondContact OE1-CB 3.42Å; E33-N62 PolarHBondContact OE1-N 2.88Å; N62-N64 PolarHBondContact O-N 3.06Å; N62-N64 PolarHBondContact OD1-N 3.43Å; N62-C65 HydrophobicContact CB-CB 4.39Å; N62-C65 VanDerWaalsContact O-CB 3.3Å; N62-C65 WeakPolarHBondContact O-CB 3.05Å; N62-C65 PolarHBondContact O-N 3.44Å; N62-C65 PolarHBondContact O-SG 2.91Å
63	I	82.9	Confident	81.4	Confident	33 Å²	33	69.8 Å²	69.8	17%	0.169	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.9	179.9	-53.4	174.2	0	0	0	111.1	F36 L52 A55 V61 C65 V94	F36-I63 HydrophobicContact CZ-CG2 4.48Å; L52-I63 HydrophobicContact CD2-CD1 4.15Å; L52-I63 HydrophobicContact CD2-CG1 4.23Å; L52-I63 HydrophobicContact CD2-CG2 3.6Å; A55-I63 HydrophobicContact CB-CD1 4.07Å; A55-I63 HydrophobicContact CB-CG1 3.93Å; V61-I63 PolarHBondContact O-N 3.29Å; I63-C65 VanDerWaalsContact C-N 3.31Å; I63-C65 PolarHBondContact O-N 3.37Å; I63-V94 HydrophobicContact CG2-CG2 3.59Å
64	N	82.8	Confident	81.6	Confident	69 Å²	69	65.4 Å²	65.4	37%	0.369	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	26.5	177	-56.2	-50	0	0	0	112.4	N62 Y95	N62-N64 PolarHBondContact O-N 3.06Å; N62-N64 PolarHBondContact OD1-N 3.43Å; N64-Y95 WeakPolarHBondContact OD1-CB 3.07Å; N64-Y95 PolarHBondContact OD1-N 3.21Å
65	C	85.4	Confident	81.8	Confident	8 Å²	8	62.7 Å²	62.7	5%	0.054	32%	0.317	C	S	.	.			trans	-63.8	147.3	171.4	60.3	0	0	0	0	111.3	E33 N62 I63	E33-C65 HydrophobicContact CB-CB 4.43Å; E33-C65 HydrophobicContact CG-CB 4.28Å; N62-C65 HydrophobicContact CB-CB 4.39Å; N62-C65 VanDerWaalsContact O-CB 3.3Å; N62-C65 WeakPolarHBondContact O-CB 3.05Å; N62-C65 PolarHBondContact O-N 3.44Å; N62-C65 PolarHBondContact O-SG 2.91Å; I63-C65 VanDerWaalsContact C-N 3.31Å; I63-C65 PolarHBondContact O-N 3.37Å
66	M	82.7	Confident	82.1	Confident	89 Å²	89	62.7 Å²	62.7	44%	0.438	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-112.6	138.7	179.6	-56.9	-67.1	-89.3	0	0	108.4	L29 G70 R71 S72	L29-M66 WeakPolarHBondContact CD1-O 3.15Å; L29-M66 WeakPolarHBondContact CD2-O 3.34Å; M66-G70 WeakPolarHBondContact CE-O 3.33Å; M66-R71 WeakPolarHBondContact CA-O 3.43Å; M66-S72 VanDerWaalsContact SD-CB 3.51Å
67	D	84.3	Confident	82.7	Confident	19 Å²	19	57.9 Å²	57.9	10%	0.102	29%	0.294	C	S	.	.			trans	-71.2	168.7	170.8	80.7	-7.2	0	0	0	111.8	L37 L69 G70 R71	L37-D67 HydrophobicContact CD1-CB 4.18Å; D67-L69 PolarHBondContact O-N 2.73Å; D67-L69 VanDerWaalsContact OD1-C 3.31Å; D67-L69 VanDerWaalsContact OD1-CA 3.31Å; D67-L69 WeakPolarHBondContact OD1-CA 3.42Å; D67-L69 WeakPolarHBondContact OD1-CB 3.42Å; D67-L69 PolarHBondContact OD1-N 3.39Å; D67-G70 PolarHBondContact O-N 3.4Å; D67-G70 PolarHBondContact OD1-N 3.33Å; D67-G70 VanDerWaalsContact OD1-N 3.11Å; D67-R71 PolarHBondContact N-O 3.11Å; D67-R71 WeakPolarHBondContact OD1-CB 3.31Å; D67-R71 PolarHBondContact OD1-N 2.8Å; D67-R71 IonicContact OD1-NE 2.64Å; D67-R71 IonicContact OD2-CZ 2.86Å; D67-R71 VanDerWaalsContact OD2-CZ 3.24Å; D67-R71 IonicContact OD2-NE 2.69Å; D67-R71 PolarHBondContact OD2-NE 2.95Å; D67-R71 IonicContact OD2-NH2 3.55Å; D67-R71 PolarHBondContact OD2-NH2 2.93Å
68	P	82.1	Confident	83.4	Confident	84 Å²	84	52.6 Å²	52.6	55%	0.545	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	14.1	175.2	-19.7	34.1	0	0	0	115.1	E26 L29	E26-P68 WeakPolarHBondContact OE2-CA 3.37Å; L29-P68 HydrophobicContact CD1-CG 3.99Å
69	L	80.1	Confident	84.1	Confident	137 Å²	137	46.1 Å²	46.1	72%	0.717	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.8	4.4	171	-58.6	171	0	0	0	111.1	D67 R71	D67-L69 PolarHBondContact O-N 2.73Å; D67-L69 VanDerWaalsContact OD1-C 3.31Å; D67-L69 VanDerWaalsContact OD1-CA 3.31Å; D67-L69 WeakPolarHBondContact OD1-CA 3.42Å; D67-L69 WeakPolarHBondContact OD1-CB 3.42Å; D67-L69 PolarHBondContact OD1-N 3.39Å; L69-R71 HydrophobicContact CB-CG 4.44Å
70	G	80.1	Confident	84.8	Confident	42 Å²	42	37.5 Å²	37.5	43%	0.433	21%	0.21	S	C	.	.	S	Bend	trans	77.2	20.8	-178.5	0	0	0	0	0	114.5	M66 D67	M66-G70 WeakPolarHBondContact CE-O 3.33Å; D67-G70 PolarHBondContact O-N 3.4Å; D67-G70 PolarHBondContact OD1-N 3.33Å; D67-G70 VanDerWaalsContact OD1-N 3.11Å
71	R	84.7	Confident	85.4	Confident	44 Å²	44	38.1 Å²	38.1	17%	0.166	21%	0.211	C	C	.	.			trans	-99.5	129.3	178.7	-55.3	179.9	-61.9	166	5.2	111.1	M66 D67 L69 L75 I76 E79	M66-R71 WeakPolarHBondContact CA-O 3.43Å; D67-R71 PolarHBondContact N-O 3.11Å; D67-R71 WeakPolarHBondContact OD1-CB 3.31Å; D67-R71 PolarHBondContact OD1-N 2.8Å; D67-R71 IonicContact OD1-NE 2.64Å; D67-R71 IonicContact OD2-CZ 2.86Å; D67-R71 VanDerWaalsContact OD2-CZ 3.24Å; D67-R71 IonicContact OD2-NE 2.69Å; D67-R71 PolarHBondContact OD2-NE 2.95Å; D67-R71 IonicContact OD2-NH2 3.55Å; D67-R71 PolarHBondContact OD2-NH2 2.93Å; L69-R71 HydrophobicContact CB-CG 4.44Å; R71-L75 HydrophobicContact CB-CB 4.37Å; R71-I76 HydrophobicContact CB-CD1 4.42Å; R71-I76 HydrophobicContact CB-CG1 3.98Å; R71-E79 WeakPolarHBondContact CD-OE2 3.45Å; R71-E79 IonicContact CZ-OE2 3.5Å; R71-E79 IonicContact NE-OE2 2.73Å; R71-E79 IonicContact NH1-OE1 3.19Å; R71-E79 IonicContact NH1-OE2 3.69Å; R71-E79 PolarHBondContact NH1-OE2 3.18Å
72	S	87.9	Confident	86	Confident	13 Å²	13	38 Å²	38	9%	0.091	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-79.9	164.7	169.2	75.5	0	0	0	0	111.3	M66 L74 L75 I76	M66-S72 VanDerWaalsContact SD-CB 3.51Å; S72-L74 PolarHBondContact O-N 3.06Å; S72-L74 VanDerWaalsContact O-N 3.17Å; S72-L74 PolarHBondContact OG-N 2.87Å; S72-L75 PolarHBondContact O-N 2.91Å; S72-L75 PolarHBondContact OG-N 3Å; S72-I76 WeakPolarHBondContact O-CG1 3.46Å; S72-I76 PolarHBondContact O-N 2.91Å
73	A	88.9	Confident	86.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-51	-37.2	170.3	0	0	0	0	0	112.9	F36 L37 V40 A77 L89	F36-A73 HydrophobicContact CE1-CB 3.75Å; F36-A73 HydrophobicContact CZ-CB 4.12Å; L37-A73 HydrophobicContact CD2-CB 3.81Å; V40-A73 WeakPolarHBondContact CG1-O 3.42Å; V40-A73 HydrophobicContact CG2-CB 4.37Å; A73-A77 PolarHBondContact O-N 3.11Å; A73-L89 HydrophobicContact CB-CD1 4.35Å; A73-L89 HydrophobicContact CB-CD2 4.33Å
74	L	89.6	Confident	86.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.3	-41.6	177.8	-173.5	66.2	0	0	0	112.1	S72 I76 A77 I78 M86 L89 L90 V94 V96 A99	S72-L74 PolarHBondContact O-N 3.06Å; S72-L74 VanDerWaalsContact O-N 3.17Å; S72-L74 PolarHBondContact OG-N 2.87Å; L74-I76 VanDerWaalsContact C-N 3.34Å; L74-I76 PolarHBondContact O-N 3.35Å; L74-A77 PolarHBondContact O-N 3.15Å; L74-I78 HydrophobicContact CG-CD1 4.12Å; L74-I78 WeakPolarHBondContact O-CD1 3.4Å; L74-I78 VanDerWaalsContact O-CG1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.31Å; L74-I78 PolarHBondContact O-N 2.73Å; L74-M86 HydrophobicContact CD1-CG 3.52Å; L74-M86 HydrophobicContact CD1-SD 4.47Å; L74-L89 HydrophobicContact CD1-CB 4.35Å; L74-L89 HydrophobicContact CD1-CD1 4.48Å; L74-L90 HydrophobicContact CD1-CD2 4.33Å; L74-L90 HydrophobicContact CD1-CG 4.38Å; L74-L90 HydrophobicContact CD2-CD2 4.44Å; L74-V94 HydrophobicContact CB-CG1 4.07Å; L74-V94 HydrophobicContact CD2-CG1 4.38Å; L74-V96 HydrophobicContact CD2-CB 4.44Å; L74-V96 HydrophobicContact CD2-CG1 4.39Å; L74-V96 HydrophobicContact CD2-CG2 4.39Å; L74-A99 HydrophobicContact CD2-CB 3.66Å; L74-A99 HydrophobicContact CG-CB 4.17Å
75	L	89.3	Confident	87	Confident	24 Å²	24	37.8 Å²	37.8	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-65	-37.8	176.3	-64.5	178.7	0	0	0	111.7	R71 S72 I78 E79 A99 Y102	R71-L75 HydrophobicContact CB-CB 4.37Å; S72-L75 PolarHBondContact O-N 2.91Å; S72-L75 PolarHBondContact OG-N 3Å; L75-I78 PolarHBondContact O-N 2.86Å; L75-E79 WeakPolarHBondContact O-CB 3.36Å; L75-E79 PolarHBondContact O-N 2.84Å; L75-A99 HydrophobicContact CD2-CB 3.85Å; L75-Y102 HydrophobicContact CD2-CD1 3.95Å; L75-Y102 HydrophobicContact CD2-CD2 4Å; L75-Y102 HydrophobicContact CD2-CG 3.6Å
76	I	89.2	Confident	87.2	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-66.6	-38.6	174.9	-62.8	168.1	0	0	0	111.2	L37 V40 E41 R71 S72 L74 I78 N80	L37-I76 HydrophobicContact CD2-CD1 4.22Å; V40-I76 HydrophobicContact CG1-CB 4.21Å; V40-I76 HydrophobicContact CG1-CG2 4.01Å; E41-I76 HydrophobicContact CB-CG2 4.03Å; E41-I76 HydrophobicContact CG-CG2 4.44Å; R71-I76 HydrophobicContact CB-CD1 4.42Å; R71-I76 HydrophobicContact CB-CG1 3.98Å; S72-I76 WeakPolarHBondContact O-CG1 3.46Å; S72-I76 PolarHBondContact O-N 2.91Å; L74-I76 VanDerWaalsContact C-N 3.34Å; L74-I76 PolarHBondContact O-N 3.35Å; I76-I78 VanDerWaalsContact C-N 3.34Å; I76-N80 PolarHBondContact O-N 3.43Å; I76-N80 PolarHBondContact O-ND2 3.09Å
77	A	90.5	Very high	87.6	Confident	2 Å²	2	38.2 Å²	38.2	2%	0.017	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-39.9	174.9	0	0	0	0	0	111.9	V40 A73 L74 E81 N82 I85 M86 L89	V40-A77 HydrophobicContact CG1-CB 4.39Å; A73-A77 PolarHBondContact O-N 3.11Å; L74-A77 PolarHBondContact O-N 3.15Å; A77-E81 PolarHBondContact O-N 3.07Å; A77-N82 PolarHBondContact O-N 3.05Å; A77-I85 HydrophobicContact CB-CG2 4.16Å; A77-M86 HydrophobicContact CB-CB 4.35Å; A77-L89 HydrophobicContact CB-CD1 4.08Å
78	I	90.2	Very high	87.8	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-69.3	-43.3	176.3	-65.8	161.3	0	0	0	111.8	L74 L75 I76 N80 E81 M86 A99 Y102 A103 A111 L115	L74-I78 HydrophobicContact CG-CD1 4.12Å; L74-I78 WeakPolarHBondContact O-CD1 3.4Å; L74-I78 VanDerWaalsContact O-CG1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.31Å; L74-I78 PolarHBondContact O-N 2.73Å; L75-I78 PolarHBondContact O-N 2.86Å; I76-I78 VanDerWaalsContact C-N 3.34Å; I78-N80 PolarHBondContact O-N 3.36Å; I78-E81 PolarHBondContact O-N 2.84Å; I78-E81 VanDerWaalsContact O-N 3.14Å; I78-M86 HydrophobicContact CD1-SD 4.2Å; I78-M86 HydrophobicContact CG1-CG 4.4Å; I78-M86 HydrophobicContact CG1-SD 3.6Å; I78-M86 VanDerWaalsContact CG1-SD 3.6Å; I78-A99 HydrophobicContact CD1-CB 3.83Å; I78-Y102 HydrophobicContact CB-CD1 4.39Å; I78-Y102 HydrophobicContact CG2-CD1 3.86Å; I78-Y102 HydrophobicContact CG2-CE1 4.32Å; I78-A103 HydrophobicContact CD1-CB 4.38Å; I78-A103 HydrophobicContact CG2-CB 3.82Å; I78-A111 HydrophobicContact CG1-CB 4.47Å; I78-L115 HydrophobicContact CD1-CD1 4.17Å
79	E	88	Confident	88.1	Confident	34 Å²	34	33.8 Å²	33.8	16%	0.159	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-26.4	179.1	-168.5	-175	164.3	0	0	112.7	R71 L75 Y102 K744	R71-E79 WeakPolarHBondContact CD-OE2 3.45Å; R71-E79 IonicContact CZ-OE2 3.5Å; R71-E79 IonicContact NE-OE2 2.73Å; R71-E79 IonicContact NH1-OE1 3.19Å; R71-E79 IonicContact NH1-OE2 3.69Å; R71-E79 PolarHBondContact NH1-OE2 3.18Å; L75-E79 WeakPolarHBondContact O-CB 3.36Å; L75-E79 PolarHBondContact O-N 2.84Å; E79-Y102 HydrophobicContact CB-CE1 4.19Å; E79-K744 IonicContact OE1-NZ 2.67Å
80	N	87.1	Confident	88.5	Confident	16 Å²	16	27.5 Å²	27.5	9%	0.086	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	17	178.5	-59.5	-73.5	0	0	0	113.4	I76 I78 N82 Q748	I76-N80 PolarHBondContact O-N 3.43Å; I76-N80 PolarHBondContact O-ND2 3.09Å; I78-N80 PolarHBondContact O-N 3.36Å; N80-N82 PolarHBondContact O-N 3.28Å; N80-Q748 HydrophobicContact CB-CB 4.22Å; N80-Q748 HydrophobicContact CB-CG 3.89Å
81	E	88.3	Confident	88.8	Confident	79 Å²	79	30.9 Å²	30.9	37%	0.369	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	20	-179.9	-56.7	-150.3	-169.7	0	0	116.9	A77 I78 L83 V108 E745	A77-E81 PolarHBondContact O-N 3.07Å; I78-E81 PolarHBondContact O-N 2.84Å; I78-E81 VanDerWaalsContact O-N 3.14Å; E81-L83 PolarHBondContact O-N 3.08Å; E81-V108 HydrophobicContact CB-CG1 4.36Å; E81-V108 HydrophobicContact CG-CG1 3.95Å; E81-V108 HydrophobicContact CG-CG2 3.84Å; E81-E745 HydrophobicContact CB-CG 4.47Å; E81-E745 HydrophobicContact CG-CG 4.45Å
82	N	90.2	Very high	88.8	Confident	12 Å²	12	30.3 Å²	30.3	6%	0.064	15%	0.151	C	C	.	.			trans	-81.3	88	-175.8	-167.6	-53.2	0	0	0	111.6	A77 N80 E84 I85 M86	A77-N82 PolarHBondContact O-N 3.05Å; N80-N82 PolarHBondContact O-N 3.28Å; N82-E84 VanDerWaalsContact C-N 3.31Å; N82-E84 PolarHBondContact O-N 3.3Å; N82-E84 PolarHBondContact OD1-N 2.72Å; N82-I85 WeakPolarHBondContact OD1-CB 3.41Å; N82-I85 WeakPolarHBondContact OD1-CG1 3.06Å; N82-I85 PolarHBondContact OD1-N 3.34Å; N82-M86 WeakPolarHBondContact O-CB 3.48Å; N82-M86 PolarHBondContact O-N 2.91Å; N82-M86 VanDerWaalsContact O-N 3.09Å
83	L	90	Very high	88.5	Confident	72 Å²	72	34.1 Å²	34.1	38%	0.377	18%	0.178	S	C	.	.	H	α-helix	trans	-61	-34.8	-177	-55.9	-177.7	0	0	0	113.3	E81 M86 E87 A111 L114	E81-L83 PolarHBondContact O-N 3.08Å; L83-M86 WeakPolarHBondContact O-CB 3.49Å; L83-M86 PolarHBondContact O-N 3.46Å; L83-E87 PolarHBondContact O-N 3.19Å; L83-A111 HydrophobicContact CD2-CB 4.26Å; L83-L114 HydrophobicContact CB-CD1 4.12Å; L83-L114 HydrophobicContact CD2-CD1 4.3Å
84	E	88.6	Confident	88.2	Confident	113 Å²	113	34.3 Å²	34.3	53%	0.528	18%	0.179	S	C	.	.	H	α-helix	trans	-69.8	-44.3	-177.1	-60.1	-177.8	169.8	0	0	112.5	Y45 N82 M86 E87 L88	Y45-E84 HydrophobicContact CD2-CB 4.19Å; Y45-E84 HydrophobicContact CE2-CB 4.37Å; N82-E84 VanDerWaalsContact C-N 3.31Å; N82-E84 PolarHBondContact O-N 3.3Å; N82-E84 PolarHBondContact OD1-N 2.72Å; E84-M86 VanDerWaalsContact C-N 3.28Å; E84-E87 PolarHBondContact O-N 2.97Å; E84-L88 WeakPolarHBondContact O-CB 3.45Å; E84-L88 PolarHBondContact O-N 3.49Å
85	I	89.9	Confident	87.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.8	-35.9	173.3	-68.8	176.4	0	0	0	109.8	V40 Y45 V48 A77 N82 L88 L89	V40-I85 HydrophobicContact CG1-CG2 4.21Å; Y45-I85 HydrophobicContact CD2-CG1 4.25Å; V48-I85 HydrophobicContact CG1-CG2 4.31Å; A77-I85 HydrophobicContact CB-CG2 4.16Å; N82-I85 WeakPolarHBondContact OD1-CB 3.41Å; N82-I85 WeakPolarHBondContact OD1-CG1 3.06Å; N82-I85 PolarHBondContact OD1-N 3.34Å; I85-L88 PolarHBondContact O-N 3.27Å; I85-L89 HydrophobicContact CG2-CD1 3.85Å; I85-L89 HydrophobicContact CG2-CG 4.25Å; I85-L89 WeakPolarHBondContact O-CB 3.23Å; I85-L89 VanDerWaalsContact O-CG 3.23Å; I85-L89 WeakPolarHBondContact O-CG 3.21Å; I85-L89 PolarHBondContact O-N 3.08Å
86	M	90.5	Very high	87.4	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-44.9	175.8	-158.4	-169	63.8	0	0	112.1	L74 A77 I78 N82 L83 E84 L88 L89 L90 A111 L114 L115	L74-M86 HydrophobicContact CD1-CG 3.52Å; L74-M86 HydrophobicContact CD1-SD 4.47Å; A77-M86 HydrophobicContact CB-CB 4.35Å; I78-M86 HydrophobicContact CD1-SD 4.2Å; I78-M86 HydrophobicContact CG1-CG 4.4Å; I78-M86 HydrophobicContact CG1-SD 3.6Å; I78-M86 VanDerWaalsContact CG1-SD 3.6Å; N82-M86 WeakPolarHBondContact O-CB 3.48Å; N82-M86 PolarHBondContact O-N 2.91Å; N82-M86 VanDerWaalsContact O-N 3.09Å; L83-M86 WeakPolarHBondContact O-CB 3.49Å; L83-M86 PolarHBondContact O-N 3.46Å; E84-M86 VanDerWaalsContact C-N 3.28Å; M86-L88 VanDerWaalsContact C-N 3.34Å; M86-L88 PolarHBondContact O-N 2.86Å; M86-L89 PolarHBondContact O-N 3.27Å; M86-L90 HydrophobicContact CE-CD1 4.11Å; M86-L90 HydrophobicContact CG-CD1 4.29Å; M86-L90 WeakPolarHBondContact O-CB 3.4Å; M86-L90 VanDerWaalsContact O-CG 3.23Å; M86-L90 WeakPolarHBondContact O-CG 3.4Å; M86-L90 PolarHBondContact O-N 2.93Å; M86-A111 HydrophobicContact CE-CB 3.99Å; M86-A111 HydrophobicContact SD-CB 3.79Å; M86-L114 HydrophobicContact CE-CB 3.41Å; M86-L114 VanDerWaalsContact CE-CB 3.41Å; M86-L114 HydrophobicContact CE-CD1 3.56Å; M86-L114 HydrophobicContact CE-CG 4.13Å; M86-L115 HydrophobicContact SD-CG 4.43Å
87	E	89.6	Confident	86.9	Confident	104 Å²	104	41 Å²	41	49%	0.486	22%	0.216	S	C	.	.	H	α-helix	trans	-61	-43.1	174.6	-169.5	-173.7	167.8	0	0	111.4	L83 E84 L90 N91	L83-E87 PolarHBondContact O-N 3.19Å; E84-E87 PolarHBondContact O-N 2.97Å; E87-L90 PolarHBondContact O-N 3.05Å; E87-N91 WeakPolarHBondContact O-CB 3.32Å; E87-N91 VanDerWaalsContact O-CG 3.26Å; E87-N91 PolarHBondContact O-N 2.9Å; E87-N91 PolarHBondContact O-ND2 3Å; E87-N91 VanDerWaalsContact O-ND2 3.14Å
88	L	89.4	Confident	86.3	Confident	10 Å²	10	42.9 Å²	42.9	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-59.3	-47.1	175.1	-179.6	70.1	0	0	0	112.2	Y45 V48 K49 L52 E84 I85 M86 N91 H92	Y45-L88 HydrophobicContact CD2-CD2 4.14Å; Y45-L88 HydrophobicContact CE2-CB 4.08Å; Y45-L88 HydrophobicContact CE2-CD2 3.89Å; Y45-L88 HydrophobicContact CE2-CG 4.39Å; V48-L88 HydrophobicContact CB-CD2 4.47Å; V48-L88 HydrophobicContact CG1-CD2 4.01Å; K49-L88 HydrophobicContact CB-CD1 4.34Å; K49-L88 HydrophobicContact CB-CD2 3.82Å; K49-L88 HydrophobicContact CD-CD1 4.3Å; K49-L88 HydrophobicContact CG-CD1 4.09Å; K49-L88 HydrophobicContact CG-CD2 4.47Å; L52-L88 HydrophobicContact CD1-CD2 4.04Å; L52-L88 HydrophobicContact CD1-CG 3.85Å; E84-L88 WeakPolarHBondContact O-CB 3.45Å; E84-L88 PolarHBondContact O-N 3.49Å; I85-L88 PolarHBondContact O-N 3.27Å; M86-L88 VanDerWaalsContact C-N 3.34Å; M86-L88 PolarHBondContact O-N 2.86Å; L88-N91 PolarHBondContact O-N 3.17Å; L88-H92 PolarHBondContact O-CD2 3.39Å; L88-H92 PolarHBondContact O-N 3.44Å
89	L	88.8	Confident	86.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-42.2	177	-74	169	0	0	0	111.8	F36 L52 A73 L74 A77 I85 M86 H92 S93 V94	F36-L89 HydrophobicContact CZ-CD2 4.15Å; L52-L89 HydrophobicContact CD1-CD2 4.09Å; L52-L89 HydrophobicContact CD2-CD2 4.2Å; A73-L89 HydrophobicContact CB-CD1 4.35Å; A73-L89 HydrophobicContact CB-CD2 4.33Å; L74-L89 HydrophobicContact CD1-CB 4.35Å; L74-L89 HydrophobicContact CD1-CD1 4.48Å; A77-L89 HydrophobicContact CB-CD1 4.08Å; I85-L89 HydrophobicContact CG2-CD1 3.85Å; I85-L89 HydrophobicContact CG2-CG 4.25Å; I85-L89 WeakPolarHBondContact O-CB 3.23Å; I85-L89 VanDerWaalsContact O-CG 3.23Å; I85-L89 WeakPolarHBondContact O-CG 3.21Å; I85-L89 PolarHBondContact O-N 3.08Å; M86-L89 PolarHBondContact O-N 3.27Å; L89-H92 CarbonylContact O-C 3.52Å; L89-H92 PolarHBondContact O-N 3.14Å; L89-S93 PolarHBondContact O-N 3.45Å; L89-V94 HydrophobicContact CB-CG2 4Å; L89-V94 HydrophobicContact CD2-CG2 3.97Å; L89-V94 WeakPolarHBondContact O-CG2 3.43Å; L89-V94 PolarHBondContact O-N 3.29Å
90	L	87.4	Confident	86.1	Confident	5 Å²	5	43 Å²	43	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-39.9	177.5	-70.2	171.5	0	0	0	111.9	L74 M86 E87 H92 S93 V96 L115 Y118	L74-L90 HydrophobicContact CD1-CD2 4.33Å; L74-L90 HydrophobicContact CD1-CG 4.38Å; L74-L90 HydrophobicContact CD2-CD2 4.44Å; M86-L90 HydrophobicContact CE-CD1 4.11Å; M86-L90 HydrophobicContact CG-CD1 4.29Å; M86-L90 WeakPolarHBondContact O-CB 3.4Å; M86-L90 VanDerWaalsContact O-CG 3.23Å; M86-L90 WeakPolarHBondContact O-CG 3.4Å; M86-L90 PolarHBondContact O-N 2.93Å; E87-L90 PolarHBondContact O-N 3.05Å; L90-H92 VanDerWaalsContact C-N 3.27Å; L90-H92 PolarHBondContact O-N 2.77Å; L90-S93 PolarHBondContact O-N 3.34Å; L90-V96 HydrophobicContact CD2-CG2 3.92Å; L90-L115 HydrophobicContact CD1-CD2 3.99Å; L90-L115 HydrophobicContact CD2-CD2 3.86Å; L90-Y118 HydrophobicContact CB-CD2 3.78Å; L90-Y118 HydrophobicContact CB-CE2 3.75Å; L90-Y118 HydrophobicContact CB-CG 4.27Å; L90-Y118 HydrophobicContact CD1-CG 4.39Å; L90-Y118 HydrophobicContact CD2-CD1 3.86Å; L90-Y118 HydrophobicContact CD2-CD2 4.37Å; L90-Y118 HydrophobicContact CD2-CE1 3.99Å; L90-Y118 HydrophobicContact CD2-CE2 4.49Å; L90-Y118 HydrophobicContact CD2-CG 4.05Å; L90-Y118 HydrophobicContact CG-CD2 4.45Å; L90-Y118 HydrophobicContact CG-CG 4.47Å; L90-Y118 WeakPolarHBondContact O-CE2 3.17Å; L90-Y118 PolarHBondContact O-OH 3.34Å
91	N	87.1	Confident	86.2	Confident	114 Å²	114	42.7 Å²	42.7	61%	0.61	23%	0.227	S	C	*	.	H	α-helix	trans	-60.4	-34.5	174.9	-76.6	-33.7	0	0	0	112.8	E87 L88 S93	E87-N91 WeakPolarHBondContact O-CB 3.32Å; E87-N91 VanDerWaalsContact O-CG 3.26Å; E87-N91 PolarHBondContact O-N 2.9Å; E87-N91 PolarHBondContact O-ND2 3Å; E87-N91 VanDerWaalsContact O-ND2 3.14Å; L88-N91 PolarHBondContact O-N 3.17Å; N91-S93 VanDerWaalsContact C-N 3.27Å; N91-S93 PolarHBondContact O-N 3.21Å
92	H	84.8	Confident	86.2	Confident	32 Å²	32	39.7 Å²	39.7	15%	0.148	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	16.9	173.8	-73.1	-76.2	0	0	0	114.3	L52 E56 L88 L89 L90 V94	L52-H92 HydrophobicContact CD2-CB 4.38Å; E56-H92 IonicContact OE1-CE1 3.53Å; E56-H92 PolarHBondContact OE1-CE1 2.81Å; E56-H92 IonicContact OE1-CG 2.6Å; E56-H92 IonicContact OE1-ND1 3.96Å; E56-H92 PolarHBondContact OE1-ND1 3.01Å; E56-H92 IonicContact OE2-CE1 2.6Å; E56-H92 IonicContact OE2-ND1 2.88Å; L88-H92 PolarHBondContact O-CD2 3.39Å; L88-H92 PolarHBondContact O-N 3.44Å; L89-H92 CarbonylContact O-C 3.52Å; L89-H92 PolarHBondContact O-N 3.14Å; L90-H92 VanDerWaalsContact C-N 3.27Å; L90-H92 PolarHBondContact O-N 2.77Å; H92-V94 PolarHBondContact O-N 3.43Å
93	S	80.3	Confident	86.2	Confident	93 Å²	93	39.1 Å²	39.1	65%	0.65	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	32.4	169.8	71.5	0	0	0	0	117.2	L89 L90 N91	L89-S93 PolarHBondContact O-N 3.45Å; L90-S93 PolarHBondContact O-N 3.34Å; N91-S93 VanDerWaalsContact C-N 3.27Å; N91-S93 PolarHBondContact O-N 3.21Å
94	V	84	Confident	86.3	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.018	19%	0.191	C	C	.	.			trans	-52	146.6	173.9	173.1	0	0	0	0	112.8	I63 L74 L89 H92 V96	I63-V94 HydrophobicContact CG2-CG2 3.59Å; L74-V94 HydrophobicContact CB-CG1 4.07Å; L74-V94 HydrophobicContact CD2-CG1 4.38Å; L89-V94 HydrophobicContact CB-CG2 4Å; L89-V94 HydrophobicContact CD2-CG2 3.97Å; L89-V94 WeakPolarHBondContact O-CG2 3.43Å; L89-V94 PolarHBondContact O-N 3.29Å; H92-V94 PolarHBondContact O-N 3.43Å; V94-V96 PolarHBondContact O-N 3.32Å; V94-V96 VanDerWaalsContact O-N 3.14Å
95	Y	82.1	Confident	86.4	Confident	102 Å²	102	34.3 Å²	34.3	40%	0.4	18%	0.181	S	C	.	.			trans	-67.2	111.3	174.3	-179.9	-92.8	0	0	0	110.5	N64 D133	N64-Y95 WeakPolarHBondContact OD1-CB 3.07Å; N64-Y95 PolarHBondContact OD1-N 3.21Å; Y95-D133 PolarHBondContact OH-OD2 2.88Å
96	V	80.2	Confident	86.3	Confident	33 Å²	33	36.4 Å²	36.4	20%	0.2	19%	0.19	C	C	.	.			trans	-73.9	-41.6	-176.9	-177.7	0	0	0	0	112.1	L74 L90 V94 D98 A99 L115 Y118	L74-V96 HydrophobicContact CD2-CB 4.44Å; L74-V96 HydrophobicContact CD2-CG1 4.39Å; L74-V96 HydrophobicContact CD2-CG2 4.39Å; L90-V96 HydrophobicContact CD2-CG2 3.92Å; V94-V96 PolarHBondContact O-N 3.32Å; V94-V96 VanDerWaalsContact O-N 3.14Å; V96-D98 PolarHBondContact O-N 2.93Å; V96-A99 HydrophobicContact CG1-CB 4.15Å; V96-A99 WeakPolarHBondContact O-CB 3.23Å; V96-A99 PolarHBondContact O-N 3.17Å; V96-L115 HydrophobicContact CG1-CD2 3.95Å; V96-Y118 HydrophobicContact CG2-CD1 4.31Å; V96-Y118 HydrophobicContact CG2-CE1 4.09Å
97	G	77.4	Confident	86.4	Confident	33 Å²	33	40.4 Å²	40.4	34%	0.34	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	-129.5	-177.8	0	0	0	0	0	113.1	A99	G97-A99 VanDerWaalsContact C-N 3.27Å; G97-A99 PolarHBondContact O-N 3.21Å
98	D	79.6	Confident	86.4	Confident	42 Å²	42	35.6 Å²	35.6	23%	0.225	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	9.5	178.3	-62.1	-31.2	0	0	0	114.2	V96 L100 L101 Y102 S137 F139	V96-D98 PolarHBondContact O-N 2.93Å; D98-L100 PolarHBondContact O-N 3.34Å; D98-L100 VanDerWaalsContact O-N 3.1Å; D98-L101 HydrophobicContact CB-CD1 4.41Å; D98-L101 WeakPolarHBondContact O-CA 3.4Å; D98-L101 WeakPolarHBondContact O-CB 3.23Å; D98-L101 PolarHBondContact O-N 3.33Å; D98-Y102 PolarHBondContact O-N 3.48Å; D98-S137 VanDerWaalsContact OD2-CB 3.26Å; D98-S137 WeakPolarHBondContact OD2-CB 3.38Å; D98-S137 PolarHBondContact OD2-OG 2.76Å; D98-F139 HydrophobicContact CB-CD2 4.35Å
99	A	85.8	Confident	86.5	Confident	2 Å²	2	37 Å²	37	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-59.1	-26.8	-177.5	0	0	0	0	0	113.7	L74 L75 I78 V96 G97 Y102 A103	L74-A99 HydrophobicContact CD2-CB 3.66Å; L74-A99 HydrophobicContact CG-CB 4.17Å; L75-A99 HydrophobicContact CD2-CB 3.85Å; I78-A99 HydrophobicContact CD1-CB 3.83Å; V96-A99 HydrophobicContact CG1-CB 4.15Å; V96-A99 WeakPolarHBondContact O-CB 3.23Å; V96-A99 PolarHBondContact O-N 3.17Å; G97-A99 VanDerWaalsContact C-N 3.27Å; G97-A99 PolarHBondContact O-N 3.21Å; A99-Y102 PolarHBondContact O-N 3.38Å; A99-A103 WeakPolarHBondContact O-CB 3.44Å; A99-A103 PolarHBondContact O-N 2.91Å
100	L	87.8	Confident	86.5	Confident	36 Å²	36	38.1 Å²	38.1	19%	0.188	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-42.1	170.9	179.6	63	0	0	0	112	D98 I104 V112 L115 L116 P145	D98-L100 PolarHBondContact O-N 3.34Å; D98-L100 VanDerWaalsContact O-N 3.1Å; L100-I104 HydrophobicContact CD1-CD1 4.17Å; L100-I104 HydrophobicContact CG-CD1 4.07Å; L100-I104 WeakPolarHBondContact O-CB 3.41Å; L100-I104 WeakPolarHBondContact O-CD1 3.41Å; L100-I104 WeakPolarHBondContact O-CG1 3.42Å; L100-I104 PolarHBondContact O-N 2.89Å; L100-I104 VanDerWaalsContact O-N 3.07Å; L100-V112 HydrophobicContact CD1-CG1 4.18Å; L100-L115 HydrophobicContact CD1-CB 4.1Å; L100-L115 HydrophobicContact CD1-CD1 4.49Å; L100-L116 HydrophobicContact CD1-CD2 4.29Å; L100-L116 HydrophobicContact CD1-CG 4.32Å; L100-L116 HydrophobicContact CD2-CD2 4.2Å; L100-P145 HydrophobicContact CD2-CB 4.21Å; L100-P145 HydrophobicContact CD2-CG 4.02Å
101	L	88.5	Confident	86.7	Confident	11 Å²	11	38 Å²	38	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-66.3	-41	175.6	-62.6	178.6	0	0	0	110.5	D98 I104 R105 M132 F139 P145 L148	D98-L101 HydrophobicContact CB-CD1 4.41Å; D98-L101 WeakPolarHBondContact O-CA 3.4Å; D98-L101 WeakPolarHBondContact O-CB 3.23Å; D98-L101 PolarHBondContact O-N 3.33Å; L101-I104 PolarHBondContact O-N 3.01Å; L101-R105 PolarHBondContact O-N 3.4Å; L101-M132 HydrophobicContact CD1-CE 4.31Å; L101-F139 HydrophobicContact CB-CD2 3.65Å; L101-F139 HydrophobicContact CB-CE1 4.45Å; L101-F139 HydrophobicContact CB-CE2 3.5Å; L101-F139 VanDerWaalsContact CB-CE2 3.5Å; L101-F139 HydrophobicContact CB-CG 4.21Å; L101-F139 HydrophobicContact CB-CZ 3.93Å; L101-F139 HydrophobicContact CD1-CB 4.05Å; L101-F139 HydrophobicContact CD1-CD2 3.86Å; L101-F139 HydrophobicContact CD1-CG 3.99Å; L101-F139 HydrophobicContact CG-CD2 4.41Å; L101-P145 HydrophobicContact CD2-CB 4.11Å; L101-P145 HydrophobicContact CD2-CG 3.85Å; L101-L148 HydrophobicContact CB-CD2 3.75Å; L101-L148 HydrophobicContact CD2-CB 4.48Å; L101-L148 HydrophobicContact CD2-CD2 4Å; L101-L148 HydrophobicContact CG-CD2 4.46Å; L101-L148 WeakPolarHBondContact O-CD2 3.02Å
102	Y	88.5	Confident	86.8	Confident	15 Å²	15	32.5 Å²	32.5	6%	0.059	18%	0.178	C	C	.	.	H	α-helix	trans	-62.4	-46.2	176.3	-166.7	-83.9	0	0	0	112.4	L75 I78 E79 D98 A99 I104 R105 K106	L75-Y102 HydrophobicContact CD2-CD1 3.95Å; L75-Y102 HydrophobicContact CD2-CD2 4Å; L75-Y102 HydrophobicContact CD2-CG 3.6Å; I78-Y102 HydrophobicContact CB-CD1 4.39Å; I78-Y102 HydrophobicContact CG2-CD1 3.86Å; I78-Y102 HydrophobicContact CG2-CE1 4.32Å; E79-Y102 HydrophobicContact CB-CE1 4.19Å; D98-Y102 PolarHBondContact O-N 3.48Å; A99-Y102 PolarHBondContact O-N 3.38Å; Y102-I104 VanDerWaalsContact C-N 3.32Å; Y102-I104 PolarHBondContact O-N 3.29Å; Y102-R105 PolarHBondContact O-N 3.05Å; Y102-K106 HydrophobicContact CD1-CG 4.07Å; Y102-K106 HydrophobicContact CE1-CG 3.77Å; Y102-K106 PolarHBondContact O-N 3.5Å
103	A	91.1	Very high	87.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.1	-38.3	175.8	0	0	0	0	0	112.6	I78 A99 K106 E107 V108 A111 V112 L115	I78-A103 HydrophobicContact CD1-CB 4.38Å; I78-A103 HydrophobicContact CG2-CB 3.82Å; A99-A103 WeakPolarHBondContact O-CB 3.44Å; A99-A103 PolarHBondContact O-N 2.91Å; A103-K106 PolarHBondContact O-N 3.34Å; A103-E107 PolarHBondContact O-N 3.32Å; A103-E107 VanDerWaalsContact O-N 3.1Å; A103-V108 PolarHBondContact O-N 3.14Å; A103-A111 HydrophobicContact CB-CB 4.2Å; A103-V112 HydrophobicContact CB-CG2 3.85Å; A103-L115 HydrophobicContact CB-CD1 3.95Å
104	I	91.4	Very high	87.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-42.1	174.8	-71	167.4	0	0	0	111.3	L100 L101 Y102 K106 E107 V112 P145 L148 A149 I157 L161	L100-I104 HydrophobicContact CD1-CD1 4.17Å; L100-I104 HydrophobicContact CG-CD1 4.07Å; L100-I104 WeakPolarHBondContact O-CB 3.41Å; L100-I104 WeakPolarHBondContact O-CD1 3.41Å; L100-I104 WeakPolarHBondContact O-CG1 3.42Å; L100-I104 PolarHBondContact O-N 2.89Å; L100-I104 VanDerWaalsContact O-N 3.07Å; L101-I104 PolarHBondContact O-N 3.01Å; Y102-I104 VanDerWaalsContact C-N 3.32Å; Y102-I104 PolarHBondContact O-N 3.29Å; I104-K106 VanDerWaalsContact C-N 3.32Å; I104-K106 PolarHBondContact O-N 2.86Å; I104-E107 PolarHBondContact O-N 2.97Å; I104-E107 VanDerWaalsContact O-N 3.12Å; I104-V112 HydrophobicContact CG1-CG1 4.49Å; I104-V112 HydrophobicContact CG1-CG2 3.79Å; I104-P145 HydrophobicContact CD1-CB 3.73Å; I104-L148 HydrophobicContact CB-CD2 4.45Å; I104-L148 HydrophobicContact CG2-CB 4.12Å; I104-L148 HydrophobicContact CG2-CD2 4.29Å; I104-L148 HydrophobicContact CG2-CG 3.99Å; I104-A149 VanDerWaalsContact CG2-CA 3.45Å; I104-A149 HydrophobicContact CG2-CB 3.7Å; I104-I157 HydrophobicContact CG1-CG2 3.93Å; I104-I157 HydrophobicContact CG2-CG2 4.29Å; I104-L161 HydrophobicContact CD1-CD1 4.1Å
105	R	90.5	Very high	87.6	Confident	85 Å²	85	35.1 Å²	35.1	32%	0.321	18%	0.181	S	C	.	.	H	α-helix	trans	-65.8	-33.5	177.1	-176.3	179	63.4	173.4	-0.6	112.8	L101 Y102 E107 E138 F139 L148	L101-R105 PolarHBondContact O-N 3.4Å; Y102-R105 PolarHBondContact O-N 3.05Å; R105-E107 VanDerWaalsContact C-N 3.26Å; R105-E138 IonicContact CZ-OE1 3.35Å; R105-E138 VanDerWaalsContact CZ-OE1 3.24Å; R105-E138 IonicContact CZ-OE2 3.42Å; R105-E138 IonicContact NH1-OE1 2.71Å; R105-E138 PolarHBondContact NH1-OE1 3.14Å; R105-E138 IonicContact NH1-OE2 3.83Å; R105-E138 IonicContact NH2-OE1 3.88Å; R105-E138 PolarHBondContact NH2-OE1 3.29Å; R105-E138 IonicContact NH2-OE2 3.6Å; R105-E138 PolarHBondContact NH2-OE2 2.95Å; R105-F139 HydrophobicContact CB-CE1 4.48Å; R105-F139 HydrophobicContact CB-CZ 4.27Å; R105-L148 HydrophobicContact CB-CD2 4.37Å
106	K	88.6	Confident	87.7	Confident	43 Å²	43	32.1 Å²	32.1	19%	0.187	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-1.7	173.6	-68.1	-60.7	-165.4	177.2	0	113.6	Y102 A103 I104 V108 E741	Y102-K106 HydrophobicContact CD1-CG 4.07Å; Y102-K106 HydrophobicContact CE1-CG 3.77Å; Y102-K106 PolarHBondContact O-N 3.5Å; A103-K106 PolarHBondContact O-N 3.34Å; I104-K106 VanDerWaalsContact C-N 3.32Å; I104-K106 PolarHBondContact O-N 2.86Å; K106-V108 HydrophobicContact CB-CG2 3.74Å; K106-V108 PolarHBondContact O-N 2.73Å; K106-V108 VanDerWaalsContact O-N 3.15Å; K106-E741 IonicContact NZ-OE1 3.4Å; K106-E741 PolarHBondContact NZ-OE1 3.05Å; K106-E741 IonicContact NZ-OE2 3.87Å; K106-E741 PolarHBondContact NZ-OE2 3.09Å
107	E	90.8	Very high	87.9	Confident	85 Å²	85	34 Å²	34	40%	0.397	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	17.6	178.5	-59.3	-163.6	-149.5	0	0	116.2	A103 I104 R105 V109 T152 N154 I157	A103-E107 PolarHBondContact O-N 3.32Å; A103-E107 VanDerWaalsContact O-N 3.1Å; I104-E107 PolarHBondContact O-N 2.97Å; I104-E107 VanDerWaalsContact O-N 3.12Å; R105-E107 VanDerWaalsContact C-N 3.26Å; E107-V109 PolarHBondContact O-N 2.83Å; E107-T152 HydrophobicContact CG-CG2 4.29Å; E107-N154 HydrophobicContact CG-CB 4.44Å; E107-N154 WeakPolarHBondContact OE2-CB 3.48Å; E107-N154 PolarHBondContact OE2-ND2 3.46Å; E107-I157 HydrophobicContact CB-CD1 4.41Å
108	V	91.1	Very high	87.9	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.024	18%	0.182	C	C	.	.			trans	-77.2	89.7	-175.5	-168.8	0	0	0	0	111	E81 A103 K106 G110 A111 V112	E81-V108 HydrophobicContact CB-CG1 4.36Å; E81-V108 HydrophobicContact CG-CG1 3.95Å; E81-V108 HydrophobicContact CG-CG2 3.84Å; A103-V108 PolarHBondContact O-N 3.14Å; K106-V108 HydrophobicContact CB-CG2 3.74Å; K106-V108 PolarHBondContact O-N 2.73Å; K106-V108 VanDerWaalsContact O-N 3.15Å; V108-G110 VanDerWaalsContact C-N 3.34Å; V108-G110 PolarHBondContact O-N 2.79Å; V108-A111 HydrophobicContact CB-CB 3.88Å; V108-A111 HydrophobicContact CG1-CB 3.57Å; V108-A111 PolarHBondContact O-N 3.29Å; V108-A111 VanDerWaalsContact O-N 3.14Å; V108-V112 PolarHBondContact O-N 3.44Å
109	V	91.1	Very high	87	Confident	38 Å²	38	43.4 Å²	43.4	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-55.8	-44.6	-174.1	-174	0	0	0	0	112.4	E107 A111 V112 E113 E156 I157 L160	E107-V109 PolarHBondContact O-N 2.83Å; V109-A111 PolarHBondContact O-N 3.27Å; V109-V112 PolarHBondContact O-N 3.18Å; V109-E113 PolarHBondContact O-N 2.78Å; V109-E156 HydrophobicContact CG1-CB 4.3Å; V109-E156 HydrophobicContact CG2-CB 4.24Å; V109-I157 HydrophobicContact CG2-CG1 4.13Å; V109-L160 HydrophobicContact CG1-CD1 4.01Å
110	G	88.8	Confident	85.5	Confident	25 Å²	25	49.3 Å²	49.3	26%	0.258	23%	0.234	S	C	.	.	H	α-helix	trans	-64.5	-37.7	179.5	0	0	0	0	0	113.1	V108 E113 L114	V108-G110 VanDerWaalsContact C-N 3.34Å; V108-G110 PolarHBondContact O-N 2.79Å; G110-E113 PolarHBondContact O-N 3.1Å; G110-L114 WeakPolarHBondContact O-CB 3.3Å; G110-L114 WeakPolarHBondContact O-CG 3.4Å; G110-L114 PolarHBondContact O-N 2.96Å
111	A	90.3	Very high	83.3	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-67	-41.5	175.7	0	0	0	0	0	111.3	I78 L83 M86 A103 V108 V109 L114 L115	I78-A111 HydrophobicContact CG1-CB 4.47Å; L83-A111 HydrophobicContact CD2-CB 4.26Å; M86-A111 HydrophobicContact CE-CB 3.99Å; M86-A111 HydrophobicContact SD-CB 3.79Å; A103-A111 HydrophobicContact CB-CB 4.2Å; V108-A111 HydrophobicContact CB-CB 3.88Å; V108-A111 HydrophobicContact CG1-CB 3.57Å; V108-A111 PolarHBondContact O-N 3.29Å; V108-A111 VanDerWaalsContact O-N 3.14Å; V109-A111 PolarHBondContact O-N 3.27Å; A111-L114 PolarHBondContact O-N 3.13Å; A111-L115 WeakPolarHBondContact O-CB 3.37Å; A111-L115 VanDerWaalsContact O-CG 3.24Å; A111-L115 WeakPolarHBondContact O-CG 3.36Å; A111-L115 PolarHBondContact O-N 3.26Å
112	V	90.2	Very high	81	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-41.3	175.3	175.2	0	0	0	0	111.6	L100 A103 I104 V108 V109 L115 L116 I157	L100-V112 HydrophobicContact CD1-CG1 4.18Å; A103-V112 HydrophobicContact CB-CG2 3.85Å; I104-V112 HydrophobicContact CG1-CG1 4.49Å; I104-V112 HydrophobicContact CG1-CG2 3.79Å; V108-V112 PolarHBondContact O-N 3.44Å; V109-V112 PolarHBondContact O-N 3.18Å; V112-L115 PolarHBondContact O-N 3.2Å; V112-L116 HydrophobicContact CG1-CD1 3.63Å; V112-L116 HydrophobicContact CG1-CG 4.09Å; V112-L116 VanDerWaalsContact O-CB 3.27Å; V112-L116 WeakPolarHBondContact O-CB 3.22Å; V112-L116 WeakPolarHBondContact O-CG 3.29Å; V112-L116 PolarHBondContact O-N 3.04Å; V112-I157 HydrophobicContact CG1-CG2 4.35Å; V112-I157 HydrophobicContact CG2-CD1 4.38Å
113	E	90.2	Very high	78.5	Confident	116 Å²	116	61.3 Å²	61.3	54%	0.542	33%	0.334	S	S	.	.	H	α-helix	trans	-64.8	-43.2	177.5	-176.4	166.6	-156.6	0	0	112.5	V109 G110 L116 S117 L160	V109-E113 PolarHBondContact O-N 2.78Å; G110-E113 PolarHBondContact O-N 3.1Å; E113-L116 PolarHBondContact O-N 3.28Å; E113-S117 WeakPolarHBondContact O-CB 3.31Å; E113-S117 PolarHBondContact O-N 3.29Å; E113-S117 PolarHBondContact O-OG 3.26Å; E113-L160 HydrophobicContact CB-CD1 4.37Å
114	L	88.1	Confident	75.7	Confident	49 Å²	49	69.2 Å²	69.2	26%	0.257	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-44.7	173.5	-76.3	170.4	0	0	0	111.5	L83 M86 G110 A111 L116 S117 Y118	L83-L114 HydrophobicContact CB-CD1 4.12Å; L83-L114 HydrophobicContact CD2-CD1 4.3Å; M86-L114 HydrophobicContact CE-CB 3.41Å; M86-L114 VanDerWaalsContact CE-CB 3.41Å; M86-L114 HydrophobicContact CE-CD1 3.56Å; M86-L114 HydrophobicContact CE-CG 4.13Å; G110-L114 WeakPolarHBondContact O-CB 3.3Å; G110-L114 WeakPolarHBondContact O-CG 3.4Å; G110-L114 PolarHBondContact O-N 2.96Å; A111-L114 PolarHBondContact O-N 3.13Å; L114-L116 PolarHBondContact O-N 2.84Å; L114-S117 WeakPolarHBondContact CA-OG 3.45Å; L114-S117 PolarHBondContact O-N 3.49Å; L114-S117 PolarHBondContact O-OG 3.44Å; L114-Y118 VanDerWaalsContact O-CB 3.23Å; L114-Y118 WeakPolarHBondContact O-CB 3.33Å; L114-Y118 PolarHBondContact O-N 2.55Å
115	L	87.6	Confident	73.1	Confident	17 Å²	17	79 Å²	79	9%	0.089	41%	0.413	C	S	.	.	H	α-helix	trans	-67.3	-32.5	176.7	-70.1	170	0	0	0	113.4	I78 M86 L90 V96 L100 A103 A111 V112	I78-L115 HydrophobicContact CD1-CD1 4.17Å; M86-L115 HydrophobicContact SD-CG 4.43Å; L90-L115 HydrophobicContact CD1-CD2 3.99Å; L90-L115 HydrophobicContact CD2-CD2 3.86Å; V96-L115 HydrophobicContact CG1-CD2 3.95Å; L100-L115 HydrophobicContact CD1-CB 4.1Å; L100-L115 HydrophobicContact CD1-CD1 4.49Å; A103-L115 HydrophobicContact CB-CD1 3.95Å; A111-L115 WeakPolarHBondContact O-CB 3.37Å; A111-L115 VanDerWaalsContact O-CG 3.24Å; A111-L115 WeakPolarHBondContact O-CG 3.36Å; A111-L115 PolarHBondContact O-N 3.26Å; V112-L115 PolarHBondContact O-N 3.2Å
116	L	85	Confident	70.5	Confident	39 Å²	39	80.3 Å²	80.3	20%	0.204	42%	0.423	C	S	.	.	H	α-helix	trans	-82.2	-15.4	176.3	-71.3	176.3	0	0	0	114.1	L100 V112 E113 L114 L160 L161 K164	L100-L116 HydrophobicContact CD1-CD2 4.29Å; L100-L116 HydrophobicContact CD1-CG 4.32Å; L100-L116 HydrophobicContact CD2-CD2 4.2Å; V112-L116 HydrophobicContact CG1-CD1 3.63Å; V112-L116 HydrophobicContact CG1-CG 4.09Å; V112-L116 VanDerWaalsContact O-CB 3.27Å; V112-L116 WeakPolarHBondContact O-CB 3.22Å; V112-L116 WeakPolarHBondContact O-CG 3.29Å; V112-L116 PolarHBondContact O-N 3.04Å; E113-L116 PolarHBondContact O-N 3.28Å; L114-L116 PolarHBondContact O-N 2.84Å; L116-L160 HydrophobicContact CD1-CB 4.27Å; L116-L161 HydrophobicContact CD1-CD2 3.83Å; L116-L161 HydrophobicContact CD1-CG 4.47Å; L116-L161 HydrophobicContact CD2-CD2 3.96Å; L116-L161 HydrophobicContact CG-CD2 4.5Å; L116-K164 PolarHBondContact O-NZ 2.9Å
117	S	83.6	Confident	68	Low	74 Å²	74	84.6 Å²	84.6	52%	0.517	45%	0.453	S	S	.	.	H	α-helix	trans	-93.8	-27.7	171.2	58.1	0	0	0	0	111.8	E113 L114 R119	E113-S117 WeakPolarHBondContact O-CB 3.31Å; E113-S117 PolarHBondContact O-N 3.29Å; E113-S117 PolarHBondContact O-OG 3.26Å; L114-S117 WeakPolarHBondContact CA-OG 3.45Å; L114-S117 PolarHBondContact O-N 3.49Å; L114-S117 PolarHBondContact O-OG 3.44Å; S117-R119 VanDerWaalsContact C-N 3.26Å; S117-R119 PolarHBondContact O-N 3.32Å
118	Y	77.4	Confident	65.6	Low	63 Å²	63	86 Å²	86	25%	0.247	47%	0.469	C	S	.	.			trans	-64.9	80	171.3	-172.7	-103.4	0	0	0	112.4	L90 V96 L114 K120	L90-Y118 HydrophobicContact CB-CD2 3.78Å; L90-Y118 HydrophobicContact CB-CE2 3.75Å; L90-Y118 HydrophobicContact CB-CG 4.27Å; L90-Y118 HydrophobicContact CD1-CG 4.39Å; L90-Y118 HydrophobicContact CD2-CD1 3.86Å; L90-Y118 HydrophobicContact CD2-CD2 4.37Å; L90-Y118 HydrophobicContact CD2-CE1 3.99Å; L90-Y118 HydrophobicContact CD2-CE2 4.49Å; L90-Y118 HydrophobicContact CD2-CG 4.05Å; L90-Y118 HydrophobicContact CG-CD2 4.45Å; L90-Y118 HydrophobicContact CG-CG 4.47Å; L90-Y118 WeakPolarHBondContact O-CE2 3.17Å; L90-Y118 PolarHBondContact O-OH 3.34Å; V96-Y118 HydrophobicContact CG2-CD1 4.31Å; V96-Y118 HydrophobicContact CG2-CE1 4.09Å; L114-Y118 VanDerWaalsContact O-CB 3.23Å; L114-Y118 WeakPolarHBondContact O-CB 3.33Å; L114-Y118 PolarHBondContact O-N 2.55Å; Y118-K120 HydrophobicContact CE1-CG 4.39Å
119	R	60.8	Low	63	Low	208 Å²	208	90.8 Å²	90.8	79%	0.785	50%	0.499	S	S	*	.			trans	-87.8	109.1	175.1	-170.1	179.6	-166.2	165.1	7.4	109.3	S117	S117-R119 VanDerWaalsContact C-N 3.26Å; S117-R119 PolarHBondContact O-N 3.32Å
120	K	54.2	Low	60.7	Low	126 Å²	126	95.1 Å²	95.1	55%	0.548	52%	0.52	S	S	.	.			trans	-48.1	128.9	165.9	-83.9	-171.7	173.8	-177.8	0	109.6	Y118 S122	Y118-K120 HydrophobicContact CE1-CG 4.39Å; K120-S122 PolarHBondContact O-N 3.36Å
121	P	40.8	Very low	58.3	Low	141 Å²	141	101.7 Å²	101.7	92%	0.916	55%	0.546	S	S	*	.			trans	-75.7	71.2	173.6	31.9	-34.8	0	0	0	110.1
122	S	41.3	Very low	56	Low	92 Å²	92	103.5 Å²	103.5	64%	0.643	56%	0.555	S	S	*	*			trans	-125.7	135.8	167.8	-168.2	0	0	0	0	110	K120 E124	K120-S122 PolarHBondContact O-N 3.36Å; S122-E124 PolarHBondContact O-N 2.93Å
123	G	35.6	Very low	53.6	Low	82 Å²	82	108.8 Å²	108.8	85%	0.845	58%	0.583	S	S	*	*			trans	-77.8	18.5	-160.4	0	0	0	0	0	116.9
124	E	32.7	Very low	51.6	Low	166 Å²	166	109.7 Å²	109.7	78%	0.776	60%	0.597	S	S	*	*			trans	-97	117.3	-175.9	-65.6	-164.3	137.4	0	0	112.6	S122 Q126	S122-E124 PolarHBondContact O-N 2.93Å; E124-Q126 PolarHBondContact O-N 3.01Å
125	K	35.8	Very low	49.9	Very low	204 Å²	204	114.9 Å²	114.9	89%	0.887	62%	0.619	S	S	*	*			trans	-80.8	70.4	170.2	-71.5	-179.1	179.4	174	0	110.4
126	Q	37.2	Very low	48.5	Very low	113 Å²	113	123.1 Å²	123.1	53%	0.528	66%	0.655	S	S	.	*	S	Bend	trans	-146.9	146	161.2	-107.1	158.3	7.5	0	0	109.1	E124	E124-Q126 PolarHBondContact O-N 3.01Å
127	V	36.3	Very low	47.7	Very low	134 Å²	134	122.9 Å²	122.9	81%	0.812	66%	0.657	S	S	*	*			trans	-60.9	128.6	166.8	-176.1	0	0	0	0	106	T129	V127-T129 PolarHBondContact O-N 2.88Å
128	P	39.7	Very low	47.4	Very low	114 Å²	114	125 Å²	125	74%	0.74	66%	0.658	S	S	*	*			trans	-55.5	112.3	-172.3	-29	36	0	0	0	112.4	L130	P128-L130 PolarHBondContact O-N 3.1Å
129	T	37.5	Very low	47.6	Very low	104 Å²	104	123 Å²	123	64%	0.638	65%	0.651	S	S	*	*			trans	-64.8	124.2	171.4	-41.2	0	0	0	0	108.5	V127 M131	V127-T129 PolarHBondContact O-N 2.88Å; T129-M131 PolarHBondContact O-N 3.44Å
130	L	41.8	Very low	48.6	Very low	130 Å²	130	115.3 Å²	115.3	68%	0.681	63%	0.627	S	S	*	*			trans	18.8	85.9	171.5	-76.3	94.7	0	0	0	115.7	P128	P128-L130 PolarHBondContact O-N 3.1Å
131	M	38.8	Very low	49.8	Very low	163 Å²	163	112.1 Å²	112.1	80%	0.803	62%	0.619	S	S	*	*			trans	-114.1	57.9	159.7	-69	-143.1	158.5	0	0	110.6	T129	T129-M131 PolarHBondContact O-N 3.44Å
132	M	42.5	Very low	51.7	Low	39 Å²	39	106.6 Å²	106.6	19%	0.192	58%	0.582	C	S	.	*			trans	-81.9	121.4	154.7	-76.8	-169.6	166.6	0	0	108.1	L101 T134 S137 F139 P141	L101-M132 HydrophobicContact CD1-CE 4.31Å; M132-T134 PolarHBondContact O-N 2.73Å; M132-T134 VanDerWaalsContact O-N 3.17Å; M132-S137 WeakPolarHBondContact CE-OG 3.46Å; M132-F139 HydrophobicContact CE-CB 4.34Å; M132-P141 WeakPolarHBondContact SD-CA 3.44Å; M132-P141 HydrophobicContact SD-CB 3.59Å; M132-P141 VanDerWaalsContact SD-CB 3.59Å
133	D	39.2	Very low	53.9	Low	111 Å²	111	103.4 Å²	103.4	59%	0.594	56%	0.558	S	S	*	*			trans	-66.2	111.7	158.4	-102.7	-50	0	0	0	107.7	Y95 Q135	Y95-D133 PolarHBondContact OH-OD2 2.88Å; D133-Q135 PolarHBondContact O-N 2.91Å
134	T	47.4	Very low	56.4	Low	135 Å²	135	101.7 Å²	101.7	83%	0.828	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	3.3	-163.9	33.8	0	0	0	0	115.3	M132	M132-T134 PolarHBondContact O-N 2.73Å; M132-T134 VanDerWaalsContact O-N 3.17Å
135	Q	52	Low	59.1	Low	157 Å²	157	95.6 Å²	95.6	73%	0.734	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-28.5	-170.8	-59.9	-173	2.8	0	0	113.5	D133	D133-Q135 PolarHBondContact O-N 2.91Å
136	F	58.6	Low	61.7	Low	190 Å²	190	86 Å²	86	83%	0.833	46%	0.464	S	S	*	.	S	Bend	trans	-148.9	31	-174.4	-65.4	-78.1	0	0	0	115	E138	F136-E138 PolarHBondContact O-N 2.68Å
137	S	69.3	Low	64.3	Low	35 Å²	35	80.7 Å²	80.7	25%	0.245	44%	0.439	C	S	.	.			trans	-67.5	130.9	168.3	-172.6	0	0	0	0	110.4	D98 M132 F139	D98-S137 VanDerWaalsContact OD2-CB 3.26Å; D98-S137 WeakPolarHBondContact OD2-CB 3.38Å; D98-S137 PolarHBondContact OD2-OG 2.76Å; M132-S137 WeakPolarHBondContact CE-OG 3.46Å; S137-F139 PolarHBondContact O-N 2.85Å; S137-F139 PolarHBondContact OG-N 2.67Å; S137-F139 PolarHBondContact OG-O 3.23Å
138	E	75.8	Confident	66.9	Low	118 Å²	118	75 Å²	75	55%	0.551	40%	0.404	S	S	*	.	S	Bend	trans	-73.9	-18.4	174.6	-162.1	-176.2	174.6	0	0	112.1	R105 F136	R105-E138 IonicContact CZ-OE1 3.35Å; R105-E138 VanDerWaalsContact CZ-OE1 3.24Å; R105-E138 IonicContact CZ-OE2 3.42Å; R105-E138 IonicContact NH1-OE1 2.71Å; R105-E138 PolarHBondContact NH1-OE1 3.14Å; R105-E138 IonicContact NH1-OE2 3.83Å; R105-E138 IonicContact NH2-OE1 3.88Å; R105-E138 PolarHBondContact NH2-OE1 3.29Å; R105-E138 IonicContact NH2-OE2 3.6Å; R105-E138 PolarHBondContact NH2-OE2 2.95Å; F136-E138 PolarHBondContact O-N 2.68Å
139	F	82.3	Confident	69.5	Low	20 Å²	20	69.5 Å²	69.5	9%	0.088	37%	0.369	C	S	.	.	S	Bend	trans	-105.4	152.5	-176.1	-62.3	-80.2	0	0	0	111.3	D98 L101 R105 M132 S137 L148	D98-F139 HydrophobicContact CB-CD2 4.35Å; L101-F139 HydrophobicContact CB-CD2 3.65Å; L101-F139 HydrophobicContact CB-CE1 4.45Å; L101-F139 HydrophobicContact CB-CE2 3.5Å; L101-F139 VanDerWaalsContact CB-CE2 3.5Å; L101-F139 HydrophobicContact CB-CG 4.21Å; L101-F139 HydrophobicContact CB-CZ 3.93Å; L101-F139 HydrophobicContact CD1-CB 4.05Å; L101-F139 HydrophobicContact CD1-CD2 3.86Å; L101-F139 HydrophobicContact CD1-CG 3.99Å; L101-F139 HydrophobicContact CG-CD2 4.41Å; R105-F139 HydrophobicContact CB-CE1 4.48Å; R105-F139 HydrophobicContact CB-CZ 4.27Å; M132-F139 HydrophobicContact CE-CB 4.34Å; S137-F139 PolarHBondContact O-N 2.85Å; S137-F139 PolarHBondContact OG-N 2.67Å; S137-F139 PolarHBondContact OG-O 3.23Å; F139-L148 HydrophobicContact CD1-CD1 4.47Å; F139-L148 HydrophobicContact CD1-CD2 4.01Å; F139-L148 HydrophobicContact CE1-CD1 4.13Å; F139-L148 HydrophobicContact CE1-CD2 3.51Å; F139-L148 HydrophobicContact CE1-CG 4.5Å; F139-L148 HydrophobicContact CZ-CD2 3.94Å
140	T	82.3	Confident	72.2	Confident	47 Å²	47	64.7 Å²	64.7	29%	0.288	34%	0.339	S	S	.	.			trans	-72.6	139.4	173.8	61.1	0	0	0	0	110	D142 I143	T140-D142 WeakPolarHBondContact CB-OD1 3.26Å; T140-D142 PolarHBondContact O-N 3.03Å; T140-D142 PolarHBondContact OG1-OD1 3.36Å; T140-I143 WeakPolarHBondContact O-CB 3.18Å; T140-I143 PolarHBondContact O-N 2.91Å; T140-I143 VanDerWaalsContact OG1-CD1 3.32Å; T140-I143 WeakPolarHBondContact OG1-CD1 3.13Å; T140-I143 WeakPolarHBondContact OG1-CG1 3.43Å
141	P	79.3	Confident	74.6	Confident	59 Å²	59	60.7 Å²	60.7	38%	0.383	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	0.9	-169.1	25.7	-36.6	0	0	0	116.2	M132	M132-P141 WeakPolarHBondContact SD-CA 3.44Å; M132-P141 HydrophobicContact SD-CB 3.59Å; M132-P141 VanDerWaalsContact SD-CB 3.59Å
142	D	80.9	Confident	77.2	Confident	26 Å²	26	54.4 Å²	54.4	14%	0.139	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-13.9	170.7	61.2	-59.4	0	0	0	113.4	T140 T144 S195 N198	T140-D142 WeakPolarHBondContact CB-OD1 3.26Å; T140-D142 PolarHBondContact O-N 3.03Å; T140-D142 PolarHBondContact OG1-OD1 3.36Å; D142-T144 PolarHBondContact O-N 2.94Å; D142-S195 WeakPolarHBondContact OD2-CA 3.48Å; D142-N198 PolarHBondContact OD2-ND2 3.12Å
143	I	86.8	Confident	79.6	Confident	25 Å²	25	54.6 Å²	54.6	13%	0.128	29%	0.289	C	S	.	.			trans	-78.3	116.3	-177.2	-65.7	174.4	0	0	0	110.5	T140 L148	T140-I143 WeakPolarHBondContact O-CB 3.18Å; T140-I143 PolarHBondContact O-N 2.91Å; T140-I143 VanDerWaalsContact OG1-CD1 3.32Å; T140-I143 WeakPolarHBondContact OG1-CD1 3.13Å; T140-I143 WeakPolarHBondContact OG1-CG1 3.43Å; I143-L148 HydrophobicContact CG2-CB 3.79Å; I143-L148 HydrophobicContact CG2-CD1 4.46Å
144	T	88.1	Confident	82.2	Confident	45 Å²	45	50.6 Å²	50.6	28%	0.276	27%	0.268	S	S	.	.			trans	-88	157	168.4	66.5	0	0	0	0	111.4	D142 I146 M147 L148	D142-T144 PolarHBondContact O-N 2.94Å; T144-I146 PolarHBondContact O-N 3.1Å; T144-I146 WeakPolarHBondContact OG1-CG2 3.38Å; T144-M147 HydrophobicContact CG2-SD 4Å; T144-M147 WeakPolarHBondContact O-CB 3.26Å; T144-M147 PolarHBondContact O-N 2.9Å; T144-M147 VanDerWaalsContact OG1-CG 3.22Å; T144-M147 WeakPolarHBondContact OG1-CG 3.5Å; T144-M147 PolarHBondContact OG1-N 3.41Å; T144-M147 PolarHBondContact OG1-SD 3.3Å; T144-L148 PolarHBondContact O-N 3.1Å
145	P	89.8	Confident	84.3	Confident	38 Å²	38	46.9 Å²	46.9	25%	0.247	24%	0.239	C	C	.	.	H	α-helix	trans	-54.8	-36.9	177.7	-28.3	35.5	0	0	0	114.2	L100 L101 I104 A149 L161	L100-P145 HydrophobicContact CD2-CB 4.21Å; L100-P145 HydrophobicContact CD2-CG 4.02Å; L101-P145 HydrophobicContact CD2-CB 4.11Å; L101-P145 HydrophobicContact CD2-CG 3.85Å; I104-P145 HydrophobicContact CD1-CB 3.73Å; P145-A149 WeakPolarHBondContact O-CB 3.42Å; P145-A149 PolarHBondContact O-N 3.19Å; P145-L161 HydrophobicContact CB-CD2 4.45Å
146	I	90	Very high	86.2	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-71.5	-33.3	177.1	-173	63.1	0	0	0	112.4	T144 A150 I158 L161 V162 V166 I168	T144-I146 PolarHBondContact O-N 3.1Å; T144-I146 WeakPolarHBondContact OG1-CG2 3.38Å; I146-A150 VanDerWaalsContact O-CB 3.27Å; I146-A150 WeakPolarHBondContact O-CB 3.23Å; I146-A150 PolarHBondContact O-N 3.48Å; I146-I158 HydrophobicContact CD1-CG2 4.11Å; I146-L161 HydrophobicContact CD1-CB 3.9Å; I146-L161 HydrophobicContact CD1-CD1 4.24Å; I146-V162 HydrophobicContact CD1-CG2 4.29Å; I146-V166 HydrophobicContact CB-CB 4.31Å; I146-V166 HydrophobicContact CB-CG1 3.83Å; I146-V166 HydrophobicContact CG2-CB 4.4Å; I146-V166 HydrophobicContact CG2-CG1 3.51Å; I146-I168 HydrophobicContact CG1-CD1 4.05Å; I146-I168 HydrophobicContact CG1-CG1 4.07Å; I146-I168 HydrophobicContact CG2-CD1 4.43Å; I146-I168 HydrophobicContact CG2-CG1 3.66Å
147	M	91.7	Very high	87.8	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-66.8	-45.3	175	-72.7	160.6	63.2	0	0	110.6	T144 A150 H151 N198 I199 A202	T144-M147 HydrophobicContact CG2-SD 4Å; T144-M147 WeakPolarHBondContact O-CB 3.26Å; T144-M147 PolarHBondContact O-N 2.9Å; T144-M147 VanDerWaalsContact OG1-CG 3.22Å; T144-M147 WeakPolarHBondContact OG1-CG 3.5Å; T144-M147 PolarHBondContact OG1-N 3.41Å; T144-M147 PolarHBondContact OG1-SD 3.3Å; M147-A150 WeakPolarHBondContact O-CB 3.39Å; M147-A150 PolarHBondContact O-N 2.99Å; M147-H151 PolarHBondContact O-CD2 3.03Å; M147-H151 VanDerWaalsContact O-CG 3.3Å; M147-H151 PolarHBondContact O-N 3.15Å; M147-N198 HydrophobicContact CE-CB 3.78Å; M147-I199 HydrophobicContact CE-CG1 3.81Å; M147-I199 HydrophobicContact SD-CG1 4.33Å; M147-A202 HydrophobicContact CB-CB 4.08Å; M147-A202 HydrophobicContact CG-CB 3.95Å
148	L	92.1	Very high	88.9	Confident	14 Å²	14	33.2 Å²	33.2	7%	0.073	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-40.5	177.9	-169.1	61.2	0	0	0	112.4	L101 I104 R105 F139 I143 T144 A150 H151 T152	L101-L148 HydrophobicContact CB-CD2 3.75Å; L101-L148 HydrophobicContact CD2-CB 4.48Å; L101-L148 HydrophobicContact CD2-CD2 4Å; L101-L148 HydrophobicContact CG-CD2 4.46Å; L101-L148 WeakPolarHBondContact O-CD2 3.02Å; I104-L148 HydrophobicContact CB-CD2 4.45Å; I104-L148 HydrophobicContact CG2-CB 4.12Å; I104-L148 HydrophobicContact CG2-CD2 4.29Å; I104-L148 HydrophobicContact CG2-CG 3.99Å; R105-L148 HydrophobicContact CB-CD2 4.37Å; F139-L148 HydrophobicContact CD1-CD1 4.47Å; F139-L148 HydrophobicContact CD1-CD2 4.01Å; F139-L148 HydrophobicContact CE1-CD1 4.13Å; F139-L148 HydrophobicContact CE1-CD2 3.51Å; F139-L148 HydrophobicContact CE1-CG 4.5Å; F139-L148 HydrophobicContact CZ-CD2 3.94Å; I143-L148 HydrophobicContact CG2-CB 3.79Å; I143-L148 HydrophobicContact CG2-CD1 4.46Å; T144-L148 PolarHBondContact O-N 3.1Å; L148-A150 VanDerWaalsContact C-N 3.28Å; L148-A150 PolarHBondContact O-N 2.83Å; L148-H151 WeakPolarHBondContact O-CB 3.34Å; L148-H151 PolarHBondContact O-N 2.96Å; L148-H151 VanDerWaalsContact O-N 3.1Å; L148-T152 PolarHBondContact O-N 2.87Å
149	A	92.8	Very high	89.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-33.3	175.1	0	0	0	0	0	112.6	I104 P145 T152 N153 I157 I158 L161	I104-A149 VanDerWaalsContact CG2-CA 3.45Å; I104-A149 HydrophobicContact CG2-CB 3.7Å; P145-A149 WeakPolarHBondContact O-CB 3.42Å; P145-A149 PolarHBondContact O-N 3.19Å; A149-T152 PolarHBondContact O-OG1 3.39Å; A149-T152 VanDerWaalsContact O-OG1 3.14Å; A149-N153 PolarHBondContact O-N 3.46Å; A149-N153 VanDerWaalsContact O-N 3.16Å; A149-I157 HydrophobicContact CB-CG2 3.66Å; A149-I158 HydrophobicContact CB-CG1 3.93Å; A149-I158 WeakPolarHBondContact O-CD1 3.46Å; A149-I158 WeakPolarHBondContact O-CG1 3.48Å; A149-L161 HydrophobicContact CB-CD1 3.61Å
150	A	94	Very high	90.1	Very high	2 Å²	2	32.8 Å²	32.8	2%	0.017	17%	0.172	C	C	.	.	H	α-helix	trans	-70.4	-34.8	171.6	0	0	0	0	0	112.1	I146 M147 L148 N153 A202 S205 L208	I146-A150 VanDerWaalsContact O-CB 3.27Å; I146-A150 WeakPolarHBondContact O-CB 3.23Å; I146-A150 PolarHBondContact O-N 3.48Å; M147-A150 WeakPolarHBondContact O-CB 3.39Å; M147-A150 PolarHBondContact O-N 2.99Å; L148-A150 VanDerWaalsContact C-N 3.28Å; L148-A150 PolarHBondContact O-N 2.83Å; A150-N153 PolarHBondContact O-N 2.98Å; A150-N153 VanDerWaalsContact O-N 3.12Å; A150-A202 HydrophobicContact CB-CB 3.71Å; A150-S205 WeakPolarHBondContact CB-OG 3.46Å; A150-S205 WeakPolarHBondContact O-CB 3.27Å; A150-L208 HydrophobicContact CB-CD2 4.42Å
151	H	94.2	Very high	90.4	Very high	47 Å²	47	30.7 Å²	30.7	22%	0.218	16%	0.159	C	C	.	.	H	α-helix	trans	-66.9	-37.1	175.4	-67.5	-171.4	0	0	0	112.8	M147 L148 N153 N198	M147-H151 PolarHBondContact O-CD2 3.03Å; M147-H151 VanDerWaalsContact O-CG 3.3Å; M147-H151 PolarHBondContact O-N 3.15Å; L148-H151 WeakPolarHBondContact O-CB 3.34Å; L148-H151 PolarHBondContact O-N 2.96Å; L148-H151 VanDerWaalsContact O-N 3.1Å; H151-N153 VanDerWaalsContact C-N 3.25Å; H151-N198 PolarHBondContact NE2-O 3.18Å
152	T	92.1	Very high	90.9	Very high	31 Å²	31	30.6 Å²	30.6	19%	0.19	16%	0.157	C	C	.	.	H	α-helix	trans	-76.4	-12.5	170.8	58.1	0	0	0	0	112.9	E107 L148 A149 N154	E107-T152 HydrophobicContact CG-CG2 4.29Å; L148-T152 PolarHBondContact O-N 2.87Å; A149-T152 PolarHBondContact O-OG1 3.39Å; A149-T152 VanDerWaalsContact O-OG1 3.14Å; T152-N154 PolarHBondContact O-N 3.3Å; T152-N154 VanDerWaalsContact O-N 3.12Å
153	N	93.7	Very high	91.2	Very high	42 Å²	42	35.5 Å²	35.5	23%	0.225	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	18.2	179.1	-170.8	53.1	0	0	0	114.2	A149 A150 H151 Y155 P206 S207	A149-N153 PolarHBondContact O-N 3.46Å; A149-N153 VanDerWaalsContact O-N 3.16Å; A150-N153 PolarHBondContact O-N 2.98Å; A150-N153 VanDerWaalsContact O-N 3.12Å; H151-N153 VanDerWaalsContact C-N 3.25Å; N153-Y155 PolarHBondContact O-N 2.97Å; N153-P206 WeakPolarHBondContact OD1-CD 3.46Å; N153-S207 WeakPolarHBondContact O-CB 3.24Å; N153-S207 PolarHBondContact O-OG 3.06Å; N153-S207 VanDerWaalsContact OD1-CB 3.31Å; N153-S207 WeakPolarHBondContact OD1-CB 3.49Å; N153-S207 PolarHBondContact OD1-N 3.04Å; N153-S207 PolarHBondContact OD1-OG 2.95Å
154	N	92.6	Very high	91.1	Very high	28 Å²	28	40.1 Å²	40.1	15%	0.15	20%	0.198	C	C	.	.			trans	-76.1	111.5	-178.9	-171.3	-55.3	0	0	0	111.9	E107 T152 E156 I157 I158	E107-N154 HydrophobicContact CG-CB 4.44Å; E107-N154 WeakPolarHBondContact OE2-CB 3.48Å; E107-N154 PolarHBondContact OE2-ND2 3.46Å; T152-N154 PolarHBondContact O-N 3.3Å; T152-N154 VanDerWaalsContact O-N 3.12Å; N154-E156 VanDerWaalsContact C-N 3.34Å; N154-E156 PolarHBondContact O-N 3.4Å; N154-E156 PolarHBondContact OD1-N 2.86Å; N154-E156 VanDerWaalsContact OD1-N 3.1Å; N154-I157 HydrophobicContact CB-CB 4.36Å; N154-I157 HydrophobicContact CB-CD1 4.19Å; N154-I157 HydrophobicContact CB-CG1 4.38Å; N154-I157 PolarHBondContact OD1-N 3.39Å; N154-I158 WeakPolarHBondContact O-CD1 3.37Å; N154-I158 VanDerWaalsContact O-CG1 3.23Å; N154-I158 WeakPolarHBondContact O-CG1 3.5Å; N154-I158 PolarHBondContact O-N 3.17Å; N154-I158 VanDerWaalsContact O-N 3.14Å
155	Y	92.3	Very high	90.8	Very high	57 Å²	57	48.7 Å²	48.7	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-35.7	-174.4	177.7	-94.6	0	0	0	114.1	N153 K159 L211 V725 I729	N153-Y155 PolarHBondContact O-N 2.97Å; Y155-K159 HydrophobicContact CE1-CD 4.3Å; Y155-K159 VanDerWaalsContact O-CB 3.24Å; Y155-K159 WeakPolarHBondContact O-CB 3.26Å; Y155-K159 PolarHBondContact O-N 3.35Å; Y155-L211 HydrophobicContact CD2-CD1 3.89Å; Y155-L211 HydrophobicContact CD2-CD2 4.34Å; Y155-L211 HydrophobicContact CD2-CG 3.98Å; Y155-L211 HydrophobicContact CE2-CD1 3.85Å; Y155-L211 HydrophobicContact CE2-CD2 3.46Å; Y155-L211 VanDerWaalsContact CE2-CD2 3.46Å; Y155-L211 HydrophobicContact CE2-CG 3.5Å; Y155-V725 HydrophobicContact CD1-CG1 3.81Å; Y155-V725 HydrophobicContact CD2-CG1 3.69Å; Y155-V725 HydrophobicContact CD2-CG2 3.95Å; Y155-V725 HydrophobicContact CE1-CG1 3.86Å; Y155-V725 HydrophobicContact CE2-CB 4.35Å; Y155-V725 HydrophobicContact CE2-CG1 3.73Å; Y155-V725 HydrophobicContact CE2-CG2 3.72Å; Y155-V725 HydrophobicContact CG-CG1 3.72Å; Y155-I729 HydrophobicContact CD1-CD1 4.33Å
156	E	91.8	Very high	90.4	Very high	94 Å²	94	49.7 Å²	49.7	44%	0.439	23%	0.231	S	C	.	.	H	α-helix	trans	-75.3	-43.5	-174.5	-63.5	-173.5	-173.9	0	0	111.1	V109 N154 K159 L160	V109-E156 HydrophobicContact CG1-CB 4.3Å; V109-E156 HydrophobicContact CG2-CB 4.24Å; N154-E156 VanDerWaalsContact C-N 3.34Å; N154-E156 PolarHBondContact O-N 3.4Å; N154-E156 PolarHBondContact OD1-N 2.86Å; N154-E156 VanDerWaalsContact OD1-N 3.1Å; E156-K159 WeakPolarHBondContact O-CB 3.39Å; E156-K159 PolarHBondContact O-N 2.93Å; E156-L160 WeakPolarHBondContact O-CG 3.43Å; E156-L160 PolarHBondContact O-N 2.79Å
157	I	92.2	Very high	90.1	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-47.9	175.4	-63	179	0	0	0	111	I104 E107 V109 V112 A149 N154 K159 L160 L161	I104-I157 HydrophobicContact CG1-CG2 3.93Å; I104-I157 HydrophobicContact CG2-CG2 4.29Å; E107-I157 HydrophobicContact CB-CD1 4.41Å; V109-I157 HydrophobicContact CG2-CG1 4.13Å; V112-I157 HydrophobicContact CG1-CG2 4.35Å; V112-I157 HydrophobicContact CG2-CD1 4.38Å; A149-I157 HydrophobicContact CB-CG2 3.66Å; N154-I157 HydrophobicContact CB-CB 4.36Å; N154-I157 HydrophobicContact CB-CD1 4.19Å; N154-I157 HydrophobicContact CB-CG1 4.38Å; N154-I157 PolarHBondContact OD1-N 3.39Å; I157-K159 VanDerWaalsContact C-N 3.28Å; I157-K159 PolarHBondContact O-N 2.96Å; I157-L160 PolarHBondContact O-N 2.95Å; I157-L161 HydrophobicContact CG2-CD1 4.07Å; I157-L161 WeakPolarHBondContact O-CG 3.43Å; I157-L161 PolarHBondContact O-N 2.93Å
158	I	93	Very high	89.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.8	-43.2	177.2	-64.2	163.2	0	0	0	110.2	I146 A149 N154 L160 L161 V162 L208 L211	I146-I158 HydrophobicContact CD1-CG2 4.11Å; A149-I158 HydrophobicContact CB-CG1 3.93Å; A149-I158 WeakPolarHBondContact O-CD1 3.46Å; A149-I158 WeakPolarHBondContact O-CG1 3.48Å; N154-I158 WeakPolarHBondContact O-CD1 3.37Å; N154-I158 VanDerWaalsContact O-CG1 3.23Å; N154-I158 WeakPolarHBondContact O-CG1 3.5Å; N154-I158 PolarHBondContact O-N 3.17Å; N154-I158 VanDerWaalsContact O-N 3.14Å; I158-L160 PolarHBondContact O-N 2.63Å; I158-L161 PolarHBondContact O-N 3.45Å; I158-V162 HydrophobicContact CG2-CG2 4.11Å; I158-V162 WeakPolarHBondContact O-CB 3.12Å; I158-V162 VanDerWaalsContact O-CG2 3.27Å; I158-V162 WeakPolarHBondContact O-CG2 3.49Å; I158-V162 PolarHBondContact O-N 2.84Å; I158-L208 HydrophobicContact CG2-CD1 3.87Å; I158-L211 HydrophobicContact CB-CD1 4.04Å; I158-L211 HydrophobicContact CG2-CD1 3.62Å
159	K	93.1	Very high	89.6	Confident	96 Å²	96	59.4 Å²	59.4	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-61.6	-42.8	178.1	-177.9	-172.6	172.1	-158.5	0	112.4	Y155 E156 I157 V162 Q163 L211	Y155-K159 HydrophobicContact CE1-CD 4.3Å; Y155-K159 VanDerWaalsContact O-CB 3.24Å; Y155-K159 WeakPolarHBondContact O-CB 3.26Å; Y155-K159 PolarHBondContact O-N 3.35Å; E156-K159 WeakPolarHBondContact O-CB 3.39Å; E156-K159 PolarHBondContact O-N 2.93Å; I157-K159 VanDerWaalsContact C-N 3.28Å; I157-K159 PolarHBondContact O-N 2.96Å; K159-V162 PolarHBondContact O-N 2.96Å; K159-Q163 VanDerWaalsContact O-CG 3.32Å; K159-Q163 WeakPolarHBondContact O-CG 3.43Å; K159-Q163 PolarHBondContact O-N 3.33Å; K159-L211 HydrophobicContact CB-CD1 4.05Å; K159-L211 HydrophobicContact CB-CD2 4.49Å
160	L	89.6	Confident	89.3	Confident	34 Å²	34	70.2 Å²	70.2	18%	0.178	33%	0.331	C	S	.	.	H	α-helix	trans	-61.5	-43.3	175.4	-70.9	172.3	0	0	0	111.7	V109 E113 L116 E156 I157 I158 Q163 K164	V109-L160 HydrophobicContact CG1-CD1 4.01Å; E113-L160 HydrophobicContact CB-CD1 4.37Å; L116-L160 HydrophobicContact CD1-CB 4.27Å; E156-L160 WeakPolarHBondContact O-CG 3.43Å; E156-L160 PolarHBondContact O-N 2.79Å; I157-L160 PolarHBondContact O-N 2.95Å; I158-L160 PolarHBondContact O-N 2.63Å; L160-Q163 PolarHBondContact O-N 3.32Å; L160-K164 WeakPolarHBondContact O-CG 3.03Å; L160-K164 PolarHBondContact O-N 3.07Å
161	L	88.4	Confident	89	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-69.1	-40.2	178.6	-67.4	171	0	0	0	112.7	I104 L116 P145 I146 A149 I157 I158 Q163 K164 R165 V166	I104-L161 HydrophobicContact CD1-CD1 4.1Å; L116-L161 HydrophobicContact CD1-CD2 3.83Å; L116-L161 HydrophobicContact CD1-CG 4.47Å; L116-L161 HydrophobicContact CD2-CD2 3.96Å; L116-L161 HydrophobicContact CG-CD2 4.5Å; P145-L161 HydrophobicContact CB-CD2 4.45Å; I146-L161 HydrophobicContact CD1-CB 3.9Å; I146-L161 HydrophobicContact CD1-CD1 4.24Å; A149-L161 HydrophobicContact CB-CD1 3.61Å; I157-L161 HydrophobicContact CG2-CD1 4.07Å; I157-L161 WeakPolarHBondContact O-CG 3.43Å; I157-L161 PolarHBondContact O-N 2.93Å; I158-L161 PolarHBondContact O-N 3.45Å; L161-Q163 VanDerWaalsContact C-N 3.32Å; L161-Q163 PolarHBondContact O-N 3.38Å; L161-K164 WeakPolarHBondContact O-CB 3.27Å; L161-K164 PolarHBondContact O-N 2.86Å; L161-K164 VanDerWaalsContact O-N 3.08Å; L161-R165 PolarHBondContact O-N 2.99Å; L161-V166 HydrophobicContact CB-CG2 4.49Å; L161-V166 PolarHBondContact O-N 2.86Å
162	V	89	Confident	88.6	Confident	57 Å²	57	73.4 Å²	73.4	35%	0.345	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-36.8	175.6	170	0	0	0	0	111.2	I146 I158 K159 K164 R165	I146-V162 HydrophobicContact CD1-CG2 4.29Å; I158-V162 HydrophobicContact CG2-CG2 4.11Å; I158-V162 WeakPolarHBondContact O-CB 3.12Å; I158-V162 VanDerWaalsContact O-CG2 3.27Å; I158-V162 WeakPolarHBondContact O-CG2 3.49Å; I158-V162 PolarHBondContact O-N 2.84Å; K159-V162 PolarHBondContact O-N 2.96Å; V162-K164 PolarHBondContact O-N 3.39Å; V162-R165 WeakPolarHBondContact O-CA 3.44Å; V162-R165 PolarHBondContact O-N 3.47Å
163	Q	88.6	Confident	88.1	Confident	129 Å²	129	79.4 Å²	79.4	60%	0.603	38%	0.375	S	S	*	.	H	α-helix	trans	-61.7	-29.9	172.4	-75.7	176.4	-10.7	0	0	113	K159 L160 L161 R165	K159-Q163 VanDerWaalsContact O-CG 3.32Å; K159-Q163 WeakPolarHBondContact O-CG 3.43Å; K159-Q163 PolarHBondContact O-N 3.33Å; L160-Q163 PolarHBondContact O-N 3.32Å; L161-Q163 VanDerWaalsContact C-N 3.32Å; L161-Q163 PolarHBondContact O-N 3.38Å; Q163-R165 PolarHBondContact O-N 3.04Å
164	K	83.4	Confident	87.5	Confident	123 Å²	123	80 Å²	80	54%	0.535	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	2.5	173.3	-58.1	-78.6	176.8	157.1	0	113.2	L116 L160 L161 V162 V166	L116-K164 PolarHBondContact O-NZ 2.9Å; L160-K164 WeakPolarHBondContact O-CG 3.03Å; L160-K164 PolarHBondContact O-N 3.07Å; L161-K164 WeakPolarHBondContact O-CB 3.27Å; L161-K164 PolarHBondContact O-N 2.86Å; L161-K164 VanDerWaalsContact O-N 3.08Å; V162-K164 PolarHBondContact O-N 3.39Å; K164-V166 HydrophobicContact CB-CG2 4.44Å; K164-V166 PolarHBondContact O-N 3.1Å
165	R	82.3	Confident	87.1	Confident	224 Å²	224	88.5 Å²	88.5	85%	0.845	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	37.5	179.9	-56.4	-174.7	179	-168.6	-1.3	114.5	L161 V162 Q163	L161-R165 PolarHBondContact O-N 2.99Å; V162-R165 WeakPolarHBondContact O-CA 3.44Å; V162-R165 PolarHBondContact O-N 3.47Å; Q163-R165 PolarHBondContact O-N 3.04Å
166	V	81.6	Confident	86.8	Confident	60 Å²	60	87.7 Å²	87.7	36%	0.364	41%	0.409	S	S	.	.			trans	-66.7	140.4	169.7	-170.5	0	0	0	0	109.4	I146 L161 K164	I146-V166 HydrophobicContact CB-CB 4.31Å; I146-V166 HydrophobicContact CB-CG1 3.83Å; I146-V166 HydrophobicContact CG2-CB 4.4Å; I146-V166 HydrophobicContact CG2-CG1 3.51Å; L161-V166 HydrophobicContact CB-CG2 4.49Å; L161-V166 PolarHBondContact O-N 2.86Å; K164-V166 HydrophobicContact CB-CG2 4.44Å; K164-V166 PolarHBondContact O-N 3.1Å
167	T	84.4	Confident	86.5	Confident	118 Å²	118	90.3 Å²	90.3	72%	0.724	43%	0.426	S	S	*	.			trans	-112.4	152.8	179.7	52.9	0	0	0	0	111.5
168	I	87.3	Confident	86.5	Confident	35 Å²	35	92.1 Å²	92.1	18%	0.179	44%	0.439	C	S	.	.			trans	-107.4	133.4	171.7	-61.2	170.9	0	0	0	107.3	I146 I199 L203 L208	I146-I168 HydrophobicContact CG1-CD1 4.05Å; I146-I168 HydrophobicContact CG1-CG1 4.07Å; I146-I168 HydrophobicContact CG2-CD1 4.43Å; I146-I168 HydrophobicContact CG2-CG1 3.66Å; I168-I199 HydrophobicContact CG2-CG2 4.2Å; I168-L203 HydrophobicContact CD1-CD2 4.25Å; I168-L203 HydrophobicContact CG2-CD2 4.14Å; I168-L203 HydrophobicContact CG2-CG 4.4Å; I168-L208 HydrophobicContact CD1-CD1 4.42Å; I168-L208 HydrophobicContact CD1-CD2 3.48Å; I168-L208 VanDerWaalsContact CD1-CD2 3.48Å
169	P	86.3	Confident	86.3	Confident	68 Å²	68	98.1 Å²	98.1	44%	0.442	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-63.2	141.8	174.2	27.5	-34.9	0	0	0	110.5	I199	P169-I199 HydrophobicContact CG-CD1 3.81Å; P169-I199 HydrophobicContact CG-CG1 4.1Å; P169-I199 WeakPolarHBondContact O-CG2 3.48Å
170	R	86	Confident	85.9	Confident	227 Å²	227	100.1 Å²	100.1	86%	0.857	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-75.8	129.4	173.1	-71.3	-171.6	176.1	-165.9	-0.3	109	H172	R170-H172 PolarHBondContact O-N 3.12Å
171	P	87.9	Confident	85.7	Confident	32 Å²	32	99 Å²	99	21%	0.208	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-65.9	131.5	177.4	27.2	-32.1	0	0	0	109.7	I199 Y200 L203	P171-I199 HydrophobicContact CB-CG2 4.12Å; P171-I199 HydrophobicContact CG-CG2 4.11Å; P171-Y200 HydrophobicContact CB-CD2 4.23Å; P171-Y200 HydrophobicContact CB-CE2 3.6Å; P171-Y200 HydrophobicContact CG-CD1 4.4Å; P171-Y200 HydrophobicContact CG-CD2 4.37Å; P171-Y200 HydrophobicContact CG-CE1 3.79Å; P171-Y200 HydrophobicContact CG-CE2 3.74Å; P171-Y200 VanDerWaalsContact CG-CZ 3.41Å; P171-L203 HydrophobicContact CG-CD1 4.21Å
172	H	84.6	Confident	85.7	Confident	84 Å²	84	101.8 Å²	101.8	39%	0.389	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-73.6	152.4	168.6	-66.6	171.4	0	0	0	110.2	R170 C176 C178 C181	R170-H172 PolarHBondContact O-N 3.12Å; H172-C176 HydrophobicContact CB-CB 3.98Å; H172-C178 PolarHBondContact ND1-SG 3.05Å; H172-C181 PolarHBondContact ND1-SG 3.37Å
173	Q	81.4	Confident	85.5	Confident	157 Å²	157	101.6 Å²	101.6	73%	0.734	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-61.4	147.7	172.7	-63.9	-179.5	-1.9	0	0	110.3	R175 C176	Q173-R175 PolarHBondContact O-N 3.43Å; Q173-R175 VanDerWaalsContact O-N 3.13Å; Q173-C176 WeakPolarHBondContact O-CB 3.32Å; Q173-C176 PolarHBondContact O-N 2.99Å
174	I	82.8	Confident	85.2	Confident	56 Å²	56	97.5 Å²	97.5	29%	0.287	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.5	179	-62.8	166.6	0	0	0	111.9	C176 L230 V233 E234	I174-C176 PolarHBondContact O-N 3.48Å; I174-L230 HydrophobicContact CD1-CD2 3.39Å; I174-L230 HydrophobicContact CG1-CD2 3.86Å; I174-V233 HydrophobicContact CB-CG1 4.43Å; I174-V233 HydrophobicContact CD1-CB 3.79Å; I174-V233 HydrophobicContact CD1-CG1 3.53Å; I174-V233 HydrophobicContact CG2-CG1 4.14Å; I174-E234 HydrophobicContact CD1-CG 3.51Å; I174-E234 HydrophobicContact CG1-CG 4.42Å
175	R	83.4	Confident	85.3	Confident	206 Å²	206	94.3 Å²	94.3	78%	0.777	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	22.7	179.3	-57.5	-177.7	-178.6	-178.9	-0.6	113.5	Q173 N177	Q173-R175 PolarHBondContact O-N 3.43Å; Q173-R175 VanDerWaalsContact O-N 3.13Å; R175-N177 PolarHBondContact O-N 3.2Å
176	C	86.6	Confident	85.5	Confident	39 Å²	39	91.2 Å²	91.2	26%	0.264	47%	0.473	S	S	.	.			trans	-81.9	109.9	-178.2	-172.2	0	0	0	0	111.2	H172 Q173 I174 C178 C181	H172-C176 HydrophobicContact CB-CB 3.98Å; Q173-C176 WeakPolarHBondContact O-CB 3.32Å; Q173-C176 PolarHBondContact O-N 2.99Å; I174-C176 PolarHBondContact O-N 3.48Å; C176-C178 PolarHBondContact O-N 3.42Å; C176-C178 VanDerWaalsContact O-N 3.13Å; C176-C178 VanDerWaalsContact SG-SG 3.62Å; C176-C181 WeakPolarHBondContact O-CB 3.45Å
177	N	85.8	Confident	85.7	Confident	149 Å²	149	94.6 Å²	94.6	80%	0.797	49%	0.493	S	S	*	.			trans	-84.3	30.9	178.6	-60.4	-11.9	0	0	0	112.8	R175	R175-N177 PolarHBondContact O-N 3.2Å
178	C	90.3	Very high	85.8	Confident	38 Å²	38	92.1 Å²	92.1	26%	0.257	48%	0.476	S	S	.	.			trans	-77.8	150.7	175.8	77.4	0	0	0	0	110.8	H172 C176 E180 C181 V182	H172-C178 PolarHBondContact ND1-SG 3.05Å; C176-C178 PolarHBondContact O-N 3.42Å; C176-C178 VanDerWaalsContact O-N 3.13Å; C176-C178 VanDerWaalsContact SG-SG 3.62Å; C178-E180 PolarHBondContact O-N 3.21Å; C178-C181 PolarHBondContact O-N 3.3Å; C178-C181 VanDerWaalsContact O-N 3.09Å; C178-C181 PolarHBondContact SG-N 3.47Å; C178-C181 VanDerWaalsContact SG-N 3.45Å; C178-C181 PolarHBondContact SG-SG 3.14Å; C178-V182 WeakPolarHBondContact O-CG2 3.15Å; C178-V182 PolarHBondContact O-N 3.15Å
179	V	88.9	Confident	85.7	Confident	126 Å²	126	94 Å²	94	76%	0.764	49%	0.492	S	S	*	.	H	α-helix	trans	-56.4	-38.1	-174.8	-176.9	0	0	0	0	112.2	S183	V179-S183 VanDerWaalsContact O-CB 3.27Å; V179-S183 WeakPolarHBondContact O-CB 3.39Å; V179-S183 PolarHBondContact O-N 3.02Å; V179-S183 PolarHBondContact O-OG 3.15Å
180	E	84.7	Confident	85.8	Confident	138 Å²	138	96.2 Å²	96.2	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-65	-44.5	176.7	-173.6	176.8	-166.9	0	0	113	C178 S183 S184	C178-E180 PolarHBondContact O-N 3.21Å; E180-S183 PolarHBondContact O-OG 2.64Å; E180-S184 VanDerWaalsContact O-CB 3.28Å; E180-S184 WeakPolarHBondContact O-CB 3.35Å; E180-S184 PolarHBondContact O-N 3.33Å; E180-S184 PolarHBondContact O-OG 3.28Å
181	C	85.7	Confident	85.7	Confident	12 Å²	12	90.8 Å²	90.8	8%	0.081	48%	0.479	C	S	.	.	H	α-helix	trans	-67	-44.8	176.4	-76.1	0	0	0	0	112.2	H172 C176 C178 S184 S185	H172-C181 PolarHBondContact ND1-SG 3.37Å; C176-C181 WeakPolarHBondContact O-CB 3.45Å; C178-C181 PolarHBondContact O-N 3.3Å; C178-C181 VanDerWaalsContact O-N 3.09Å; C178-C181 PolarHBondContact SG-N 3.47Å; C178-C181 VanDerWaalsContact SG-N 3.45Å; C178-C181 PolarHBondContact SG-SG 3.14Å; C181-S184 PolarHBondContact O-OG 2.72Å; C181-S185 WeakPolarHBondContact O-CB 3.49Å; C181-S185 PolarHBondContact O-N 3.37Å
182	V	88.1	Confident	85.7	Confident	59 Å²	59	91.1 Å²	91.1	36%	0.358	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-53.5	-179.3	176.3	0	0	0	0	110.1	C178 S184 S185 E186	C178-V182 WeakPolarHBondContact O-CG2 3.15Å; C178-V182 PolarHBondContact O-N 3.15Å; V182-S184 PolarHBondContact O-N 2.64Å; V182-S185 PolarHBondContact O-N 3.25Å; V182-E186 HydrophobicContact CG1-CG 4.38Å; V182-E186 WeakPolarHBondContact CG1-OE1 3.4Å; V182-E186 WeakPolarHBondContact O-CG 3.48Å; V182-E186 PolarHBondContact O-N 3.42Å
183	S	86.6	Confident	85.9	Confident	53 Å²	53	87.9 Å²	87.9	37%	0.371	47%	0.465	S	S	.	.	H	α-helix	trans	-61.1	-42.5	179.1	56.8	0	0	0	0	113.4	V179 E180 S185 E186 V187	V179-S183 VanDerWaalsContact O-CB 3.27Å; V179-S183 WeakPolarHBondContact O-CB 3.39Å; V179-S183 PolarHBondContact O-N 3.02Å; V179-S183 PolarHBondContact O-OG 3.15Å; E180-S183 PolarHBondContact O-OG 2.64Å; S183-S185 VanDerWaalsContact C-N 3.32Å; S183-S185 PolarHBondContact O-N 2.96Å; S183-E186 PolarHBondContact O-N 2.86Å; S183-V187 WeakPolarHBondContact O-CB 3.18Å; S183-V187 VanDerWaalsContact O-CG2 3.27Å; S183-V187 WeakPolarHBondContact O-CG2 3.46Å; S183-V187 PolarHBondContact O-N 3.17Å
184	S	81.9	Confident	86.3	Confident	44 Å²	44	85.6 Å²	85.6	31%	0.308	45%	0.449	S	S	.	.	H	α-helix	trans	-67.9	-32.4	177	56.8	0	0	0	0	112.7	E180 C181 V182 D188 H192	E180-S184 VanDerWaalsContact O-CB 3.28Å; E180-S184 WeakPolarHBondContact O-CB 3.35Å; E180-S184 PolarHBondContact O-N 3.33Å; E180-S184 PolarHBondContact O-OG 3.28Å; C181-S184 PolarHBondContact O-OG 2.72Å; V182-S184 PolarHBondContact O-N 2.64Å; S184-D188 CarbonylContact O-C 3.48Å; S184-D188 PolarHBondContact O-N 2.98Å; S184-H192 PolarHBondContact OG-ND1 3.45Å
185	S	84.8	Confident	86.6	Confident	55 Å²	55	84.4 Å²	84.4	39%	0.385	45%	0.446	S	S	.	.	H	α-helix	trans	-75.4	-31.2	174.8	-171.6	0	0	0	0	113.7	C181 V182 S183 S189	C181-S185 WeakPolarHBondContact O-CB 3.49Å; C181-S185 PolarHBondContact O-N 3.37Å; V182-S185 PolarHBondContact O-N 3.25Å; S183-S185 VanDerWaalsContact C-N 3.32Å; S183-S185 PolarHBondContact O-N 2.96Å; S185-S189 WeakPolarHBondContact O-CB 3.37Å; S185-S189 PolarHBondContact O-N 2.87Å
186	E	86.6	Confident	87	Confident	159 Å²	159	75.6 Å²	75.6	74%	0.743	41%	0.413	S	S	*	.	H	α-helix	trans	-72.7	-36.3	173.9	-75.6	176.4	176.3	0	0	111.8	V182 S183	V182-E186 HydrophobicContact CG1-CG 4.38Å; V182-E186 WeakPolarHBondContact CG1-OE1 3.4Å; V182-E186 WeakPolarHBondContact O-CG 3.48Å; V182-E186 PolarHBondContact O-N 3.42Å; S183-E186 PolarHBondContact O-N 2.86Å
187	V	85.9	Confident	87.3	Confident	131 Å²	131	73.9 Å²	73.9	79%	0.794	40%	0.401	S	S	*	.	H	α-helix	trans	-76.2	-47.7	177.2	172.6	0	0	0	0	111.8	S183	S183-V187 WeakPolarHBondContact O-CB 3.18Å; S183-V187 VanDerWaalsContact O-CG2 3.27Å; S183-V187 WeakPolarHBondContact O-CG2 3.46Å; S183-V187 PolarHBondContact O-N 3.17Å
188	D	85.5	Confident	87.6	Confident	66 Å²	66	67.6 Å²	67.6	35%	0.353	37%	0.367	S	S	.	.	H	α-helix	trans	-157	89.9	-179.2	-172.3	-14.9	0	0	0	111.8	S184 L190 R191 H192	S184-D188 CarbonylContact O-C 3.48Å; S184-D188 PolarHBondContact O-N 2.98Å; D188-L190 VanDerWaalsContact C-N 3.28Å; D188-L190 PolarHBondContact O-N 2.87Å; D188-L190 PolarHBondContact OD1-N 3.1Å; D188-L190 VanDerWaalsContact OD1-N 3.17Å; D188-R191 HydrophobicContact CB-CB 3.99Å; D188-R191 PolarHBondContact O-N 2.88Å; D188-R191 WeakPolarHBondContact OD1-CB 3.4Å; D188-R191 PolarHBondContact OD1-N 3.36Å; D188-R191 WeakPolarHBondContact OD2-CB 3.27Å; D188-H192 WeakPolarHBondContact O-CB 3.47Å; D188-H192 PolarHBondContact O-N 3.3Å
189	S	86.7	Confident	87.8	Confident	76 Å²	76	66.5 Å²	66.5	53%	0.531	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-29.1	178.7	59.9	0	0	0	0	113.9	S185 S193	S185-S189 WeakPolarHBondContact O-CB 3.37Å; S185-S189 PolarHBondContact O-N 2.87Å; S189-S193 WeakPolarHBondContact O-CB 3.28Å; S189-S193 PolarHBondContact O-N 3.38Å; S189-S193 PolarHBondContact O-OG 3.02Å
190	L	86.8	Confident	88.1	Confident	114 Å²	114	61.1 Å²	61.1	60%	0.597	33%	0.325	S	S	*	.	H	α-helix	trans	-75.2	-42.6	179	-176.5	142.7	0	0	0	110.7	D188 S193 R194	D188-L190 VanDerWaalsContact C-N 3.28Å; D188-L190 PolarHBondContact O-N 2.87Å; D188-L190 PolarHBondContact OD1-N 3.1Å; D188-L190 VanDerWaalsContact OD1-N 3.17Å; L190-S193 PolarHBondContact O-OG 2.76Å; L190-S193 VanDerWaalsContact O-OG 3.06Å; L190-R194 WeakPolarHBondContact O-CB 3.5Å; L190-R194 PolarHBondContact O-N 3.21Å
191	R	85.4	Confident	88.6	Confident	113 Å²	113	58.5 Å²	58.5	43%	0.426	31%	0.311	S	S	.	.	H	α-helix	trans	-67.7	-36.3	172.8	-176.1	177.2	174.2	-166.7	-3.3	112	D188 S195	D188-R191 HydrophobicContact CB-CB 3.99Å; D188-R191 PolarHBondContact O-N 2.88Å; D188-R191 WeakPolarHBondContact OD1-CB 3.4Å; D188-R191 PolarHBondContact OD1-N 3.36Å; D188-R191 WeakPolarHBondContact OD2-CB 3.27Å; R191-S195 WeakPolarHBondContact O-CB 3.14Å; R191-S195 PolarHBondContact O-N 2.92Å
192	H	87.9	Confident	89.1	Confident	38 Å²	38	57.9 Å²	57.9	18%	0.176	31%	0.307	C	S	.	.	H	α-helix	trans	-62.4	-49.1	174.9	-176.1	89.2	0	0	0	112	S184 D188 R196	S184-H192 PolarHBondContact OG-ND1 3.45Å; D188-H192 WeakPolarHBondContact O-CB 3.47Å; D188-H192 PolarHBondContact O-N 3.3Å; H192-R196 PolarHBondContact CD2-NH1 2.93Å; H192-R196 PolarHBondContact NE2-NH1 2.85Å; H192-R196 VanDerWaalsContact NE2-NH1 3.13Å; H192-R196 PolarHBondContact O-N 3.06Å; H192-R196 VanDerWaalsContact O-N 3.1Å
193	S	88.7	Confident	89.4	Confident	16 Å²	16	57.1 Å²	57.1	11%	0.112	30%	0.301	C	S	.	.	H	α-helix	trans	-66.3	-43.7	177.7	52.4	0	0	0	0	112.5	S189 L190 S195 R196 L197	S189-S193 WeakPolarHBondContact O-CB 3.28Å; S189-S193 PolarHBondContact O-N 3.38Å; S189-S193 PolarHBondContact O-OG 3.02Å; L190-S193 PolarHBondContact O-OG 2.76Å; L190-S193 VanDerWaalsContact O-OG 3.06Å; S193-S195 PolarHBondContact O-N 3.19Å; S193-R196 PolarHBondContact O-N 3.1Å; S193-L197 PolarHBondContact O-N 3.38Å
194	R	89.4	Confident	89.9	Confident	109 Å²	109	54.7 Å²	54.7	41%	0.411	28%	0.284	S	S	.	.	H	α-helix	trans	-65.5	-35.5	177.4	-165.9	167.9	-177.3	88.5	-3.4	112.8	L190 L197 N198	L190-R194 WeakPolarHBondContact O-CB 3.5Å; L190-R194 PolarHBondContact O-N 3.21Å; R194-L197 PolarHBondContact O-N 3.38Å; R194-N198 WeakPolarHBondContact O-CB 3.22Å; R194-N198 VanDerWaalsContact O-CG 3.26Å; R194-N198 PolarHBondContact O-N 3Å; R194-N198 PolarHBondContact O-ND2 3.06Å
195	S	89.3	Confident	90.5	Very high	31 Å²	31	52.7 Å²	52.7	22%	0.217	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-45.7	172.8	177.5	0	0	0	0	112.1	D142 R191 S193 L197 N198 I199	D142-S195 WeakPolarHBondContact OD2-CA 3.48Å; R191-S195 WeakPolarHBondContact O-CB 3.14Å; R191-S195 PolarHBondContact O-N 2.92Å; S193-S195 PolarHBondContact O-N 3.19Å; S195-L197 VanDerWaalsContact C-N 3.32Å; S195-L197 PolarHBondContact O-N 2.97Å; S195-N198 PolarHBondContact O-N 3.35Å; S195-I199 VanDerWaalsContact O-CG1 3.29Å; S195-I199 WeakPolarHBondContact O-CG1 3.37Å; S195-I199 PolarHBondContact O-N 2.91Å
196	R	91.6	Very high	91	Very high	22 Å²	22	50.4 Å²	50.4	8%	0.083	25%	0.254	C	S	.	.	H	α-helix	trans	-56.2	-46.3	172.4	171.4	168.7	54.9	-113	-1.3	111.4	H192 S193 I199 Y200 E234	H192-R196 PolarHBondContact CD2-NH1 2.93Å; H192-R196 PolarHBondContact NE2-NH1 2.85Å; H192-R196 VanDerWaalsContact NE2-NH1 3.13Å; H192-R196 PolarHBondContact O-N 3.06Å; H192-R196 VanDerWaalsContact O-N 3.1Å; S193-R196 PolarHBondContact O-N 3.1Å; R196-I199 PolarHBondContact O-N 3.42Å; R196-Y200 HydrophobicContact CG-CD2 3.71Å; R196-Y200 HydrophobicContact CG-CE2 3.76Å; R196-Y200 VanDerWaalsContact O-CD2 3.32Å; R196-Y200 WeakPolarHBondContact O-CD2 3.32Å; R196-Y200 PolarHBondContact O-N 3.04Å; R196-E234 IonicContact CZ-OE1 3.72Å; R196-E234 IonicContact CZ-OE2 3.24Å; R196-E234 IonicContact NE-OE1 2.73Å; R196-E234 IonicContact NE-OE2 3.97Å; R196-E234 PolarHBondContact NE-OE2 3.01Å; R196-E234 VanDerWaalsContact NH2-CD 3.31Å; R196-E234 IonicContact NH2-OE1 2.86Å; R196-E234 PolarHBondContact NH2-OE1 3.42Å; R196-E234 IonicContact NH2-OE2 2.73Å; R196-E234 PolarHBondContact NH2-OE2 3.14Å
197	L	92.8	Very high	91.4	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-43.6	177.5	-178.1	60.7	0	0	0	112	S193 R194 S195 I199 Y200 K201 F237 E240 Y241 L244	S193-L197 PolarHBondContact O-N 3.38Å; R194-L197 PolarHBondContact O-N 3.38Å; S195-L197 VanDerWaalsContact C-N 3.32Å; S195-L197 PolarHBondContact O-N 2.97Å; L197-I199 PolarHBondContact O-N 2.78Å; L197-Y200 PolarHBondContact O-N 3.45Å; L197-K201 VanDerWaalsContact O-CB 3.29Å; L197-K201 WeakPolarHBondContact O-CB 3.2Å; L197-K201 PolarHBondContact O-N 3.49Å; L197-F237 HydrophobicContact CD2-CB 4.11Å; L197-F237 HydrophobicContact CD2-CD1 3.71Å; L197-F237 HydrophobicContact CD2-CE1 4.29Å; L197-F237 HydrophobicContact CD2-CG 3.89Å; L197-E240 HydrophobicContact CD1-CB 4.15Å; L197-E240 HydrophobicContact CD2-CB 4.44Å; L197-Y241 HydrophobicContact CD1-CD1 3.89Å; L197-Y241 HydrophobicContact CD1-CE1 3.57Å; L197-Y241 HydrophobicContact CD1-CE2 4.3Å; L197-Y241 HydrophobicContact CD1-CG 4.37Å; L197-L244 HydrophobicContact CD1-CD1 4.23Å
198	N	92.9	Very high	91.8	Very high	16 Å²	16	37 Å²	37	9%	0.086	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-40.1	175.2	-78.5	-25.1	0	0	0	112.5	D142 M147 H151 R194 S195 A202	D142-N198 PolarHBondContact OD2-ND2 3.12Å; M147-N198 HydrophobicContact CE-CB 3.78Å; H151-N198 PolarHBondContact NE2-O 3.18Å; R194-N198 WeakPolarHBondContact O-CB 3.22Å; R194-N198 VanDerWaalsContact O-CG 3.26Å; R194-N198 PolarHBondContact O-N 3Å; R194-N198 PolarHBondContact O-ND2 3.06Å; S195-N198 PolarHBondContact O-N 3.35Å; N198-A202 PolarHBondContact O-N 3.4Å
199	I	94	Very high	92.3	Very high	15 Å²	15	34 Å²	34	8%	0.077	17%	0.166	C	C	.	.	H	α-helix	trans	-64.5	-48.6	174.8	-67.4	162	0	0	0	110.3	M147 I168 P169 P171 S195 R196 L197 K201 A202 L203	M147-I199 HydrophobicContact CE-CG1 3.81Å; M147-I199 HydrophobicContact SD-CG1 4.33Å; I168-I199 HydrophobicContact CG2-CG2 4.2Å; P169-I199 HydrophobicContact CG-CD1 3.81Å; P169-I199 HydrophobicContact CG-CG1 4.1Å; P169-I199 WeakPolarHBondContact O-CG2 3.48Å; P171-I199 HydrophobicContact CB-CG2 4.12Å; P171-I199 HydrophobicContact CG-CG2 4.11Å; S195-I199 VanDerWaalsContact O-CG1 3.29Å; S195-I199 WeakPolarHBondContact O-CG1 3.37Å; S195-I199 PolarHBondContact O-N 2.91Å; R196-I199 PolarHBondContact O-N 3.42Å; L197-I199 PolarHBondContact O-N 2.78Å; I199-K201 PolarHBondContact O-N 3.14Å; I199-A202 WeakPolarHBondContact O-CB 3.22Å; I199-A202 PolarHBondContact O-N 2.98Å; I199-L203 HydrophobicContact CG2-CD1 3.9Å; I199-L203 HydrophobicContact CG2-CG 4.41Å; I199-L203 WeakPolarHBondContact O-CG 3.44Å; I199-L203 PolarHBondContact O-N 3.19Å
200	Y	95.3	Very high	92.6	Very high	14 Å²	14	31 Å²	31	6%	0.055	15%	0.146	C	C	.	.	H	α-helix	trans	-62.8	-40.3	178.3	-88.7	-62.6	0	0	0	112.7	P171 R196 L197 A202 L203 A204 L227 L230 Y241	P171-Y200 HydrophobicContact CB-CD2 4.23Å; P171-Y200 HydrophobicContact CB-CE2 3.6Å; P171-Y200 HydrophobicContact CG-CD1 4.4Å; P171-Y200 HydrophobicContact CG-CD2 4.37Å; P171-Y200 HydrophobicContact CG-CE1 3.79Å; P171-Y200 HydrophobicContact CG-CE2 3.74Å; P171-Y200 VanDerWaalsContact CG-CZ 3.41Å; R196-Y200 HydrophobicContact CG-CD2 3.71Å; R196-Y200 HydrophobicContact CG-CE2 3.76Å; R196-Y200 VanDerWaalsContact O-CD2 3.32Å; R196-Y200 WeakPolarHBondContact O-CD2 3.32Å; R196-Y200 PolarHBondContact O-N 3.04Å; L197-Y200 PolarHBondContact O-N 3.45Å; Y200-A202 VanDerWaalsContact C-N 3.31Å; Y200-A202 PolarHBondContact O-N 3.09Å; Y200-L203 PolarHBondContact O-N 3.45Å; Y200-A204 VanDerWaalsContact O-CB 3.25Å; Y200-A204 WeakPolarHBondContact O-CB 3.2Å; Y200-A204 PolarHBondContact O-N 3.5Å; Y200-L227 HydrophobicContact CD1-CD2 3.7Å; Y200-L227 HydrophobicContact CD1-CG 4.44Å; Y200-L227 HydrophobicContact CG-CD2 3.86Å; Y200-L230 HydrophobicContact CD1-CD1 4.5Å; Y200-L230 HydrophobicContact CD2-CD1 4.11Å; Y200-L230 HydrophobicContact CE1-CD1 3.94Å; Y200-L230 HydrophobicContact CE2-CD1 3.5Å; Y200-L230 VanDerWaalsContact CZ-CD1 3.41Å; Y200-Y241 HydrophobicContact CD2-CE1 4.2Å; Y200-Y241 HydrophobicContact CG-CE1 4.48Å
201	K	95.5	Very high	92.9	Very high	82 Å²	82	27.9 Å²	27.9	36%	0.357	13%	0.13	S	C	.	.	H	α-helix	trans	-61	-37.7	173.9	-176.1	167.5	-173.6	167.6	0	112.5	L197 I199 L244	L197-K201 VanDerWaalsContact O-CB 3.29Å; L197-K201 WeakPolarHBondContact O-CB 3.2Å; L197-K201 PolarHBondContact O-N 3.49Å; I199-K201 PolarHBondContact O-N 3.14Å; K201-L244 HydrophobicContact CB-CD1 3.97Å; K201-L244 HydrophobicContact CB-CD2 4.22Å; K201-L244 HydrophobicContact CG-CD2 3.99Å
202	A	94.8	Very high	93.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.8	-49	173.3	0	0	0	0	0	111.8	M147 A150 N198 I199 Y200 A204 S205 L208	M147-A202 HydrophobicContact CB-CB 4.08Å; M147-A202 HydrophobicContact CG-CB 3.95Å; A150-A202 HydrophobicContact CB-CB 3.71Å; N198-A202 PolarHBondContact O-N 3.4Å; I199-A202 WeakPolarHBondContact O-CB 3.22Å; I199-A202 PolarHBondContact O-N 2.98Å; Y200-A202 VanDerWaalsContact C-N 3.31Å; Y200-A202 PolarHBondContact O-N 3.09Å; A202-A204 VanDerWaalsContact C-N 3.31Å; A202-A204 PolarHBondContact O-N 3.49Å; A202-S205 WeakPolarHBondContact O-CB 3.43Å; A202-S205 PolarHBondContact O-N 3.13Å; A202-S205 PolarHBondContact O-OG 2.92Å; A202-L208 WeakPolarHBondContact O-CD2 3.41Å
203	L	94.9	Very high	93.3	Very high	43 Å²	43	25.9 Å²	25.9	23%	0.225	14%	0.138	C	C	.	.	H	α-helix	trans	-65	-30	-179.2	-68	175.2	0	0	0	113.7	I168 P171 I199 Y200 S205 L208 I209 L223	I168-L203 HydrophobicContact CD1-CD2 4.25Å; I168-L203 HydrophobicContact CG2-CD2 4.14Å; I168-L203 HydrophobicContact CG2-CG 4.4Å; P171-L203 HydrophobicContact CG-CD1 4.21Å; I199-L203 HydrophobicContact CG2-CD1 3.9Å; I199-L203 HydrophobicContact CG2-CG 4.41Å; I199-L203 WeakPolarHBondContact O-CG 3.44Å; I199-L203 PolarHBondContact O-N 3.19Å; Y200-L203 PolarHBondContact O-N 3.45Å; L203-S205 VanDerWaalsContact C-N 3.28Å; L203-S205 PolarHBondContact O-N 3.25Å; L203-L208 HydrophobicContact CD2-CD2 4.37Å; L203-I209 WeakPolarHBondContact O-CG1 3.36Å; L203-L223 HydrophobicContact CB-CD1 4.48Å; L203-L223 WeakPolarHBondContact O-CD1 3.29Å
204	A	96.3	Very high	93.2	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.008	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-12	177.6	0	0	0	0	0	114.1	Y200 A202 L227 L244	Y200-A204 VanDerWaalsContact O-CB 3.25Å; Y200-A204 WeakPolarHBondContact O-CB 3.2Å; Y200-A204 PolarHBondContact O-N 3.5Å; A202-A204 VanDerWaalsContact C-N 3.31Å; A202-A204 PolarHBondContact O-N 3.49Å; A204-L227 HydrophobicContact CB-CD1 4.21Å; A204-L244 HydrophobicContact CB-CB 4.32Å; A204-L244 HydrophobicContact CB-CD2 4.25Å
205	S	95.3	Very high	93.3	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.014	15%	0.153	C	C	.	.			trans	-67.4	128.4	-173.1	66	0	0	0	0	112.8	A150 A202 L203 S207 L208 I209	A150-S205 WeakPolarHBondContact CB-OG 3.46Å; A150-S205 WeakPolarHBondContact O-CB 3.27Å; A202-S205 WeakPolarHBondContact O-CB 3.43Å; A202-S205 PolarHBondContact O-N 3.13Å; A202-S205 PolarHBondContact O-OG 2.92Å; L203-S205 VanDerWaalsContact C-N 3.28Å; L203-S205 PolarHBondContact O-N 3.25Å; S205-S207 VanDerWaalsContact C-N 3.32Å; S205-S207 PolarHBondContact O-N 3.38Å; S205-L208 PolarHBondContact O-N 2.69Å; S205-L208 WeakPolarHBondContact OG-CB 3.46Å; S205-I209 WeakPolarHBondContact O-CG1 3.35Å; S205-I209 PolarHBondContact O-N 3.5Å; S205-I209 VanDerWaalsContact O-N 3.1Å
206	P	96	Very high	93.6	Very high	7 Å²	7	27.1 Å²	27.1	5%	0.045	14%	0.144	C	C	.	.	H	α-helix	trans	-51.9	-44.1	179.8	-32.7	37.1	0	0	0	114.6	N153 I209 A210 Q247 F251 Y724	N153-P206 WeakPolarHBondContact OD1-CD 3.46Å; P206-I209 PolarHBondContact O-N 3.49Å; P206-A210 WeakPolarHBondContact O-CB 3.32Å; P206-A210 PolarHBondContact O-N 2.94Å; P206-Q247 HydrophobicContact CG-CG 4.41Å; P206-F251 HydrophobicContact CB-CD2 3.65Å; P206-F251 HydrophobicContact CB-CE2 4.11Å; P206-F251 HydrophobicContact CB-CG 4.32Å; P206-F251 HydrophobicContact CG-CB 4.34Å; P206-F251 HydrophobicContact CG-CD2 4.26Å; P206-Y724 HydrophobicContact CB-CE1 4.26Å
207	S	94.3	Very high	93.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.6	-36.2	-178.3	-71.9	0	0	0	0	113.1	N153 S205 L211 M728	N153-S207 WeakPolarHBondContact O-CB 3.24Å; N153-S207 PolarHBondContact O-OG 3.06Å; N153-S207 VanDerWaalsContact OD1-CB 3.31Å; N153-S207 WeakPolarHBondContact OD1-CB 3.49Å; N153-S207 PolarHBondContact OD1-N 3.04Å; N153-S207 PolarHBondContact OD1-OG 2.95Å; S205-S207 VanDerWaalsContact C-N 3.32Å; S205-S207 PolarHBondContact O-N 3.38Å; S207-L211 WeakPolarHBondContact O-CG 3.42Å; S207-L211 PolarHBondContact O-N 3.29Å; S207-M728 WeakPolarHBondContact OG-CE 3.29Å
208	L	94.7	Very high	93.7	Very high	9 Å²	9	26.7 Å²	26.7	5%	0.047	14%	0.143	C	C	.	.	H	α-helix	trans	-71.1	-48.2	176.1	-176.3	69.1	0	0	0	110.8	A150 I158 I168 A202 L203 S205 A210 L211 S212	A150-L208 HydrophobicContact CB-CD2 4.42Å; I158-L208 HydrophobicContact CG2-CD1 3.87Å; I168-L208 HydrophobicContact CD1-CD1 4.42Å; I168-L208 HydrophobicContact CD1-CD2 3.48Å; I168-L208 VanDerWaalsContact CD1-CD2 3.48Å; A202-L208 WeakPolarHBondContact O-CD2 3.41Å; L203-L208 HydrophobicContact CD2-CD2 4.37Å; S205-L208 PolarHBondContact O-N 2.69Å; S205-L208 WeakPolarHBondContact OG-CB 3.46Å; L208-A210 VanDerWaalsContact C-N 3.26Å; L208-A210 PolarHBondContact O-N 3.41Å; L208-L211 PolarHBondContact O-N 3.42Å; L208-S212 PolarHBondContact O-N 2.97Å; L208-S212 PolarHBondContact O-OG 3.23Å
209	I	95.3	Very high	93.7	Very high	2 Å²	2	28 Å²	28	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-57.1	-44	178.5	-61.5	168.6	0	0	0	110	L203 S205 P206 L211 S213 P216 T219 L223 F251	L203-I209 WeakPolarHBondContact O-CG1 3.36Å; S205-I209 WeakPolarHBondContact O-CG1 3.35Å; S205-I209 PolarHBondContact O-N 3.5Å; S205-I209 VanDerWaalsContact O-N 3.1Å; P206-I209 PolarHBondContact O-N 3.49Å; I209-L211 VanDerWaalsContact C-N 3.26Å; I209-L211 PolarHBondContact O-N 2.7Å; I209-S213 WeakPolarHBondContact CG2-OG 3.29Å; I209-S213 WeakPolarHBondContact O-CB 3.47Å; I209-S213 PolarHBondContact O-N 2.83Å; I209-S213 PolarHBondContact O-OG 3.48Å; I209-P216 HydrophobicContact CG2-CB 3.8Å; I209-T219 HydrophobicContact CG2-CG2 4.18Å; I209-L223 HydrophobicContact CD1-CD1 4.29Å; I209-F251 HydrophobicContact CB-CE1 4.08Å; I209-F251 HydrophobicContact CB-CZ 4.21Å; I209-F251 HydrophobicContact CD1-CD1 4.45Å; I209-F251 HydrophobicContact CD1-CE1 4.46Å; I209-F251 HydrophobicContact CG2-CD1 4.48Å; I209-F251 HydrophobicContact CG2-CE1 3.54Å; I209-F251 HydrophobicContact CG2-CZ 3.92Å
210	A	94.3	Very high	93.8	Very high	13 Å²	13	27.3 Å²	27.3	11%	0.107	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-26.8	176.6	0	0	0	0	0	114.7	P206 L208 V721 V725	P206-A210 WeakPolarHBondContact O-CB 3.32Å; P206-A210 PolarHBondContact O-N 2.94Å; L208-A210 VanDerWaalsContact C-N 3.26Å; L208-A210 PolarHBondContact O-N 3.41Å; A210-V721 HydrophobicContact CB-CG1 3.98Å; A210-V721 WeakPolarHBondContact O-CG1 3.47Å; A210-V725 HydrophobicContact CB-CG2 4.21Å
211	L	92.7	Very high	93.8	Very high	50 Å²	50	26.7 Å²	26.7	26%	0.262	15%	0.146	S	C	.	.	H	α-helix	trans	-95.1	-33.1	-179.2	-79.7	170	0	0	0	113.8	Y155 I158 K159 S207 L208 I209	Y155-L211 HydrophobicContact CD2-CD1 3.89Å; Y155-L211 HydrophobicContact CD2-CD2 4.34Å; Y155-L211 HydrophobicContact CD2-CG 3.98Å; Y155-L211 HydrophobicContact CE2-CD1 3.85Å; Y155-L211 HydrophobicContact CE2-CD2 3.46Å; Y155-L211 VanDerWaalsContact CE2-CD2 3.46Å; Y155-L211 HydrophobicContact CE2-CG 3.5Å; I158-L211 HydrophobicContact CB-CD1 4.04Å; I158-L211 HydrophobicContact CG2-CD1 3.62Å; K159-L211 HydrophobicContact CB-CD1 4.05Å; K159-L211 HydrophobicContact CB-CD2 4.49Å; S207-L211 WeakPolarHBondContact O-CG 3.42Å; S207-L211 PolarHBondContact O-N 3.29Å; L208-L211 PolarHBondContact O-N 3.42Å; I209-L211 VanDerWaalsContact C-N 3.26Å; I209-L211 PolarHBondContact O-N 2.7Å
212	S	90.2	Very high	93.7	Very high	81 Å²	81	28.2 Å²	28.2	57%	0.566	15%	0.149	S	C	*	.	H	α-helix	trans	-108.1	-16.1	-167.1	70.6	0	0	0	0	115.5	L208	L208-S212 PolarHBondContact O-N 2.97Å; L208-S212 PolarHBondContact O-OG 3.23Å
213	S	90.5	Very high	93.7	Very high	28 Å²	28	29.3 Å²	29.3	20%	0.196	16%	0.155	C	C	.	.			trans	-102.9	140	-174.5	69	0	0	0	0	113.3	I209 P216	I209-S213 WeakPolarHBondContact CG2-OG 3.29Å; I209-S213 WeakPolarHBondContact O-CB 3.47Å; I209-S213 PolarHBondContact O-N 2.83Å; I209-S213 PolarHBondContact O-OG 3.48Å; S213-P216 WeakPolarHBondContact OG-CA 3.43Å; S213-P216 WeakPolarHBondContact OG-CB 3.34Å
214	E	88.1	Confident	93.8	Very high	162 Å²	162	27.3 Å²	27.3	76%	0.757	14%	0.144	S	C	*	.	S	Bend	trans	-75.7	-33.1	175.4	-62.1	179	178.3	0	0	112.3	Q714	E214-Q714 PolarHBondContact O-NE2 3.34Å; E214-Q714 PolarHBondContact O-OE1 3.29Å
215	D	90.9	Very high	93.7	Very high	17 Å²	17	31.6 Å²	31.6	9%	0.091	16%	0.16	C	C	.	.			trans	-126.6	96.1	167.1	-179.5	-2.9	0	0	0	110	I217 L218 T219 K289 Y713	D215-I217 VanDerWaalsContact C-N 3.25Å; D215-I217 PolarHBondContact O-N 2.97Å; D215-I217 WeakPolarHBondContact OD1-CA 3.38Å; D215-I217 WeakPolarHBondContact OD1-CB 3.45Å; D215-I217 PolarHBondContact OD1-N 3.32Å; D215-L218 HydrophobicContact CB-CB 4.14Å; D215-L218 VanDerWaalsContact CG-CB 3.49Å; D215-L218 PolarHBondContact O-N 3.45Å; D215-L218 PolarHBondContact OD1-N 2.92Å; D215-L218 VanDerWaalsContact OD1-N 3.11Å; D215-L218 WeakPolarHBondContact OD2-CB 3.45Å; D215-T219 WeakPolarHBondContact O-CB 3.37Å; D215-T219 PolarHBondContact O-N 2.86Å; D215-T219 PolarHBondContact O-OG1 3.49Å; D215-T219 VanDerWaalsContact O-OG1 3.09Å; D215-K289 IonicContact OD2-NZ 3.81Å; D215-K289 PolarHBondContact OD2-NZ 3.39Å; D215-Y713 PolarHBondContact OD1-OH 3.11Å; D215-Y713 VanDerWaalsContact OD1-OH 3.07Å; D215-Y713 PolarHBondContact OD2-OH 3.15Å; D215-Y713 VanDerWaalsContact OD2-OH 3.07Å
216	P	94.8	Very high	93.6	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.013	18%	0.179	C	C	.	.	H	α-helix	trans	-65.3	-25.5	178.7	26.4	-35.8	0	0	0	113.6	I209 S213 A220 F251 L255 I717 V721	I209-P216 HydrophobicContact CG2-CB 3.8Å; S213-P216 WeakPolarHBondContact OG-CA 3.43Å; S213-P216 WeakPolarHBondContact OG-CB 3.34Å; P216-A220 WeakPolarHBondContact O-CB 3.42Å; P216-A220 PolarHBondContact O-N 3.46Å; P216-F251 HydrophobicContact CB-CE1 3.95Å; P216-F251 HydrophobicContact CB-CZ 3.93Å; P216-L255 HydrophobicContact CB-CD2 3.98Å; P216-L255 HydrophobicContact CG-CD2 3.6Å; P216-I717 HydrophobicContact CG-CG2 4Å; P216-V721 HydrophobicContact CG-CG2 3.94Å
217	I	93.9	Very high	93.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-72	-50.4	-179.7	-60.2	175	0	0	0	109.1	D215 A220 F221 L255 I268 F301 I717	D215-I217 VanDerWaalsContact C-N 3.25Å; D215-I217 PolarHBondContact O-N 2.97Å; D215-I217 WeakPolarHBondContact OD1-CA 3.38Å; D215-I217 WeakPolarHBondContact OD1-CB 3.45Å; D215-I217 PolarHBondContact OD1-N 3.32Å; I217-A220 PolarHBondContact O-N 3.08Å; I217-F221 HydrophobicContact CG2-CD1 4.36Å; I217-F221 HydrophobicContact CG2-CD2 4.26Å; I217-F221 HydrophobicContact CG2-CE1 3.8Å; I217-F221 HydrophobicContact CG2-CE2 3.66Å; I217-F221 HydrophobicContact CG2-CZ 3.41Å; I217-F221 VanDerWaalsContact CG2-CZ 3.41Å; I217-F221 VanDerWaalsContact O-CD1 3.26Å; I217-F221 WeakPolarHBondContact O-CD1 3.47Å; I217-F221 WeakPolarHBondContact O-CG 3.23Å; I217-F221 PolarHBondContact O-N 3.27Å; I217-L255 HydrophobicContact CG1-CD2 3.84Å; I217-I268 HydrophobicContact CD1-CG2 3.64Å; I217-F301 HydrophobicContact CG2-CE2 3.76Å; I217-F301 HydrophobicContact CG2-CZ 4.05Å; I217-I717 HydrophobicContact CD1-CD1 3.94Å; I217-I717 HydrophobicContact CG1-CD1 4.49Å
218	L	92.2	Very high	93.6	Very high	16 Å²	16	38.2 Å²	38.2	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-67.9	-37.7	179.2	-177.8	66	0	0	0	112.4	D215 F221 R222 D273 V292	D215-L218 HydrophobicContact CB-CB 4.14Å; D215-L218 VanDerWaalsContact CG-CB 3.49Å; D215-L218 PolarHBondContact O-N 3.45Å; D215-L218 PolarHBondContact OD1-N 2.92Å; D215-L218 VanDerWaalsContact OD1-N 3.11Å; D215-L218 WeakPolarHBondContact OD2-CB 3.45Å; L218-F221 PolarHBondContact O-N 3.07Å; L218-R222 WeakPolarHBondContact O-CG 3.44Å; L218-R222 PolarHBondContact O-N 2.88Å; L218-D273 WeakPolarHBondContact CD2-OD2 3.27Å; L218-V292 HydrophobicContact CD1-CG1 4.19Å
219	T	94	Very high	93.5	Very high	45 Å²	45	40.6 Å²	40.6	28%	0.276	20%	0.201	S	C	.	.	H	α-helix	trans	-60.9	-46.3	173	-65.7	0	0	0	0	111.2	I209 D215 F221 R222 L223	I209-T219 HydrophobicContact CG2-CG2 4.18Å; D215-T219 WeakPolarHBondContact O-CB 3.37Å; D215-T219 PolarHBondContact O-N 2.86Å; D215-T219 PolarHBondContact O-OG1 3.49Å; D215-T219 VanDerWaalsContact O-OG1 3.09Å; T219-F221 VanDerWaalsContact C-N 3.33Å; T219-F221 PolarHBondContact O-N 3.05Å; T219-R222 PolarHBondContact O-N 3.35Å; T219-L223 HydrophobicContact CG2-CD1 3.8Å; T219-L223 HydrophobicContact CG2-CG 4.39Å; T219-L223 WeakPolarHBondContact O-CB 3.45Å; T219-L223 WeakPolarHBondContact O-CG 3.33Å; T219-L223 PolarHBondContact O-N 3.09Å
220	A	96.1	Very high	93.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-34.8	175.8	0	0	0	0	0	113.2	P216 I217 G224 C248 F251 A252	P216-A220 WeakPolarHBondContact O-CB 3.42Å; P216-A220 PolarHBondContact O-N 3.46Å; I217-A220 PolarHBondContact O-N 3.08Å; A220-G224 WeakPolarHBondContact O-CA 3.07Å; A220-G224 PolarHBondContact O-N 3.2Å; A220-C248 HydrophobicContact CB-CB 4.47Å; A220-F251 HydrophobicContact CB-CD1 3.77Å; A220-F251 HydrophobicContact CB-CE1 4.17Å; A220-A252 HydrophobicContact CB-CB 4.17Å
221	F	95.2	Very high	93.5	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-45.4	175.1	-68.8	-5.4	0	0	0	112.5	I217 L218 T219 W225 A252 V292 A293 Y296 Q298 F301	I217-F221 HydrophobicContact CG2-CD1 4.36Å; I217-F221 HydrophobicContact CG2-CD2 4.26Å; I217-F221 HydrophobicContact CG2-CE1 3.8Å; I217-F221 HydrophobicContact CG2-CE2 3.66Å; I217-F221 HydrophobicContact CG2-CZ 3.41Å; I217-F221 VanDerWaalsContact CG2-CZ 3.41Å; I217-F221 VanDerWaalsContact O-CD1 3.26Å; I217-F221 WeakPolarHBondContact O-CD1 3.47Å; I217-F221 WeakPolarHBondContact O-CG 3.23Å; I217-F221 PolarHBondContact O-N 3.27Å; L218-F221 PolarHBondContact O-N 3.07Å; T219-F221 VanDerWaalsContact C-N 3.33Å; T219-F221 PolarHBondContact O-N 3.05Å; F221-W225 WeakPolarHBondContact O-CB 3.33Å; F221-W225 PolarHBondContact O-N 2.99Å; F221-W225 VanDerWaalsContact O-N 3.09Å; F221-A252 HydrophobicContact CD1-CB 4.16Å; F221-A252 HydrophobicContact CE1-CB 3.74Å; F221-V292 HydrophobicContact CD2-CG1 4.34Å; F221-A293 HydrophobicContact CE2-CB 3.61Å; F221-A293 HydrophobicContact CZ-CB 3.68Å; F221-Y296 HydrophobicContact CB-CD2 3.91Å; F221-Y296 HydrophobicContact CB-CG 4.22Å; F221-Y296 HydrophobicContact CD2-CD2 4.48Å; F221-Q298 HydrophobicContact CB-CG 4.44Å; F221-Q298 HydrophobicContact CD1-CB 4.31Å; F221-Q298 HydrophobicContact CD1-CG 3.44Å; F221-Q298 VanDerWaalsContact CD1-CG 3.44Å; F221-Q298 HydrophobicContact CD2-CG 4.41Å; F221-Q298 HydrophobicContact CE1-CB 3.97Å; F221-Q298 HydrophobicContact CE1-CG 3.61Å; F221-Q298 HydrophobicContact CG-CG 3.86Å; F221-Q298 HydrophobicContact CZ-CB 4.36Å; F221-Q298 HydrophobicContact CZ-CG 4.18Å; F221-F301 HydrophobicContact CE1-CB 4.39Å; F221-F301 HydrophobicContact CE1-CD1 4.45Å; F221-F301 AromaticContact CE1-CD2 3.92Å; F221-F301 HydrophobicContact CE1-CD2 3.92Å; F221-F301 HydrophobicContact CE1-CE2 4.24Å; F221-F301 HydrophobicContact CE1-CG 4.03Å; F221-F301 AromaticContact CZ-CD1 3.8Å; F221-F301 HydrophobicContact CZ-CD1 3.8Å; F221-F301 AromaticContact CZ-CD2 3.8Å; F221-F301 HydrophobicContact CZ-CD2 3.8Å; F221-F301 AromaticContact CZ-CE1 3.8Å; F221-F301 HydrophobicContact CZ-CE1 3.8Å; F221-F301 AromaticContact CZ-CE2 3.78Å; F221-F301 HydrophobicContact CZ-CE2 3.78Å; F221-F301 AromaticContact CZ-CG 3.8Å; F221-F301 HydrophobicContact CZ-CG 3.8Å; F221-F301 AromaticContact CZ-CZ 3.77Å; F221-F301 HydrophobicContact CZ-CZ 3.77Å
222	R	94.3	Very high	93.5	Very high	113 Å²	113	44.2 Å²	44.2	43%	0.426	21%	0.212	S	C	.	.	H	α-helix	trans	-66.2	-52.5	178.4	-70.4	176.1	-176.7	168.7	2.7	111.4	L218 T219 G224 W225 E226	L218-R222 WeakPolarHBondContact O-CG 3.44Å; L218-R222 PolarHBondContact O-N 2.88Å; T219-R222 PolarHBondContact O-N 3.35Å; R222-G224 PolarHBondContact O-N 3.31Å; R222-W225 WeakPolarHBondContact O-CB 3.49Å; R222-W225 PolarHBondContact O-N 3.44Å; R222-E226 WeakPolarHBondContact O-CG 3.32Å; R222-E226 PolarHBondContact O-N 3.25Å
223	L	94.7	Very high	93.5	Very high	24 Å²	24	43.8 Å²	43.8	13%	0.126	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-47	177.6	-70.5	174.2	0	0	0	111.5	L203 I209 T219 W225 E226 L227	L203-L223 HydrophobicContact CB-CD1 4.48Å; L203-L223 WeakPolarHBondContact O-CD1 3.29Å; I209-L223 HydrophobicContact CD1-CD1 4.29Å; T219-L223 HydrophobicContact CG2-CD1 3.8Å; T219-L223 HydrophobicContact CG2-CG 4.39Å; T219-L223 WeakPolarHBondContact O-CB 3.45Å; T219-L223 WeakPolarHBondContact O-CG 3.33Å; T219-L223 PolarHBondContact O-N 3.09Å; L223-W225 PolarHBondContact O-N 3.16Å; L223-E226 PolarHBondContact O-N 3Å; L223-L227 WeakPolarHBondContact O-CB 3.4Å; L223-L227 WeakPolarHBondContact O-CD1 3.19Å; L223-L227 WeakPolarHBondContact O-CG 3.05Å; L223-L227 PolarHBondContact O-N 3.22Å
224	G	95.6	Very high	93.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-27.6	178.4	0	0	0	0	0	113.8	A220 R222 S245	A220-G224 WeakPolarHBondContact O-CA 3.07Å; A220-G224 PolarHBondContact O-N 3.2Å; R222-G224 PolarHBondContact O-N 3.31Å; G224-S245 PolarHBondContact O-OG 3.43Å
225	W	94.8	Very high	93.6	Very high	91 Å²	91	40.7 Å²	40.7	35%	0.345	19%	0.192	S	C	.	.	H	α-helix	trans	-77.9	-50.2	171.6	176.2	-98.6	0	0	0	112.3	F221 R222 L223 L227 K228 E229 Y296 H297	F221-W225 WeakPolarHBondContact O-CB 3.33Å; F221-W225 PolarHBondContact O-N 2.99Å; F221-W225 VanDerWaalsContact O-N 3.09Å; R222-W225 WeakPolarHBondContact O-CB 3.49Å; R222-W225 PolarHBondContact O-N 3.44Å; L223-W225 PolarHBondContact O-N 3.16Å; W225-L227 VanDerWaalsContact C-N 3.33Å; W225-L227 PolarHBondContact O-N 3.01Å; W225-K228 WeakPolarHBondContact O-CA 3.47Å; W225-K228 PolarHBondContact O-N 2.92Å; W225-E229 HydrophobicContact CD2-CG 4.46Å; W225-E229 WeakPolarHBondContact CH2-OE1 3.44Å; W225-E229 HydrophobicContact CZ2-CG 4Å; W225-E229 PolarHBondContact O-N 3.36Å; W225-Y296 HydrophobicContact CB-CD1 3.6Å; W225-Y296 HydrophobicContact CB-CE1 4.14Å; W225-Y296 HydrophobicContact CD2-CD1 4.15Å; W225-Y296 AromaticContact CG-CD1 3.67Å; W225-Y296 HydrophobicContact CG-CD1 3.67Å; W225-Y296 HydrophobicContact CG-CE1 4.07Å; W225-H297 AromaticContact CZ3-CD2 3.67Å
226	E	93.9	Very high	93.6	Very high	84 Å²	84	47.2 Å²	47.2	39%	0.393	22%	0.222	S	C	.	.	H	α-helix	trans	-53.5	-49.6	176.9	-74.6	173.7	-156.9	0	0	111	R222 L223 K228 E229 L230	R222-E226 WeakPolarHBondContact O-CG 3.32Å; R222-E226 PolarHBondContact O-N 3.25Å; L223-E226 PolarHBondContact O-N 3Å; E226-K228 VanDerWaalsContact C-N 3.25Å; E226-K228 PolarHBondContact O-N 3.47Å; E226-E229 PolarHBondContact O-N 3.29Å; E226-E229 VanDerWaalsContact O-N 3.14Å; E226-L230 WeakPolarHBondContact O-CB 3.34Å; E226-L230 WeakPolarHBondContact O-CG 3.27Å; E226-L230 PolarHBondContact O-N 3.12Å
227	L	95.4	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.3	-36.6	175.3	-67.5	165	0	0	0	112.8	Y200 A204 L223 W225 S231 Y241 L244	Y200-L227 HydrophobicContact CD1-CD2 3.7Å; Y200-L227 HydrophobicContact CD1-CG 4.44Å; Y200-L227 HydrophobicContact CG-CD2 3.86Å; A204-L227 HydrophobicContact CB-CD1 4.21Å; L223-L227 WeakPolarHBondContact O-CB 3.4Å; L223-L227 WeakPolarHBondContact O-CD1 3.19Å; L223-L227 WeakPolarHBondContact O-CG 3.05Å; L223-L227 PolarHBondContact O-N 3.22Å; W225-L227 VanDerWaalsContact C-N 3.33Å; W225-L227 PolarHBondContact O-N 3.01Å; L227-S231 WeakPolarHBondContact O-CB 3.44Å; L227-S231 PolarHBondContact O-N 3.32Å; L227-Y241 HydrophobicContact CD2-CD1 3.82Å; L227-Y241 HydrophobicContact CD2-CE1 4.34Å; L227-L244 HydrophobicContact CD1-CB 3.91Å; L227-L244 HydrophobicContact CD2-CB 4.31Å; L227-L244 HydrophobicContact CD2-CD1 4.46Å
228	K	94.6	Very high	93.6	Very high	64 Å²	64	53.2 Å²	53.2	28%	0.278	25%	0.248	S	C	.	.	H	α-helix	trans	-79	-23.2	-179.5	-168.8	53.5	175.2	-178.7	0	113.8	W225 E226 S231 E242	W225-K228 WeakPolarHBondContact O-CA 3.47Å; W225-K228 PolarHBondContact O-N 2.92Å; E226-K228 VanDerWaalsContact C-N 3.25Å; E226-K228 PolarHBondContact O-N 3.47Å; K228-S231 PolarHBondContact O-OG 2.66Å; K228-E242 HydrophobicContact CD-CG 4.21Å; K228-E242 IonicContact NZ-OE1 3.11Å; K228-E242 PolarHBondContact NZ-OE1 3.39Å; K228-E242 IonicContact NZ-OE2 2.84Å; K228-E242 PolarHBondContact NZ-OE2 2.89Å
229	E	92.5	Very high	93.8	Very high	60 Å²	60	56.2 Å²	56.2	28%	0.28	28%	0.275	S	S	.	.	H	α-helix	trans	-81.8	-40.2	168.7	-65	-50.8	126	0	0	111	W225 E226 S231 K232 V233	W225-E229 HydrophobicContact CD2-CG 4.46Å; W225-E229 WeakPolarHBondContact CH2-OE1 3.44Å; W225-E229 HydrophobicContact CZ2-CG 4Å; W225-E229 PolarHBondContact O-N 3.36Å; E226-E229 PolarHBondContact O-N 3.29Å; E226-E229 VanDerWaalsContact O-N 3.14Å; E229-S231 VanDerWaalsContact C-N 3.28Å; E229-S231 PolarHBondContact O-N 3.07Å; E229-K232 WeakPolarHBondContact O-CB 3.45Å; E229-K232 PolarHBondContact O-N 3.14Å; E229-K232 WeakPolarHBondContact OE1-CE 3.37Å; E229-K232 IonicContact OE1-NZ 2.66Å; E229-K232 PolarHBondContact OE1-NZ 3.12Å; E229-K232 IonicContact OE2-NZ 2.73Å; E229-K232 PolarHBondContact OE2-NZ 3.16Å; E229-V233 PolarHBondContact O-N 3.1Å
230	L	92.8	Very high	93.9	Very high	20 Å²	20	57.4 Å²	57.4	11%	0.105	28%	0.278	C	S	.	.	H	α-helix	trans	-57.7	-39.5	173.3	-67.2	165.7	0	0	0	111.6	I174 Y200 E226 K232 V233 E234	I174-L230 HydrophobicContact CD1-CD2 3.39Å; I174-L230 HydrophobicContact CG1-CD2 3.86Å; Y200-L230 HydrophobicContact CD1-CD1 4.5Å; Y200-L230 HydrophobicContact CD2-CD1 4.11Å; Y200-L230 HydrophobicContact CE1-CD1 3.94Å; Y200-L230 HydrophobicContact CE2-CD1 3.5Å; Y200-L230 VanDerWaalsContact CZ-CD1 3.41Å; E226-L230 WeakPolarHBondContact O-CB 3.34Å; E226-L230 WeakPolarHBondContact O-CG 3.27Å; E226-L230 PolarHBondContact O-N 3.12Å; L230-K232 PolarHBondContact O-N 3.27Å; L230-K232 VanDerWaalsContact O-N 3.08Å; L230-V233 PolarHBondContact O-N 2.59Å; L230-E234 PolarHBondContact O-N 3.33Å
231	S	95.6	Very high	93.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-5.9	175.2	90.6	0	0	0	0	115.2	L227 K228 E229 K238 E242	L227-S231 WeakPolarHBondContact O-CB 3.44Å; L227-S231 PolarHBondContact O-N 3.32Å; K228-S231 PolarHBondContact O-OG 2.66Å; E229-S231 VanDerWaalsContact C-N 3.28Å; E229-S231 PolarHBondContact O-N 3.07Å; S231-K238 WeakPolarHBondContact O-CD 3.29Å; S231-K238 VanDerWaalsContact O-CG 3.28Å; S231-K238 WeakPolarHBondContact O-CG 3.24Å; S231-E242 WeakPolarHBondContact OG-CG 3.32Å; S231-E242 PolarHBondContact OG-OE1 3.32Å
232	K	92.8	Very high	93.9	Very high	120 Å²	120	60.3 Å²	60.3	52%	0.522	29%	0.291	S	S	.	.	H	α-helix	trans	-101.8	-16.5	169.9	-55.3	174.9	-163	163.3	0	112.6	E229 L230	E229-K232 WeakPolarHBondContact O-CB 3.45Å; E229-K232 PolarHBondContact O-N 3.14Å; E229-K232 WeakPolarHBondContact OE1-CE 3.37Å; E229-K232 IonicContact OE1-NZ 2.66Å; E229-K232 PolarHBondContact OE1-NZ 3.12Å; E229-K232 IonicContact OE2-NZ 2.73Å; E229-K232 PolarHBondContact OE2-NZ 3.16Å; L230-K232 PolarHBondContact O-N 3.27Å; L230-K232 VanDerWaalsContact O-N 3.08Å
233	V	91.6	Very high	94	Very high	72 Å²	72	61.4 Å²	61.4	44%	0.436	30%	0.301	S	S	.	.	H	α-helix	trans	-94.6	-43.1	-179.9	-177.7	0	0	0	0	110.4	I174 E229 L230	I174-V233 HydrophobicContact CB-CG1 4.43Å; I174-V233 HydrophobicContact CD1-CB 3.79Å; I174-V233 HydrophobicContact CD1-CG1 3.53Å; I174-V233 HydrophobicContact CG2-CG1 4.14Å; E229-V233 PolarHBondContact O-N 3.1Å; L230-V233 PolarHBondContact O-N 2.59Å
234	E	90.1	Very high	94.1	Very high	17 Å²	17	60.8 Å²	60.8	8%	0.079	30%	0.298	C	S	.	.			trans	-100	107.4	171.5	-51.2	-162.9	91.3	0	0	108.6	I174 R196 L230 Y241	I174-E234 HydrophobicContact CD1-CG 3.51Å; I174-E234 HydrophobicContact CG1-CG 4.42Å; R196-E234 IonicContact CZ-OE1 3.72Å; R196-E234 IonicContact CZ-OE2 3.24Å; R196-E234 IonicContact NE-OE1 2.73Å; R196-E234 IonicContact NE-OE2 3.97Å; R196-E234 PolarHBondContact NE-OE2 3.01Å; R196-E234 VanDerWaalsContact NH2-CD 3.31Å; R196-E234 IonicContact NH2-OE1 2.86Å; R196-E234 PolarHBondContact NH2-OE1 3.42Å; R196-E234 IonicContact NH2-OE2 2.73Å; R196-E234 PolarHBondContact NH2-OE2 3.14Å; L230-E234 PolarHBondContact O-N 3.33Å; E234-Y241 HydrophobicContact CB-CE2 4.06Å; E234-Y241 HydrophobicContact CG-CE2 4.36Å; E234-Y241 WeakPolarHBondContact OE2-CE2 3.39Å; E234-Y241 PolarHBondContact OE2-OH 3.3Å
235	N	90.8	Very high	94.2	Very high	109 Å²	109	60.8 Å²	60.8	58%	0.583	30%	0.298	S	S	*	.	S	Bend	trans	-81.1	-26.9	-176.3	-71.2	-52.2	0	0	0	111.9	K238	N235-K238 WeakPolarHBondContact O-CB 3.28Å
236	E	91	Very high	94.2	Very high	153 Å²	153	60.4 Å²	60.4	72%	0.715	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-47.4	-174.4	-60.4	69.6	-154.8	0	0	110.9
237	F	93.6	Very high	94.3	Very high	39 Å²	39	59.5 Å²	59.5	17%	0.171	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	17.8	179.3	-59.9	-69	0	0	0	113.2	L197 A239 E240 Y241	L197-F237 HydrophobicContact CD2-CB 4.11Å; L197-F237 HydrophobicContact CD2-CD1 3.71Å; L197-F237 HydrophobicContact CD2-CE1 4.29Å; L197-F237 HydrophobicContact CD2-CG 3.89Å; F237-A239 VanDerWaalsContact C-N 3.27Å; F237-A239 PolarHBondContact O-N 3.02Å; F237-E240 PolarHBondContact O-N 3.05Å; F237-E240 VanDerWaalsContact O-N 3.16Å; F237-Y241 HydrophobicContact CB-CD2 4.02Å; F237-Y241 HydrophobicContact CB-CE2 3.92Å; F237-Y241 WeakPolarHBondContact O-CD2 3.43Å; F237-Y241 PolarHBondContact O-N 2.95Å; F237-Y241 VanDerWaalsContact O-N 3.09Å
238	K	94.6	Very high	94.4	Very high	89 Å²	89	59.5 Å²	59.5	39%	0.387	30%	0.296	S	S	.	.	H	α-helix	trans	-52.7	-42.8	-175.9	171.6	173.5	178.5	-173.8	0	113	S231 N235 Y241 E242	S231-K238 WeakPolarHBondContact O-CD 3.29Å; S231-K238 VanDerWaalsContact O-CG 3.28Å; S231-K238 WeakPolarHBondContact O-CG 3.24Å; N235-K238 WeakPolarHBondContact O-CB 3.28Å; K238-Y241 PolarHBondContact O-N 2.96Å; K238-E242 WeakPolarHBondContact CE-OE1 3.25Å; K238-E242 HydrophobicContact CG-CG 4.28Å; K238-E242 WeakPolarHBondContact O-CB 3.09Å; K238-E242 VanDerWaalsContact O-CG 3.28Å; K238-E242 WeakPolarHBondContact O-CG 3.42Å; K238-E242 PolarHBondContact O-N 3.13Å
239	A	95.9	Very high	94.4	Very high	79 Å²	79	58.4 Å²	58.4	65%	0.653	29%	0.291	S	S	*	.	H	α-helix	trans	-61.7	-46.7	-179.1	0	0	0	0	0	111.9	F237 E242 E243	F237-A239 VanDerWaalsContact C-N 3.27Å; F237-A239 PolarHBondContact O-N 3.02Å; A239-E242 PolarHBondContact O-N 3.39Å; A239-E243 WeakPolarHBondContact O-CB 3.12Å; A239-E243 PolarHBondContact O-N 2.93Å
240	E	95.8	Very high	94.5	Very high	70 Å²	70	58.7 Å²	58.7	33%	0.327	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-43.2	178.9	-62.1	-169.7	-126	0	0	111.4	L197 F237 E242 E243 L244	L197-E240 HydrophobicContact CD1-CB 4.15Å; L197-E240 HydrophobicContact CD2-CB 4.44Å; F237-E240 PolarHBondContact O-N 3.05Å; F237-E240 VanDerWaalsContact O-N 3.16Å; E240-E242 VanDerWaalsContact C-N 3.35Å; E240-E242 PolarHBondContact O-N 3.32Å; E240-E243 PolarHBondContact O-N 3.37Å; E240-L244 VanDerWaalsContact O-CG 3.29Å; E240-L244 WeakPolarHBondContact O-CG 2.97Å; E240-L244 PolarHBondContact O-N 3.2Å
241	Y	96.4	Very high	94.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-34.9	175.4	-73.7	-57.6	0	0	0	113.3	L197 Y200 L227 E234 F237 K238 S245	L197-Y241 HydrophobicContact CD1-CD1 3.89Å; L197-Y241 HydrophobicContact CD1-CE1 3.57Å; L197-Y241 HydrophobicContact CD1-CE2 4.3Å; L197-Y241 HydrophobicContact CD1-CG 4.37Å; Y200-Y241 HydrophobicContact CD2-CE1 4.2Å; Y200-Y241 HydrophobicContact CG-CE1 4.48Å; L227-Y241 HydrophobicContact CD2-CD1 3.82Å; L227-Y241 HydrophobicContact CD2-CE1 4.34Å; E234-Y241 HydrophobicContact CB-CE2 4.06Å; E234-Y241 HydrophobicContact CG-CE2 4.36Å; E234-Y241 WeakPolarHBondContact OE2-CE2 3.39Å; E234-Y241 PolarHBondContact OE2-OH 3.3Å; F237-Y241 HydrophobicContact CB-CD2 4.02Å; F237-Y241 HydrophobicContact CB-CE2 3.92Å; F237-Y241 WeakPolarHBondContact O-CD2 3.43Å; F237-Y241 PolarHBondContact O-N 2.95Å; F237-Y241 VanDerWaalsContact O-N 3.09Å; K238-Y241 PolarHBondContact O-N 2.96Å; Y241-S245 VanDerWaalsContact O-CB 3.24Å; Y241-S245 WeakPolarHBondContact O-CB 3.43Å; Y241-S245 PolarHBondContact O-N 3.22Å
242	E	95.7	Very high	94.7	Very high	63 Å²	63	57.9 Å²	57.9	29%	0.294	29%	0.29	S	S	.	.	H	α-helix	trans	-70	-37.5	175.1	-72	-171.3	171.6	0	0	112.3	K228 S231 K238 A239 E240 S245 Q246	K228-E242 HydrophobicContact CD-CG 4.21Å; K228-E242 IonicContact NZ-OE1 3.11Å; K228-E242 PolarHBondContact NZ-OE1 3.39Å; K228-E242 IonicContact NZ-OE2 2.84Å; K228-E242 PolarHBondContact NZ-OE2 2.89Å; S231-E242 WeakPolarHBondContact OG-CG 3.32Å; S231-E242 PolarHBondContact OG-OE1 3.32Å; K238-E242 WeakPolarHBondContact CE-OE1 3.25Å; K238-E242 HydrophobicContact CG-CG 4.28Å; K238-E242 WeakPolarHBondContact O-CB 3.09Å; K238-E242 VanDerWaalsContact O-CG 3.28Å; K238-E242 WeakPolarHBondContact O-CG 3.42Å; K238-E242 PolarHBondContact O-N 3.13Å; A239-E242 PolarHBondContact O-N 3.39Å; E240-E242 VanDerWaalsContact C-N 3.35Å; E240-E242 PolarHBondContact O-N 3.32Å; E242-S245 WeakPolarHBondContact O-CB 3.36Å; E242-S245 PolarHBondContact O-N 2.96Å; E242-Q246 PolarHBondContact O-N 3.13Å
243	E	96.6	Very high	94.9	Very high	136 Å²	136	55.1 Å²	55.1	64%	0.636	28%	0.278	S	S	*	.	H	α-helix	trans	-63.3	-49.8	173	-174.7	178.7	-175.8	0	0	111.6	A239 E240 S245 Q246 Q247	A239-E243 WeakPolarHBondContact O-CB 3.12Å; A239-E243 PolarHBondContact O-N 2.93Å; E240-E243 PolarHBondContact O-N 3.37Å; E243-S245 VanDerWaalsContact C-N 3.31Å; E243-S245 PolarHBondContact O-N 3.08Å; E243-Q246 CarbonylContact O-C 3.34Å; E243-Q246 WeakPolarHBondContact O-CA 3.24Å; E243-Q246 WeakPolarHBondContact O-CB 3.38Å; E243-Q246 PolarHBondContact O-N 2.95Å; E243-Q247 PolarHBondContact O-N 3.29Å
244	L	96.8	Very high	95	Very high	10 Å²	10	54.2 Å²	54.2	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-61.3	-39.3	176.1	-64.8	174.5	0	0	0	111.9	L197 K201 A204 L227 E240 Q246 Q247 C248	L197-L244 HydrophobicContact CD1-CD1 4.23Å; K201-L244 HydrophobicContact CB-CD1 3.97Å; K201-L244 HydrophobicContact CB-CD2 4.22Å; K201-L244 HydrophobicContact CG-CD2 3.99Å; A204-L244 HydrophobicContact CB-CB 4.32Å; A204-L244 HydrophobicContact CB-CD2 4.25Å; L227-L244 HydrophobicContact CD1-CB 3.91Å; L227-L244 HydrophobicContact CD2-CB 4.31Å; L227-L244 HydrophobicContact CD2-CD1 4.46Å; E240-L244 VanDerWaalsContact O-CG 3.29Å; E240-L244 WeakPolarHBondContact O-CG 2.97Å; E240-L244 PolarHBondContact O-N 3.2Å; L244-Q246 VanDerWaalsContact C-N 3.28Å; L244-Q246 PolarHBondContact O-N 3.46Å; L244-Q247 WeakPolarHBondContact O-CB 3.43Å; L244-Q247 PolarHBondContact O-N 2.88Å; L244-C248 PolarHBondContact O-N 3.46Å; L244-C248 PolarHBondContact O-SG 3.2Å
245	S	96.9	Very high	95.3	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-36.1	173.4	-179.8	0	0	0	0	112.2	G224 Y241 E242 E243 K249	G224-S245 PolarHBondContact O-OG 3.43Å; Y241-S245 VanDerWaalsContact O-CB 3.24Å; Y241-S245 WeakPolarHBondContact O-CB 3.43Å; Y241-S245 PolarHBondContact O-N 3.22Å; E242-S245 WeakPolarHBondContact O-CB 3.36Å; E242-S245 PolarHBondContact O-N 2.96Å; E243-S245 VanDerWaalsContact C-N 3.31Å; E243-S245 PolarHBondContact O-N 3.08Å; S245-K249 VanDerWaalsContact O-CD 3.32Å; S245-K249 WeakPolarHBondContact O-CD 3.41Å; S245-K249 WeakPolarHBondContact O-CG 3.28Å; S245-K249 PolarHBondContact O-N 3.05Å; S245-K249 PolarHBondContact OG-NZ 2.97Å
246	Q	95.6	Very high	95.4	Very high	83 Å²	83	48.2 Å²	48.2	39%	0.388	24%	0.239	S	C	.	.	H	α-helix	trans	-72.8	-39.1	174.6	-170.8	169.1	4.7	0	0	111.9	E242 E243 L244 C248 K249 L250	E242-Q246 PolarHBondContact O-N 3.13Å; E243-Q246 CarbonylContact O-C 3.34Å; E243-Q246 WeakPolarHBondContact O-CA 3.24Å; E243-Q246 WeakPolarHBondContact O-CB 3.38Å; E243-Q246 PolarHBondContact O-N 2.95Å; L244-Q246 VanDerWaalsContact C-N 3.28Å; L244-Q246 PolarHBondContact O-N 3.46Å; Q246-C248 VanDerWaalsContact C-N 3.33Å; Q246-C248 PolarHBondContact O-N 3.27Å; Q246-K249 WeakPolarHBondContact O-CB 3.36Å; Q246-K249 PolarHBondContact O-N 3.46Å; Q246-K249 VanDerWaalsContact O-N 3.11Å; Q246-L250 HydrophobicContact CG-CD1 4.05Å; Q246-L250 HydrophobicContact CG-CG 4.4Å; Q246-L250 WeakPolarHBondContact O-CB 3.5Å; Q246-L250 WeakPolarHBondContact O-CG 3.45Å; Q246-L250 PolarHBondContact O-N 2.97Å
247	Q	96.1	Very high	95.6	Very high	65 Å²	65	44.6 Å²	44.6	30%	0.304	22%	0.224	S	C	.	.	H	α-helix	trans	-57	-44.6	174	-169.6	-179.6	15.3	0	0	111.7	P206 E243 L244 K249 L250 F251	P206-Q247 HydrophobicContact CG-CG 4.41Å; E243-Q247 PolarHBondContact O-N 3.29Å; L244-Q247 WeakPolarHBondContact O-CB 3.43Å; L244-Q247 PolarHBondContact O-N 2.88Å; Q247-K249 PolarHBondContact O-N 3.37Å; Q247-L250 PolarHBondContact O-N 2.73Å; Q247-F251 WeakPolarHBondContact O-CB 3.47Å; Q247-F251 PolarHBondContact O-N 3.1Å
248	C	96.4	Very high	95.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-38.1	174.8	-64.8	0	0	0	0	113.2	A220 L244 Q246 A252	A220-C248 HydrophobicContact CB-CB 4.47Å; L244-C248 PolarHBondContact O-N 3.46Å; L244-C248 PolarHBondContact O-SG 3.2Å; Q246-C248 VanDerWaalsContact C-N 3.33Å; Q246-C248 PolarHBondContact O-N 3.27Å; C248-A252 PolarHBondContact O-N 3.29Å; C248-A252 VanDerWaalsContact O-N 3.1Å
249	K	95.3	Very high	95.6	Very high	41 Å²	41	40.7 Å²	40.7	18%	0.178	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-46.5	176.8	-74.4	158.6	-175.7	145.3	0	111.7	S245 Q246 Q247 A252 K253 Q298	S245-K249 VanDerWaalsContact O-CD 3.32Å; S245-K249 WeakPolarHBondContact O-CD 3.41Å; S245-K249 WeakPolarHBondContact O-CG 3.28Å; S245-K249 PolarHBondContact O-N 3.05Å; S245-K249 PolarHBondContact OG-NZ 2.97Å; Q246-K249 WeakPolarHBondContact O-CB 3.36Å; Q246-K249 PolarHBondContact O-N 3.46Å; Q246-K249 VanDerWaalsContact O-N 3.11Å; Q247-K249 PolarHBondContact O-N 3.37Å; K249-A252 PolarHBondContact O-N 3.39Å; K249-K253 WeakPolarHBondContact O-CB 3.45Å; K249-K253 PolarHBondContact O-N 3.33Å; K249-Q298 VanDerWaalsContact CG-OE1 3.32Å
250	L	95.3	Very high	95.4	Very high	65 Å²	65	46.4 Å²	46.4	34%	0.34	22%	0.215	S	C	.	.	H	α-helix	trans	-60.3	-47.2	176.1	-75.6	166.4	0	0	0	110.9	Q246 Q247 A252 K253 D254 E300	Q246-L250 HydrophobicContact CG-CD1 4.05Å; Q246-L250 HydrophobicContact CG-CG 4.4Å; Q246-L250 WeakPolarHBondContact O-CB 3.5Å; Q246-L250 WeakPolarHBondContact O-CG 3.45Å; Q246-L250 PolarHBondContact O-N 2.97Å; Q247-L250 PolarHBondContact O-N 2.73Å; L250-A252 PolarHBondContact O-N 2.94Å; L250-K253 HydrophobicContact CD2-CD 4.46Å; L250-K253 PolarHBondContact O-N 3.27Å; L250-D254 WeakPolarHBondContact O-CB 3.31Å; L250-D254 PolarHBondContact O-N 3.22Å; L250-E300 WeakPolarHBondContact CD2-OE2 3.35Å; L250-E300 WeakPolarHBondContact CG-OE2 3.22Å
251	F	96.1	Very high	95.3	Very high	3 Å²	3	45.5 Å²	45.5	1%	0.013	22%	0.216	C	C	.	.	H	α-helix	trans	-55.2	-49.1	175.6	168.6	-106.9	0	0	0	112.5	P206 I209 P216 A220 Q247 K253 D254 L255 Y724	P206-F251 HydrophobicContact CB-CD2 3.65Å; P206-F251 HydrophobicContact CB-CE2 4.11Å; P206-F251 HydrophobicContact CB-CG 4.32Å; P206-F251 HydrophobicContact CG-CB 4.34Å; P206-F251 HydrophobicContact CG-CD2 4.26Å; I209-F251 HydrophobicContact CB-CE1 4.08Å; I209-F251 HydrophobicContact CB-CZ 4.21Å; I209-F251 HydrophobicContact CD1-CD1 4.45Å; I209-F251 HydrophobicContact CD1-CE1 4.46Å; I209-F251 HydrophobicContact CG2-CD1 4.48Å; I209-F251 HydrophobicContact CG2-CE1 3.54Å; I209-F251 HydrophobicContact CG2-CZ 3.92Å; P216-F251 HydrophobicContact CB-CE1 3.95Å; P216-F251 HydrophobicContact CB-CZ 3.93Å; A220-F251 HydrophobicContact CB-CD1 3.77Å; A220-F251 HydrophobicContact CB-CE1 4.17Å; Q247-F251 WeakPolarHBondContact O-CB 3.47Å; Q247-F251 PolarHBondContact O-N 3.1Å; F251-K253 VanDerWaalsContact C-N 3.32Å; F251-K253 PolarHBondContact O-N 2.93Å; F251-D254 PolarHBondContact O-N 3.44Å; F251-L255 HydrophobicContact CZ-CD2 4.29Å; F251-L255 VanDerWaalsContact O-CB 3.31Å; F251-L255 WeakPolarHBondContact O-CB 3.29Å; F251-L255 PolarHBondContact O-N 3.02Å; F251-Y724 AromaticContact CD2-CE1 3.81Å; F251-Y724 HydrophobicContact CD2-CE1 3.81Å; F251-Y724 HydrophobicContact CD2-CE2 4.24Å; F251-Y724 AromaticContact CD2-CZ 3.63Å; F251-Y724 HydrophobicContact CE2-CD1 4.04Å; F251-Y724 AromaticContact CE2-CE1 3.62Å; F251-Y724 HydrophobicContact CE2-CE1 3.62Å; F251-Y724 AromaticContact CE2-CZ 3.94Å
252	A	96.1	Very high	94.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-39.2	178.9	0	0	0	0	0	112.3	A220 F221 C248 K249 L250 L256 F301	A220-A252 HydrophobicContact CB-CB 4.17Å; F221-A252 HydrophobicContact CD1-CB 4.16Å; F221-A252 HydrophobicContact CE1-CB 3.74Å; C248-A252 PolarHBondContact O-N 3.29Å; C248-A252 VanDerWaalsContact O-N 3.1Å; K249-A252 PolarHBondContact O-N 3.39Å; L250-A252 PolarHBondContact O-N 2.94Å; A252-L256 PolarHBondContact O-N 3.17Å; A252-F301 HydrophobicContact CB-CD2 4.13Å; A252-F301 WeakPolarHBondContact O-CD2 3.48Å
253	K	95.4	Very high	94.7	Very high	63 Å²	63	54.5 Å²	54.5	27%	0.274	26%	0.259	S	S	.	.	H	α-helix	trans	-67.9	-42.1	176.4	161.1	-102.4	169.3	-170.5	0	112.2	K249 L250 F251 L256 D257 E300	K249-K253 WeakPolarHBondContact O-CB 3.45Å; K249-K253 PolarHBondContact O-N 3.33Å; L250-K253 HydrophobicContact CD2-CD 4.46Å; L250-K253 PolarHBondContact O-N 3.27Å; F251-K253 VanDerWaalsContact C-N 3.32Å; F251-K253 PolarHBondContact O-N 2.93Å; K253-L256 PolarHBondContact O-N 2.92Å; K253-D257 PolarHBondContact O-N 3.49Å; K253-D257 VanDerWaalsContact O-N 3.13Å; K253-E300 HydrophobicContact CB-CB 4.21Å; K253-E300 HydrophobicContact CG-CB 4.25Å
254	D	95.3	Very high	94.4	Very high	52 Å²	52	49.2 Å²	49.2	28%	0.278	24%	0.235	S	C	.	.	H	α-helix	trans	-73	-30.2	179.2	-71.8	-20.7	0	0	0	112.9	L250 F251 D257 Q258 Y724	L250-D254 WeakPolarHBondContact O-CB 3.31Å; L250-D254 PolarHBondContact O-N 3.22Å; F251-D254 PolarHBondContact O-N 3.44Å; D254-D257 WeakPolarHBondContact O-CB 3.39Å; D254-D257 PolarHBondContact O-N 2.95Å; D254-Q258 PolarHBondContact O-NE2 2.83Å; D254-Y724 HydrophobicContact CB-CD2 4.32Å; D254-Y724 HydrophobicContact CB-CE2 3.81Å
255	L	95.1	Very high	94.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.5	-40.9	171.9	-175	63.8	0	0	0	111.3	P216 I217 F251 D257 Q258 L720 V721 Y724	P216-L255 HydrophobicContact CB-CD2 3.98Å; P216-L255 HydrophobicContact CG-CD2 3.6Å; I217-L255 HydrophobicContact CG1-CD2 3.84Å; F251-L255 HydrophobicContact CZ-CD2 4.29Å; F251-L255 VanDerWaalsContact O-CB 3.31Å; F251-L255 WeakPolarHBondContact O-CB 3.29Å; F251-L255 PolarHBondContact O-N 3.02Å; L255-D257 PolarHBondContact O-N 2.87Å; L255-Q258 PolarHBondContact O-N 3.38Å; L255-L720 HydrophobicContact CD1-CB 3.87Å; L255-L720 HydrophobicContact CG-CB 4.46Å; L255-V721 HydrophobicContact CD1-CG2 4.14Å; L255-Y724 HydrophobicContact CD1-CG 4.18Å
256	L	94.4	Very high	93.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.2	-22.1	172.7	-161.3	64.4	0	0	0	112.3	A252 K253 Q258 A259 L265 I268 F301 Q304 C307	A252-L256 PolarHBondContact O-N 3.17Å; K253-L256 PolarHBondContact O-N 2.92Å; L256-Q258 VanDerWaalsContact C-N 3.26Å; L256-Q258 PolarHBondContact O-N 3.45Å; L256-A259 WeakPolarHBondContact O-CB 3.47Å; L256-A259 PolarHBondContact O-N 3.45Å; L256-L265 HydrophobicContact CD1-CD1 3.66Å; L256-L265 HydrophobicContact CD2-CD1 4.19Å; L256-L265 HydrophobicContact CG-CD1 3.97Å; L256-I268 HydrophobicContact CD1-CD1 3.85Å; L256-I268 HydrophobicContact CD1-CG2 4.01Å; L256-F301 HydrophobicContact CB-CD2 4.32Å; L256-F301 HydrophobicContact CB-CE2 4.03Å; L256-F301 HydrophobicContact CD1-CE2 4.29Å; L256-F301 HydrophobicContact CD1-CZ 4.35Å; L256-F301 HydrophobicContact CD2-CD1 4.41Å; L256-F301 HydrophobicContact CD2-CD2 4Å; L256-F301 HydrophobicContact CD2-CE1 4.06Å; L256-F301 HydrophobicContact CD2-CE2 3.64Å; L256-F301 HydrophobicContact CD2-CG 4.39Å; L256-F301 HydrophobicContact CD2-CZ 3.68Å; L256-F301 HydrophobicContact CG-CE2 4.2Å; L256-F301 HydrophobicContact CG-CZ 4.49Å; L256-Q304 VanDerWaalsContact C-NE2 3.26Å; L256-Q304 VanDerWaalsContact CG-OE1 3.29Å; L256-Q304 PolarHBondContact O-NE2 2.88Å; L256-C307 HydrophobicContact CD2-CB 4.32Å
257	D	94.3	Very high	93.5	Very high	77 Å²	77	50.7 Å²	50.7	41%	0.412	24%	0.242	S	C	.	.	H	α-helix	trans	-72.9	-16.4	174.6	-140.1	50.1	0	0	0	113.9	K253 D254 L255 A259 Q304	K253-D257 PolarHBondContact O-N 3.49Å; K253-D257 VanDerWaalsContact O-N 3.13Å; D254-D257 WeakPolarHBondContact O-CB 3.39Å; D254-D257 PolarHBondContact O-N 2.95Å; L255-D257 PolarHBondContact O-N 2.87Å; D257-A259 VanDerWaalsContact C-N 3.26Å; D257-A259 PolarHBondContact O-N 3.04Å; D257-Q304 PolarHBondContact OD1-NE2 2.89Å
258	Q	95	Very high	93.3	Very high	35 Å²	35	47.6 Å²	47.6	16%	0.164	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.5	173.6	-52.8	-48.4	-51.6	0	0	114	D254 L255 L256 R260 L720 R723	D254-Q258 PolarHBondContact O-NE2 2.83Å; L255-Q258 PolarHBondContact O-N 3.38Å; L256-Q258 VanDerWaalsContact C-N 3.26Å; L256-Q258 PolarHBondContact O-N 3.45Å; Q258-R260 PolarHBondContact O-N 2.94Å; Q258-L720 HydrophobicContact CB-CD2 3.84Å; Q258-L720 WeakPolarHBondContact O-CD2 3.5Å; Q258-R723 HydrophobicContact CB-CB 3.87Å; Q258-R723 HydrophobicContact CG-CB 4.15Å; Q258-R723 WeakPolarHBondContact O-CD 3.3Å; Q258-R723 PolarHBondContact O-NH1 3.36Å
259	A	93.6	Very high	93	Very high	11 Å²	11	47.6 Å²	47.6	9%	0.091	23%	0.227	C	C	.	.			trans	-73	120.1	175.6	0	0	0	0	0	110.2	L256 D257 E264 L720	L256-A259 WeakPolarHBondContact O-CB 3.47Å; L256-A259 PolarHBondContact O-N 3.45Å; D257-A259 VanDerWaalsContact C-N 3.26Å; D257-A259 PolarHBondContact O-N 3.04Å; A259-E264 HydrophobicContact CB-CB 4.49Å; A259-L720 HydrophobicContact CB-CD2 4Å; A259-L720 VanDerWaalsContact N-CD2 3.32Å
260	R	91.7	Very high	92.6	Very high	199 Å²	199	47.1 Å²	47.1	75%	0.751	23%	0.227	S	C	*	.			trans	-104.9	-9.2	-173.5	-68.3	-177.5	-179.5	-177	0.2	113.8	Q258 E264	Q258-R260 PolarHBondContact O-N 2.94Å; R260-E264 PolarHBondContact N-OE2 3.26Å
261	S	92.8	Very high	92.1	Very high	52 Å²	52	44.7 Å²	44.7	36%	0.364	21%	0.214	S	C	.	.	S	Bend	trans	-132.5	151.8	177.4	70.2	0	0	0	0	111.5	R263 E264 L265	S261-R263 PolarHBondContact O-N 3.13Å; S261-E264 PolarHBondContact N-OE2 3.39Å; S261-E264 PolarHBondContact O-N 2.91Å; S261-E264 WeakPolarHBondContact OG-CB 3.45Å; S261-E264 VanDerWaalsContact OG-CG 3.32Å; S261-E264 WeakPolarHBondContact OG-CG 3.27Å; S261-E264 PolarHBondContact OG-N 3.42Å; S261-E264 VanDerWaalsContact OG-N 3.1Å; S261-L265 PolarHBondContact O-N 2.73Å
262	S	89.2	Confident	91.1	Very high	75 Å²	75	49.1 Å²	49.1	52%	0.524	23%	0.23	S	C	.	.	H	α-helix	trans	-61.5	-32.5	173.5	61.5	0	0	0	0	111.7	L265 E266	S262-L265 WeakPolarHBondContact O-CB 3.49Å; S262-L265 PolarHBondContact O-N 2.89Å; S262-E266 WeakPolarHBondContact O-CB 3.29Å; S262-E266 VanDerWaalsContact O-CG 3.24Å; S262-E266 WeakPolarHBondContact O-CG 3.17Å; S262-E266 PolarHBondContact O-N 3.49Å
263	R	89.9	Confident	89.7	Confident	176 Å²	176	51.3 Å²	51.3	66%	0.664	24%	0.242	S	C	*	.	H	α-helix	trans	-66.6	-42.4	176.7	-171.3	175.5	179.4	179.6	-0.9	112.8	S261 L265 I267	S261-R263 PolarHBondContact O-N 3.13Å; R263-L265 VanDerWaalsContact C-N 3.3Å; R263-L265 PolarHBondContact O-N 3.38Å; R263-I267 HydrophobicContact CG-CD1 4.05Å; R263-I267 WeakPolarHBondContact O-CB 3.49Å; R263-I267 WeakPolarHBondContact O-CD1 3.39Å; R263-I267 WeakPolarHBondContact O-CG1 3.39Å; R263-I267 PolarHBondContact O-N 3.3Å
264	E	91.9	Very high	87.8	Confident	26 Å²	26	52.8 Å²	52.8	12%	0.121	25%	0.253	C	S	.	.	H	α-helix	trans	-56.7	-47.9	170.6	-77.3	172.8	170.9	0	0	109.9	A259 R260 S261 I267 I268 V716 R723	A259-E264 HydrophobicContact CB-CB 4.49Å; R260-E264 PolarHBondContact N-OE2 3.26Å; S261-E264 PolarHBondContact N-OE2 3.39Å; S261-E264 PolarHBondContact O-N 2.91Å; S261-E264 WeakPolarHBondContact OG-CB 3.45Å; S261-E264 VanDerWaalsContact OG-CG 3.32Å; S261-E264 WeakPolarHBondContact OG-CG 3.27Å; S261-E264 PolarHBondContact OG-N 3.42Å; S261-E264 VanDerWaalsContact OG-N 3.1Å; E264-I267 PolarHBondContact O-N 2.84Å; E264-I268 VanDerWaalsContact O-CD1 3.27Å; E264-I268 WeakPolarHBondContact O-CD1 3.32Å; E264-I268 VanDerWaalsContact O-CG1 3.22Å; E264-I268 WeakPolarHBondContact O-CG1 3.49Å; E264-I268 PolarHBondContact O-N 2.83Å; E264-V716 HydrophobicContact CB-CG1 4.09Å; E264-V716 HydrophobicContact CG-CG1 4.18Å; E264-V716 HydrophobicContact CG-CG2 4.28Å; E264-R723 VanDerWaalsContact CD-NH1 3.35Å; E264-R723 IonicContact OE1-CZ 2.67Å; E264-R723 IonicContact OE1-NH1 2.69Å; E264-R723 PolarHBondContact OE1-NH1 2.88Å; E264-R723 VanDerWaalsContact OE1-NH1 3.11Å; E264-R723 IonicContact OE1-NH2 3.63Å; E264-R723 PolarHBondContact OE1-NH2 3.47Å; E264-R723 IonicContact OE2-CZ 2.76Å; E264-R723 IonicContact OE2-NH1 3.38Å; E264-R723 PolarHBondContact OE2-NH1 3.45Å; E264-R723 IonicContact OE2-NH2 3.57Å
265	L	91.6	Very high	85.7	Confident	8 Å²	8	59.3 Å²	59.3	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-43.3	-179	-175.7	65.1	0	0	0	113.5	L256 S261 S262 R263 I268 L269 N306 L310	L256-L265 HydrophobicContact CD1-CD1 3.66Å; L256-L265 HydrophobicContact CD2-CD1 4.19Å; L256-L265 HydrophobicContact CG-CD1 3.97Å; S261-L265 PolarHBondContact O-N 2.73Å; S262-L265 WeakPolarHBondContact O-CB 3.49Å; S262-L265 PolarHBondContact O-N 2.89Å; R263-L265 VanDerWaalsContact C-N 3.3Å; R263-L265 PolarHBondContact O-N 3.38Å; L265-I268 PolarHBondContact O-N 2.91Å; L265-L269 HydrophobicContact CD1-CD1 3.8Å; L265-L269 HydrophobicContact CD1-CG 4.17Å; L265-L269 HydrophobicContact CG-CD1 3.83Å; L265-L269 HydrophobicContact CG-CG 4.47Å; L265-L269 WeakPolarHBondContact O-CG 3.31Å; L265-L269 PolarHBondContact O-N 3.46Å; L265-N306 HydrophobicContact CD2-CB 4.1Å; L265-N306 WeakPolarHBondContact CD2-O 3.42Å; L265-L310 HydrophobicContact CD2-CB 4.03Å; L265-L310 HydrophobicContact CD2-CD2 4.3Å; L265-L310 HydrophobicContact CG-CD2 4.29Å
266	E	89.1	Confident	83.3	Confident	75 Å²	75	61.7 Å²	61.7	35%	0.35	30%	0.298	S	S	.	.	H	α-helix	trans	-64.4	-39.1	177.3	-76.8	162.1	-148.7	0	0	111.8	S262 I268 N270 L310	S262-E266 WeakPolarHBondContact O-CB 3.29Å; S262-E266 VanDerWaalsContact O-CG 3.24Å; S262-E266 WeakPolarHBondContact O-CG 3.17Å; S262-E266 PolarHBondContact O-N 3.49Å; E266-I268 VanDerWaalsContact C-N 3.34Å; E266-N270 VanDerWaalsContact O-CB 3.28Å; E266-N270 WeakPolarHBondContact O-CB 3.44Å; E266-N270 PolarHBondContact O-N 2.79Å; E266-N270 PolarHBondContact O-ND2 3.21Å; E266-L310 HydrophobicContact CG-CD1 3.76Å; E266-L310 HydrophobicContact CG-CD2 3.88Å; E266-L310 HydrophobicContact CG-CG 4.49Å
267	I	89.1	Confident	80.7	Confident	41 Å²	41	70.7 Å²	70.7	21%	0.21	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-42.7	175.4	-71.5	165.5	0	0	0	110.4	R263 E264 H271 Y713 V716	R263-I267 HydrophobicContact CG-CD1 4.05Å; R263-I267 WeakPolarHBondContact O-CB 3.49Å; R263-I267 WeakPolarHBondContact O-CD1 3.39Å; R263-I267 WeakPolarHBondContact O-CG1 3.39Å; R263-I267 PolarHBondContact O-N 3.3Å; E264-I267 PolarHBondContact O-N 2.84Å; I267-H271 WeakPolarHBondContact O-CB 3.24Å; I267-H271 PolarHBondContact O-N 3.37Å; I267-Y713 HydrophobicContact CG2-CD2 4.29Å; I267-V716 HydrophobicContact CD1-CG2 4.25Å; I267-V716 HydrophobicContact CG2-CG2 4.34Å
268	I	91.1	Very high	78.2	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-66.1	-51.1	179	-59.8	154.2	0	0	0	111.2	I217 L256 E264 L265 E266 N270 H271 K289 Y713 V716 L720	I217-I268 HydrophobicContact CD1-CG2 3.64Å; L256-I268 HydrophobicContact CD1-CD1 3.85Å; L256-I268 HydrophobicContact CD1-CG2 4.01Å; E264-I268 VanDerWaalsContact O-CD1 3.27Å; E264-I268 WeakPolarHBondContact O-CD1 3.32Å; E264-I268 VanDerWaalsContact O-CG1 3.22Å; E264-I268 WeakPolarHBondContact O-CG1 3.49Å; E264-I268 PolarHBondContact O-N 2.83Å; L265-I268 PolarHBondContact O-N 2.91Å; E266-I268 VanDerWaalsContact C-N 3.34Å; I268-N270 VanDerWaalsContact C-N 3.34Å; I268-N270 PolarHBondContact O-N 3.4Å; I268-H271 PolarHBondContact O-N 2.94Å; I268-K289 WeakPolarHBondContact O-CB 3.42Å; I268-Y713 HydrophobicContact CB-CE2 4.5Å; I268-Y713 HydrophobicContact CG1-CE2 4.47Å; I268-Y713 HydrophobicContact CG2-CE2 4.44Å; I268-V716 HydrophobicContact CD1-CG1 4.05Å; I268-V716 HydrophobicContact CG1-CG1 3.94Å; I268-L720 HydrophobicContact CD1-CD1 3.48Å; I268-L720 VanDerWaalsContact CD1-CD1 3.48Å; I268-L720 HydrophobicContact CG1-CD1 4.21Å
269	L	89.8	Confident	75.8	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-72.8	-26	-171.9	-66.3	175	0	0	0	113.1	L265 L287 A288 K289 L290 F301 L310	L265-L269 HydrophobicContact CD1-CD1 3.8Å; L265-L269 HydrophobicContact CD1-CG 4.17Å; L265-L269 HydrophobicContact CG-CD1 3.83Å; L265-L269 HydrophobicContact CG-CG 4.47Å; L265-L269 WeakPolarHBondContact O-CG 3.31Å; L265-L269 PolarHBondContact O-N 3.46Å; L269-L287 HydrophobicContact CB-CD2 4.06Å; L269-L287 CarbonylContact O-C 3.46Å; L269-L287 WeakPolarHBondContact O-CA 3.46Å; L269-A288 PolarHBondContact O-N 3.37Å; L269-K289 PolarHBondContact O-N 3.01Å; L269-K289 VanDerWaalsContact O-N 3.07Å; L269-L290 HydrophobicContact CD2-CB 4.38Å; L269-L290 HydrophobicContact CD2-CD1 4.29Å; L269-F301 HydrophobicContact CD2-CE1 4.01Å; L269-F301 HydrophobicContact CD2-CZ 4.21Å; L269-L310 HydrophobicContact CD1-CD2 3.73Å
270	N	87.1	Confident	73.2	Confident	31 Å²	31	86.7 Å²	86.7	17%	0.166	42%	0.419	C	S	.	.	H	α-helix	trans	-93.8	-3.9	175.5	-64.5	-54.1	0	0	0	114.1	E266 I268 L287	E266-N270 VanDerWaalsContact O-CB 3.28Å; E266-N270 WeakPolarHBondContact O-CB 3.44Å; E266-N270 PolarHBondContact O-N 2.79Å; E266-N270 PolarHBondContact O-ND2 3.21Å; I268-N270 VanDerWaalsContact C-N 3.34Å; I268-N270 PolarHBondContact O-N 3.4Å; N270-L287 WeakPolarHBondContact OD1-CA 3.43Å; N270-L287 PolarHBondContact OD1-N 2.78Å
271	H	85.1	Confident	70.9	Confident	14 Å²	14	81.2 Å²	81.2	7%	0.065	41%	0.409	C	S	.	.			trans	-63.6	140.2	176.4	-176.8	94	0	0	0	111.2	I267 I268 D273 K289 N710 Y713	I267-H271 WeakPolarHBondContact O-CB 3.24Å; I267-H271 PolarHBondContact O-N 3.37Å; I268-H271 PolarHBondContact O-N 2.94Å; H271-D273 IonicContact CD2-OD1 3.97Å; H271-D273 IonicContact NE2-OD1 2.91Å; H271-K289 PolarHBondContact CD2-NZ 3.3Å; H271-K289 PolarHBondContact O-N 3.15Å; H271-N710 PolarHBondContact CE1-OD1 3.47Å; H271-Y713 HydrophobicContact CB-CD2 3.76Å; H271-Y713 HydrophobicContact CB-CE2 3.89Å; H271-Y713 HydrophobicContact CB-CG 4.23Å; H271-Y713 AromaticContact CE1-CD1 3.33Å; H271-Y713 WeakPolarHBondContact CE1-CD1 3.43Å; H271-Y713 AromaticContact CE1-CE1 3.83Å; H271-Y713 AromaticContact CE1-CG 3.66Å; H271-Y713 AromaticContact CG-CD1 3.91Å; H271-Y713 AromaticContact CG-CD2 3.74Å; H271-Y713 AromaticContact CG-CE2 3.93Å; H271-Y713 AromaticContact CG-CG 3.73Å; H271-Y713 WeakPolarHBondContact ND1-CB 3.3Å; H271-Y713 AromaticContact ND1-CD1 3.37Å; H271-Y713 WeakPolarHBondContact ND1-CD1 3.26Å; H271-Y713 AromaticContact ND1-CD2 3.66Å; H271-Y713 AromaticContact ND1-CE1 3.96Å; H271-Y713 AromaticContact ND1-CG 3.18Å; H271-Y713 AromaticContact NE2-CD1 3.85Å; H271-Y713 AromaticContact NE2-CE1 3.86Å
272	R	76.4	Confident	68.5	Low	96 Å²	96	87.6 Å²	87.6	36%	0.362	43%	0.433	S	S	.	.			trans	-132.7	132.3	-179.9	176.5	178.3	178.1	175.2	-2	108.3	S276 A288	R272-S276 PolarHBondContact NE-OG 3.31Å; R272-S276 PolarHBondContact NH2-O 2.85Å; R272-A288 HydrophobicContact CB-CB 4.06Å
273	D	66.4	Low	66.7	Low	46 Å²	46	87.8 Å²	87.8	25%	0.246	42%	0.424	C	S	.	.			trans	-71.5	133.9	178.8	-46.5	-13.7	0	0	0	110	L218 H271 H275 S276 K289	L218-D273 WeakPolarHBondContact CD2-OD2 3.27Å; H271-D273 IonicContact CD2-OD1 3.97Å; H271-D273 IonicContact NE2-OD1 2.91Å; D273-H275 PolarHBondContact O-N 3.39Å; D273-S276 PolarHBondContact O-N 2.9Å; D273-S276 PolarHBondContact O-OG 3.28Å; D273-K289 IonicContact OD1-NZ 2.74Å
274	D	55.2	Low	64.6	Low	94 Å²	94	86.5 Å²	86.5	50%	0.503	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.4	-172.3	-68.5	-57.6	0	0	0	114.5	S276 S706 N710	D274-S276 PolarHBondContact O-N 3.15Å; D274-S276 VanDerWaalsContact O-N 3.1Å; D274-S706 PolarHBondContact OD1-OG 3.12Å; D274-N710 PolarHBondContact OD2-ND2 2.83Å
275	H	50.2	Low	62.9	Low	189 Å²	189	92.2 Å²	92.2	88%	0.875	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	4.1	-179.3	-62.6	-56.4	0	0	0	115.2	D273	D273-H275 PolarHBondContact O-N 3.39Å
276	S	46.1	Very low	61.7	Low	50 Å²	50	94.4 Å²	94.4	35%	0.35	46%	0.459	S	S	.	.			trans	-106.8	72.1	-176.1	55.7	0	0	0	0	112	R272 D273 D274 E278	R272-S276 PolarHBondContact NE-OG 3.31Å; R272-S276 PolarHBondContact NH2-O 2.85Å; D273-S276 PolarHBondContact O-N 2.9Å; D273-S276 PolarHBondContact O-OG 3.28Å; D274-S276 PolarHBondContact O-N 3.15Å; D274-S276 VanDerWaalsContact O-N 3.1Å; S276-E278 PolarHBondContact O-N 3.3Å; S276-E278 VanDerWaalsContact O-N 3.09Å
277	E	39.7	Very low	61.4	Low	190 Å²	190	91 Å²	91	89%	0.888	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-8.5	-170.9	-67.5	-164.7	127.2	0	0	116.4
278	E	41.6	Very low	61.1	Low	185 Å²	185	90.3 Å²	90.3	86%	0.864	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	16.1	-156.4	-97	-173	157.5	0	0	119.1	S276	S276-E278 PolarHBondContact O-N 3.3Å; S276-E278 VanDerWaalsContact O-N 3.09Å
279	L	44.6	Very low	61	Low	134 Å²	134	90.5 Å²	90.5	70%	0.702	44%	0.444	S	S	*	.	S	Bend	trans	-136	141.7	176.4	-82.7	103.6	0	0	0	116.2
280	D	39.3	Very low	61	Low	140 Å²	140	90.5 Å²	90.5	75%	0.749	44%	0.444	S	S	*	.			trans	-45.4	124.6	-171.9	-90.2	-40.1	0	0	0	114.7	Q282	D280-Q282 PolarHBondContact O-N 2.96Å
281	P	42.6	Very low	61.1	Low	83 Å²	83	92.3 Å²	92.3	54%	0.539	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	10	-175.2	29.9	-34.6	0	0	0	114.8	K283	P281-K283 VanDerWaalsContact C-N 3.32Å; P281-K283 PolarHBondContact O-N 3.01Å
282	Q	42.8	Very low	61.3	Low	186 Å²	186	93.9 Å²	93.9	87%	0.869	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	4	-172.4	-158.1	148.5	32.2	0	0	114.1	D280	D280-Q282 PolarHBondContact O-N 2.96Å
283	K	50.6	Low	62.1	Low	79 Å²	79	89.3 Å²	89.3	34%	0.343	44%	0.444	S	S	.	.			trans	-122.6	82.1	-178.7	-61.6	-180	-177.8	173.5	0	112.6	P281 H285 D286	P281-K283 VanDerWaalsContact C-N 3.32Å; P281-K283 PolarHBondContact O-N 3.01Å; K283-H285 PolarHBondContact O-N 3.2Å; K283-D286 WeakPolarHBondContact CB-OD1 3.4Å; K283-D286 WeakPolarHBondContact CD-OD1 3.48Å; K283-D286 WeakPolarHBondContact CD-OD2 3.21Å; K283-D286 IonicContact NZ-OD2 3.3Å
284	Y	46.7	Very low	63.3	Low	150 Å²	150	88.3 Å²	88.3	59%	0.588	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	7.5	-179.2	-100	-93.9	0	0	0	115.8
285	H	56.3	Low	64.9	Low	146 Å²	146	89.8 Å²	89.8	68%	0.676	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	22.6	-172.2	-64.5	-48.9	0	0	0	114.4	K283 L287	K283-H285 PolarHBondContact O-N 3.2Å; H285-L287 PolarHBondContact O-N 2.98Å
286	D	66.6	Low	66.9	Low	54 Å²	54	83.6 Å²	83.6	29%	0.289	41%	0.409	S	S	.	.	S	Bend	trans	-74.3	8.5	-174.4	-85.6	7.4	0	0	0	115.2	K283 A288 K291 M648	K283-D286 WeakPolarHBondContact CB-OD1 3.4Å; K283-D286 WeakPolarHBondContact CD-OD1 3.48Å; K283-D286 WeakPolarHBondContact CD-OD2 3.21Å; K283-D286 IonicContact NZ-OD2 3.3Å; D286-A288 VanDerWaalsContact C-N 3.27Å; D286-A288 PolarHBondContact O-N 3.08Å; D286-K291 VanDerWaalsContact O-CE 3.28Å; D286-K291 WeakPolarHBondContact O-CE 3.49Å; D286-M648 WeakPolarHBondContact O-CE 3.47Å
287	L	82.6	Confident	69.1	Low	4 Å²	4	84.9 Å²	84.9	2%	0.021	41%	0.41	C	S	.	.			trans	49.6	46.1	178	-64.5	162.2	0	0	0	112.2	L269 N270 H285 K289 L290 K291 L311 L314 M648 F651	L269-L287 HydrophobicContact CB-CD2 4.06Å; L269-L287 CarbonylContact O-C 3.46Å; L269-L287 WeakPolarHBondContact O-CA 3.46Å; N270-L287 WeakPolarHBondContact OD1-CA 3.43Å; N270-L287 PolarHBondContact OD1-N 2.78Å; H285-L287 PolarHBondContact O-N 2.98Å; L287-K289 PolarHBondContact O-N 3.01Å; L287-L290 HydrophobicContact CB-CB 4.02Å; L287-L290 HydrophobicContact CB-CD2 4.34Å; L287-L290 HydrophobicContact CD1-CD2 4.25Å; L287-L290 WeakPolarHBondContact O-CA 3.44Å; L287-L290 VanDerWaalsContact O-CB 3.27Å; L287-L290 WeakPolarHBondContact O-CB 3.46Å; L287-L290 PolarHBondContact O-N 3.42Å; L287-K291 PolarHBondContact O-N 3.09Å; L287-L311 HydrophobicContact CD1-CD2 3.85Å; L287-L314 HydrophobicContact CD1-CD1 3.94Å; L287-L314 HydrophobicContact CD2-CD1 4.18Å; L287-L314 HydrophobicContact CG-CD1 4.43Å; L287-M648 HydrophobicContact CB-CE 3.92Å; L287-M648 HydrophobicContact CD1-CE 4.11Å; L287-M648 HydrophobicContact CD1-SD 4.29Å; L287-F651 HydrophobicContact CD1-CD2 4.29Å; L287-F651 HydrophobicContact CD1-CE2 4.33Å
288	A	83.1	Confident	71.7	Confident	26 Å²	26	75.8 Å²	75.8	22%	0.215	37%	0.367	C	S	.	.	H	α-helix	trans	-54.6	-47.3	-168	0	0	0	0	0	113.5	L269 R272 D286 L290 K291 V292	L269-A288 PolarHBondContact O-N 3.37Å; R272-A288 HydrophobicContact CB-CB 4.06Å; D286-A288 VanDerWaalsContact C-N 3.27Å; D286-A288 PolarHBondContact O-N 3.08Å; A288-L290 PolarHBondContact O-N 3.28Å; A288-K291 PolarHBondContact O-N 2.99Å; A288-K291 VanDerWaalsContact O-N 3.15Å; A288-V292 WeakPolarHBondContact O-CG2 3.35Å; A288-V292 PolarHBondContact O-N 2.85Å
289	K	88.3	Confident	74.2	Confident	4 Å²	4	70 Å²	70	2%	0.017	34%	0.339	C	S	.	.	H	α-helix	trans	-67.3	-25.4	178.5	-164.9	143.1	-68.1	-166.2	0	112.4	D215 I268 L269 H271 D273 L287 A293 Y713	D215-K289 IonicContact OD2-NZ 3.81Å; D215-K289 PolarHBondContact OD2-NZ 3.39Å; I268-K289 WeakPolarHBondContact O-CB 3.42Å; L269-K289 PolarHBondContact O-N 3.01Å; L269-K289 VanDerWaalsContact O-N 3.07Å; H271-K289 PolarHBondContact CD2-NZ 3.3Å; H271-K289 PolarHBondContact O-N 3.15Å; D273-K289 IonicContact OD1-NZ 2.74Å; L287-K289 PolarHBondContact O-N 3.01Å; K289-A293 WeakPolarHBondContact O-CB 3.35Å; K289-A293 PolarHBondContact O-N 3.24Å; K289-Y713 PolarHBondContact NZ-OH 3.12Å; K289-Y713 VanDerWaalsContact NZ-OH 3.09Å
290	L	90.3	Very high	76.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-73	-40.5	170.8	-170.1	71.8	0	0	0	112.2	L269 L287 A288 V292 A293 I294 V302 L311 T644 M648	L269-L290 HydrophobicContact CD2-CB 4.38Å; L269-L290 HydrophobicContact CD2-CD1 4.29Å; L287-L290 HydrophobicContact CB-CB 4.02Å; L287-L290 HydrophobicContact CB-CD2 4.34Å; L287-L290 HydrophobicContact CD1-CD2 4.25Å; L287-L290 WeakPolarHBondContact O-CA 3.44Å; L287-L290 VanDerWaalsContact O-CB 3.27Å; L287-L290 WeakPolarHBondContact O-CB 3.46Å; L287-L290 PolarHBondContact O-N 3.42Å; A288-L290 PolarHBondContact O-N 3.28Å; L290-V292 VanDerWaalsContact C-N 3.26Å; L290-V292 PolarHBondContact O-N 3.14Å; L290-A293 WeakPolarHBondContact O-CB 3.4Å; L290-A293 PolarHBondContact O-N 2.89Å; L290-A293 VanDerWaalsContact O-N 3.16Å; L290-I294 HydrophobicContact CG-CD1 4.4Å; L290-I294 WeakPolarHBondContact O-CG1 3.36Å; L290-I294 PolarHBondContact O-N 3.37Å; L290-V302 HydrophobicContact CD1-CG1 4.43Å; L290-V302 HydrophobicContact CD1-CG2 3.91Å; L290-L311 HydrophobicContact CD2-CD1 3.98Å; L290-L311 HydrophobicContact CD2-CD2 3.59Å; L290-L311 HydrophobicContact CD2-CG 4.24Å; L290-T644 HydrophobicContact CD2-CG2 4.23Å; L290-M648 HydrophobicContact CD2-SD 4.37Å
291	K	88.8	Confident	79.2	Confident	68 Å²	68	58.4 Å²	58.4	30%	0.296	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-42.1	172.3	-64.7	-167.5	-178.1	-171.6	0	110.5	D286 L287 A288 I294 K295 M648 D652	D286-K291 VanDerWaalsContact O-CE 3.28Å; D286-K291 WeakPolarHBondContact O-CE 3.49Å; L287-K291 PolarHBondContact O-N 3.09Å; A288-K291 PolarHBondContact O-N 2.99Å; A288-K291 VanDerWaalsContact O-N 3.15Å; K291-I294 PolarHBondContact O-N 3.34Å; K291-K295 PolarHBondContact O-N 3.21Å; K291-M648 HydrophobicContact CD-CE 4.2Å; K291-M648 HydrophobicContact CG-CE 3.87Å; K291-M648 HydrophobicContact CG-CG 4.35Å; K291-M648 HydrophobicContact CG-SD 4.46Å; K291-D652 IonicContact NZ-OD1 3.87Å; K291-D652 PolarHBondContact NZ-OD1 3.42Å; K291-D652 IonicContact NZ-OD2 2.63Å; K291-D652 PolarHBondContact NZ-OD2 3.11Å
292	V	90	Very high	81.8	Confident	48 Å²	48	54.5 Å²	54.5	29%	0.291	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-43.1	173.6	175.4	0	0	0	0	112.1	L218 F221 A288 L290 I294 K295 Y296	L218-V292 HydrophobicContact CD1-CG1 4.19Å; F221-V292 HydrophobicContact CD2-CG1 4.34Å; A288-V292 WeakPolarHBondContact O-CG2 3.35Å; A288-V292 PolarHBondContact O-N 2.85Å; L290-V292 VanDerWaalsContact C-N 3.26Å; L290-V292 PolarHBondContact O-N 3.14Å; V292-I294 VanDerWaalsContact C-N 3.32Å; V292-I294 PolarHBondContact O-N 3.01Å; V292-K295 PolarHBondContact O-N 3.01Å; V292-Y296 HydrophobicContact CG1-CD2 3.68Å; V292-Y296 HydrophobicContact CG1-CE2 3.7Å; V292-Y296 WeakPolarHBondContact O-CD2 3.45Å; V292-Y296 PolarHBondContact O-N 3.42Å
293	A	92.8	Very high	84.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-38.3	175	0	0	0	0	0	112.7	F221 K289 L290 H297 Q298 F301 V302	F221-A293 HydrophobicContact CE2-CB 3.61Å; F221-A293 HydrophobicContact CZ-CB 3.68Å; K289-A293 WeakPolarHBondContact O-CB 3.35Å; K289-A293 PolarHBondContact O-N 3.24Å; L290-A293 WeakPolarHBondContact O-CB 3.4Å; L290-A293 PolarHBondContact O-N 2.89Å; L290-A293 VanDerWaalsContact O-N 3.16Å; A293-H297 PolarHBondContact O-N 2.66Å; A293-Q298 HydrophobicContact CB-CB 4.2Å; A293-Q298 VanDerWaalsContact O-CB 3.31Å; A293-Q298 WeakPolarHBondContact O-CB 3.43Å; A293-Q298 PolarHBondContact O-N 2.9Å; A293-F301 HydrophobicContact CB-CD1 3.73Å; A293-F301 HydrophobicContact CB-CE1 3.87Å; A293-V302 HydrophobicContact CB-CG2 4.19Å
294	I	90.9	Very high	86.4	Confident	24 Å²	24	42.6 Å²	42.6	12%	0.123	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-44.5	174.6	-65.8	165.5	0	0	0	110.6	L290 K291 V292 Y296 H297 V302 F641 T644 M648	L290-I294 HydrophobicContact CG-CD1 4.4Å; L290-I294 WeakPolarHBondContact O-CG1 3.36Å; L290-I294 PolarHBondContact O-N 3.37Å; K291-I294 PolarHBondContact O-N 3.34Å; V292-I294 VanDerWaalsContact C-N 3.32Å; V292-I294 PolarHBondContact O-N 3.01Å; I294-Y296 PolarHBondContact O-N 3.25Å; I294-H297 WeakPolarHBondContact O-CA 3.16Å; I294-H297 PolarHBondContact O-N 2.89Å; I294-V302 HydrophobicContact CG1-CG2 4.3Å; I294-F641 HydrophobicContact CB-CE2 4.48Å; I294-F641 HydrophobicContact CG1-CE2 4.32Å; I294-F641 HydrophobicContact CG2-CE2 4.44Å; I294-F641 HydrophobicContact CG2-CZ 4.15Å; I294-T644 HydrophobicContact CD1-CG2 4.17Å; I294-M648 HydrophobicContact CD1-CB 4.4Å; I294-M648 HydrophobicContact CD1-CG 4.36Å
295	K	88.9	Confident	88.6	Confident	125 Å²	125	40.1 Å²	40.1	54%	0.543	20%	0.201	S	C	.	.	H	α-helix	trans	-60.2	-41.3	177.9	-177.7	165.2	-179.7	131.6	0	113	K291 V292 H297 E429	K291-K295 PolarHBondContact O-N 3.21Å; V292-K295 PolarHBondContact O-N 3.01Å; K295-H297 PolarHBondContact O-CD2 3.49Å; K295-H297 PolarHBondContact O-N 3.22Å; K295-E429 WeakPolarHBondContact CE-OE1 3.2Å; K295-E429 IonicContact NZ-OE1 2.73Å; K295-E429 PolarHBondContact NZ-OE1 3.46Å
296	Y	92.2	Very high	90.3	Very high	59 Å²	59	35.8 Å²	35.8	23%	0.231	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	14.1	173.7	-70.1	-64.6	0	0	0	114	F221 W225 V292 I294 Q298	F221-Y296 HydrophobicContact CB-CD2 3.91Å; F221-Y296 HydrophobicContact CB-CG 4.22Å; F221-Y296 HydrophobicContact CD2-CD2 4.48Å; W225-Y296 HydrophobicContact CB-CD1 3.6Å; W225-Y296 HydrophobicContact CB-CE1 4.14Å; W225-Y296 HydrophobicContact CD2-CD1 4.15Å; W225-Y296 AromaticContact CG-CD1 3.67Å; W225-Y296 HydrophobicContact CG-CD1 3.67Å; W225-Y296 HydrophobicContact CG-CE1 4.07Å; V292-Y296 HydrophobicContact CG1-CD2 3.68Å; V292-Y296 HydrophobicContact CG1-CE2 3.7Å; V292-Y296 WeakPolarHBondContact O-CD2 3.45Å; V292-Y296 PolarHBondContact O-N 3.42Å; I294-Y296 PolarHBondContact O-N 3.25Å; Y296-Q298 VanDerWaalsContact C-N 3.28Å; Y296-Q298 PolarHBondContact O-N 3.36Å; Y296-Q298 PolarHBondContact O-NE2 2.96Å
297	H	91.6	Very high	91.6	Very high	77 Å²	77	33.2 Å²	33.2	36%	0.356	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	41	179	-67.5	-86.5	0	0	0	114.6	W225 A293 I294 K295 K299	W225-H297 AromaticContact CZ3-CD2 3.67Å; A293-H297 PolarHBondContact O-N 2.66Å; I294-H297 WeakPolarHBondContact O-CA 3.16Å; I294-H297 PolarHBondContact O-N 2.89Å; K295-H297 PolarHBondContact O-CD2 3.49Å; K295-H297 PolarHBondContact O-N 3.22Å; H297-K299 VanDerWaalsContact C-N 3.28Å; H297-K299 PolarHBondContact O-N 3.47Å
298	Q	94.8	Very high	92.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.			trans	-82	67.8	-176.5	-61.8	-71.5	-30.8	0	0	111.5	F221 K249 A293 Y296 E300 F301 V302	F221-Q298 HydrophobicContact CB-CG 4.44Å; F221-Q298 HydrophobicContact CD1-CB 4.31Å; F221-Q298 HydrophobicContact CD1-CG 3.44Å; F221-Q298 VanDerWaalsContact CD1-CG 3.44Å; F221-Q298 HydrophobicContact CD2-CG 4.41Å; F221-Q298 HydrophobicContact CE1-CB 3.97Å; F221-Q298 HydrophobicContact CE1-CG 3.61Å; F221-Q298 HydrophobicContact CG-CG 3.86Å; F221-Q298 HydrophobicContact CZ-CB 4.36Å; F221-Q298 HydrophobicContact CZ-CG 4.18Å; K249-Q298 VanDerWaalsContact CG-OE1 3.32Å; A293-Q298 HydrophobicContact CB-CB 4.2Å; A293-Q298 VanDerWaalsContact O-CB 3.31Å; A293-Q298 WeakPolarHBondContact O-CB 3.43Å; A293-Q298 PolarHBondContact O-N 2.9Å; Y296-Q298 VanDerWaalsContact C-N 3.28Å; Y296-Q298 PolarHBondContact O-N 3.36Å; Y296-Q298 PolarHBondContact O-NE2 2.96Å; Q298-E300 PolarHBondContact O-N 3.3Å; Q298-F301 HydrophobicContact CB-CB 4.12Å; Q298-F301 PolarHBondContact O-N 3Å; Q298-V302 WeakPolarHBondContact O-CG2 3.47Å; Q298-V302 PolarHBondContact O-N 3.31Å
299	K	94.3	Very high	92.5	Very high	64 Å²	64	38.2 Å²	38.2	28%	0.278	19%	0.188	S	C	.	.	H	α-helix	trans	-58.6	-44.8	-169.4	-55.9	177.5	-169	162.8	0	113.6	H297 V302 A303 I637 E638 F641	H297-K299 VanDerWaalsContact C-N 3.28Å; H297-K299 PolarHBondContact O-N 3.47Å; K299-V302 PolarHBondContact O-N 3.27Å; K299-A303 VanDerWaalsContact O-CB 3.25Å; K299-A303 WeakPolarHBondContact O-CB 3.44Å; K299-A303 PolarHBondContact O-N 3.49Å; K299-I637 HydrophobicContact CB-CG2 4.13Å; K299-E638 HydrophobicContact CD-CG 3.95Å; K299-E638 WeakPolarHBondContact CD-OE2 3.49Å; K299-E638 VanDerWaalsContact CE-OE2 3.28Å; K299-E638 WeakPolarHBondContact CE-OE2 3.26Å; K299-E638 IonicContact NZ-OE2 3.46Å; K299-E638 PolarHBondContact NZ-OE2 2.65Å; K299-F641 HydrophobicContact CB-CB 4.23Å; K299-F641 HydrophobicContact CB-CD2 4.2Å; K299-F641 HydrophobicContact CB-CG 4.2Å; K299-F641 HydrophobicContact CG-CB 4.32Å; K299-F641 HydrophobicContact CG-CD1 4.09Å; K299-F641 HydrophobicContact CG-CD2 4.02Å; K299-F641 HydrophobicContact CG-CE1 4.42Å; K299-F641 HydrophobicContact CG-CE2 4.32Å; K299-F641 HydrophobicContact CG-CG 3.88Å
300	E	94.1	Very high	92.6	Very high	30 Å²	30	38.6 Å²	38.6	14%	0.14	19%	0.19	C	C	.	.	H	α-helix	trans	-67.2	-44	-177.9	-64.6	176	-168.5	0	0	112.5	L250 K253 Q298 V302 A303 Q304 I637	L250-E300 WeakPolarHBondContact CD2-OE2 3.35Å; L250-E300 WeakPolarHBondContact CG-OE2 3.22Å; K253-E300 HydrophobicContact CB-CB 4.21Å; K253-E300 HydrophobicContact CG-CB 4.25Å; Q298-E300 PolarHBondContact O-N 3.3Å; E300-V302 VanDerWaalsContact C-N 3.34Å; E300-V302 PolarHBondContact O-N 3.2Å; E300-A303 PolarHBondContact O-N 2.94Å; E300-Q304 PolarHBondContact O-N 3.27Å; E300-Q304 VanDerWaalsContact O-N 3.14Å; E300-I637 HydrophobicContact CG-CG2 4.23Å
301	F	95.7	Very high	92.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.5	-47.6	175.1	178.7	-87.7	0	0	0	111.4	I217 F221 A252 L256 L269 A293 Q298 Q304	I217-F301 HydrophobicContact CG2-CE2 3.76Å; I217-F301 HydrophobicContact CG2-CZ 4.05Å; F221-F301 HydrophobicContact CE1-CB 4.39Å; F221-F301 HydrophobicContact CE1-CD1 4.45Å; F221-F301 AromaticContact CE1-CD2 3.92Å; F221-F301 HydrophobicContact CE1-CD2 3.92Å; F221-F301 HydrophobicContact CE1-CE2 4.24Å; F221-F301 HydrophobicContact CE1-CG 4.03Å; F221-F301 AromaticContact CZ-CD1 3.8Å; F221-F301 HydrophobicContact CZ-CD1 3.8Å; F221-F301 AromaticContact CZ-CD2 3.8Å; F221-F301 HydrophobicContact CZ-CD2 3.8Å; F221-F301 AromaticContact CZ-CE1 3.8Å; F221-F301 HydrophobicContact CZ-CE1 3.8Å; F221-F301 AromaticContact CZ-CE2 3.78Å; F221-F301 HydrophobicContact CZ-CE2 3.78Å; F221-F301 AromaticContact CZ-CG 3.8Å; F221-F301 HydrophobicContact CZ-CG 3.8Å; F221-F301 AromaticContact CZ-CZ 3.77Å; F221-F301 HydrophobicContact CZ-CZ 3.77Å; A252-F301 HydrophobicContact CB-CD2 4.13Å; A252-F301 WeakPolarHBondContact O-CD2 3.48Å; L256-F301 HydrophobicContact CB-CD2 4.32Å; L256-F301 HydrophobicContact CB-CE2 4.03Å; L256-F301 HydrophobicContact CD1-CE2 4.29Å; L256-F301 HydrophobicContact CD1-CZ 4.35Å; L256-F301 HydrophobicContact CD2-CD1 4.41Å; L256-F301 HydrophobicContact CD2-CD2 4Å; L256-F301 HydrophobicContact CD2-CE1 4.06Å; L256-F301 HydrophobicContact CD2-CE2 3.64Å; L256-F301 HydrophobicContact CD2-CG 4.39Å; L256-F301 HydrophobicContact CD2-CZ 3.68Å; L256-F301 HydrophobicContact CG-CE2 4.2Å; L256-F301 HydrophobicContact CG-CZ 4.49Å; L269-F301 HydrophobicContact CD2-CE1 4.01Å; L269-F301 HydrophobicContact CD2-CZ 4.21Å; A293-F301 HydrophobicContact CB-CD1 3.73Å; A293-F301 HydrophobicContact CB-CE1 3.87Å; Q298-F301 HydrophobicContact CB-CB 4.12Å; Q298-F301 PolarHBondContact O-N 3Å; F301-Q304 VanDerWaalsContact O-CB 3.29Å; F301-Q304 WeakPolarHBondContact O-CB 3.14Å; F301-Q304 PolarHBondContact O-N 2.93Å
302	V	95.6	Very high	92.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.6	-37.6	177.8	176.6	0	0	0	0	111.5	L290 A293 I294 Q298 K299 E300 Q304 Q308 F641 T644	L290-V302 HydrophobicContact CD1-CG1 4.43Å; L290-V302 HydrophobicContact CD1-CG2 3.91Å; A293-V302 HydrophobicContact CB-CG2 4.19Å; I294-V302 HydrophobicContact CG1-CG2 4.3Å; Q298-V302 WeakPolarHBondContact O-CG2 3.47Å; Q298-V302 PolarHBondContact O-N 3.31Å; K299-V302 PolarHBondContact O-N 3.27Å; E300-V302 VanDerWaalsContact C-N 3.34Å; E300-V302 PolarHBondContact O-N 3.2Å; V302-Q304 PolarHBondContact O-N 3.14Å; V302-Q308 WeakPolarHBondContact O-CG 3.5Å; V302-Q308 PolarHBondContact O-NE2 2.82Å; V302-F641 HydrophobicContact CB-CD2 4.04Å; V302-F641 HydrophobicContact CG1-CD2 4.25Å; V302-F641 HydrophobicContact CG2-CD2 4.11Å; V302-F641 HydrophobicContact CG2-CE2 4.3Å; V302-T644 HydrophobicContact CG1-CG2 3.61Å
303	A	95.5	Very high	92.6	Very high	11 Å²	11	37.3 Å²	37.3	9%	0.091	19%	0.189	C	C	.	.	H	α-helix	trans	-74.2	-9.9	-178.5	0	0	0	0	0	114.5	K299 E300 I637 K640	K299-A303 VanDerWaalsContact O-CB 3.25Å; K299-A303 WeakPolarHBondContact O-CB 3.44Å; K299-A303 PolarHBondContact O-N 3.49Å; E300-A303 PolarHBondContact O-N 2.94Å; A303-I637 HydrophobicContact CB-CB 4.19Å; A303-I637 HydrophobicContact CB-CG1 4.41Å; A303-I637 HydrophobicContact CB-CG2 3.74Å; A303-K640 HydrophobicContact CB-CB 4Å; A303-K640 HydrophobicContact CB-CD 4.18Å
304	Q	94.9	Very high	92.4	Very high	5 Å²	5	40.7 Å²	40.7	2%	0.023	21%	0.207	C	C	.	.			trans	-53.1	134.1	-179.2	-166.3	-132.6	5.5	0	0	111.7	L256 D257 E300 F301 V302 N306 C307 Q308	L256-Q304 VanDerWaalsContact C-NE2 3.26Å; L256-Q304 VanDerWaalsContact CG-OE1 3.29Å; L256-Q304 PolarHBondContact O-NE2 2.88Å; D257-Q304 PolarHBondContact OD1-NE2 2.89Å; E300-Q304 PolarHBondContact O-N 3.27Å; E300-Q304 VanDerWaalsContact O-N 3.14Å; F301-Q304 VanDerWaalsContact O-CB 3.29Å; F301-Q304 WeakPolarHBondContact O-CB 3.14Å; F301-Q304 PolarHBondContact O-N 2.93Å; V302-Q304 PolarHBondContact O-N 3.14Å; Q304-N306 VanDerWaalsContact C-N 3.3Å; Q304-N306 PolarHBondContact NE2-ND2 3.47Å; Q304-N306 PolarHBondContact O-N 3.11Å; Q304-C307 HydrophobicContact CB-CB 4.37Å; Q304-C307 PolarHBondContact O-N 3.5Å; Q304-Q308 WeakPolarHBondContact O-CG 3.09Å; Q304-Q308 PolarHBondContact O-N 2.91Å
305	P	93.9	Very high	92.4	Very high	97 Å²	97	39.8 Å²	39.8	63%	0.63	20%	0.202	S	C	*	.	H	α-helix	trans	-54.4	-39	-174.7	-31.4	37.1	0	0	0	115.1	Q308 Q309	P305-Q308 PolarHBondContact O-N 3.33Å; P305-Q309 WeakPolarHBondContact O-CB 3.37Å; P305-Q309 PolarHBondContact O-N 3.38Å
306	N	92	Very high	92.5	Very high	56 Å²	56	36.9 Å²	36.9	30%	0.299	19%	0.188	S	C	.	.	H	α-helix	trans	-68.1	-47.1	-178.7	-62.2	-30.3	0	0	0	111.4	L265 Q304 Q308 Q309 L310	L265-N306 HydrophobicContact CD2-CB 4.1Å; L265-N306 WeakPolarHBondContact CD2-O 3.42Å; Q304-N306 VanDerWaalsContact C-N 3.3Å; Q304-N306 PolarHBondContact NE2-ND2 3.47Å; Q304-N306 PolarHBondContact O-N 3.11Å; N306-Q308 PolarHBondContact O-N 2.9Å; N306-Q309 PolarHBondContact O-N 3.26Å; N306-L310 PolarHBondContact O-N 3.07Å; N306-L310 VanDerWaalsContact O-N 3.1Å
307	C	92.5	Very high	92.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.3	-48.5	172.2	-173.1	0	0	0	0	111.8	L256 Q304 Q309 L310 L311	L256-C307 HydrophobicContact CD2-CB 4.32Å; Q304-C307 HydrophobicContact CB-CB 4.37Å; Q304-C307 PolarHBondContact O-N 3.5Å; C307-Q309 VanDerWaalsContact C-N 3.29Å; C307-Q309 PolarHBondContact O-N 3.46Å; C307-L310 PolarHBondContact O-N 3.46Å; C307-L311 WeakPolarHBondContact O-CG 3.48Å; C307-L311 PolarHBondContact O-N 3.27Å
308	Q	93.9	Very high	91.5	Very high	15 Å²	15	37 Å²	37	7%	0.07	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-30	178.7	-69.8	-66.8	-34.7	0	0	113.3	V302 Q304 P305 N306 A312 T644	V302-Q308 WeakPolarHBondContact O-CG 3.5Å; V302-Q308 PolarHBondContact O-NE2 2.82Å; Q304-Q308 WeakPolarHBondContact O-CG 3.09Å; Q304-Q308 PolarHBondContact O-N 2.91Å; P305-Q308 PolarHBondContact O-N 3.33Å; N306-Q308 PolarHBondContact O-N 2.9Å; Q308-A312 VanDerWaalsContact O-CB 3.28Å; Q308-A312 WeakPolarHBondContact O-CB 3.19Å; Q308-A312 PolarHBondContact O-N 2.94Å; Q308-T644 PolarHBondContact NE2-OG1 3.39Å
309	Q	90.9	Very high	90.9	Very high	119 Å²	119	38.8 Å²	38.8	56%	0.556	21%	0.214	S	C	*	.	H	α-helix	trans	-68	-46.5	172.8	177.5	164.4	-38.8	0	0	111.7	P305 N306 C307 A312 T313	P305-Q309 WeakPolarHBondContact O-CB 3.37Å; P305-Q309 PolarHBondContact O-N 3.38Å; N306-Q309 PolarHBondContact O-N 3.26Å; C307-Q309 VanDerWaalsContact C-N 3.29Å; C307-Q309 PolarHBondContact O-N 3.46Å; Q309-A312 PolarHBondContact O-N 2.88Å; Q309-T313 PolarHBondContact O-N 3.45Å; Q309-T313 PolarHBondContact O-OG1 3.42Å
310	L	90.3	Very high	90.3	Very high	12 Å²	12	41.4 Å²	41.4	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-61.1	-46.8	176.7	-175.8	70.4	0	0	0	111.3	L265 E266 L269 N306 C307 A312 T313 L314	L265-L310 HydrophobicContact CD2-CB 4.03Å; L265-L310 HydrophobicContact CD2-CD2 4.3Å; L265-L310 HydrophobicContact CG-CD2 4.29Å; E266-L310 HydrophobicContact CG-CD1 3.76Å; E266-L310 HydrophobicContact CG-CD2 3.88Å; E266-L310 HydrophobicContact CG-CG 4.49Å; L269-L310 HydrophobicContact CD1-CD2 3.73Å; N306-L310 PolarHBondContact O-N 3.07Å; N306-L310 VanDerWaalsContact O-N 3.1Å; C307-L310 PolarHBondContact O-N 3.46Å; L310-A312 VanDerWaalsContact C-N 3.3Å; L310-A312 PolarHBondContact O-N 3.49Å; L310-T313 WeakPolarHBondContact CA-OG1 3.47Å; L310-T313 PolarHBondContact O-N 2.66Å; L310-T313 VanDerWaalsContact O-N 3.08Å; L310-T313 PolarHBondContact O-OG1 3.28Å; L310-L314 HydrophobicContact CG-CD1 4.28Å; L310-L314 WeakPolarHBondContact O-CG 3.14Å; L310-L314 PolarHBondContact O-N 2.98Å
311	L	91.1	Very high	89.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59	-41.4	176.4	-73.2	167.7	0	0	0	112.1	L287 L290 C307 T313 L314 W315 T644 W647 F651	L287-L311 HydrophobicContact CD1-CD2 3.85Å; L290-L311 HydrophobicContact CD2-CD1 3.98Å; L290-L311 HydrophobicContact CD2-CD2 3.59Å; L290-L311 HydrophobicContact CD2-CG 4.24Å; C307-L311 WeakPolarHBondContact O-CG 3.48Å; C307-L311 PolarHBondContact O-N 3.27Å; L311-T313 VanDerWaalsContact C-N 3.34Å; L311-T313 PolarHBondContact O-N 2.75Å; L311-L314 PolarHBondContact O-N 3.44Å; L311-W315 VanDerWaalsContact O-CB 3.25Å; L311-W315 WeakPolarHBondContact O-CB 3.3Å; L311-W315 PolarHBondContact O-N 3.26Å; L311-T644 HydrophobicContact CD1-CG2 3.72Å; L311-W647 HydrophobicContact CB-CE3 4.11Å; L311-W647 HydrophobicContact CB-CZ3 4.06Å; L311-F651 HydrophobicContact CD2-CE2 3.83Å; L311-F651 HydrophobicContact CD2-CZ 4.36Å
312	A	90.5	Very high	89.3	Confident	7 Å²	7	41.9 Å²	41.9	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-68.2	-30.8	175.9	0	0	0	0	0	113.1	Q308 Q309 L310 Y316 R323 W647	Q308-A312 VanDerWaalsContact O-CB 3.28Å; Q308-A312 WeakPolarHBondContact O-CB 3.19Å; Q308-A312 PolarHBondContact O-N 2.94Å; Q309-A312 PolarHBondContact O-N 2.88Å; L310-A312 VanDerWaalsContact C-N 3.3Å; L310-A312 PolarHBondContact O-N 3.49Å; A312-Y316 VanDerWaalsContact O-CD2 3.22Å; A312-Y316 WeakPolarHBondContact O-CD2 3.37Å; A312-Y316 PolarHBondContact O-N 3.06Å; A312-R323 VanDerWaalsContact CB-NH2 3.35Å; A312-W647 HydrophobicContact CB-CH2 4.3Å; A312-W647 HydrophobicContact CB-CZ3 4.28Å
313	T	88.9	Confident	88.8	Confident	83 Å²	83	49.4 Å²	49.4	51%	0.509	27%	0.274	S	S	.	.	H	α-helix	trans	-70.6	-39.8	173.2	43.2	0	0	0	0	112.4	Q309 L310 L311 D317	Q309-T313 PolarHBondContact O-N 3.45Å; Q309-T313 PolarHBondContact O-OG1 3.42Å; L310-T313 WeakPolarHBondContact CA-OG1 3.47Å; L310-T313 PolarHBondContact O-N 2.66Å; L310-T313 VanDerWaalsContact O-N 3.08Å; L310-T313 PolarHBondContact O-OG1 3.28Å; L311-T313 VanDerWaalsContact C-N 3.34Å; L311-T313 PolarHBondContact O-N 2.75Å; T313-D317 PolarHBondContact O-N 3.4Å
314	L	88.3	Confident	88.4	Confident	70 Å²	70	59.5 Å²	59.5	37%	0.366	31%	0.31	S	S	.	.	H	α-helix	trans	-67.5	-38.7	174.1	-65.6	170.9	0	0	0	111.8	L287 L310 L311 F651	L287-L314 HydrophobicContact CD1-CD1 3.94Å; L287-L314 HydrophobicContact CD2-CD1 4.18Å; L287-L314 HydrophobicContact CG-CD1 4.43Å; L310-L314 HydrophobicContact CG-CD1 4.28Å; L310-L314 WeakPolarHBondContact O-CG 3.14Å; L310-L314 PolarHBondContact O-N 2.98Å; L311-L314 PolarHBondContact O-N 3.44Å; L314-F651 HydrophobicContact CB-CE1 3.94Å; L314-F651 HydrophobicContact CB-CZ 4.07Å
315	W	90.9	Very high	88.1	Confident	6 Å²	6	63.1 Å²	63.1	2%	0.023	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-46	178.8	-175.7	-102.3	0	0	0	112.9	L311 D317 P363 F364 F367 W647 Y650 F651	L311-W315 VanDerWaalsContact O-CB 3.25Å; L311-W315 WeakPolarHBondContact O-CB 3.3Å; L311-W315 PolarHBondContact O-N 3.26Å; W315-D317 VanDerWaalsContact C-N 3.32Å; W315-D317 PolarHBondContact O-N 3.4Å; W315-P363 HydrophobicContact CE3-CB 3.79Å; W315-P363 HydrophobicContact CE3-CG 4.23Å; W315-P363 HydrophobicContact CZ3-CB 3.82Å; W315-F364 HydrophobicContact CD2-CB 4.47Å; W315-F364 AromaticContact CE2-CD2 3.96Å; W315-F364 HydrophobicContact CZ2-CB 4.46Å; W315-F364 HydrophobicContact CZ2-CD2 4.21Å; W315-F364 AromaticContact NE1-CD2 3.34Å; W315-F364 VanDerWaalsContact NE1-CD2 3.34Å; W315-F364 AromaticContact NE1-CG 3.88Å; W315-F364 VanDerWaalsContact O-CB 3.26Å; W315-F364 WeakPolarHBondContact O-CB 3.34Å; W315-F367 HydrophobicContact CH2-CB 3.71Å; W315-F367 HydrophobicContact CH2-CG 4.14Å; W315-F367 HydrophobicContact CZ2-CB 3.74Å; W315-F367 HydrophobicContact CZ2-CD1 4.14Å; W315-F367 AromaticContact CZ2-CG 3.93Å; W315-F367 HydrophobicContact CZ2-CG 3.93Å; W315-W647 HydrophobicContact CB-CD2 4.47Å; W315-W647 HydrophobicContact CB-CE3 4.27Å; W315-W647 HydrophobicContact CB-CZ3 4.39Å; W315-W647 AromaticContact CD2-CD1 3.9Å; W315-W647 AromaticContact CD2-CD2 3.95Å; W315-W647 HydrophobicContact CD2-CD2 3.95Å; W315-W647 AromaticContact CD2-CG 3.9Å; W315-W647 HydrophobicContact CD2-CG 3.9Å; W315-W647 AromaticContact CD2-NE1 3.96Å; W315-W647 AromaticContact CE2-CD1 3.89Å; W315-W647 AromaticContact CE2-NE1 3.73Å; W315-W647 HydrophobicContact CE3-CB 3.72Å; W315-W647 AromaticContact CE3-CD1 3.76Å; W315-W647 HydrophobicContact CE3-CD2 4.03Å; W315-W647 AromaticContact CE3-CG 3.56Å; W315-W647 HydrophobicContact CE3-CG 3.56Å; W315-W647 HydrophobicContact CG-CD2 4.14Å; W315-W647 HydrophobicContact CG-CE3 4.4Å; W315-W647 HydrophobicContact CG-CZ2 4.38Å; W315-W647 AromaticContact CH2-CD1 3.64Å; W315-W647 HydrophobicContact CH2-CG 4.22Å; W315-W647 AromaticContact CZ2-CD1 3.78Å; W315-W647 AromaticContact CZ2-NE1 3.89Å; W315-W647 HydrophobicContact CZ3-CB 3.73Å; W315-W647 AromaticContact CZ3-CD1 3.63Å; W315-W647 AromaticContact CZ3-CG 3.73Å; W315-W647 HydrophobicContact CZ3-CG 3.73Å; W315-Y650 AromaticContact CH2-CD2 4Å; W315-Y650 HydrophobicContact CH2-CD2 4Å; W315-Y650 HydrophobicContact CH2-CG 4.34Å; W315-Y650 HydrophobicContact CZ3-CD2 4.41Å; W315-F651 HydrophobicContact CB-CE1 4.48Å; W315-F651 HydrophobicContact CB-CZ 4.33Å; W315-F651 HydrophobicContact CE3-CE1 4.08Å; W315-F651 HydrophobicContact CE3-CZ 4.11Å
316	Y	90.6	Very high	88.1	Confident	63 Å²	63	64 Å²	64	25%	0.247	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	26.2	-178.3	-64.1	-60.7	0	0	0	113.9	A312 G318 F319 W322 F364	A312-Y316 VanDerWaalsContact O-CD2 3.22Å; A312-Y316 WeakPolarHBondContact O-CD2 3.37Å; A312-Y316 PolarHBondContact O-N 3.06Å; Y316-G318 PolarHBondContact O-N 3.32Å; Y316-F319 PolarHBondContact O-N 3.07Å; Y316-W322 HydrophobicContact CD1-CB 4.36Å; Y316-W322 AromaticContact CD1-CD1 3.39Å; Y316-W322 AromaticContact CD1-CG 3.91Å; Y316-W322 HydrophobicContact CD1-CG 3.91Å; Y316-W322 AromaticContact CD1-NE1 3.9Å; Y316-W322 AromaticContact CE1-CD1 3.18Å; Y316-W322 HydrophobicContact CE1-CG 4.1Å; Y316-W322 AromaticContact CE1-NE1 3.31Å; Y316-W322 VanDerWaalsContact CE1-NE1 3.31Å; Y316-W322 HydrophobicContact CG-CB 4.44Å; Y316-W322 AromaticContact CG-CD1 3.97Å; Y316-W322 HydrophobicContact CG-CG 4.42Å; Y316-W322 AromaticContact CZ-CD1 3.6Å; Y316-W322 AromaticContact CZ-NE1 3.84Å; Y316-F364 HydrophobicContact CD1-CB 4.47Å; Y316-F364 AromaticContact CD1-CD1 3.96Å; Y316-F364 HydrophobicContact CD1-CD1 3.96Å; Y316-F364 HydrophobicContact CD1-CD2 4.37Å; Y316-F364 HydrophobicContact CD1-CE1 4.24Å; Y316-F364 HydrophobicContact CD1-CG 4.02Å; Y316-F364 HydrophobicContact CE1-CD1 4.17Å; Y316-F364 AromaticContact CE1-CD2 3.93Å; Y316-F364 HydrophobicContact CE1-CD2 3.93Å; Y316-F364 HydrophobicContact CE1-CE1 4.16Å; Y316-F364 AromaticContact CE1-CE2 3.92Å; Y316-F364 HydrophobicContact CE1-CE2 3.92Å; Y316-F364 HydrophobicContact CE1-CG 4.05Å; Y316-F364 HydrophobicContact CE1-CZ 4.03Å
317	D	85.6	Confident	88	Confident	93 Å²	93	69.4 Å²	69.4	50%	0.497	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	132.6	-174.1	177.5	45.6	0	0	0	113.6	T313 W315 F319 K362	T313-D317 PolarHBondContact O-N 3.4Å; W315-D317 VanDerWaalsContact C-N 3.32Å; W315-D317 PolarHBondContact O-N 3.4Å; D317-F319 PolarHBondContact O-N 3.49Å; D317-K362 WeakPolarHBondContact O-CD 3.43Å; D317-K362 WeakPolarHBondContact O-CE 3.31Å; D317-K362 PolarHBondContact O-NZ 2.92Å
318	G	77.4	Confident	88.1	Confident	45 Å²	45	72.7 Å²	72.7	46%	0.464	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	25.6	-171.8	0	0	0	0	0	116.2	Y316 P320 K362	Y316-G318 PolarHBondContact O-N 3.32Å; G318-P320 VanDerWaalsContact O-CD 3.32Å; G318-P320 WeakPolarHBondContact O-CD 3.48Å; G318-K362 VanDerWaalsContact CA-NZ 3.28Å
319	F	82.4	Confident	88	Confident	39 Å²	39	75.2 Å²	75.2	17%	0.171	37%	0.374	C	S	.	.			trans	-108.4	74.3	157.8	-76.1	-85.7	0	0	0	110.6	Y316 D317 G321 W322 I337 F359 F364 I365	Y316-F319 PolarHBondContact O-N 3.07Å; D317-F319 PolarHBondContact O-N 3.49Å; F319-G321 PolarHBondContact O-N 3.48Å; F319-W322 HydrophobicContact CB-CB 4.08Å; F319-W322 HydrophobicContact CD1-CE3 4.26Å; F319-W322 PolarHBondContact O-N 2.94Å; F319-W322 VanDerWaalsContact O-N 3.08Å; F319-I337 HydrophobicContact CZ-CD1 4.34Å; F319-F359 HydrophobicContact CE1-CE2 4.5Å; F319-F359 HydrophobicContact CE2-CE2 4.08Å; F319-F359 HydrophobicContact CE2-CZ 4.44Å; F319-F359 AromaticContact CZ-CE2 3.56Å; F319-F359 HydrophobicContact CZ-CE2 3.56Å; F319-F359 AromaticContact CZ-CZ 3.7Å; F319-F359 HydrophobicContact CZ-CZ 3.7Å; F319-F364 HydrophobicContact CD2-CD1 4.44Å; F319-I365 HydrophobicContact CE2-CD1 3.7Å; F319-I365 HydrophobicContact CE2-CG1 3.89Å; F319-I365 HydrophobicContact CZ-CD1 3.64Å; F319-I365 HydrophobicContact CZ-CG1 4.25Å
320	P	81.1	Confident	88.1	Confident	118 Å²	118	72.1 Å²	72.1	77%	0.766	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	124.6	-174.1	23.6	-34.1	0	0	0	111.3	G318 W322	G318-P320 VanDerWaalsContact O-CD 3.32Å; G318-P320 WeakPolarHBondContact O-CD 3.48Å; P320-W322 VanDerWaalsContact C-N 3.33Å; P320-W322 PolarHBondContact O-N 3.39Å
321	G	82.1	Confident	88.1	Confident	27 Å²	27	76 Å²	76	28%	0.278	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	16.5	178.5	0	0	0	0	0	115.9	F319 R323 R324	F319-G321 PolarHBondContact O-N 3.48Å; G321-R323 PolarHBondContact O-N 2.84Å; G321-R323 VanDerWaalsContact O-N 3.14Å; G321-R324 WeakPolarHBondContact O-CB 3.35Å; G321-R324 PolarHBondContact O-N 3.24Å
322	W	87.5	Confident	88.2	Confident	13 Å²	13	81.5 Å²	81.5	5%	0.049	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-45.1	-47.1	176.9	-179.2	-104.7	0	0	0	113.1	Y316 F319 P320 R324 K325 K330 T333 F364	Y316-W322 HydrophobicContact CD1-CB 4.36Å; Y316-W322 AromaticContact CD1-CD1 3.39Å; Y316-W322 AromaticContact CD1-CG 3.91Å; Y316-W322 HydrophobicContact CD1-CG 3.91Å; Y316-W322 AromaticContact CD1-NE1 3.9Å; Y316-W322 AromaticContact CE1-CD1 3.18Å; Y316-W322 HydrophobicContact CE1-CG 4.1Å; Y316-W322 AromaticContact CE1-NE1 3.31Å; Y316-W322 VanDerWaalsContact CE1-NE1 3.31Å; Y316-W322 HydrophobicContact CG-CB 4.44Å; Y316-W322 AromaticContact CG-CD1 3.97Å; Y316-W322 HydrophobicContact CG-CG 4.42Å; Y316-W322 AromaticContact CZ-CD1 3.6Å; Y316-W322 AromaticContact CZ-NE1 3.84Å; F319-W322 HydrophobicContact CB-CB 4.08Å; F319-W322 HydrophobicContact CD1-CE3 4.26Å; F319-W322 PolarHBondContact O-N 2.94Å; F319-W322 VanDerWaalsContact O-N 3.08Å; P320-W322 VanDerWaalsContact C-N 3.33Å; P320-W322 PolarHBondContact O-N 3.39Å; W322-R324 PolarHBondContact O-N 2.9Å; W322-K325 HydrophobicContact CE3-CD 4.23Å; W322-K325 PolarHBondContact O-N 2.99Å; W322-K325 VanDerWaalsContact O-N 3.1Å; W322-K330 HydrophobicContact CD2-CG 4.47Å; W322-K330 HydrophobicContact CH2-CB 4.07Å; W322-K330 HydrophobicContact CH2-CG 4.17Å; W322-K330 HydrophobicContact CZ2-CB 3.79Å; W322-K330 HydrophobicContact CZ2-CG 3.78Å; W322-K330 WeakPolarHBondContact O-CE 3.35Å; W322-T333 WeakPolarHBondContact CH2-OG1 3.46Å; W322-T333 VanDerWaalsContact CZ3-OG1 3.26Å; W322-T333 WeakPolarHBondContact CZ3-OG1 3.4Å; W322-F364 HydrophobicContact CD2-CE1 4.25Å; W322-F364 AromaticContact CE2-CE1 3.78Å; W322-F364 AromaticContact CE2-CZ 3.73Å; W322-F364 HydrophobicContact CH2-CE1 4.03Å; W322-F364 HydrophobicContact CH2-CZ 4.13Å; W322-F364 AromaticContact CZ2-CE1 3.7Å; W322-F364 HydrophobicContact CZ2-CE1 3.7Å; W322-F364 AromaticContact CZ2-CZ 3.47Å; W322-F364 HydrophobicContact CZ2-CZ 3.47Å; W322-F364 VanDerWaalsContact CZ2-CZ 3.47Å; W322-F364 HydrophobicContact CZ3-CE1 4.43Å; W322-F364 AromaticContact NE1-CZ 3.93Å
323	R	84.5	Confident	88.3	Confident	159 Å²	159	83 Å²	83	60%	0.6	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-53.4	-37.9	178.2	-167.3	178.6	-69.8	171.8	-1.3	112.9	A312 G321 K330	A312-R323 VanDerWaalsContact CB-NH2 3.35Å; G321-R323 PolarHBondContact O-N 2.84Å; G321-R323 VanDerWaalsContact O-N 3.14Å; R323-K330 PolarHBondContact O-NZ 3.28Å
324	R	87.4	Confident	88.4	Confident	222 Å²	222	80.6 Å²	80.6	84%	0.838	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-76.2	-15.3	-178	-61.2	-174.1	-70.1	179.7	-3.9	114.6	G321 W322	G321-R324 WeakPolarHBondContact O-CB 3.35Å; G321-R324 PolarHBondContact O-N 3.24Å; W322-R324 PolarHBondContact O-N 2.9Å
325	K	89.4	Confident	88.6	Confident	82 Å²	82	83.4 Å²	83.4	36%	0.357	42%	0.415	S	S	.	.	S	Bend	trans	-70.1	145.2	-179	-65.7	-173.9	177.7	-174.4	0	111.7	W322 V329 K330	W322-K325 HydrophobicContact CE3-CD 4.23Å; W322-K325 PolarHBondContact O-N 2.99Å; W322-K325 VanDerWaalsContact O-N 3.1Å; K325-V329 HydrophobicContact CD-CG1 4.1Å; K325-K330 HydrophobicContact CB-CG 4.02Å; K325-K330 WeakPolarHBondContact O-CE 3.38Å; K325-K330 PolarHBondContact O-NZ 3Å
326	H	92.5	Very high	88.7	Confident	115 Å²	115	86.5 Å²	86.5	53%	0.532	44%	0.435	S	S	.	.			trans	-61.3	151.1	171.8	-170.2	-111.7	0	0	0	111.4	V328 V329 K330	H326-V328 VanDerWaalsContact C-N 3.31Å; H326-V328 PolarHBondContact O-N 2.81Å; H326-V329 HydrophobicContact CB-CG2 4.42Å; H326-V329 PolarHBondContact O-N 3.12Å; H326-V329 VanDerWaalsContact O-N 3.11Å; H326-K330 PolarHBondContact O-N 3.27Å; H326-K330 VanDerWaalsContact O-N 3.09Å
327	W	90.9	Very high	88.9	Confident	169 Å²	169	84.4 Å²	84.4	64%	0.64	43%	0.428	S	S	*	.	H	α-helix	trans	-60.8	-37.5	-174.1	73.4	-95.7	0	0	0	112.8	V329 K330 L331	W327-V329 VanDerWaalsContact C-N 3.34Å; W327-V329 PolarHBondContact O-N 3.47Å; W327-K330 WeakPolarHBondContact O-CB 3.32Å; W327-K330 PolarHBondContact O-N 3.06Å; W327-L331 HydrophobicContact CZ3-CD2 3.98Å; W327-L331 WeakPolarHBondContact O-CB 3.2Å; W327-L331 PolarHBondContact O-N 2.68Å
328	V	93.1	Very high	89.3	Confident	69 Å²	69	80.5 Å²	80.5	42%	0.418	41%	0.409	S	S	.	.	H	α-helix	trans	-60.6	-42.1	175.7	179	0	0	0	0	111.6	H326 L331 L332	H326-V328 VanDerWaalsContact C-N 3.31Å; H326-V328 PolarHBondContact O-N 2.81Å; V328-L331 PolarHBondContact O-N 2.63Å; V328-L332 WeakPolarHBondContact O-CB 3.4Å; V328-L332 PolarHBondContact O-N 3.1Å
329	V	92.9	Very high	90	Very high	68 Å²	68	86.8 Å²	86.8	41%	0.412	42%	0.424	S	S	.	.	H	α-helix	trans	-68.7	-39.1	179.3	-178.6	0	0	0	0	110.5	K325 H326 W327 T333	K325-V329 HydrophobicContact CD-CG1 4.1Å; H326-V329 HydrophobicContact CB-CG2 4.42Å; H326-V329 PolarHBondContact O-N 3.12Å; H326-V329 VanDerWaalsContact O-N 3.11Å; W327-V329 VanDerWaalsContact C-N 3.34Å; W327-V329 PolarHBondContact O-N 3.47Å; V329-T333 WeakPolarHBondContact O-CB 3.47Å; V329-T333 WeakPolarHBondContact O-CG2 3.5Å; V329-T333 PolarHBondContact O-N 3.4Å; V329-T333 PolarHBondContact O-OG1 2.97Å
330	K	91.8	Very high	90.5	Very high	55 Å²	55	89 Å²	89	24%	0.239	44%	0.438	C	S	.	.	H	α-helix	trans	-60.5	-49.5	172.9	-69.6	168.9	171.7	148.5	0	110.7	W322 R323 K325 H326 W327 T333 C334	W322-K330 HydrophobicContact CD2-CG 4.47Å; W322-K330 HydrophobicContact CH2-CB 4.07Å; W322-K330 HydrophobicContact CH2-CG 4.17Å; W322-K330 HydrophobicContact CZ2-CB 3.79Å; W322-K330 HydrophobicContact CZ2-CG 3.78Å; W322-K330 WeakPolarHBondContact O-CE 3.35Å; R323-K330 PolarHBondContact O-NZ 3.28Å; K325-K330 HydrophobicContact CB-CG 4.02Å; K325-K330 WeakPolarHBondContact O-CE 3.38Å; K325-K330 PolarHBondContact O-NZ 3Å; H326-K330 PolarHBondContact O-N 3.27Å; H326-K330 VanDerWaalsContact O-N 3.09Å; W327-K330 WeakPolarHBondContact O-CB 3.32Å; W327-K330 PolarHBondContact O-N 3.06Å; K330-T333 PolarHBondContact O-N 3.27Å; K330-T333 PolarHBondContact O-OG1 2.8Å; K330-T333 VanDerWaalsContact O-OG1 3.06Å; K330-C334 WeakPolarHBondContact O-CB 3.45Å; K330-C334 PolarHBondContact O-N 2.78Å; K330-C334 PolarHBondContact O-SG 2.94Å
331	L	91.6	Very high	91.1	Very high	92 Å²	92	84 Å²	84	48%	0.482	40%	0.404	S	S	.	.	H	α-helix	trans	-58.8	-51.6	178.1	179.6	61.9	0	0	0	111.4	W327 V328 T333 C334 M335	W327-L331 HydrophobicContact CZ3-CD2 3.98Å; W327-L331 WeakPolarHBondContact O-CB 3.2Å; W327-L331 PolarHBondContact O-N 2.68Å; V328-L331 PolarHBondContact O-N 2.63Å; L331-T333 VanDerWaalsContact C-N 3.31Å; L331-T333 PolarHBondContact O-N 2.89Å; L331-C334 PolarHBondContact O-N 2.78Å; L331-C334 VanDerWaalsContact O-N 3.15Å; L331-M335 HydrophobicContact CD1-CG 4.11Å; L331-M335 HydrophobicContact CG-CG 4.41Å; L331-M335 VanDerWaalsContact O-CG 3.3Å; L331-M335 WeakPolarHBondContact O-CG 3.21Å; L331-M335 PolarHBondContact O-N 2.87Å
332	L	93.6	Very high	91.6	Very high	116 Å²	116	84.8 Å²	84.8	61%	0.607	40%	0.404	S	S	*	.	H	α-helix	trans	-58.4	-43	179.5	-176.1	64.2	0	0	0	112	V328 M335 T336	V328-L332 WeakPolarHBondContact O-CB 3.4Å; V328-L332 PolarHBondContact O-N 3.1Å; L332-M335 PolarHBondContact O-N 3.01Å; L332-T336 WeakPolarHBondContact O-CG2 3.31Å; L332-T336 PolarHBondContact O-N 3.23Å; L332-T336 PolarHBondContact O-OG1 3.36Å
333	T	91.6	Very high	91.8	Very high	38 Å²	38	90.8 Å²	90.8	23%	0.233	43%	0.434	C	S	.	.	H	α-helix	trans	-71.3	-31.1	177.6	47.5	0	0	0	0	113.6	W322 V329 K330 L331 T336 I337	W322-T333 WeakPolarHBondContact CH2-OG1 3.46Å; W322-T333 VanDerWaalsContact CZ3-OG1 3.26Å; W322-T333 WeakPolarHBondContact CZ3-OG1 3.4Å; V329-T333 WeakPolarHBondContact O-CB 3.47Å; V329-T333 WeakPolarHBondContact O-CG2 3.5Å; V329-T333 PolarHBondContact O-N 3.4Å; V329-T333 PolarHBondContact O-OG1 2.97Å; K330-T333 PolarHBondContact O-N 3.27Å; K330-T333 PolarHBondContact O-OG1 2.8Å; K330-T333 VanDerWaalsContact O-OG1 3.06Å; L331-T333 VanDerWaalsContact C-N 3.31Å; L331-T333 PolarHBondContact O-N 2.89Å; T333-T336 PolarHBondContact O-OG1 3.45Å; T333-I337 WeakPolarHBondContact O-CB 3.44Å; T333-I337 WeakPolarHBondContact O-CD1 3.36Å; T333-I337 VanDerWaalsContact O-CG1 3.23Å; T333-I337 WeakPolarHBondContact O-CG1 3.36Å; T333-I337 PolarHBondContact O-N 3.42Å; T333-I337 VanDerWaalsContact O-N 3.12Å
334	C	92.3	Very high	92	Very high	34 Å²	34	83.9 Å²	83.9	23%	0.23	41%	0.409	C	S	.	.	H	α-helix	trans	-68.7	-40	170.7	-64.6	0	0	0	0	111.3	K330 L331 G338 I368	K330-C334 WeakPolarHBondContact O-CB 3.45Å; K330-C334 PolarHBondContact O-N 2.78Å; K330-C334 PolarHBondContact O-SG 2.94Å; L331-C334 PolarHBondContact O-N 2.78Å; L331-C334 VanDerWaalsContact O-N 3.15Å; C334-G338 WeakPolarHBondContact O-CA 3.49Å; C334-G338 PolarHBondContact O-N 2.81Å; C334-I368 HydrophobicContact CB-CD1 4.37Å
335	M	92.5	Very high	92.1	Very high	129 Å²	129	73.3 Å²	73.3	64%	0.635	37%	0.369	S	S	*	.	H	α-helix	trans	-67.9	-37.6	177.6	-67.2	-63.6	-106	0	0	112.2	L331 L332 G338 F339	L331-M335 HydrophobicContact CD1-CG 4.11Å; L331-M335 HydrophobicContact CG-CG 4.41Å; L331-M335 VanDerWaalsContact O-CG 3.3Å; L331-M335 WeakPolarHBondContact O-CG 3.21Å; L331-M335 PolarHBondContact O-N 2.87Å; L332-M335 PolarHBondContact O-N 3.01Å; M335-G338 PolarHBondContact O-N 3.1Å; M335-F339 WeakPolarHBondContact O-CB 3.29Å; M335-F339 PolarHBondContact O-N 3.21Å
336	T	92.8	Very high	92.1	Very high	71 Å²	71	72.9 Å²	72.9	44%	0.436	37%	0.37	S	S	.	.	H	α-helix	trans	-69.2	-45.7	174.7	56	0	0	0	0	112.1	L332 T333 G338 F339 L340	L332-T336 WeakPolarHBondContact O-CG2 3.31Å; L332-T336 PolarHBondContact O-N 3.23Å; L332-T336 PolarHBondContact O-OG1 3.36Å; T333-T336 PolarHBondContact O-OG1 3.45Å; T336-G338 VanDerWaalsContact C-N 3.28Å; T336-G338 PolarHBondContact O-N 2.81Å; T336-F339 PolarHBondContact O-N 2.88Å; T336-L340 WeakPolarHBondContact O-CD1 3.44Å; T336-L340 PolarHBondContact O-N 3.41Å
337	I	93.2	Very high	91.8	Very high	19 Å²	19	68.5 Å²	68.5	10%	0.097	35%	0.353	C	S	.	.	H	α-helix	trans	-59.7	-43	173.9	-66.5	163.6	0	0	0	110.3	F319 T333 L340 F341 L344 I365 I368	F319-I337 HydrophobicContact CZ-CD1 4.34Å; T333-I337 WeakPolarHBondContact O-CB 3.44Å; T333-I337 WeakPolarHBondContact O-CD1 3.36Å; T333-I337 VanDerWaalsContact O-CG1 3.23Å; T333-I337 WeakPolarHBondContact O-CG1 3.36Å; T333-I337 PolarHBondContact O-N 3.42Å; T333-I337 VanDerWaalsContact O-N 3.12Å; I337-L340 PolarHBondContact O-N 2.9Å; I337-F341 PolarHBondContact O-N 3.27Å; I337-L344 HydrophobicContact CG2-CD1 4.41Å; I337-I365 HydrophobicContact CD1-CD1 3.65Å; I337-I365 HydrophobicContact CG1-CD1 4.47Å; I337-I365 HydrophobicContact CG2-CD1 3.99Å; I337-I365 HydrophobicContact CG2-CG2 4.3Å; I337-I368 HydrophobicContact CB-CG2 4.13Å; I337-I368 HydrophobicContact CD1-CD1 4.45Å; I337-I368 HydrophobicContact CG2-CB 4.26Å; I337-I368 HydrophobicContact CG2-CG2 3.73Å
338	G	93.8	Very high	91.7	Very high	11 Å²	11	62.3 Å²	62.3	11%	0.113	33%	0.33	C	S	.	.	H	α-helix	trans	-58.5	-47.9	176	0	0	0	0	0	112.5	C334 M335 T336 L340 F341	C334-G338 WeakPolarHBondContact O-CA 3.49Å; C334-G338 PolarHBondContact O-N 2.81Å; M335-G338 PolarHBondContact O-N 3.1Å; T336-G338 VanDerWaalsContact C-N 3.28Å; T336-G338 PolarHBondContact O-N 2.81Å; G338-L340 VanDerWaalsContact C-N 3.32Å; G338-L340 PolarHBondContact O-N 3.42Å; G338-F341 WeakPolarHBondContact O-CB 3.16Å; G338-F341 WeakPolarHBondContact O-CD1 3.39Å; G338-F341 PolarHBondContact O-N 2.9Å
339	F	93	Very high	91.2	Very high	176 Å²	176	61.7 Å²	61.7	77%	0.772	32%	0.324	S	S	*	.	H	α-helix	trans	-64.7	-34	176.7	-175.7	-102.3	0	0	0	113	M335 T336 F341 P342	M335-F339 WeakPolarHBondContact O-CB 3.29Å; M335-F339 PolarHBondContact O-N 3.21Å; T336-F339 PolarHBondContact O-N 2.88Å; F339-F341 VanDerWaalsContact C-N 3.27Å; F339-F341 PolarHBondContact O-N 3.36Å; F339-P342 WeakPolarHBondContact O-CD 3.29Å
340	L	93.4	Very high	90.9	Very high	87 Å²	87	64.9 Å²	64.9	46%	0.455	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	2.3	177.8	-83.2	86.7	0	0	0	114.4	T336 I337 G338 M343 L344	T336-L340 WeakPolarHBondContact O-CD1 3.44Å; T336-L340 PolarHBondContact O-N 3.41Å; I337-L340 PolarHBondContact O-N 2.9Å; G338-L340 VanDerWaalsContact C-N 3.32Å; G338-L340 PolarHBondContact O-N 3.42Å; L340-M343 PolarHBondContact O-N 2.97Å; L340-L344 HydrophobicContact CB-CD1 4.38Å; L340-L344 HydrophobicContact CB-CG 4.47Å; L340-L344 WeakPolarHBondContact O-CG 3.4Å; L340-L344 PolarHBondContact O-N 3.42Å
341	F	93.8	Very high	90.6	Very high	13 Å²	13	64.8 Å²	64.8	6%	0.057	34%	0.344	C	S	.	.	H	α-helix	trans	-52.2	-38	-176.9	94.2	-90.9	0	0	0	115.6	I337 G338 F339 S345 C369 A372 T376 P658 F661	I337-F341 PolarHBondContact O-N 3.27Å; G338-F341 WeakPolarHBondContact O-CB 3.16Å; G338-F341 WeakPolarHBondContact O-CD1 3.39Å; G338-F341 PolarHBondContact O-N 2.9Å; F339-F341 VanDerWaalsContact C-N 3.27Å; F339-F341 PolarHBondContact O-N 3.36Å; F341-S345 WeakPolarHBondContact O-CB 3.46Å; F341-S345 PolarHBondContact O-N 3.47Å; F341-S345 PolarHBondContact O-OG 2.94Å; F341-C369 HydrophobicContact CB-CB 4.24Å; F341-A372 HydrophobicContact CB-CB 4.36Å; F341-A372 HydrophobicContact CD1-CB 4.11Å; F341-A372 HydrophobicContact CG-CB 4.35Å; F341-T376 HydrophobicContact CE1-CG2 3.81Å; F341-T376 HydrophobicContact CZ-CG2 4.39Å; F341-P658 HydrophobicContact CD2-CG 4.26Å; F341-F661 HydrophobicContact CD2-CE2 4.46Å; F341-F661 HydrophobicContact CE2-CE2 4.02Å
342	P	91.8	Very high	90.1	Very high	42 Å²	42	63.4 Å²	63.4	27%	0.273	34%	0.34	S	S	.	.	H	α-helix	trans	-70.4	-42.6	-177.9	-16.8	32.9	0	0	0	110.9	F339 S345 I346 F661	F339-P342 WeakPolarHBondContact O-CD 3.29Å; P342-S345 PolarHBondContact O-N 3.36Å; P342-I346 WeakPolarHBondContact O-CB 3.43Å; P342-I346 VanDerWaalsContact O-CG1 3.27Å; P342-I346 WeakPolarHBondContact O-CG1 3.47Å; P342-I346 PolarHBondContact O-N 3.02Å; P342-F661 HydrophobicContact CB-CE2 4.27Å; P342-F661 HydrophobicContact CB-CZ 4.08Å
343	M	91	Very high	89.5	Confident	139 Å²	139	68.4 Å²	68.4	69%	0.685	35%	0.351	S	S	*	.	H	α-helix	trans	-64.5	-41.3	178.3	-66.4	-64.2	178.6	0	0	111.6	L340 A347	L340-M343 PolarHBondContact O-N 2.97Å; M343-A347 VanDerWaalsContact O-CB 3.29Å; M343-A347 WeakPolarHBondContact O-CB 3.5Å; M343-A347 PolarHBondContact O-N 3.38Å
344	L	90.2	Very high	89.4	Confident	14 Å²	14	68.2 Å²	68.2	7%	0.073	35%	0.351	C	S	.	.	H	α-helix	trans	-65.4	-40.1	176	-67.6	173.9	0	0	0	112.1	I337 L340 A347 Y348 L356 F359 I360	I337-L344 HydrophobicContact CG2-CD1 4.41Å; L340-L344 HydrophobicContact CB-CD1 4.38Å; L340-L344 HydrophobicContact CB-CG 4.47Å; L340-L344 WeakPolarHBondContact O-CG 3.4Å; L340-L344 PolarHBondContact O-N 3.42Å; L344-A347 PolarHBondContact O-N 3.37Å; L344-Y348 PolarHBondContact O-N 3.42Å; L344-Y348 VanDerWaalsContact O-N 3.13Å; L344-L356 HydrophobicContact CD2-CD2 4.29Å; L344-F359 HydrophobicContact CD1-CD1 4.48Å; L344-F359 HydrophobicContact CD1-CE1 4.3Å; L344-F359 HydrophobicContact CD2-CD1 4.24Å; L344-I360 HydrophobicContact CB-CD1 4.48Å
345	S	89.1	Confident	89.1	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-44.2	178.7	-56.3	0	0	0	0	111.8	F341 P342 Y348 L349	F341-S345 WeakPolarHBondContact O-CB 3.46Å; F341-S345 PolarHBondContact O-N 3.47Å; F341-S345 PolarHBondContact O-OG 2.94Å; P342-S345 PolarHBondContact O-N 3.36Å; S345-Y348 PolarHBondContact O-N 2.92Å; S345-L349 PolarHBondContact O-N 2.82Å; S345-L349 VanDerWaalsContact O-N 3.11Å
346	I	88.3	Confident	88.8	Confident	74 Å²	74	71.6 Å²	71.6	38%	0.379	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-42.3	175.6	-67.6	165.2	0	0	0	111	P342 Y348 L349 I350 F661	P342-I346 WeakPolarHBondContact O-CB 3.43Å; P342-I346 VanDerWaalsContact O-CG1 3.27Å; P342-I346 WeakPolarHBondContact O-CG1 3.47Å; P342-I346 PolarHBondContact O-N 3.02Å; I346-Y348 VanDerWaalsContact C-N 3.3Å; I346-Y348 PolarHBondContact O-N 3.03Å; I346-L349 PolarHBondContact O-N 2.84Å; I346-I350 HydrophobicContact CG2-CD1 3.67Å; I346-I350 HydrophobicContact CG2-CG1 4.36Å; I346-I350 WeakPolarHBondContact O-CG1 3.49Å; I346-I350 PolarHBondContact O-N 3.31Å; I346-F661 HydrophobicContact CD1-CE1 4.38Å; I346-F661 HydrophobicContact CG1-CE1 4.13Å
347	A	88	Confident	88.3	Confident	22 Å²	22	68.2 Å²	68.2	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-37.3	177.5	0	0	0	0	0	112.8	M343 L344 S351 L356	M343-A347 VanDerWaalsContact O-CB 3.29Å; M343-A347 WeakPolarHBondContact O-CB 3.5Å; M343-A347 PolarHBondContact O-N 3.38Å; L344-A347 PolarHBondContact O-N 3.37Å; A347-S351 CarbonylContact O-C 3.6Å; A347-S351 PolarHBondContact O-N 2.99Å; A347-L356 HydrophobicContact CB-CB 4.1Å; A347-L356 HydrophobicContact CB-CD1 4.12Å
348	Y	87.1	Confident	88	Confident	39 Å²	39	71.6 Å²	71.6	15%	0.153	37%	0.366	C	S	.	.	H	α-helix	trans	-67.9	-40.1	173.9	177.5	-91.4	0	0	0	112.8	L344 S345 I346 S351 P352 I360 K361 T656 L657	L344-Y348 PolarHBondContact O-N 3.42Å; L344-Y348 VanDerWaalsContact O-N 3.13Å; S345-Y348 PolarHBondContact O-N 2.92Å; I346-Y348 VanDerWaalsContact C-N 3.3Å; I346-Y348 PolarHBondContact O-N 3.03Å; Y348-S351 CarbonylContact O-C 3.12Å; Y348-P352 HydrophobicContact CD2-CB 4.19Å; Y348-P352 HydrophobicContact CE2-CB 4.04Å; Y348-P352 WeakPolarHBondContact O-CA 3.11Å; Y348-P352 WeakPolarHBondContact O-CB 3.35Å; Y348-P352 VanDerWaalsContact O-CD 3.32Å; Y348-P352 WeakPolarHBondContact O-CD 3.5Å; Y348-I360 HydrophobicContact CD2-CG2 3.39Å; Y348-I360 HydrophobicContact CE2-CG2 4.23Å; Y348-I360 HydrophobicContact CG-CG2 3.75Å; Y348-K361 HydrophobicContact CE2-CG 4.06Å; Y348-T656 WeakPolarHBondContact CE1-OG1 3.3Å; Y348-T656 VanDerWaalsContact CZ-OG1 3.32Å; Y348-T656 PolarHBondContact OH-OG1 3.44Å; Y348-L657 HydrophobicContact CD1-CD1 4.48Å; Y348-L657 HydrophobicContact CD1-CD2 3.79Å; Y348-L657 HydrophobicContact CD1-CG 4.04Å; Y348-L657 HydrophobicContact CE1-CD2 4.45Å; Y348-L657 HydrophobicContact CE1-CG 4.2Å
349	L	84.2	Confident	87.8	Confident	57 Å²	57	73.8 Å²	73.8	30%	0.298	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-43.8	178.6	-163.3	158.8	0	0	0	111.4	S345 I346 I664	S345-L349 PolarHBondContact O-N 2.82Å; S345-L349 VanDerWaalsContact O-N 3.11Å; I346-L349 PolarHBondContact O-N 2.84Å; L349-I664 HydrophobicContact CD1-CB 3.87Å; L349-I664 HydrophobicContact CD1-CD1 4.09Å; L349-I664 HydrophobicContact CD1-CG2 3.78Å
350	I	85.3	Confident	87.5	Confident	135 Å²	135	65.4 Å²	65.4	69%	0.692	34%	0.336	S	S	*	.	H	α-helix	trans	-72.4	-44.2	178.3	-62.8	170.8	0	0	0	111.6	I346	I346-I350 HydrophobicContact CG2-CD1 3.67Å; I346-I350 HydrophobicContact CG2-CG1 4.36Å; I346-I350 WeakPolarHBondContact O-CG1 3.49Å; I346-I350 PolarHBondContact O-N 3.31Å
351	S	85.1	Confident	87.2	Confident	53 Å²	53	64.8 Å²	64.8	37%	0.371	33%	0.33	S	S	.	.			trans	-145.8	86.5	-175.8	-171.2	0	0	0	0	112.7	A347 Y348 R353 S354	A347-S351 CarbonylContact O-C 3.6Å; A347-S351 PolarHBondContact O-N 2.99Å; Y348-S351 CarbonylContact O-C 3.12Å; S351-R353 PolarHBondContact O-N 3.36Å; S351-R353 VanDerWaalsContact O-N 3.13Å; S351-S354 WeakPolarHBondContact O-CB 3.4Å; S351-S354 PolarHBondContact O-N 2.92Å; S351-S354 VanDerWaalsContact O-N 3.08Å; S351-S354 PolarHBondContact O-OG 3.46Å
352	P	81.2	Confident	87	Confident	62 Å²	62	66.3 Å²	66.3	40%	0.403	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-6.7	-177	28.8	-35.8	0	0	0	113.9	Y348	Y348-P352 HydrophobicContact CD2-CB 4.19Å; Y348-P352 HydrophobicContact CE2-CB 4.04Å; Y348-P352 WeakPolarHBondContact O-CA 3.11Å; Y348-P352 WeakPolarHBondContact O-CB 3.35Å; Y348-P352 VanDerWaalsContact O-CD 3.32Å; Y348-P352 WeakPolarHBondContact O-CD 3.5Å
353	R	82.1	Confident	86.9	Confident	222 Å²	222	65 Å²	65	84%	0.838	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-3.8	173.3	-73.8	-176.9	171.8	154	-4.7	113.6	S351	S351-R353 PolarHBondContact O-N 3.36Å; S351-R353 VanDerWaalsContact O-N 3.13Å
354	S	88.4	Confident	87	Confident	34 Å²	34	59 Å²	59	24%	0.238	30%	0.298	C	S	.	.	S	Bend	trans	-68.6	161.6	174.8	68.2	0	0	0	0	111.8	S351 L356 G357 L358	S351-S354 WeakPolarHBondContact O-CB 3.4Å; S351-S354 PolarHBondContact O-N 2.92Å; S351-S354 VanDerWaalsContact O-N 3.08Å; S351-S354 PolarHBondContact O-OG 3.46Å; S354-L356 PolarHBondContact O-N 3.34Å; S354-G357 WeakPolarHBondContact O-CA 3.41Å; S354-G357 PolarHBondContact O-N 2.98Å; S354-G357 PolarHBondContact OG-N 3.47Å; S354-L358 PolarHBondContact O-N 3.21Å
355	N	86.9	Confident	87	Confident	140 Å²	140	58.3 Å²	58.3	75%	0.749	29%	0.294	S	S	*	.	H	α-helix	trans	-57.2	-33.9	175	-67	-10.6	0	0	0	112.4	F359	N355-F359 WeakPolarHBondContact O-CB 3.35Å; N355-F359 PolarHBondContact O-N 3.41Å
356	L	86.1	Confident	87.1	Confident	93 Å²	93	58.6 Å²	58.6	49%	0.487	30%	0.295	S	S	.	.	H	α-helix	trans	-72.9	-37.7	174.8	-61.1	178.7	0	0	0	111.9	L344 A347 S354 F359 I360	L344-L356 HydrophobicContact CD2-CD2 4.29Å; A347-L356 HydrophobicContact CB-CB 4.1Å; A347-L356 HydrophobicContact CB-CD1 4.12Å; S354-L356 PolarHBondContact O-N 3.34Å; L356-F359 WeakPolarHBondContact O-CB 3.2Å; L356-F359 PolarHBondContact O-N 2.82Å; L356-I360 PolarHBondContact O-N 3.14Å; L356-I360 VanDerWaalsContact O-N 3.11Å
357	G	83.2	Confident	87.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-40.1	172.9	0	0	0	0	0	112.8	S354 F359 I360 K361	S354-G357 WeakPolarHBondContact O-CA 3.41Å; S354-G357 PolarHBondContact O-N 2.98Å; S354-G357 PolarHBondContact OG-N 3.47Å; G357-F359 VanDerWaalsContact C-N 3.31Å; G357-I360 WeakPolarHBondContact O-CG2 3.32Å; G357-K361 PolarHBondContact O-N 3.25Å
358	L	85.9	Confident	87.6	Confident	91 Å²	91	56 Å²	56	48%	0.476	28%	0.278	S	S	.	.	H	α-helix	trans	-69.7	-28.1	172.2	-65.6	176.3	0	0	0	112.5	S354 K361	S354-L358 PolarHBondContact O-N 3.21Å; L358-K361 HydrophobicContact CD2-CD 4.33Å
359	F	89.4	Confident	87.9	Confident	57 Å²	57	54.1 Å²	54.1	25%	0.25	27%	0.271	C	S	.	.	H	α-helix	trans	-69.5	-44.1	176.8	-176.3	-103.4	0	0	0	112.6	F319 L344 N355 L356 G357 K361 K362 I365	F319-F359 HydrophobicContact CE1-CE2 4.5Å; F319-F359 HydrophobicContact CE2-CE2 4.08Å; F319-F359 HydrophobicContact CE2-CZ 4.44Å; F319-F359 AromaticContact CZ-CE2 3.56Å; F319-F359 HydrophobicContact CZ-CE2 3.56Å; F319-F359 AromaticContact CZ-CZ 3.7Å; F319-F359 HydrophobicContact CZ-CZ 3.7Å; L344-F359 HydrophobicContact CD1-CD1 4.48Å; L344-F359 HydrophobicContact CD1-CE1 4.3Å; L344-F359 HydrophobicContact CD2-CD1 4.24Å; N355-F359 WeakPolarHBondContact O-CB 3.35Å; N355-F359 PolarHBondContact O-N 3.41Å; L356-F359 WeakPolarHBondContact O-CB 3.2Å; L356-F359 PolarHBondContact O-N 2.82Å; G357-F359 VanDerWaalsContact C-N 3.31Å; F359-K361 VanDerWaalsContact C-N 3.3Å; F359-K361 PolarHBondContact O-N 3.4Å; F359-K362 WeakPolarHBondContact O-CB 3.31Å; F359-K362 PolarHBondContact O-N 3.49Å; F359-I365 HydrophobicContact CD1-CG1 4.49Å; F359-I365 HydrophobicContact CD1-CG2 4.07Å; F359-I365 HydrophobicContact CE1-CD1 3.96Å; F359-I365 HydrophobicContact CE1-CG1 4.09Å; F359-I365 HydrophobicContact CE1-CG2 3.94Å; F359-I365 HydrophobicContact CE2-CD1 4.43Å; F359-I365 HydrophobicContact CE2-CG1 4.41Å; F359-I365 HydrophobicContact CZ-CD1 3.75Å; F359-I365 HydrophobicContact CZ-CG1 4.06Å
360	I	87.9	Confident	88.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71	-23	175.9	-165.5	168.8	0	0	0	113	L344 Y348 L356 G357 K362 I365 K366	L344-I360 HydrophobicContact CB-CD1 4.48Å; Y348-I360 HydrophobicContact CD2-CG2 3.39Å; Y348-I360 HydrophobicContact CE2-CG2 4.23Å; Y348-I360 HydrophobicContact CG-CG2 3.75Å; L356-I360 PolarHBondContact O-N 3.14Å; L356-I360 VanDerWaalsContact O-N 3.11Å; G357-I360 WeakPolarHBondContact O-CG2 3.32Å; I360-K362 PolarHBondContact O-N 3.18Å; I360-K362 VanDerWaalsContact O-N 3.15Å; I360-I365 HydrophobicContact CG1-CG2 4.47Å; I360-K366 WeakPolarHBondContact O-CG 3.38Å
361	K	86.1	Confident	88.7	Confident	74 Å²	74	48.1 Å²	48.1	32%	0.322	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-18.9	171.7	-81	-166.4	172.6	-148	0	113.5	Y348 G357 L358 F359 K366 E653	Y348-K361 HydrophobicContact CE2-CG 4.06Å; G357-K361 PolarHBondContact O-N 3.25Å; L358-K361 HydrophobicContact CD2-CD 4.33Å; F359-K361 VanDerWaalsContact C-N 3.3Å; F359-K361 PolarHBondContact O-N 3.4Å; K361-K366 WeakPolarHBondContact O-CE 3.26Å; K361-E653 IonicContact NZ-OE1 2.69Å; K361-E653 PolarHBondContact NZ-OE1 3.37Å
362	K	89.4	Confident	89.1	Confident	44 Å²	44	46.3 Å²	46.3	19%	0.191	23%	0.228	C	C	.	.	S	Bend	trans	-70.9	132	179.1	-67.1	177.5	165.2	-161.7	0	111	D317 G318 F359 I360 F364 I365 K366	D317-K362 WeakPolarHBondContact O-CD 3.43Å; D317-K362 WeakPolarHBondContact O-CE 3.31Å; D317-K362 PolarHBondContact O-NZ 2.92Å; G318-K362 VanDerWaalsContact CA-NZ 3.28Å; F359-K362 WeakPolarHBondContact O-CB 3.31Å; F359-K362 PolarHBondContact O-N 3.49Å; I360-K362 PolarHBondContact O-N 3.18Å; I360-K362 VanDerWaalsContact O-N 3.15Å; K362-F364 PolarHBondContact O-N 3.17Å; K362-I365 HydrophobicContact CB-CB 4.42Å; K362-I365 HydrophobicContact CB-CG1 4.2Å; K362-I365 WeakPolarHBondContact O-CA 3.23Å; K362-I365 PolarHBondContact O-N 3.32Å; K362-K366 PolarHBondContact O-N 3.47Å
363	P	90.9	Very high	89.8	Confident	14 Å²	14	43.4 Å²	43.4	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-42.2	-168.1	24.7	-35.5	0	0	0	113	W315 I365 K366 F367 F651	W315-P363 HydrophobicContact CE3-CB 3.79Å; W315-P363 HydrophobicContact CE3-CG 4.23Å; W315-P363 HydrophobicContact CZ3-CB 3.82Å; P363-I365 VanDerWaalsContact C-N 3.26Å; P363-I365 PolarHBondContact O-N 2.77Å; P363-K366 WeakPolarHBondContact O-CB 3.5Å; P363-K366 PolarHBondContact O-N 2.6Å; P363-F367 PolarHBondContact O-N 3.31Å; P363-F651 HydrophobicContact CB-CD1 3.71Å; P363-F651 HydrophobicContact CB-CE1 3.96Å; P363-F651 HydrophobicContact CG-CD1 3.7Å; P363-F651 HydrophobicContact CG-CE1 3.64Å
364	F	91.4	Very high	90.4	Very high	14 Å²	14	34 Å²	34	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-31.7	174.5	-179.8	-127.7	0	0	0	113.6	W315 Y316 F319 W322 K362 I368	W315-F364 HydrophobicContact CD2-CB 4.47Å; W315-F364 AromaticContact CE2-CD2 3.96Å; W315-F364 HydrophobicContact CZ2-CB 4.46Å; W315-F364 HydrophobicContact CZ2-CD2 4.21Å; W315-F364 AromaticContact NE1-CD2 3.34Å; W315-F364 VanDerWaalsContact NE1-CD2 3.34Å; W315-F364 AromaticContact NE1-CG 3.88Å; W315-F364 VanDerWaalsContact O-CB 3.26Å; W315-F364 WeakPolarHBondContact O-CB 3.34Å; Y316-F364 HydrophobicContact CD1-CB 4.47Å; Y316-F364 AromaticContact CD1-CD1 3.96Å; Y316-F364 HydrophobicContact CD1-CD1 3.96Å; Y316-F364 HydrophobicContact CD1-CD2 4.37Å; Y316-F364 HydrophobicContact CD1-CE1 4.24Å; Y316-F364 HydrophobicContact CD1-CG 4.02Å; Y316-F364 HydrophobicContact CE1-CD1 4.17Å; Y316-F364 AromaticContact CE1-CD2 3.93Å; Y316-F364 HydrophobicContact CE1-CD2 3.93Å; Y316-F364 HydrophobicContact CE1-CE1 4.16Å; Y316-F364 AromaticContact CE1-CE2 3.92Å; Y316-F364 HydrophobicContact CE1-CE2 3.92Å; Y316-F364 HydrophobicContact CE1-CG 4.05Å; Y316-F364 HydrophobicContact CE1-CZ 4.03Å; F319-F364 HydrophobicContact CD2-CD1 4.44Å; W322-F364 HydrophobicContact CD2-CE1 4.25Å; W322-F364 AromaticContact CE2-CE1 3.78Å; W322-F364 AromaticContact CE2-CZ 3.73Å; W322-F364 HydrophobicContact CH2-CE1 4.03Å; W322-F364 HydrophobicContact CH2-CZ 4.13Å; W322-F364 AromaticContact CZ2-CE1 3.7Å; W322-F364 HydrophobicContact CZ2-CE1 3.7Å; W322-F364 AromaticContact CZ2-CZ 3.47Å; W322-F364 HydrophobicContact CZ2-CZ 3.47Å; W322-F364 VanDerWaalsContact CZ2-CZ 3.47Å; W322-F364 HydrophobicContact CZ3-CE1 4.43Å; W322-F364 AromaticContact NE1-CZ 3.93Å; K362-F364 PolarHBondContact O-N 3.17Å; F364-I368 HydrophobicContact CD1-CD1 4.22Å; F364-I368 HydrophobicContact CD2-CD1 4.28Å; F364-I368 HydrophobicContact CE1-CD1 3.77Å; F364-I368 HydrophobicContact CE2-CD1 3.84Å; F364-I368 HydrophobicContact CE2-CG1 4.24Å; F364-I368 HydrophobicContact CG-CD1 4.47Å; F364-I368 HydrophobicContact CZ-CD1 3.56Å; F364-I368 HydrophobicContact CZ-CG1 4.43Å; F364-I368 WeakPolarHBondContact O-CG1 3.39Å; F364-I368 PolarHBondContact O-N 2.97Å; F364-I368 VanDerWaalsContact O-N 3.16Å
365	I	91.8	Very high	90.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-79	-39.6	177.4	-57.8	-62.4	0	0	0	111	F319 I337 F359 I360 K362 P363 F367 I368 C369	F319-I365 HydrophobicContact CE2-CD1 3.7Å; F319-I365 HydrophobicContact CE2-CG1 3.89Å; F319-I365 HydrophobicContact CZ-CD1 3.64Å; F319-I365 HydrophobicContact CZ-CG1 4.25Å; I337-I365 HydrophobicContact CD1-CD1 3.65Å; I337-I365 HydrophobicContact CG1-CD1 4.47Å; I337-I365 HydrophobicContact CG2-CD1 3.99Å; I337-I365 HydrophobicContact CG2-CG2 4.3Å; F359-I365 HydrophobicContact CD1-CG1 4.49Å; F359-I365 HydrophobicContact CD1-CG2 4.07Å; F359-I365 HydrophobicContact CE1-CD1 3.96Å; F359-I365 HydrophobicContact CE1-CG1 4.09Å; F359-I365 HydrophobicContact CE1-CG2 3.94Å; F359-I365 HydrophobicContact CE2-CD1 4.43Å; F359-I365 HydrophobicContact CE2-CG1 4.41Å; F359-I365 HydrophobicContact CZ-CD1 3.75Å; F359-I365 HydrophobicContact CZ-CG1 4.06Å; I360-I365 HydrophobicContact CG1-CG2 4.47Å; K362-I365 HydrophobicContact CB-CB 4.42Å; K362-I365 HydrophobicContact CB-CG1 4.2Å; K362-I365 WeakPolarHBondContact O-CA 3.23Å; K362-I365 PolarHBondContact O-N 3.32Å; P363-I365 VanDerWaalsContact C-N 3.26Å; P363-I365 PolarHBondContact O-N 2.77Å; I365-F367 VanDerWaalsContact C-N 3.29Å; I365-F367 PolarHBondContact O-N 3.09Å; I365-I368 PolarHBondContact O-N 2.88Å; I365-C369 WeakPolarHBondContact O-CB 3.42Å; I365-C369 PolarHBondContact O-N 3.24Å; I365-C369 PolarHBondContact O-SG 3.18Å; I365-C369 VanDerWaalsContact O-SG 3.34Å
366	K	91.6	Very high	90.9	Very high	5 Å²	5	32.3 Å²	32.3	2%	0.022	16%	0.164	C	C	.	.	H	α-helix	trans	-51.8	-51.3	168.6	-59.7	-176.7	-159.3	167.7	0	110.2	I360 K361 K362 P363 I368 C369 H370 Y650 F651 D652 T656	I360-K366 WeakPolarHBondContact O-CG 3.38Å; K361-K366 WeakPolarHBondContact O-CE 3.26Å; K362-K366 PolarHBondContact O-N 3.47Å; P363-K366 WeakPolarHBondContact O-CB 3.5Å; P363-K366 PolarHBondContact O-N 2.6Å; K366-I368 PolarHBondContact O-N 2.95Å; K366-C369 PolarHBondContact O-N 2.98Å; K366-H370 WeakPolarHBondContact O-CB 3.49Å; K366-H370 PolarHBondContact O-CD2 3.44Å; K366-H370 VanDerWaalsContact O-CD2 3.25Å; K366-H370 PolarHBondContact O-N 3.09Å; K366-Y650 HydrophobicContact CB-CD1 3.84Å; K366-Y650 WeakPolarHBondContact CD-O 3.47Å; K366-Y650 WeakPolarHBondContact CE-O 3.46Å; K366-Y650 PolarHBondContact NZ-O 3.18Å; K366-F651 PolarHBondContact NZ-O 3.4Å; K366-D652 PolarHBondContact NZ-O 3.31Å; K366-T656 HydrophobicContact CD-CG2 4.38Å
367	F	92.8	Very high	91.4	Very high	27 Å²	27	27.9 Å²	27.9	12%	0.118	14%	0.14	C	C	.	.	H	α-helix	trans	-58.4	-45.3	-179.7	173.8	-104.7	0	0	0	113.2	W315 P363 I365 T371 L496 A499 L646 Y650	W315-F367 HydrophobicContact CH2-CB 3.71Å; W315-F367 HydrophobicContact CH2-CG 4.14Å; W315-F367 HydrophobicContact CZ2-CB 3.74Å; W315-F367 HydrophobicContact CZ2-CD1 4.14Å; W315-F367 AromaticContact CZ2-CG 3.93Å; W315-F367 HydrophobicContact CZ2-CG 3.93Å; P363-F367 PolarHBondContact O-N 3.31Å; I365-F367 VanDerWaalsContact C-N 3.29Å; I365-F367 PolarHBondContact O-N 3.09Å; F367-T371 VanDerWaalsContact O-CB 3.26Å; F367-T371 WeakPolarHBondContact O-CB 3.49Å; F367-T371 PolarHBondContact O-N 2.94Å; F367-T371 PolarHBondContact O-OG1 3.03Å; F367-L496 HydrophobicContact CE2-CD2 4.05Å; F367-A499 HydrophobicContact CE1-CB 4.18Å; F367-A499 HydrophobicContact CE2-CB 4.34Å; F367-A499 HydrophobicContact CZ-CB 3.64Å; F367-L646 HydrophobicContact CD2-CD2 4.08Å; F367-L646 HydrophobicContact CE2-CD2 3.99Å; F367-Y650 HydrophobicContact CB-CD2 4.31Å; F367-Y650 HydrophobicContact CB-CE2 4.37Å; F367-Y650 HydrophobicContact CB-CG 4.42Å; F367-Y650 HydrophobicContact CD2-CD2 4.27Å; F367-Y650 AromaticContact CD2-CE2 3.67Å; F367-Y650 HydrophobicContact CD2-CE2 3.67Å; F367-Y650 AromaticContact CD2-CZ 3.96Å; F367-Y650 HydrophobicContact CG-CE2 4.5Å
368	I	93.3	Very high	91.8	Very high	14 Å²	14	28.8 Å²	28.8	7%	0.072	15%	0.145	C	C	.	.	H	α-helix	trans	-64.5	-44	176.1	-67.9	167.6	0	0	0	111	C334 I337 F364 I365 K366 T371 A372	C334-I368 HydrophobicContact CB-CD1 4.37Å; I337-I368 HydrophobicContact CB-CG2 4.13Å; I337-I368 HydrophobicContact CD1-CD1 4.45Å; I337-I368 HydrophobicContact CG2-CB 4.26Å; I337-I368 HydrophobicContact CG2-CG2 3.73Å; F364-I368 HydrophobicContact CD1-CD1 4.22Å; F364-I368 HydrophobicContact CD2-CD1 4.28Å; F364-I368 HydrophobicContact CE1-CD1 3.77Å; F364-I368 HydrophobicContact CE2-CD1 3.84Å; F364-I368 HydrophobicContact CE2-CG1 4.24Å; F364-I368 HydrophobicContact CG-CD1 4.47Å; F364-I368 HydrophobicContact CZ-CD1 3.56Å; F364-I368 HydrophobicContact CZ-CG1 4.43Å; F364-I368 WeakPolarHBondContact O-CG1 3.39Å; F364-I368 PolarHBondContact O-N 2.97Å; F364-I368 VanDerWaalsContact O-N 3.16Å; I365-I368 PolarHBondContact O-N 2.88Å; K366-I368 PolarHBondContact O-N 2.95Å; I368-T371 PolarHBondContact O-N 3.36Å; I368-A372 WeakPolarHBondContact O-CB 3.5Å; I368-A372 PolarHBondContact O-N 3.04Å
369	C	93.3	Very high	92.1	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-41.9	-179.8	-70.5	0	0	0	0	112.6	F341 I365 K366 S373 P658	F341-C369 HydrophobicContact CB-CB 4.24Å; I365-C369 WeakPolarHBondContact O-CB 3.42Å; I365-C369 PolarHBondContact O-N 3.24Å; I365-C369 PolarHBondContact O-SG 3.18Å; I365-C369 VanDerWaalsContact O-SG 3.34Å; K366-C369 PolarHBondContact O-N 2.98Å; C369-S373 WeakPolarHBondContact O-CB 3.42Å; C369-S373 PolarHBondContact O-N 3.43Å; C369-P658 HydrophobicContact CB-CG 4.38Å
370	H	92.3	Very high	92.2	Very high	39 Å²	39	29 Å²	29	18%	0.181	14%	0.143	C	C	.	.	H	α-helix	trans	-63.2	-47.1	173.4	-83.9	-79.8	0	0	0	111.5	K366 S373 Y374 Y650 G655 L657 P658	K366-H370 WeakPolarHBondContact O-CB 3.49Å; K366-H370 PolarHBondContact O-CD2 3.44Å; K366-H370 VanDerWaalsContact O-CD2 3.25Å; K366-H370 PolarHBondContact O-N 3.09Å; H370-S373 PolarHBondContact O-N 3.37Å; H370-Y374 PolarHBondContact O-N 3.14Å; H370-Y650 HydrophobicContact CB-CE1 4.14Å; H370-Y650 AromaticContact CD2-CE1 3.6Å; H370-Y650 AromaticContact CG-CE1 3.99Å; H370-G655 PolarHBondContact NE2-O 2.87Å; H370-L657 PolarHBondContact CE1-O 3.17Å; H370-P658 VanDerWaalsContact CE1-CA 3.48Å; H370-P658 WeakPolarHBondContact CE1-CA 3.45Å
371	T	93.6	Very high	92.3	Very high	26 Å²	26	29.5 Å²	29.5	16%	0.16	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-45.5	176.9	-60	0	0	0	0	112.2	F367 I368 Y374 L375 L496	F367-T371 VanDerWaalsContact O-CB 3.26Å; F367-T371 WeakPolarHBondContact O-CB 3.49Å; F367-T371 PolarHBondContact O-N 2.94Å; F367-T371 PolarHBondContact O-OG1 3.03Å; I368-T371 PolarHBondContact O-N 3.36Å; T371-Y374 PolarHBondContact O-N 3.19Å; T371-L375 HydrophobicContact CG2-CD1 4.09Å; T371-L375 WeakPolarHBondContact O-CG 3.35Å; T371-L375 PolarHBondContact O-N 2.87Å; T371-L496 HydrophobicContact CG2-CD1 4Å
372	A	94.6	Very high	92.4	Very high	15 Å²	15	31.3 Å²	31.3	12%	0.124	16%	0.158	C	C	.	.	H	α-helix	trans	-62.9	-42.8	178.5	0	0	0	0	0	111.2	F341 I368 L375 T376	F341-A372 HydrophobicContact CB-CB 4.36Å; F341-A372 HydrophobicContact CD1-CB 4.11Å; F341-A372 HydrophobicContact CG-CB 4.35Å; I368-A372 WeakPolarHBondContact O-CB 3.5Å; I368-A372 PolarHBondContact O-N 3.04Å; A372-L375 PolarHBondContact O-N 3.35Å; A372-T376 PolarHBondContact O-N 3.28Å; A372-T376 PolarHBondContact O-OG1 3.32Å
373	S	94.8	Very high	92.3	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.014	16%	0.162	C	C	.	.	H	α-helix	trans	-62.5	-43.8	175.2	-169.3	0	0	0	0	112.2	C369 H370 L375 T376 F377 W410 P659	C369-S373 WeakPolarHBondContact O-CB 3.42Å; C369-S373 PolarHBondContact O-N 3.43Å; H370-S373 PolarHBondContact O-N 3.37Å; S373-L375 VanDerWaalsContact C-N 3.33Å; S373-L375 PolarHBondContact O-N 2.87Å; S373-T376 WeakPolarHBondContact CA-OG1 3.41Å; S373-T376 PolarHBondContact O-N 3.49Å; S373-T376 VanDerWaalsContact O-N 3.11Å; S373-T376 PolarHBondContact O-OG1 3.25Å; S373-F377 PolarHBondContact O-N 2.88Å; S373-W410 PolarHBondContact O-NE1 2.96Å; S373-W410 PolarHBondContact OG-NE1 2.88Å; S373-P659 WeakPolarHBondContact CB-O 3.35Å; S373-P659 PolarHBondContact OG-O 2.96Å
374	Y	94.4	Very high	92	Very high	25 Å²	25	32.4 Å²	32.4	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-42.4	176.4	-159.8	-98.4	0	0	0	112.1	H370 T371 T376 F377 L378 F414 S489 R492 L493	H370-Y374 PolarHBondContact O-N 3.14Å; T371-Y374 PolarHBondContact O-N 3.19Å; Y374-T376 VanDerWaalsContact C-N 3.35Å; Y374-T376 PolarHBondContact O-N 2.69Å; Y374-F377 HydrophobicContact CD2-CD1 4.49Å; Y374-F377 HydrophobicContact CE2-CD1 4.21Å; Y374-F377 HydrophobicContact CE2-CE1 4.47Å; Y374-F377 WeakPolarHBondContact O-CB 3.2Å; Y374-F377 PolarHBondContact O-N 3.33Å; Y374-L378 HydrophobicContact CD1-CD1 3.97Å; Y374-L378 HydrophobicContact CD1-CG 4.21Å; Y374-L378 HydrophobicContact CE1-CD1 3.79Å; Y374-L378 HydrophobicContact CE1-CD2 4.22Å; Y374-L378 HydrophobicContact CE1-CG 4.02Å; Y374-L378 WeakPolarHBondContact O-CG 3.47Å; Y374-L378 PolarHBondContact O-N 3.05Å; Y374-F414 AromaticContact CD2-CE1 3.78Å; Y374-F414 HydrophobicContact CD2-CE1 3.78Å; Y374-F414 AromaticContact CD2-CZ 3.58Å; Y374-F414 HydrophobicContact CD2-CZ 3.58Å; Y374-F414 AromaticContact CE2-CE1 3.96Å; Y374-F414 HydrophobicContact CE2-CE1 3.96Å; Y374-F414 HydrophobicContact CE2-CE2 4.31Å; Y374-F414 AromaticContact CE2-CZ 3.65Å; Y374-F414 HydrophobicContact CE2-CZ 3.65Å; Y374-S489 WeakPolarHBondContact OH-CA 3.36Å; Y374-S489 WeakPolarHBondContact OH-CB 3.46Å; Y374-S489 PolarHBondContact OH-O 3.19Å; Y374-R492 HydrophobicContact CE1-CB 4.27Å; Y374-R492 HydrophobicContact CE1-CG 4.43Å; Y374-R492 WeakPolarHBondContact OH-CB 3.09Å; Y374-L493 HydrophobicContact CD1-CD2 3.79Å; Y374-L493 HydrophobicContact CE1-CD2 4.1Å; Y374-L493 HydrophobicContact CE1-CG 4.47Å
375	L	94.1	Very high	91.4	Very high	89 Å²	89	35.8 Å²	35.8	47%	0.466	19%	0.194	S	C	.	.	H	α-helix	trans	-64	-36.8	173.7	-70.2	170.5	0	0	0	112.4	T371 A372 S373 L378 F379 L493	T371-L375 HydrophobicContact CG2-CD1 4.09Å; T371-L375 WeakPolarHBondContact O-CG 3.35Å; T371-L375 PolarHBondContact O-N 2.87Å; A372-L375 PolarHBondContact O-N 3.35Å; S373-L375 VanDerWaalsContact C-N 3.33Å; S373-L375 PolarHBondContact O-N 2.87Å; L375-L378 PolarHBondContact O-N 3.2Å; L375-F379 WeakPolarHBondContact O-CB 3.49Å; L375-F379 PolarHBondContact O-N 3.37Å; L375-L493 HydrophobicContact CD2-CD1 4.39Å; L375-L493 HydrophobicContact CD2-CD2 3.85Å
376	T	93.3	Very high	90.8	Very high	48 Å²	48	40.8 Å²	40.8	29%	0.294	22%	0.218	S	C	.	.	H	α-helix	trans	-68.7	-35.5	172.9	57.5	0	0	0	0	113	F341 A372 S373 Y374 F379 M380	F341-T376 HydrophobicContact CE1-CG2 3.81Å; F341-T376 HydrophobicContact CZ-CG2 4.39Å; A372-T376 PolarHBondContact O-N 3.28Å; A372-T376 PolarHBondContact O-OG1 3.32Å; S373-T376 WeakPolarHBondContact CA-OG1 3.41Å; S373-T376 PolarHBondContact O-N 3.49Å; S373-T376 VanDerWaalsContact O-N 3.11Å; S373-T376 PolarHBondContact O-OG1 3.25Å; Y374-T376 VanDerWaalsContact C-N 3.35Å; Y374-T376 PolarHBondContact O-N 2.69Å; T376-F379 PolarHBondContact O-N 3.46Å; T376-M380 VanDerWaalsContact O-CG 3.28Å; T376-M380 WeakPolarHBondContact O-CG 3.46Å; T376-M380 PolarHBondContact O-N 3.1Å
377	F	94.5	Very high	89.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-49.1	171.8	165.2	-107.3	0	0	0	111.4	S373 Y374 F379 M380 L381 I407 W410 V411 F414 Y446	S373-F377 PolarHBondContact O-N 2.88Å; Y374-F377 HydrophobicContact CD2-CD1 4.49Å; Y374-F377 HydrophobicContact CE2-CD1 4.21Å; Y374-F377 HydrophobicContact CE2-CE1 4.47Å; Y374-F377 WeakPolarHBondContact O-CB 3.2Å; Y374-F377 PolarHBondContact O-N 3.33Å; F377-F379 VanDerWaalsContact C-N 3.32Å; F377-F379 PolarHBondContact O-N 3.32Å; F377-M380 WeakPolarHBondContact O-CB 3.19Å; F377-M380 PolarHBondContact O-N 3.28Å; F377-M380 VanDerWaalsContact O-N 3.09Å; F377-L381 HydrophobicContact CD1-CD1 4.36Å; F377-L381 HydrophobicContact CE1-CD1 3.76Å; F377-L381 HydrophobicContact CE1-CG 4.47Å; F377-L381 HydrophobicContact CE2-CD1 4.29Å; F377-L381 HydrophobicContact CE2-CD2 4.23Å; F377-L381 HydrophobicContact CE2-CG 4.25Å; F377-L381 HydrophobicContact CZ-CD1 3.72Å; F377-L381 HydrophobicContact CZ-CD2 4.34Å; F377-L381 HydrophobicContact CZ-CG 4.19Å; F377-L381 PolarHBondContact O-N 3.42Å; F377-I407 HydrophobicContact CE2-CG2 4.12Å; F377-W410 HydrophobicContact CB-CD2 4.42Å; F377-W410 HydrophobicContact CB-CG 4Å; F377-W410 HydrophobicContact CD2-CB 3.57Å; F377-W410 AromaticContact CD2-CG 3.87Å; F377-W410 HydrophobicContact CD2-CG 3.87Å; F377-W410 HydrophobicContact CE2-CB 4.07Å; F377-W410 HydrophobicContact CG-CB 4.3Å; F377-W410 HydrophobicContact CG-CG 4.27Å; F377-V411 HydrophobicContact CE2-CG2 4.41Å; F377-F414 AromaticContact CD1-CE2 3.79Å; F377-F414 HydrophobicContact CD1-CE2 3.79Å; F377-F414 AromaticContact CD1-CZ 4Å; F377-F414 HydrophobicContact CD1-CZ 4Å; F377-F414 HydrophobicContact CD2-CE2 4.04Å; F377-F414 AromaticContact CE1-CE2 3.72Å; F377-F414 HydrophobicContact CE1-CE2 3.72Å; F377-F414 HydrophobicContact CE1-CZ 4.33Å; F377-F414 AromaticContact CE2-CE2 3.97Å; F377-F414 HydrophobicContact CE2-CE2 3.97Å; F377-F414 AromaticContact CG-CE2 3.94Å; F377-F414 HydrophobicContact CG-CE2 3.94Å; F377-F414 HydrophobicContact CG-CZ 4.15Å; F377-F414 AromaticContact CZ-CE2 3.81Å; F377-F414 HydrophobicContact CZ-CE2 3.81Å; F377-Y446 HydrophobicContact CZ-CE2 4.13Å; F377-Y446 AromaticContact CZ-CZ 3.93Å
378	L	93.3	Very high	87.6	Confident	19 Å²	19	52.7 Å²	52.7	10%	0.099	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-37.7	175.7	-64.6	-179.8	0	0	0	112.5	Y374 L375 M380 L381 L382 L493	Y374-L378 HydrophobicContact CD1-CD1 3.97Å; Y374-L378 HydrophobicContact CD1-CG 4.21Å; Y374-L378 HydrophobicContact CE1-CD1 3.79Å; Y374-L378 HydrophobicContact CE1-CD2 4.22Å; Y374-L378 HydrophobicContact CE1-CG 4.02Å; Y374-L378 WeakPolarHBondContact O-CG 3.47Å; Y374-L378 PolarHBondContact O-N 3.05Å; L375-L378 PolarHBondContact O-N 3.2Å; L378-M380 VanDerWaalsContact C-N 3.31Å; L378-M380 PolarHBondContact O-N 3.28Å; L378-L381 HydrophobicContact CD2-CD1 4.07Å; L378-L381 PolarHBondContact O-N 3.36Å; L378-L382 WeakPolarHBondContact O-CG 3.36Å; L378-L382 PolarHBondContact O-N 3.06Å; L378-L493 HydrophobicContact CD1-CD1 3.49Å; L378-L493 VanDerWaalsContact CD1-CD1 3.49Å; L378-L493 HydrophobicContact CD1-CD2 3.71Å; L378-L493 HydrophobicContact CD1-CG 3.52Å
379	F	92.1	Very high	86.1	Confident	131 Å²	131	54.3 Å²	54.3	58%	0.575	29%	0.287	S	S	*	.	H	α-helix	trans	-62.1	-38.9	172.8	-179.5	-98.8	0	0	0	112	L375 T376 F377 L382 L383	L375-F379 WeakPolarHBondContact O-CB 3.49Å; L375-F379 PolarHBondContact O-N 3.37Å; T376-F379 PolarHBondContact O-N 3.46Å; F377-F379 VanDerWaalsContact C-N 3.32Å; F377-F379 PolarHBondContact O-N 3.32Å; F379-L382 PolarHBondContact O-N 3.39Å; F379-L383 HydrophobicContact CE1-CD1 4.14Å; F379-L383 WeakPolarHBondContact O-CB 3.33Å; F379-L383 PolarHBondContact O-N 3.38Å
380	M	90.3	Very high	84.4	Confident	21 Å²	21	60.3 Å²	60.3	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-35.4	174.2	-70.7	-62.6	-68.7	0	0	112.6	T376 F377 L378 L383 A384 V403 M406 I407	T376-M380 VanDerWaalsContact O-CG 3.28Å; T376-M380 WeakPolarHBondContact O-CG 3.46Å; T376-M380 PolarHBondContact O-N 3.1Å; F377-M380 WeakPolarHBondContact O-CB 3.19Å; F377-M380 PolarHBondContact O-N 3.28Å; F377-M380 VanDerWaalsContact O-N 3.09Å; L378-M380 VanDerWaalsContact C-N 3.31Å; L378-M380 PolarHBondContact O-N 3.28Å; M380-L383 PolarHBondContact O-N 2.88Å; M380-A384 WeakPolarHBondContact O-CB 3.18Å; M380-A384 PolarHBondContact O-N 2.83Å; M380-V403 HydrophobicContact CE-CG1 4.09Å; M380-M406 HydrophobicContact CE-CB 3.67Å; M380-M406 HydrophobicContact CE-CE 3.56Å; M380-M406 HydrophobicContact CE-CG 4.22Å; M380-M406 HydrophobicContact CE-SD 3.54Å; M380-M406 VanDerWaalsContact CE-SD 3.54Å; M380-M406 HydrophobicContact SD-CE 4.33Å; M380-I407 HydrophobicContact CB-CG1 4.31Å
381	L	90.7	Very high	82.8	Confident	12 Å²	12	61 Å²	61	6%	0.063	32%	0.317	C	S	.	.	H	α-helix	trans	-65.3	-41.9	171.3	-65.2	-179.7	0	0	0	112.2	F377 L378 L383 A384 S385 I407 Y446 F482 N486 S489	F377-L381 HydrophobicContact CD1-CD1 4.36Å; F377-L381 HydrophobicContact CE1-CD1 3.76Å; F377-L381 HydrophobicContact CE1-CG 4.47Å; F377-L381 HydrophobicContact CE2-CD1 4.29Å; F377-L381 HydrophobicContact CE2-CD2 4.23Å; F377-L381 HydrophobicContact CE2-CG 4.25Å; F377-L381 HydrophobicContact CZ-CD1 3.72Å; F377-L381 HydrophobicContact CZ-CD2 4.34Å; F377-L381 HydrophobicContact CZ-CG 4.19Å; F377-L381 PolarHBondContact O-N 3.42Å; L378-L381 HydrophobicContact CD2-CD1 4.07Å; L378-L381 PolarHBondContact O-N 3.36Å; L381-L383 VanDerWaalsContact C-N 3.34Å; L381-A384 WeakPolarHBondContact O-CB 3.48Å; L381-A384 PolarHBondContact O-N 3.11Å; L381-S385 PolarHBondContact O-N 3.07Å; L381-I407 HydrophobicContact CD2-CD1 3.83Å; L381-I407 HydrophobicContact CD2-CG1 4.31Å; L381-I407 HydrophobicContact CD2-CG2 4.44Å; L381-Y446 WeakPolarHBondContact CD1-OH 3.26Å; L381-F482 HydrophobicContact CD2-CE2 4.18Å; L381-F482 HydrophobicContact CD2-CZ 3.88Å; L381-N486 HydrophobicContact CD1-CB 4.41Å; L381-N486 WeakPolarHBondContact CD2-OD1 3.32Å; L381-S489 WeakPolarHBondContact CD1-OG 3.27Å
382	L	88.8	Confident	81.3	Confident	111 Å²	111	65.9 Å²	65.9	58%	0.581	34%	0.342	S	S	*	.	H	α-helix	trans	-61.4	-44	173.3	-70.3	171.3	0	0	0	110.9	L378 F379 A384 S385	L378-L382 WeakPolarHBondContact O-CG 3.36Å; L378-L382 PolarHBondContact O-N 3.06Å; F379-L382 PolarHBondContact O-N 3.39Å; L382-A384 PolarHBondContact O-N 3.2Å; L382-S385 PolarHBondContact O-N 2.9Å; L382-S385 PolarHBondContact O-OG 3.24Å
383	L	86.7	Confident	79.9	Confident	52 Å²	52	69.1 Å²	69.1	27%	0.272	36%	0.357	S	S	.	.	H	α-helix	trans	-62.6	-39.6	174.8	-161.7	158.3	0	0	0	112	F379 M380 L381 S385 Q386 V389 V403	F379-L383 HydrophobicContact CE1-CD1 4.14Å; F379-L383 WeakPolarHBondContact O-CB 3.33Å; F379-L383 PolarHBondContact O-N 3.38Å; M380-L383 PolarHBondContact O-N 2.88Å; L381-L383 VanDerWaalsContact C-N 3.34Å; L383-S385 PolarHBondContact O-N 3.5Å; L383-Q386 WeakPolarHBondContact O-CB 3.21Å; L383-Q386 PolarHBondContact O-N 3.01Å; L383-V389 HydrophobicContact CD2-CG2 4.09Å; L383-V403 HydrophobicContact CD2-CG1 4.49Å; L383-V403 HydrophobicContact CD2-CG2 3.63Å
384	A	83.7	Confident	78.7	Confident	30 Å²	30	74.1 Å²	74.1	25%	0.248	38%	0.38	C	S	.	.	H	α-helix	trans	-58.1	-31.1	176	0	0	0	0	0	113.3	M380 L381 L382 V403 I407	M380-A384 WeakPolarHBondContact O-CB 3.18Å; M380-A384 PolarHBondContact O-N 2.83Å; L381-A384 WeakPolarHBondContact O-CB 3.48Å; L381-A384 PolarHBondContact O-N 3.11Å; L382-A384 PolarHBondContact O-N 3.2Å; A384-V403 HydrophobicContact CB-CG1 3.6Å; A384-I407 HydrophobicContact CB-CD1 4.11Å
385	S	79.3	Confident	77.8	Confident	84 Å²	84	75 Å²	75	59%	0.587	39%	0.388	S	S	*	.	H	α-helix	trans	-77.5	-18.4	176.1	75.8	0	0	0	0	114.3	L381 L382 L383	L381-S385 PolarHBondContact O-N 3.07Å; L382-S385 PolarHBondContact O-N 2.9Å; L382-S385 PolarHBondContact O-OG 3.24Å; L383-S385 PolarHBondContact O-N 3.5Å
386	Q	78.9	Confident	77.2	Confident	105 Å²	105	71.8 Å²	71.8	49%	0.491	37%	0.37	S	S	.	.	S	Bend	trans	-78.2	141	-177	-67	-170.2	-5.9	0	0	111.3	L383 I388 V389	L383-Q386 WeakPolarHBondContact O-CB 3.21Å; L383-Q386 PolarHBondContact O-N 3.01Å; Q386-I388 PolarHBondContact O-N 3.2Å; Q386-V389 PolarHBondContact O-N 2.78Å
387	H	59.2	Low	76.5	Confident	140 Å²	140	69.8 Å²	69.8	65%	0.648	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-58	-10	-176.3	-91.6	-111.8	0	0	0	115.7	V389 R390	H387-V389 PolarHBondContact O-N 3.25Å; H387-R390 PolarHBondContact CE1-NH1 3.29Å; H387-R390 VanDerWaalsContact NE2-CZ 3.27Å; H387-R390 PolarHBondContact NE2-NH1 3.39Å; H387-R390 PolarHBondContact NE2-NH2 2.9Å; H387-R390 VanDerWaalsContact NE2-NH2 3.12Å
388	I	59.6	Low	75.8	Confident	143 Å²	143	71.5 Å²	71.5	73%	0.733	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-67.9	-22.8	-174.7	-58	169.3	0	0	0	112.1	Q386	Q386-I388 PolarHBondContact O-N 3.2Å
389	V	59.9	Low	75.2	Confident	48 Å²	48	74.1 Å²	74.1	29%	0.291	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-126.9	38.2	-175.5	-158	0	0	0	0	112.3	L383 Q386 H387 V403	L383-V389 HydrophobicContact CD2-CG2 4.09Å; Q386-V389 PolarHBondContact O-N 2.78Å; H387-V389 PolarHBondContact O-N 3.25Å; V389-V403 HydrophobicContact CB-CG2 4.22Å; V389-V403 HydrophobicContact CG1-CG2 3.99Å; V389-V403 HydrophobicContact CG2-CG2 3.97Å
390	R	59.1	Low	74.8	Confident	126 Å²	126	70.3 Å²	70.3	48%	0.475	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-81	129.7	173.3	-76.5	-169.1	178.6	-179.5	5.5	111.8	H387	H387-R390 PolarHBondContact CE1-NH1 3.29Å; H387-R390 VanDerWaalsContact NE2-CZ 3.27Å; H387-R390 PolarHBondContact NE2-NH1 3.39Å; H387-R390 PolarHBondContact NE2-NH2 2.9Å; H387-R390 VanDerWaalsContact NE2-NH2 3.12Å
391	T	59	Low	74.6	Confident	54 Å²	54	70.3 Å²	70.3	33%	0.331	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-67.5	161.7	152.3	48.5	0	0	0	0	110.3	L393 P398 T401	T391-L393 PolarHBondContact O-N 2.87Å; T391-P398 HydrophobicContact CG2-CB 4.32Å; T391-T401 HydrophobicContact CG2-CG2 4.1Å
392	D	62.2	Low	74.3	Confident	128 Å²	128	74.9 Å²	74.9	68%	0.684	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-53.8	122.5	179.3	-67.7	-49.7	0	0	0	112.3	H394 V395	D392-H394 PolarHBondContact O-N 3.42Å; D392-V395 HydrophobicContact CB-CG2 3.88Å; D392-V395 PolarHBondContact O-N 3.5Å
393	L	64.7	Low	74.3	Confident	84 Å²	84	70 Å²	70	44%	0.44	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-3.5	-174.8	-80.7	138	0	0	0	115	T391	T391-L393 PolarHBondContact O-N 2.87Å
394	H	68.1	Low	74.3	Confident	106 Å²	106	69.8 Å²	69.8	49%	0.491	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	11.1	-174.4	-54.4	-40.6	0	0	0	112.8	D392 S463 R464	D392-H394 PolarHBondContact O-N 3.42Å; H394-S463 CarbonylContact O-C 3.52Å; H394-S463 WeakPolarHBondContact O-CA 3.42Å; H394-R464 CarbonylContact C-O 3.13Å; H394-R464 CarbonylContact O-C 3.56Å; H394-R464 PolarHBondContact O-N 3.29Å
395	V	77.1	Confident	74.6	Confident	44 Å²	44	75.9 Å²	75.9	27%	0.267	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-98.4	124.6	176.4	178	0	0	0	0	109.9	D392	D392-V395 HydrophobicContact CB-CG2 3.88Å; D392-V395 PolarHBondContact O-N 3.5Å
396	Q	80.4	Confident	75.1	Confident	21 Å²	21	76.1 Å²	76.1	10%	0.098	39%	0.388	C	S	.	.	S	Bend	trans	-77.7	130	169.9	-65.4	179.6	-22.1	0	0	109.3	G462 W469	Q396-G462 WeakPolarHBondContact CB-O 3.44Å; Q396-G462 PolarHBondContact N-O 3.04Å; Q396-W469 HydrophobicContact CB-CZ2 4.48Å; Q396-W469 HydrophobicContact CG-CD2 4.22Å; Q396-W469 HydrophobicContact CG-CZ2 3.72Å
397	G	78.1	Confident	75.7	Confident	6 Å²	6	71.5 Å²	71.5	6%	0.062	37%	0.367	C	S	.	.	S	Bend	trans	65.5	51.2	-176.6	0	0	0	0	0	114.4
398	P	79.9	Confident	77.2	Confident	37 Å²	37	67.7 Å²	67.7	24%	0.24	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-60.3	146.4	-178.3	28.5	-35.3	0	0	0	111.3	T391	T391-P398 HydrophobicContact CG2-CB 4.32Å
399	P	81.9	Confident	78.8	Confident	73 Å²	73	63 Å²	63	47%	0.474	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60.9	144	174.7	27	-34.4	0	0	0	110.1	T401 Y457	P399-T401 PolarHBondContact O-N 2.96Å; P399-Y457 HydrophobicContact CB-CE2 4.25Å
400	P	83.3	Confident	80.4	Confident	52 Å²	52	62 Å²	62	34%	0.338	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-57.2	131.6	-178.9	-22.8	31.9	0	0	0	111.4	E404 W405	P400-E404 HydrophobicContact CB-CB 4.22Å; P400-W405 VanDerWaalsContact O-CD1 3.32Å; P400-W405 PolarHBondContact O-NE1 2.91Å
401	T	85.2	Confident	82.1	Confident	21 Å²	21	56.2 Å²	56.2	13%	0.129	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-64.4	160.9	-179.5	65.5	0	0	0	0	111.3	T391 P399 V403 E404 W405	T391-T401 HydrophobicContact CG2-CG2 4.1Å; P399-T401 PolarHBondContact O-N 2.96Å; T401-V403 PolarHBondContact O-N 3.25Å; T401-E404 WeakPolarHBondContact O-CB 3.38Å; T401-E404 PolarHBondContact O-N 2.88Å; T401-E404 WeakPolarHBondContact OG1-CG 3.32Å; T401-E404 PolarHBondContact OG1-N 2.67Å; T401-E404 VanDerWaalsContact OG1-N 3.15Å; T401-W405 PolarHBondContact O-N 3.4Å
402	V	86.1	Confident	83.7	Confident	107 Å²	107	57.5 Å²	57.5	65%	0.648	30%	0.304	S	S	*	.	H	α-helix	trans	-55.2	-35.5	174.2	-178.5	0	0	0	0	111.3	W405 M406	V402-W405 PolarHBondContact O-N 2.8Å; V402-M406 WeakPolarHBondContact O-CG 3.48Å; V402-M406 PolarHBondContact O-N 3.14Å
403	V	87.6	Confident	85.1	Confident	9 Å²	9	51.4 Å²	51.4	6%	0.055	27%	0.271	C	S	.	.	H	α-helix	trans	-69.6	-39.1	177.5	177.8	0	0	0	0	111.4	M380 L383 A384 V389 T401 M406 I407	M380-V403 HydrophobicContact CE-CG1 4.09Å; L383-V403 HydrophobicContact CD2-CG1 4.49Å; L383-V403 HydrophobicContact CD2-CG2 3.63Å; A384-V403 HydrophobicContact CB-CG1 3.6Å; V389-V403 HydrophobicContact CB-CG2 4.22Å; V389-V403 HydrophobicContact CG1-CG2 3.99Å; V389-V403 HydrophobicContact CG2-CG2 3.97Å; T401-V403 PolarHBondContact O-N 3.25Å; V403-M406 WeakPolarHBondContact O-CB 3.46Å; V403-M406 PolarHBondContact O-N 3.25Å; V403-I407 HydrophobicContact CG1-CD1 3.84Å; V403-I407 WeakPolarHBondContact O-CD1 3.45Å; V403-I407 VanDerWaalsContact O-CG1 3.29Å; V403-I407 WeakPolarHBondContact O-CG1 3.31Å; V403-I407 PolarHBondContact O-N 3.3Å
404	E	87.4	Confident	86.5	Confident	48 Å²	48	48.5 Å²	48.5	22%	0.224	26%	0.255	C	S	.	.	H	α-helix	trans	-65.6	-40.2	173.6	-73.1	173.3	-153.1	0	0	112.5	P400 T401 M406 I407 L408 K453	P400-E404 HydrophobicContact CB-CB 4.22Å; T401-E404 WeakPolarHBondContact O-CB 3.38Å; T401-E404 PolarHBondContact O-N 2.88Å; T401-E404 WeakPolarHBondContact OG1-CG 3.32Å; T401-E404 PolarHBondContact OG1-N 2.67Å; T401-E404 VanDerWaalsContact OG1-N 3.15Å; E404-M406 VanDerWaalsContact C-N 3.27Å; E404-M406 PolarHBondContact O-N 2.67Å; E404-I407 PolarHBondContact O-N 3.18Å; E404-I407 VanDerWaalsContact O-N 3.14Å; E404-L408 PolarHBondContact O-N 3.05Å; E404-K453 IonicContact OE1-NZ 2.77Å; E404-K453 PolarHBondContact OE1-NZ 3.44Å; E404-K453 IonicContact OE2-NZ 2.68Å; E404-K453 PolarHBondContact OE2-NZ 3.02Å
405	W	89.6	Confident	87.7	Confident	157 Å²	157	45.2 Å²	45.2	60%	0.595	24%	0.241	S	C	*	.	H	α-helix	trans	-60.9	-35.3	171	-82.1	109.5	0	0	0	112.7	P400 T401 V402 L408 P409	P400-W405 VanDerWaalsContact O-CD1 3.32Å; P400-W405 PolarHBondContact O-NE1 2.91Å; T401-W405 PolarHBondContact O-N 3.4Å; V402-W405 PolarHBondContact O-N 2.8Å; W405-L408 HydrophobicContact CZ3-CD1 4.46Å; W405-P409 WeakPolarHBondContact O-CD 3.41Å
406	M	89.9	Confident	88.3	Confident	90 Å²	90	49.6 Å²	49.6	44%	0.443	25%	0.253	S	S	.	.	H	α-helix	trans	-71.6	-35.9	172.2	-70.4	178.4	74.5	0	0	112.5	M380 V402 V403 E404 P409 W410	M380-M406 HydrophobicContact CE-CB 3.67Å; M380-M406 HydrophobicContact CE-CE 3.56Å; M380-M406 HydrophobicContact CE-CG 4.22Å; M380-M406 HydrophobicContact CE-SD 3.54Å; M380-M406 VanDerWaalsContact CE-SD 3.54Å; M380-M406 HydrophobicContact SD-CE 4.33Å; V402-M406 WeakPolarHBondContact O-CG 3.48Å; V402-M406 PolarHBondContact O-N 3.14Å; V403-M406 WeakPolarHBondContact O-CB 3.46Å; V403-M406 PolarHBondContact O-N 3.25Å; E404-M406 VanDerWaalsContact C-N 3.27Å; E404-M406 PolarHBondContact O-N 2.67Å; M406-P409 WeakPolarHBondContact O-CD 3.29Å; M406-W410 WeakPolarHBondContact O-CZ3 3.47Å
407	I	91.7	Very high	88.7	Confident	8 Å²	8	49.9 Å²	49.9	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-69.5	-37.4	179.3	-75.2	159.4	0	0	0	112.4	F377 M380 L381 A384 V403 E404 W410 V411	F377-I407 HydrophobicContact CE2-CG2 4.12Å; M380-I407 HydrophobicContact CB-CG1 4.31Å; L381-I407 HydrophobicContact CD2-CD1 3.83Å; L381-I407 HydrophobicContact CD2-CG1 4.31Å; L381-I407 HydrophobicContact CD2-CG2 4.44Å; A384-I407 HydrophobicContact CB-CD1 4.11Å; V403-I407 HydrophobicContact CG1-CD1 3.84Å; V403-I407 WeakPolarHBondContact O-CD1 3.45Å; V403-I407 VanDerWaalsContact O-CG1 3.29Å; V403-I407 WeakPolarHBondContact O-CG1 3.31Å; V403-I407 PolarHBondContact O-N 3.3Å; E404-I407 PolarHBondContact O-N 3.18Å; E404-I407 VanDerWaalsContact O-N 3.14Å; I407-W410 WeakPolarHBondContact O-CB 3.27Å; I407-W410 PolarHBondContact O-N 3.34Å; I407-V411 HydrophobicContact CG2-CG2 3.86Å; I407-V411 PolarHBondContact O-N 3.1Å
408	L	91.1	Very high	89.3	Confident	59 Å²	59	50.9 Å²	50.9	31%	0.309	26%	0.264	S	S	.	.	H	α-helix	trans	-53.5	-43.8	-173.2	179.6	157.3	0	0	0	113.9	E404 W405 W410 V411 L412	E404-L408 PolarHBondContact O-N 3.05Å; W405-L408 HydrophobicContact CZ3-CD1 4.46Å; L408-W410 VanDerWaalsContact C-N 3.31Å; L408-W410 PolarHBondContact O-N 2.76Å; L408-V411 PolarHBondContact O-N 3.1Å; L408-L412 HydrophobicContact CD2-CD1 3.57Å; L408-L412 HydrophobicContact CD2-CG 4.17Å; L408-L412 HydrophobicContact CG-CD1 4.47Å; L408-L412 PolarHBondContact O-N 3.25Å
409	P	92.6	Very high	89.7	Confident	45 Å²	45	53.2 Å²	53.2	29%	0.292	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-28.6	171	-29	35.7	0	0	0	116.1	W405 M406 G413 P660 I663	W405-P409 WeakPolarHBondContact O-CD 3.41Å; M406-P409 WeakPolarHBondContact O-CD 3.29Å; P409-G413 PolarHBondContact O-N 3.31Å; P409-G413 VanDerWaalsContact O-N 3.17Å; P409-P660 HydrophobicContact CB-CB 3.56Å; P409-P660 WeakPolarHBondContact O-CB 3.47Å; P409-I663 WeakPolarHBondContact O-CD1 3.31Å
410	W	94.4	Very high	89.9	Confident	28 Å²	28	53.3 Å²	53.3	11%	0.106	27%	0.266	C	S	.	.	H	α-helix	trans	-73.4	-46.7	172.2	-86.4	-92.1	0	0	0	110.8	S373 F377 M406 I407 L408 L412 G413 F414 P660	S373-W410 PolarHBondContact O-NE1 2.96Å; S373-W410 PolarHBondContact OG-NE1 2.88Å; F377-W410 HydrophobicContact CB-CD2 4.42Å; F377-W410 HydrophobicContact CB-CG 4Å; F377-W410 HydrophobicContact CD2-CB 3.57Å; F377-W410 AromaticContact CD2-CG 3.87Å; F377-W410 HydrophobicContact CD2-CG 3.87Å; F377-W410 HydrophobicContact CE2-CB 4.07Å; F377-W410 HydrophobicContact CG-CB 4.3Å; F377-W410 HydrophobicContact CG-CG 4.27Å; M406-W410 WeakPolarHBondContact O-CZ3 3.47Å; I407-W410 WeakPolarHBondContact O-CB 3.27Å; I407-W410 PolarHBondContact O-N 3.34Å; L408-W410 VanDerWaalsContact C-N 3.31Å; L408-W410 PolarHBondContact O-N 2.76Å; W410-L412 PolarHBondContact O-N 3.04Å; W410-G413 CarbonylContact O-C 3.53Å; W410-G413 WeakPolarHBondContact O-CA 3.49Å; W410-G413 PolarHBondContact O-N 3.23Å; W410-F414 HydrophobicContact CB-CE2 3.98Å; W410-F414 HydrophobicContact CB-CZ 4.45Å; W410-F414 WeakPolarHBondContact O-CD2 3.39Å; W410-F414 WeakPolarHBondContact O-CG 3.43Å; W410-F414 PolarHBondContact O-N 3.24Å; W410-P660 HydrophobicContact CD2-CB 4.2Å; W410-P660 HydrophobicContact CD2-CG 4.17Å; W410-P660 HydrophobicContact CE3-CB 4.33Å; W410-P660 HydrophobicContact CE3-CG 4.28Å; W410-P660 HydrophobicContact CG-CB 4.47Å; W410-P660 HydrophobicContact CH2-CG 4.32Å; W410-P660 HydrophobicContact CZ2-CG 4.2Å; W410-P660 HydrophobicContact CZ3-CG 4.35Å
411	V	94.3	Very high	90.1	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-48.5	179.5	175.6	0	0	0	0	111.3	F377 I407 L408 G413 F414 I415 Y446 I450	F377-V411 HydrophobicContact CE2-CG2 4.41Å; I407-V411 HydrophobicContact CG2-CG2 3.86Å; I407-V411 PolarHBondContact O-N 3.1Å; L408-V411 PolarHBondContact O-N 3.1Å; V411-G413 PolarHBondContact O-N 2.93Å; V411-F414 PolarHBondContact O-N 3.05Å; V411-I415 HydrophobicContact CG1-CD1 3.92Å; V411-I415 WeakPolarHBondContact O-CG1 3.47Å; V411-I415 PolarHBondContact O-N 3.47Å; V411-Y446 HydrophobicContact CG1-CG 4.23Å; V411-Y446 HydrophobicContact CG2-CD1 4.32Å; V411-Y446 HydrophobicContact CG2-CD2 4.47Å; V411-Y446 HydrophobicContact CG2-CG 4.22Å; V411-I450 HydrophobicContact CG1-CD1 3.89Å
412	L	91.9	Very high	90.2	Very high	81 Å²	81	57 Å²	57	42%	0.424	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-33.2	174.1	-70.2	-177.7	0	0	0	112.3	L408 W410 W416 I663	L408-L412 HydrophobicContact CD2-CD1 3.57Å; L408-L412 HydrophobicContact CD2-CG 4.17Å; L408-L412 HydrophobicContact CG-CD1 4.47Å; L408-L412 PolarHBondContact O-N 3.25Å; W410-L412 PolarHBondContact O-N 3.04Å; L412-W416 WeakPolarHBondContact O-CB 3.22Å; L412-W416 PolarHBondContact O-N 3.32Å; L412-I663 HydrophobicContact CB-CD1 3.48Å; L412-I663 VanDerWaalsContact CB-CD1 3.48Å; L412-I663 HydrophobicContact CB-CG1 4.4Å
413	G	92.5	Very high	90.2	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-70.9	-33.8	177.6	0	0	0	0	0	113.4	P409 W410 V411 G417	P409-G413 PolarHBondContact O-N 3.31Å; P409-G413 VanDerWaalsContact O-N 3.17Å; W410-G413 CarbonylContact O-C 3.53Å; W410-G413 WeakPolarHBondContact O-CA 3.49Å; W410-G413 PolarHBondContact O-N 3.23Å; V411-G413 PolarHBondContact O-N 2.93Å; G413-G417 PolarHBondContact O-N 3.21Å; G413-G417 VanDerWaalsContact O-N 3.07Å
414	F	93	Very high	89.8	Confident	23 Å²	23	66.7 Å²	66.7	10%	0.101	31%	0.311	C	S	.	.	H	α-helix	trans	-70.9	-48.3	171.2	-62	-47.6	0	0	0	111	Y374 F377 W410 V411 W416 G417 E418 N443 P659	Y374-F414 AromaticContact CD2-CE1 3.78Å; Y374-F414 HydrophobicContact CD2-CE1 3.78Å; Y374-F414 AromaticContact CD2-CZ 3.58Å; Y374-F414 HydrophobicContact CD2-CZ 3.58Å; Y374-F414 AromaticContact CE2-CE1 3.96Å; Y374-F414 HydrophobicContact CE2-CE1 3.96Å; Y374-F414 HydrophobicContact CE2-CE2 4.31Å; Y374-F414 AromaticContact CE2-CZ 3.65Å; Y374-F414 HydrophobicContact CE2-CZ 3.65Å; F377-F414 AromaticContact CD1-CE2 3.79Å; F377-F414 HydrophobicContact CD1-CE2 3.79Å; F377-F414 AromaticContact CD1-CZ 4Å; F377-F414 HydrophobicContact CD1-CZ 4Å; F377-F414 HydrophobicContact CD2-CE2 4.04Å; F377-F414 AromaticContact CE1-CE2 3.72Å; F377-F414 HydrophobicContact CE1-CE2 3.72Å; F377-F414 HydrophobicContact CE1-CZ 4.33Å; F377-F414 AromaticContact CE2-CE2 3.97Å; F377-F414 HydrophobicContact CE2-CE2 3.97Å; F377-F414 AromaticContact CG-CE2 3.94Å; F377-F414 HydrophobicContact CG-CE2 3.94Å; F377-F414 HydrophobicContact CG-CZ 4.15Å; F377-F414 AromaticContact CZ-CE2 3.81Å; F377-F414 HydrophobicContact CZ-CE2 3.81Å; W410-F414 HydrophobicContact CB-CE2 3.98Å; W410-F414 HydrophobicContact CB-CZ 4.45Å; W410-F414 WeakPolarHBondContact O-CD2 3.39Å; W410-F414 WeakPolarHBondContact O-CG 3.43Å; W410-F414 PolarHBondContact O-N 3.24Å; V411-F414 PolarHBondContact O-N 3.05Å; F414-W416 VanDerWaalsContact C-N 3.3Å; F414-W416 PolarHBondContact O-N 2.94Å; F414-G417 CarbonylContact O-C 3.25Å; F414-G417 WeakPolarHBondContact O-CA 3.45Å; F414-G417 PolarHBondContact O-N 3.07Å; F414-E418 PolarHBondContact O-N 3.49Å; F414-N443 WeakPolarHBondContact CB-OD1 3.48Å; F414-P659 HydrophobicContact CD1-CB 4.19Å; F414-P659 HydrophobicContact CD1-CG 3.8Å; F414-P659 HydrophobicContact CE1-CB 3.99Å; F414-P659 HydrophobicContact CE1-CG 3.81Å
415	I	92.9	Very high	89.2	Confident	37 Å²	37	66.3 Å²	66.3	19%	0.19	32%	0.319	C	S	.	.	H	α-helix	trans	-55.7	-45.2	176	-68.1	165.5	0	0	0	111	V411 G417 E418 I419 N443	V411-I415 HydrophobicContact CG1-CD1 3.92Å; V411-I415 WeakPolarHBondContact O-CG1 3.47Å; V411-I415 PolarHBondContact O-N 3.47Å; I415-G417 VanDerWaalsContact C-N 3.33Å; I415-G417 PolarHBondContact O-N 3.44Å; I415-E418 PolarHBondContact O-N 3.08Å; I415-I419 HydrophobicContact CG2-CD1 3.73Å; I415-I419 HydrophobicContact CG2-CG1 4.49Å; I415-I419 WeakPolarHBondContact O-CB 3.37Å; I415-I419 WeakPolarHBondContact O-CD1 3.3Å; I415-I419 VanDerWaalsContact O-CG1 3.25Å; I415-I419 WeakPolarHBondContact O-CG1 3.42Å; I415-I419 PolarHBondContact O-N 3.39Å; I415-N443 HydrophobicContact CG1-CB 4.1Å
416	W	90.5	Very high	88.9	Confident	137 Å²	137	60.1 Å²	60.1	52%	0.519	30%	0.304	S	S	.	.	H	α-helix	trans	-66.4	-33.2	175.7	-175.2	-111.2	0	0	0	113.1	L412 F414 K420	L412-W416 WeakPolarHBondContact O-CB 3.22Å; L412-W416 PolarHBondContact O-N 3.32Å; F414-W416 VanDerWaalsContact C-N 3.3Å; F414-W416 PolarHBondContact O-N 2.94Å; W416-K420 WeakPolarHBondContact O-CB 3.35Å; W416-K420 PolarHBondContact O-N 3.17Å
417	G	88.3	Confident	88.8	Confident	26 Å²	26	62 Å²	62	27%	0.268	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-53.4	172	0	0	0	0	0	112.3	G413 F414 I415 K420 E421	G413-G417 PolarHBondContact O-N 3.21Å; G413-G417 VanDerWaalsContact O-N 3.07Å; F414-G417 CarbonylContact O-C 3.25Å; F414-G417 WeakPolarHBondContact O-CA 3.45Å; F414-G417 PolarHBondContact O-N 3.07Å; I415-G417 VanDerWaalsContact C-N 3.33Å; I415-G417 PolarHBondContact O-N 3.44Å; G417-K420 WeakPolarHBondContact O-CB 3.37Å; G417-K420 PolarHBondContact O-N 3.01Å; G417-E421 PolarHBondContact O-N 3.3Å
418	E	91.1	Very high	88.4	Confident	27 Å²	27	67.2 Å²	67.2	13%	0.126	34%	0.343	C	S	.	.	H	α-helix	trans	-62.4	-44.6	179.7	-63.9	-50.3	134.3	0	0	112.6	F414 I415 K420 E421 M422 Y430 N443	F414-E418 PolarHBondContact O-N 3.49Å; I415-E418 PolarHBondContact O-N 3.08Å; E418-K420 PolarHBondContact O-N 3.42Å; E418-E421 PolarHBondContact O-N 3.28Å; E418-M422 VanDerWaalsContact O-CB 3.28Å; E418-M422 WeakPolarHBondContact O-CB 3.45Å; E418-M422 PolarHBondContact O-N 2.92Å; E418-Y430 WeakPolarHBondContact OE2-CE2 3.36Å; E418-Y430 PolarHBondContact OE2-OH 3.07Å; E418-N443 WeakPolarHBondContact CG-ND2 3.14Å
419	I	89.3	Confident	88	Confident	86 Å²	86	69.2 Å²	69.2	44%	0.441	35%	0.351	S	S	.	.	H	α-helix	trans	-57.9	-39.4	176.6	-70.9	167.3	0	0	0	110.3	I415 W423	I415-I419 HydrophobicContact CG2-CD1 3.73Å; I415-I419 HydrophobicContact CG2-CG1 4.49Å; I415-I419 WeakPolarHBondContact O-CB 3.37Å; I415-I419 WeakPolarHBondContact O-CD1 3.3Å; I415-I419 VanDerWaalsContact O-CG1 3.25Å; I415-I419 WeakPolarHBondContact O-CG1 3.42Å; I415-I419 PolarHBondContact O-N 3.39Å; I419-W423 WeakPolarHBondContact O-CB 3.28Å; I419-W423 PolarHBondContact O-N 2.89Å; I419-W423 VanDerWaalsContact O-N 3.12Å
420	K	85.7	Confident	87.8	Confident	75 Å²	75	67.7 Å²	67.7	33%	0.326	34%	0.339	S	S	.	.	H	α-helix	trans	-70.7	-45.6	177.7	-168.7	-171.2	175.7	-140.7	0	112.1	W416 G417 E418 M422 W423 D424	W416-K420 WeakPolarHBondContact O-CB 3.35Å; W416-K420 PolarHBondContact O-N 3.17Å; G417-K420 WeakPolarHBondContact O-CB 3.37Å; G417-K420 PolarHBondContact O-N 3.01Å; E418-K420 PolarHBondContact O-N 3.42Å; K420-M422 VanDerWaalsContact C-N 3.3Å; K420-M422 PolarHBondContact O-N 3.25Å; K420-W423 PolarHBondContact O-N 3.39Å; K420-W423 VanDerWaalsContact O-N 3.16Å; K420-D424 WeakPolarHBondContact CE-OD2 3.49Å; K420-D424 IonicContact NZ-OD2 2.73Å; K420-D424 PolarHBondContact NZ-OD2 3.33Å; K420-D424 PolarHBondContact O-N 3.31Å
421	E	86.3	Confident	87.5	Confident	96 Å²	96	70.2 Å²	70.2	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-40.1	178.6	-173.9	166.3	150.7	0	0	111.6	G417 E418 W423 D424 G425 Y430 N436	G417-E421 PolarHBondContact O-N 3.3Å; E418-E421 PolarHBondContact O-N 3.28Å; E421-W423 VanDerWaalsContact C-N 3.33Å; E421-W423 PolarHBondContact O-N 3.45Å; E421-D424 PolarHBondContact O-N 2.99Å; E421-G425 PolarHBondContact O-N 3.22Å; E421-Y430 HydrophobicContact CG-CD2 4.39Å; E421-N436 PolarHBondContact OE1-ND2 3.41Å
422	M	88.3	Confident	87.2	Confident	55 Å²	55	76.8 Å²	76.8	27%	0.271	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-34.7	174.4	-169.7	-178.3	-62.5	0	0	112.8	E418 K420 G426 F427 Y430 F440	E418-M422 VanDerWaalsContact O-CB 3.28Å; E418-M422 WeakPolarHBondContact O-CB 3.45Å; E418-M422 PolarHBondContact O-N 2.92Å; K420-M422 VanDerWaalsContact C-N 3.3Å; K420-M422 PolarHBondContact O-N 3.25Å; M422-G426 WeakPolarHBondContact O-CA 3.42Å; M422-G426 PolarHBondContact O-N 2.83Å; M422-F427 HydrophobicContact SD-CD2 4.28Å; M422-Y430 HydrophobicContact CB-CD2 4.39Å; M422-Y430 HydrophobicContact CE-CD1 4.08Å; M422-Y430 HydrophobicContact CE-CE1 3.77Å; M422-F440 HydrophobicContact CE-CD2 4.45Å
423	W	85.8	Confident	87	Confident	209 Å²	209	74.4 Å²	74.4	79%	0.792	37%	0.372	S	S	*	.	H	α-helix	trans	-71.2	-48.6	173.7	-165.7	-50.4	0	0	0	111.6	I419 K420 E421	I419-W423 WeakPolarHBondContact O-CB 3.28Å; I419-W423 PolarHBondContact O-N 2.89Å; I419-W423 VanDerWaalsContact O-N 3.12Å; K420-W423 PolarHBondContact O-N 3.39Å; K420-W423 VanDerWaalsContact O-N 3.16Å; E421-W423 VanDerWaalsContact C-N 3.33Å; E421-W423 PolarHBondContact O-N 3.45Å
424	D	79.4	Confident	86.9	Confident	111 Å²	111	82.7 Å²	82.7	59%	0.594	40%	0.403	S	S	*	.	H	α-helix	trans	-70.5	-34.7	-174.5	-74.4	-14.9	0	0	0	112.3	K420 E421	K420-D424 WeakPolarHBondContact CE-OD2 3.49Å; K420-D424 IonicContact NZ-OD2 2.73Å; K420-D424 PolarHBondContact NZ-OD2 3.33Å; K420-D424 PolarHBondContact O-N 3.31Å; E421-D424 PolarHBondContact O-N 2.99Å
425	G	74.1	Confident	86.8	Confident	39 Å²	39	84.6 Å²	84.6	40%	0.402	41%	0.41	S	S	.	.	H	α-helix	trans	-101.5	-20.2	-177.6	0	0	0	0	0	116.1	E421	E421-G425 PolarHBondContact O-N 3.22Å
426	G	84.2	Confident	86.8	Confident	27 Å²	27	83.4 Å²	83.4	28%	0.278	40%	0.404	S	S	.	.			trans	80.1	152.6	-174.1	0	0	0	0	0	114.3	M422 T428 Y430	M422-G426 WeakPolarHBondContact O-CA 3.42Å; M422-G426 PolarHBondContact O-N 2.83Å; G426-T428 PolarHBondContact O-N 3.01Å; G426-Y430 WeakPolarHBondContact O-CB 3.13Å; G426-Y430 PolarHBondContact O-N 3.07Å
427	F	86.6	Confident	86.9	Confident	130 Å²	130	80.4 Å²	80.4	57%	0.57	40%	0.398	S	S	*	.	H	α-helix	trans	-61.8	-36.7	-169.3	-174.9	-108.3	0	0	0	114.8	M422 I431	M422-F427 HydrophobicContact SD-CD2 4.28Å; F427-I431 HydrophobicContact CD1-CD1 4.09Å; F427-I431 HydrophobicContact CD2-CD1 4.25Å; F427-I431 HydrophobicContact CE1-CD1 3.5Å; F427-I431 VanDerWaalsContact CE1-CD1 3.5Å; F427-I431 HydrophobicContact CE2-CD1 3.69Å; F427-I431 HydrophobicContact CE2-CG1 4.44Å; F427-I431 HydrophobicContact CG-CD1 4.44Å; F427-I431 HydrophobicContact CZ-CD1 3.29Å; F427-I431 HydrophobicContact CZ-CG1 4.44Å; F427-I431 PolarHBondContact O-N 3.09Å; F427-I431 VanDerWaalsContact O-N 3.14Å
428	T	84.1	Confident	87.1	Confident	117 Å²	117	81 Å²	81	72%	0.718	39%	0.393	S	S	*	.	H	α-helix	trans	-72.8	-41.1	-176.2	48.5	0	0	0	0	112.9	G426 Y430	G426-T428 PolarHBondContact O-N 3.01Å; T428-Y430 VanDerWaalsContact C-N 3.35Å
429	E	82.3	Confident	87.2	Confident	102 Å²	102	80.1 Å²	80.1	48%	0.477	39%	0.39	S	S	.	.	H	α-helix	trans	-71.1	-33.4	175.1	-64.3	-168	-169.3	0	0	111.1	K295	K295-E429 WeakPolarHBondContact CE-OE1 3.2Å; K295-E429 IonicContact NZ-OE1 2.73Å; K295-E429 PolarHBondContact NZ-OE1 3.46Å
430	Y	88.4	Confident	87.4	Confident	12 Å²	12	81.2 Å²	81.2	5%	0.047	39%	0.392	C	S	.	.	H	α-helix	trans	-63	-50.7	177	-177.7	-90.7	0	0	0	113	E418 E421 M422 G426 T428 H432 D433 N436 F440	E418-Y430 WeakPolarHBondContact OE2-CE2 3.36Å; E418-Y430 PolarHBondContact OE2-OH 3.07Å; E421-Y430 HydrophobicContact CG-CD2 4.39Å; M422-Y430 HydrophobicContact CB-CD2 4.39Å; M422-Y430 HydrophobicContact CE-CD1 4.08Å; M422-Y430 HydrophobicContact CE-CE1 3.77Å; G426-Y430 WeakPolarHBondContact O-CB 3.13Å; G426-Y430 PolarHBondContact O-N 3.07Å; T428-Y430 VanDerWaalsContact C-N 3.35Å; Y430-H432 PolarHBondContact O-N 3.11Å; Y430-D433 PolarHBondContact O-N 2.61Å; Y430-N436 HydrophobicContact CD1-CB 4.33Å; Y430-N436 HydrophobicContact CD2-CB 4.03Å; Y430-N436 VanDerWaalsContact CD2-ND2 3.32Å; Y430-N436 WeakPolarHBondContact CD2-ND2 3.08Å; Y430-N436 HydrophobicContact CE1-CB 4.06Å; Y430-N436 HydrophobicContact CE2-CB 3.73Å; Y430-N436 WeakPolarHBondContact CE2-ND2 3.37Å; Y430-N436 HydrophobicContact CG-CB 4.31Å; Y430-N436 PolarHBondContact OH-O 3.31Å; Y430-F440 HydrophobicContact CE1-CB 4.43Å
431	I	89.5	Confident	87.9	Confident	81 Å²	81	79.3 Å²	79.3	42%	0.415	39%	0.39	S	S	.	.	H	α-helix	trans	-65.4	-25.7	-177.7	-75	-178.1	0	0	0	113	F427 D433	F427-I431 HydrophobicContact CD1-CD1 4.09Å; F427-I431 HydrophobicContact CD2-CD1 4.25Å; F427-I431 HydrophobicContact CE1-CD1 3.5Å; F427-I431 VanDerWaalsContact CE1-CD1 3.5Å; F427-I431 HydrophobicContact CE2-CD1 3.69Å; F427-I431 HydrophobicContact CE2-CG1 4.44Å; F427-I431 HydrophobicContact CG-CD1 4.44Å; F427-I431 HydrophobicContact CZ-CD1 3.29Å; F427-I431 HydrophobicContact CZ-CG1 4.44Å; F427-I431 PolarHBondContact O-N 3.09Å; F427-I431 VanDerWaalsContact O-N 3.14Å; I431-D433 PolarHBondContact O-N 2.91Å
432	H	86.4	Confident	88.3	Confident	141 Å²	141	75 Å²	75	65%	0.653	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-14.4	179.2	-162.9	-58.9	0	0	0	112.8	Y430	Y430-H432 PolarHBondContact O-N 3.11Å
433	D	88.9	Confident	88.6	Confident	32 Å²	32	72.8 Å²	72.8	17%	0.171	36%	0.359	C	S	.	.			trans	-93.8	113	170.5	-152.8	-42.2	0	0	0	111.7	Y430 I431 W435 N436 L437 K645	Y430-D433 PolarHBondContact O-N 2.61Å; I431-D433 PolarHBondContact O-N 2.91Å; D433-W435 PolarHBondContact O-N 3.21Å; D433-W435 VanDerWaalsContact O-N 3.13Å; D433-W435 WeakPolarHBondContact OD1-CB 3.4Å; D433-W435 PolarHBondContact OD1-N 3.26Å; D433-W435 VanDerWaalsContact OD1-N 3.08Å; D433-N436 HydrophobicContact CB-CB 4.16Å; D433-N436 WeakPolarHBondContact O-CB 3.26Å; D433-N436 PolarHBondContact O-N 3.24Å; D433-L437 PolarHBondContact O-N 3.37Å; D433-L437 VanDerWaalsContact O-N 3.09Å; D433-K645 IonicContact OD2-NZ 3.01Å; D433-K645 PolarHBondContact OD2-NZ 2.6Å
434	W	89.4	Confident	89.1	Confident	174 Å²	174	65.4 Å²	65.4	66%	0.659	34%	0.339	S	S	*	.	H	α-helix	trans	-56.9	-27.3	177.1	-66.3	99.2	0	0	0	113.3	L437 M438 L515	W434-L437 HydrophobicContact CE3-CD2 4.14Å; W434-L437 HydrophobicContact CZ3-CD2 4.2Å; W434-M438 PolarHBondContact O-N 3.09Å; W434-M438 VanDerWaalsContact O-N 3.1Å; W434-L515 HydrophobicContact CZ2-CD2 4.45Å
435	W	91.8	Very high	89.8	Confident	62 Å²	62	62 Å²	62	24%	0.235	32%	0.321	C	S	.	.	H	α-helix	trans	-70.3	-40.2	175.1	-68.9	113	0	0	0	112.5	D433 M438 D439 I494	D433-W435 PolarHBondContact O-N 3.21Å; D433-W435 VanDerWaalsContact O-N 3.13Å; D433-W435 WeakPolarHBondContact OD1-CB 3.4Å; D433-W435 PolarHBondContact OD1-N 3.26Å; D433-W435 VanDerWaalsContact OD1-N 3.08Å; W435-M438 HydrophobicContact CE3-CE 3.82Å; W435-M438 HydrophobicContact CE3-SD 4.49Å; W435-M438 HydrophobicContact CZ3-CE 3.85Å; W435-M438 HydrophobicContact CZ3-SD 4.36Å; W435-M438 WeakPolarHBondContact O-CB 3.46Å; W435-M438 PolarHBondContact O-N 2.88Å; W435-D439 PolarHBondContact O-N 3.39Å; W435-I494 HydrophobicContact CH2-CB 3.93Å; W435-I494 HydrophobicContact CH2-CG2 3.91Å; W435-I494 HydrophobicContact CZ2-CG2 4.46Å
436	N	92.2	Very high	90.8	Very high	13 Å²	13	60.3 Å²	60.3	7%	0.07	30%	0.302	C	S	.	.	H	α-helix	trans	-69.4	-38.4	178.9	-68.8	28.9	0	0	0	110.1	E421 Y430 D433 M438 D439 F440	E421-N436 PolarHBondContact OE1-ND2 3.41Å; Y430-N436 HydrophobicContact CD1-CB 4.33Å; Y430-N436 HydrophobicContact CD2-CB 4.03Å; Y430-N436 VanDerWaalsContact CD2-ND2 3.32Å; Y430-N436 WeakPolarHBondContact CD2-ND2 3.08Å; Y430-N436 HydrophobicContact CE1-CB 4.06Å; Y430-N436 HydrophobicContact CE2-CB 3.73Å; Y430-N436 WeakPolarHBondContact CE2-ND2 3.37Å; Y430-N436 HydrophobicContact CG-CB 4.31Å; Y430-N436 PolarHBondContact OH-O 3.31Å; D433-N436 HydrophobicContact CB-CB 4.16Å; D433-N436 WeakPolarHBondContact O-CB 3.26Å; D433-N436 PolarHBondContact O-N 3.24Å; N436-M438 VanDerWaalsContact C-N 3.31Å; N436-M438 PolarHBondContact O-N 2.96Å; N436-D439 PolarHBondContact O-N 2.94Å; N436-F440 WeakPolarHBondContact O-CB 3.2Å; N436-F440 PolarHBondContact O-N 3.18Å
437	L	92.5	Very high	91.3	Very high	74 Å²	74	63.9 Å²	63.9	39%	0.387	32%	0.315	S	S	.	.	H	α-helix	trans	-60.3	-39.2	170.5	-176.1	62.8	0	0	0	112.4	D433 W434 A441	D433-L437 PolarHBondContact O-N 3.37Å; D433-L437 VanDerWaalsContact O-N 3.09Å; W434-L437 HydrophobicContact CE3-CD2 4.14Å; W434-L437 HydrophobicContact CZ3-CD2 4.2Å; L437-A441 WeakPolarHBondContact O-CB 3.43Å; L437-A441 PolarHBondContact O-N 2.9Å
438	M	92.8	Very high	91.7	Very high	37 Å²	37	59 Å²	59	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-70	-38.2	176.1	-167.4	-174.4	76.6	0	0	112.5	W434 W435 N436 A441 M442 L488 R492	W434-M438 PolarHBondContact O-N 3.09Å; W434-M438 VanDerWaalsContact O-N 3.1Å; W435-M438 HydrophobicContact CE3-CE 3.82Å; W435-M438 HydrophobicContact CE3-SD 4.49Å; W435-M438 HydrophobicContact CZ3-CE 3.85Å; W435-M438 HydrophobicContact CZ3-SD 4.36Å; W435-M438 WeakPolarHBondContact O-CB 3.46Å; W435-M438 PolarHBondContact O-N 2.88Å; N436-M438 VanDerWaalsContact C-N 3.31Å; N436-M438 PolarHBondContact O-N 2.96Å; M438-A441 PolarHBondContact O-N 3.06Å; M438-M442 WeakPolarHBondContact O-CB 3.41Å; M438-M442 PolarHBondContact O-N 3.43Å; M438-L488 HydrophobicContact CG-CD2 4.35Å; M438-R492 HydrophobicContact CE-CB 3.76Å; M438-R492 HydrophobicContact CE-CG 4.27Å
439	D	93.3	Very high	92.2	Very high	9 Å²	9	53.7 Å²	53.7	5%	0.048	27%	0.265	C	S	.	.	H	α-helix	trans	-69	-38.3	175.9	-75.1	-17	0	0	0	111.8	W435 N436 M442 N443 R492	W435-D439 PolarHBondContact O-N 3.39Å; N436-D439 PolarHBondContact O-N 2.94Å; D439-M442 HydrophobicContact CB-CE 4.44Å; D439-M442 PolarHBondContact O-N 3.09Å; D439-N443 VanDerWaalsContact O-CB 3.3Å; D439-N443 WeakPolarHBondContact O-CB 3.45Å; D439-N443 VanDerWaalsContact O-CG 3.3Å; D439-N443 PolarHBondContact O-N 3.15Å; D439-N443 PolarHBondContact O-ND2 3.29Å; D439-R492 WeakPolarHBondContact OD1-CD 3.25Å; D439-R492 IonicContact OD1-CZ 3.23Å; D439-R492 IonicContact OD1-NE 3.75Å; D439-R492 PolarHBondContact OD1-NE 2.96Å; D439-R492 IonicContact OD2-CZ 3.46Å; D439-R492 IonicContact OD2-NE 2.92Å; D439-R492 PolarHBondContact OD2-NE 3.29Å; D439-R492 IonicContact OD2-NH2 2.77Å; D439-R492 PolarHBondContact OD2-NH2 3.11Å
440	F	94.6	Very high	92.7	Very high	110 Å²	110	51.5 Å²	51.5	48%	0.482	26%	0.256	S	S	.	.	H	α-helix	trans	-59.4	-47	169.5	179.4	-97.9	0	0	0	111.6	M422 Y430 N436 N443 S444	M422-F440 HydrophobicContact CE-CD2 4.45Å; Y430-F440 HydrophobicContact CE1-CB 4.43Å; N436-F440 WeakPolarHBondContact O-CB 3.2Å; N436-F440 PolarHBondContact O-N 3.18Å; F440-N443 PolarHBondContact O-N 2.64Å; F440-S444 WeakPolarHBondContact O-CB 3.46Å; F440-S444 PolarHBondContact O-N 2.83Å; F440-S444 PolarHBondContact O-OG 3.3Å; F440-S444 VanDerWaalsContact O-OG 3.12Å
441	A	94.7	Very high	92.9	Very high	35 Å²	35	53.5 Å²	53.5	29%	0.289	27%	0.272	S	S	.	.	H	α-helix	trans	-60.5	-47.8	175.6	0	0	0	0	0	111.7	L437 M438 N443 S444 L445 L488	L437-A441 WeakPolarHBondContact O-CB 3.43Å; L437-A441 PolarHBondContact O-N 2.9Å; M438-A441 PolarHBondContact O-N 3.06Å; A441-N443 PolarHBondContact O-N 3.16Å; A441-S444 PolarHBondContact O-N 2.88Å; A441-S444 PolarHBondContact O-OG 3.24Å; A441-L445 WeakPolarHBondContact O-CG 3.31Å; A441-L445 PolarHBondContact O-N 2.69Å; A441-L445 VanDerWaalsContact O-N 3.08Å; A441-L488 HydrophobicContact CB-CD1 4.48Å
442	M	95.2	Very high	93.1	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.02	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-49.3	175.3	177.1	-170.9	66.8	0	0	112.1	M438 D439 L445 Y446 L488 S489	M438-M442 WeakPolarHBondContact O-CB 3.41Å; M438-M442 PolarHBondContact O-N 3.43Å; D439-M442 HydrophobicContact CB-CE 4.44Å; D439-M442 PolarHBondContact O-N 3.09Å; M442-L445 PolarHBondContact O-N 3.03Å; M442-Y446 HydrophobicContact CG-CD2 3.84Å; M442-Y446 HydrophobicContact CG-CE2 3.49Å; M442-Y446 VanDerWaalsContact CG-CE2 3.49Å; M442-Y446 VanDerWaalsContact O-CD2 3.28Å; M442-Y446 WeakPolarHBondContact O-CD2 3.31Å; M442-Y446 PolarHBondContact O-N 2.79Å; M442-Y446 HydrophobicContact SD-CE2 4.04Å; M442-L488 HydrophobicContact CB-CB 4.18Å; M442-L488 HydrophobicContact CB-CD1 4.44Å; M442-L488 HydrophobicContact CG-CB 4.41Å; M442-S489 VanDerWaalsContact SD-CB 3.51Å
443	N	94.6	Very high	93.3	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.053	24%	0.243	C	C	.	.	H	α-helix	trans	-69.4	-36.2	-177.6	-74.3	-40.3	0	0	0	112.7	F414 I415 E418 D439 F440 A441 Y446 L447	F414-N443 WeakPolarHBondContact CB-OD1 3.48Å; I415-N443 HydrophobicContact CG1-CB 4.1Å; E418-N443 WeakPolarHBondContact CG-ND2 3.14Å; D439-N443 VanDerWaalsContact O-CB 3.3Å; D439-N443 WeakPolarHBondContact O-CB 3.45Å; D439-N443 VanDerWaalsContact O-CG 3.3Å; D439-N443 PolarHBondContact O-N 3.15Å; D439-N443 PolarHBondContact O-ND2 3.29Å; F440-N443 PolarHBondContact O-N 2.64Å; A441-N443 PolarHBondContact O-N 3.16Å; N443-Y446 PolarHBondContact O-N 3.43Å; N443-L447 WeakPolarHBondContact O-CB 3.5Å; N443-L447 PolarHBondContact O-N 3.45Å
444	S	95.4	Very high	93.4	Very high	53 Å²	53	50.6 Å²	50.6	37%	0.371	26%	0.259	S	S	.	.	H	α-helix	trans	-64.9	-38.4	173.7	64.5	0	0	0	0	112.4	F440 A441 L447 A448	F440-S444 WeakPolarHBondContact O-CB 3.46Å; F440-S444 PolarHBondContact O-N 2.83Å; F440-S444 PolarHBondContact O-OG 3.3Å; F440-S444 VanDerWaalsContact O-OG 3.12Å; A441-S444 PolarHBondContact O-N 2.88Å; A441-S444 PolarHBondContact O-OG 3.24Å; S444-L447 PolarHBondContact O-N 3.08Å; S444-A448 WeakPolarHBondContact O-CB 3.44Å; S444-A448 PolarHBondContact O-N 3.44Å
445	L	95.6	Very high	93.5	Very high	39 Å²	39	46 Å²	46	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-69.5	-36	174.6	-68.4	173.2	0	0	0	112.8	A441 M442 A448 T449 L481 I484 S485 L488	A441-L445 WeakPolarHBondContact O-CG 3.31Å; A441-L445 PolarHBondContact O-N 2.69Å; A441-L445 VanDerWaalsContact O-N 3.08Å; M442-L445 PolarHBondContact O-N 3.03Å; L445-A448 PolarHBondContact O-N 3.47Å; L445-T449 WeakPolarHBondContact O-CB 3.4Å; L445-T449 PolarHBondContact O-N 3.45Å; L445-T449 PolarHBondContact O-OG1 3.36Å; L445-L481 HydrophobicContact CD2-CD2 4.02Å; L445-I484 HydrophobicContact CD1-CG2 3.79Å; L445-S485 WeakPolarHBondContact CB-OG 3.45Å; L445-L488 HydrophobicContact CD1-CD1 3.79Å
446	Y	94.8	Very high	93.4	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-40.4	170.2	-78.3	-54	0	0	0	112.1	F377 L381 V411 M442 N443 T449 I450 F482 S485 N486 S489	F377-Y446 HydrophobicContact CZ-CE2 4.13Å; F377-Y446 AromaticContact CZ-CZ 3.93Å; L381-Y446 WeakPolarHBondContact CD1-OH 3.26Å; V411-Y446 HydrophobicContact CG1-CG 4.23Å; V411-Y446 HydrophobicContact CG2-CD1 4.32Å; V411-Y446 HydrophobicContact CG2-CD2 4.47Å; V411-Y446 HydrophobicContact CG2-CG 4.22Å; M442-Y446 HydrophobicContact CG-CD2 3.84Å; M442-Y446 HydrophobicContact CG-CE2 3.49Å; M442-Y446 VanDerWaalsContact CG-CE2 3.49Å; M442-Y446 VanDerWaalsContact O-CD2 3.28Å; M442-Y446 WeakPolarHBondContact O-CD2 3.31Å; M442-Y446 PolarHBondContact O-N 2.79Å; M442-Y446 HydrophobicContact SD-CE2 4.04Å; N443-Y446 PolarHBondContact O-N 3.43Å; Y446-T449 WeakPolarHBondContact O-CB 3.45Å; Y446-T449 PolarHBondContact O-N 3.13Å; Y446-I450 WeakPolarHBondContact O-CG1 3.25Å; Y446-I450 PolarHBondContact O-N 3.44Å; Y446-F482 HydrophobicContact CD1-CD2 4.28Å; Y446-F482 HydrophobicContact CD1-CE2 4.44Å; Y446-F482 HydrophobicContact CE1-CD2 4Å; Y446-F482 AromaticContact CE1-CE2 3.94Å; Y446-F482 HydrophobicContact CE1-CE2 3.94Å; Y446-S485 PolarHBondContact OH-O 3.43Å; Y446-N486 PolarHBondContact OH-OD1 3.05Å; Y446-N486 VanDerWaalsContact OH-OD1 3.13Å; Y446-S489 PolarHBondContact OH-OG 3.17Å
447	L	94.8	Very high	93.2	Very high	103 Å²	103	49.2 Å²	49.2	54%	0.539	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-43.9	175.6	-168.7	158.4	0	0	0	111.2	N443 S444 T449 I450 S451	N443-L447 WeakPolarHBondContact O-CB 3.5Å; N443-L447 PolarHBondContact O-N 3.45Å; S444-L447 PolarHBondContact O-N 3.08Å; L447-T449 VanDerWaalsContact C-N 3.32Å; L447-T449 PolarHBondContact O-N 2.67Å; L447-I450 PolarHBondContact O-N 3.19Å; L447-S451 PolarHBondContact O-N 2.94Å; L447-S451 PolarHBondContact O-OG 2.71Å
448	A	95.6	Very high	93.1	Very high	28 Å²	28	51.2 Å²	51.2	23%	0.231	28%	0.277	C	S	.	.	H	α-helix	trans	-60.9	-38.8	173.5	0	0	0	0	0	112.5	S444 L445 S451 L452 L481	S444-A448 WeakPolarHBondContact O-CB 3.44Å; S444-A448 PolarHBondContact O-N 3.44Å; L445-A448 PolarHBondContact O-N 3.47Å; A448-S451 WeakPolarHBondContact CA-OG 3.29Å; A448-S451 PolarHBondContact O-OG 2.84Å; A448-S451 VanDerWaalsContact O-OG 3.08Å; A448-L452 WeakPolarHBondContact O-CB 3.24Å; A448-L452 VanDerWaalsContact O-CG 3.28Å; A448-L452 WeakPolarHBondContact O-CG 3.44Å; A448-L452 PolarHBondContact O-N 3.14Å; A448-L481 HydrophobicContact CB-CD1 3.97Å
449	T	93.9	Very high	92.8	Very high	4 Å²	4	56.6 Å²	56.6	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-48	174.5	-60.8	0	0	0	0	111.4	L445 Y446 L447 K453 F482	L445-T449 WeakPolarHBondContact O-CB 3.4Å; L445-T449 PolarHBondContact O-N 3.45Å; L445-T449 PolarHBondContact O-OG1 3.36Å; Y446-T449 WeakPolarHBondContact O-CB 3.45Å; Y446-T449 PolarHBondContact O-N 3.13Å; L447-T449 VanDerWaalsContact C-N 3.32Å; L447-T449 PolarHBondContact O-N 2.67Å; T449-K453 HydrophobicContact CG2-CD 4.47Å; T449-K453 WeakPolarHBondContact O-CB 3.28Å; T449-K453 WeakPolarHBondContact O-CG 3.39Å; T449-K453 PolarHBondContact O-N 2.97Å; T449-F482 HydrophobicContact CG2-CB 3.76Å; T449-F482 HydrophobicContact CG2-CD2 4.03Å; T449-F482 HydrophobicContact CG2-CG 4.23Å; T449-F482 PolarHBondContact OG1-N 3.06Å
450	I	92.1	Very high	92.4	Very high	56 Å²	56	58.7 Å²	58.7	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-45.8	-179.1	-69.6	166.3	0	0	0	110.5	V411 Y446 L447 K453 I454	V411-I450 HydrophobicContact CG1-CD1 3.89Å; Y446-I450 WeakPolarHBondContact O-CG1 3.25Å; Y446-I450 PolarHBondContact O-N 3.44Å; L447-I450 PolarHBondContact O-N 3.19Å; I450-K453 PolarHBondContact O-N 3.35Å; I450-I454 HydrophobicContact CG2-CD1 3.8Å; I450-I454 VanDerWaalsContact O-CG1 3.31Å; I450-I454 WeakPolarHBondContact O-CG1 3.04Å; I450-I454 PolarHBondContact O-N 3.39Å
451	S	93.8	Very high	91.4	Very high	54 Å²	54	61.5 Å²	61.5	38%	0.378	33%	0.327	S	S	.	.	H	α-helix	trans	-64.4	-43.5	179.5	62.1	0	0	0	0	112.2	L447 A448 K453 I454 V455	L447-S451 PolarHBondContact O-N 2.94Å; L447-S451 PolarHBondContact O-OG 2.71Å; A448-S451 WeakPolarHBondContact CA-OG 3.29Å; A448-S451 PolarHBondContact O-OG 2.84Å; A448-S451 VanDerWaalsContact O-OG 3.08Å; S451-K453 PolarHBondContact O-N 3.21Å; S451-I454 PolarHBondContact O-N 3.43Å; S451-V455 WeakPolarHBondContact O-CG2 3.48Å; S451-V455 PolarHBondContact O-N 3.21Å
452	L	92.9	Very high	90.5	Very high	43 Å²	43	61.1 Å²	61.1	23%	0.225	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-37.1	174.7	-73.7	171.3	0	0	0	112.9	A448 V455 A456 P474 I477 A478 L481	A448-L452 WeakPolarHBondContact O-CB 3.24Å; A448-L452 VanDerWaalsContact O-CG 3.28Å; A448-L452 WeakPolarHBondContact O-CG 3.44Å; A448-L452 PolarHBondContact O-N 3.14Å; L452-V455 PolarHBondContact O-N 3.11Å; L452-A456 WeakPolarHBondContact O-CB 3.38Å; L452-A456 PolarHBondContact O-N 2.89Å; L452-P474 HydrophobicContact CD2-CB 4.24Å; L452-I477 HydrophobicContact CD1-CB 4.15Å; L452-I477 HydrophobicContact CD1-CG2 3.63Å; L452-A478 HydrophobicContact CB-CB 3.9Å; L452-L481 HydrophobicContact CD1-CD1 3.87Å
453	K	90.3	Very high	89.6	Confident	51 Å²	51	65.8 Å²	65.8	22%	0.222	36%	0.36	C	S	.	.	H	α-helix	trans	-65.9	-40.8	173.6	-80.9	-171.6	165.5	-173.7	0	112.6	E404 T449 I450 S451 A456 Y457 A478	E404-K453 IonicContact OE1-NZ 2.77Å; E404-K453 PolarHBondContact OE1-NZ 3.44Å; E404-K453 IonicContact OE2-NZ 2.68Å; E404-K453 PolarHBondContact OE2-NZ 3.02Å; T449-K453 HydrophobicContact CG2-CD 4.47Å; T449-K453 WeakPolarHBondContact O-CB 3.28Å; T449-K453 WeakPolarHBondContact O-CG 3.39Å; T449-K453 PolarHBondContact O-N 2.97Å; I450-K453 PolarHBondContact O-N 3.35Å; S451-K453 PolarHBondContact O-N 3.21Å; K453-A456 PolarHBondContact O-N 3.16Å; K453-Y457 WeakPolarHBondContact O-CB 2.89Å; K453-Y457 PolarHBondContact O-N 3.43Å; K453-A478 HydrophobicContact CG-CB 3.92Å
454	I	90.9	Very high	88.9	Confident	99 Å²	99	72 Å²	72	51%	0.508	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-46	174.2	-67.9	165	0	0	0	110.4	I450 S451 A456 Y457 V458	I450-I454 HydrophobicContact CG2-CD1 3.8Å; I450-I454 VanDerWaalsContact O-CG1 3.31Å; I450-I454 WeakPolarHBondContact O-CG1 3.04Å; I450-I454 PolarHBondContact O-N 3.39Å; S451-I454 PolarHBondContact O-N 3.43Å; I454-A456 VanDerWaalsContact C-N 3.34Å; I454-A456 PolarHBondContact O-N 2.99Å; I454-Y457 PolarHBondContact O-N 3.49Å; I454-V458 HydrophobicContact CG2-CG2 4.37Å; I454-V458 WeakPolarHBondContact O-CG2 3.46Å; I454-V458 PolarHBondContact O-N 3.19Å
455	V	92.1	Very high	88.3	Confident	77 Å²	77	71.9 Å²	71.9	47%	0.467	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-42.3	176.5	169.9	0	0	0	0	111.5	S451 L452 K459	S451-V455 WeakPolarHBondContact O-CG2 3.48Å; S451-V455 PolarHBondContact O-N 3.21Å; L452-V455 PolarHBondContact O-N 3.11Å; V455-K459 VanDerWaalsContact O-CB 3.3Å; V455-K459 WeakPolarHBondContact O-CB 3.42Å; V455-K459 PolarHBondContact O-N 2.83Å; V455-K459 VanDerWaalsContact O-N 3.08Å
456	A	89.8	Confident	87.7	Confident	2 Å²	2	74.7 Å²	74.7	2%	0.017	39%	0.389	C	S	.	.	H	α-helix	trans	-61.7	-48.2	176	0	0	0	0	0	111.6	L452 K453 I454 V458 K459 Y460 P474	L452-A456 WeakPolarHBondContact O-CB 3.38Å; L452-A456 PolarHBondContact O-N 2.89Å; K453-A456 PolarHBondContact O-N 3.16Å; I454-A456 VanDerWaalsContact C-N 3.34Å; I454-A456 PolarHBondContact O-N 2.99Å; A456-V458 PolarHBondContact O-N 3.03Å; A456-K459 PolarHBondContact O-N 3.42Å; A456-Y460 WeakPolarHBondContact O-CB 3.24Å; A456-Y460 PolarHBondContact O-N 3.18Å; A456-P474 HydrophobicContact CB-CB 4.45Å; A456-P474 HydrophobicContact CB-CG 4.26Å
457	Y	88.1	Confident	87.2	Confident	141 Å²	141	83.8 Å²	83.8	55%	0.553	43%	0.431	S	S	*	.	H	α-helix	trans	-63.6	-36.8	179.5	178.7	-103.6	0	0	0	113.7	P399 K453 I454	P399-Y457 HydrophobicContact CB-CE2 4.25Å; K453-Y457 WeakPolarHBondContact O-CB 2.89Å; K453-Y457 PolarHBondContact O-N 3.43Å; I454-Y457 PolarHBondContact O-N 3.49Å
458	V	89.2	Confident	86.7	Confident	116 Å²	116	84.9 Å²	84.9	70%	0.703	43%	0.433	S	S	*	.	H	α-helix	trans	-76.9	-36.1	179.7	171.8	0	0	0	0	112.3	I454 A456	I454-V458 HydrophobicContact CG2-CG2 4.37Å; I454-V458 WeakPolarHBondContact O-CG2 3.46Å; I454-V458 PolarHBondContact O-N 3.19Å; A456-V458 PolarHBondContact O-N 3.03Å
459	K	87.4	Confident	86.4	Confident	151 Å²	151	84.6 Å²	84.6	66%	0.657	43%	0.426	S	S	*	.	H	α-helix	trans	-96.6	-28.2	-171.3	-174.8	178	172.7	-163.7	0	114.1	V455 A456	V455-K459 VanDerWaalsContact O-CB 3.3Å; V455-K459 WeakPolarHBondContact O-CB 3.42Å; V455-K459 PolarHBondContact O-N 2.83Å; V455-K459 VanDerWaalsContact O-N 3.08Å; A456-K459 PolarHBondContact O-N 3.42Å
460	Y	84.1	Confident	86.1	Confident	52 Å²	52	91.3 Å²	91.3	20%	0.204	46%	0.457	C	S	.	.			trans	-117.8	128.3	-174.2	-59.7	-98.7	0	0	0	110.1	A456 H473 P474	A456-Y460 WeakPolarHBondContact O-CB 3.24Å; A456-Y460 PolarHBondContact O-N 3.18Å; Y460-H473 AromaticContact CD1-NE2 3.55Å; Y460-H473 AromaticContact CE1-CD2 3.95Å; Y460-H473 AromaticContact CE1-NE2 3.68Å; Y460-H473 AromaticContact CG-NE2 3.89Å; Y460-P474 HydrophobicContact CD2-CG 4.32Å; Y460-P474 HydrophobicContact CE2-CG 3.73Å
461	N	75	Confident	85.8	Confident	169 Å²	169	95.7 Å²	95.7	90%	0.904	48%	0.479	S	S	*	.			trans	-140.7	36.9	-179	-167.7	19	0	0	0	110.4
462	G	75.5	Confident	85.6	Confident	28 Å²	28	102.3 Å²	102.3	29%	0.289	50%	0.495	S	S	.	.			trans	-120.6	136.8	-172.4	0	0	0	0	0	112.1	Q396	Q396-G462 WeakPolarHBondContact CB-O 3.44Å; Q396-G462 PolarHBondContact N-O 3.04Å
463	S	76	Confident	85.5	Confident	101 Å²	101	100.5 Å²	100.5	71%	0.706	49%	0.486	S	S	*	.	B	Isolated β-bridge	trans	-87.3	113.1	167.5	40.8	0	0	0	0	110.2	H394	H394-S463 CarbonylContact O-C 3.52Å; H394-S463 WeakPolarHBondContact O-CA 3.42Å
464	R	80.8	Confident	85.6	Confident	141 Å²	141	98.9 Å²	98.9	53%	0.532	48%	0.48	S	S	.	.			trans	-137	140.9	172.4	-72.1	-167.3	-177.4	-176.1	2	109.5	H394 W469	H394-R464 CarbonylContact C-O 3.13Å; H394-R464 CarbonylContact O-C 3.56Å; H394-R464 PolarHBondContact O-N 3.29Å; R464-W469 PolarHBondContact O-NE1 3.27Å
465	P	81.9	Confident	85.5	Confident	50 Å²	50	94.4 Å²	94.4	33%	0.325	46%	0.458	S	S	.	.			trans	-58	143	176.4	28.2	-35.5	0	0	0	110.4	E467 E468 W469	P465-E467 PolarHBondContact O-N 3.23Å; P465-E467 VanDerWaalsContact O-N 3.12Å; P465-E468 HydrophobicContact CG-CB 4.26Å; P465-E468 HydrophobicContact CG-CG 3.8Å; P465-E468 WeakPolarHBondContact CG-OE1 3.5Å; P465-E468 PolarHBondContact O-N 2.97Å; P465-W469 PolarHBondContact O-NE1 2.99Å
466	R	82.8	Confident	85.4	Confident	99 Å²	99	92.6 Å²	92.6	37%	0.374	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-62.3	-24.4	-170.1	-176	174	172	128.5	0.1	113.4	E468 W469 E479	R466-E468 VanDerWaalsContact C-N 3.33Å; R466-W469 HydrophobicContact CG-CD2 4.42Å; R466-W469 HydrophobicContact CG-CE3 4.36Å; R466-W469 WeakPolarHBondContact O-CB 3.45Å; R466-W469 PolarHBondContact O-N 2.85Å; R466-E479 IonicContact CZ-OE2 2.8Å; R466-E479 VanDerWaalsContact NH1-CD 3.35Å; R466-E479 IonicContact NH1-OE1 2.73Å; R466-E479 PolarHBondContact NH1-OE1 3.14Å; R466-E479 VanDerWaalsContact NH1-OE1 3.07Å; R466-E479 IonicContact NH1-OE2 3.87Å; R466-E479 PolarHBondContact NH1-OE2 2.66Å; R466-E479 IonicContact NH2-OE2 3.07Å; R466-E479 PolarHBondContact NH2-OE2 3.14Å
467	E	83.6	Confident	85.6	Confident	194 Å²	194	95.1 Å²	95.1	91%	0.907	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-70.8	-25.6	177.9	-66.1	166.3	-159.3	0	0	112.9	P465 W469	P465-E467 PolarHBondContact O-N 3.23Å; P465-E467 VanDerWaalsContact O-N 3.12Å; E467-W469 VanDerWaalsContact C-N 3.33Å
468	E	85.7	Confident	85.8	Confident	126 Å²	126	88.4 Å²	88.4	59%	0.589	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-89.3	5	178.1	-67.1	175.8	-171.1	0	0	113.1	P465 R466	P465-E468 HydrophobicContact CG-CB 4.26Å; P465-E468 HydrophobicContact CG-CG 3.8Å; P465-E468 WeakPolarHBondContact CG-OE1 3.5Å; P465-E468 PolarHBondContact O-N 2.97Å; R466-E468 VanDerWaalsContact C-N 3.33Å
469	W	87.8	Confident	85.8	Confident	23 Å²	23	86.1 Å²	86.1	9%	0.087	41%	0.413	C	S	.	.	S	Bend	trans	-79.2	142.1	-179	-67	14	0	0	0	110.9	Q396 R464 P465 R466 E467 H473 T475 L476	Q396-W469 HydrophobicContact CB-CZ2 4.48Å; Q396-W469 HydrophobicContact CG-CD2 4.22Å; Q396-W469 HydrophobicContact CG-CZ2 3.72Å; R464-W469 PolarHBondContact O-NE1 3.27Å; P465-W469 PolarHBondContact O-NE1 2.99Å; R466-W469 HydrophobicContact CG-CD2 4.42Å; R466-W469 HydrophobicContact CG-CE3 4.36Å; R466-W469 WeakPolarHBondContact O-CB 3.45Å; R466-W469 PolarHBondContact O-N 2.85Å; E467-W469 VanDerWaalsContact C-N 3.33Å; W469-H473 HydrophobicContact CB-CB 4.5Å; W469-H473 AromaticContact CE3-ND1 3.59Å; W469-H473 AromaticContact CZ3-ND1 3.94Å; W469-T475 HydrophobicContact CH2-CG2 4.3Å; W469-T475 HydrophobicContact CZ3-CG2 3.99Å; W469-L476 HydrophobicContact CB-CD1 4.37Å; W469-L476 HydrophobicContact CE3-CD1 4.31Å; W469-L476 HydrophobicContact CE3-CD2 3.76Å; W469-L476 HydrophobicContact CE3-CG 3.85Å; W469-L476 HydrophobicContact CZ3-CD2 3.98Å; W469-L476 HydrophobicContact CZ3-CG 4.34Å
470	E	87.6	Confident	86.1	Confident	144 Å²	144	81.4 Å²	81.4	67%	0.673	40%	0.402	S	S	*	.			trans	-59.5	140.4	172.6	-66.7	174.6	-174.8	0	0	110.8	W472 H473	E470-W472 PolarHBondContact O-N 3.25Å; E470-H473 WeakPolarHBondContact O-CB 3.2Å; E470-H473 PolarHBondContact O-N 3.44Å
471	M	86.9	Confident	86.6	Confident	149 Å²	149	80.8 Å²	80.8	73%	0.734	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-32	-176.5	177.1	174.1	156.8	0	0	113.8
472	W	90.2	Very high	87.4	Confident	192 Å²	192	74.5 Å²	74.5	73%	0.727	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	21.1	179.3	-59.9	105.4	0	0	0	113.5	E470 I477	E470-W472 PolarHBondContact O-N 3.25Å; W472-I477 HydrophobicContact CB-CD1 4.43Å; W472-I477 HydrophobicContact CE3-CD1 4.14Å; W472-I477 WeakPolarHBondContact O-CD1 3.19Å
473	H	90.4	Very high	88.3	Confident	5 Å²	5	75.6 Å²	75.6	2%	0.023	37%	0.373	C	S	.	.			trans	-59.2	131.7	178.9	-174.2	-99.5	0	0	0	111.2	Y460 W469 E470 T475 L476 I477	Y460-H473 AromaticContact CD1-NE2 3.55Å; Y460-H473 AromaticContact CE1-CD2 3.95Å; Y460-H473 AromaticContact CE1-NE2 3.68Å; Y460-H473 AromaticContact CG-NE2 3.89Å; W469-H473 HydrophobicContact CB-CB 4.5Å; W469-H473 AromaticContact CE3-ND1 3.59Å; W469-H473 AromaticContact CZ3-ND1 3.94Å; E470-H473 WeakPolarHBondContact O-CB 3.2Å; E470-H473 PolarHBondContact O-N 3.44Å; H473-T475 PolarHBondContact CE1-OG1 3.39Å; H473-T475 PolarHBondContact ND1-OG1 3.32Å; H473-T475 PolarHBondContact O-N 2.82Å; H473-T475 VanDerWaalsContact O-N 3.09Å; H473-L476 HydrophobicContact CB-CD1 4.19Å; H473-L476 HydrophobicContact CB-CG 4.3Å; H473-L476 WeakPolarHBondContact O-CB 3.42Å; H473-L476 PolarHBondContact O-N 3.49Å; H473-I477 PolarHBondContact O-N 2.94Å
474	P	91.3	Very high	89.1	Confident	17 Å²	17	74.7 Å²	74.7	11%	0.11	36%	0.36	C	S	.	.	H	α-helix	trans	-60.5	-29.1	-169.3	21.1	-33.4	0	0	0	113.9	L452 A456 Y460 A478	L452-P474 HydrophobicContact CD2-CB 4.24Å; A456-P474 HydrophobicContact CB-CB 4.45Å; A456-P474 HydrophobicContact CB-CG 4.26Å; Y460-P474 HydrophobicContact CD2-CG 4.32Å; Y460-P474 HydrophobicContact CE2-CG 3.73Å; P474-A478 VanDerWaalsContact O-CB 3.28Å; P474-A478 WeakPolarHBondContact O-CB 3.48Å; P474-A478 PolarHBondContact O-N 2.73Å
475	T	89.3	Confident	89.8	Confident	5 Å²	5	68 Å²	68	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-38.1	173.5	-49	0	0	0	0	112.5	W469 H473 A478 E479	W469-T475 HydrophobicContact CH2-CG2 4.3Å; W469-T475 HydrophobicContact CZ3-CG2 3.99Å; H473-T475 PolarHBondContact CE1-OG1 3.39Å; H473-T475 PolarHBondContact ND1-OG1 3.32Å; H473-T475 PolarHBondContact O-N 2.82Å; H473-T475 VanDerWaalsContact O-N 3.09Å; T475-A478 PolarHBondContact O-N 3.32Å; T475-E479 WeakPolarHBondContact O-CG 3.47Å; T475-E479 PolarHBondContact O-N 3.02Å
476	L	90.4	Very high	90.3	Very high	40 Å²	40	67.3 Å²	67.3	21%	0.209	33%	0.328	C	S	.	.	H	α-helix	trans	-69.7	-41.3	178.4	-61.6	176.5	0	0	0	111.1	W469 H473 E479 A480	W469-L476 HydrophobicContact CB-CD1 4.37Å; W469-L476 HydrophobicContact CE3-CD1 4.31Å; W469-L476 HydrophobicContact CE3-CD2 3.76Å; W469-L476 HydrophobicContact CE3-CG 3.85Å; W469-L476 HydrophobicContact CZ3-CD2 3.98Å; W469-L476 HydrophobicContact CZ3-CG 4.34Å; H473-L476 HydrophobicContact CB-CD1 4.19Å; H473-L476 HydrophobicContact CB-CG 4.3Å; H473-L476 WeakPolarHBondContact O-CB 3.42Å; H473-L476 PolarHBondContact O-N 3.49Å; L476-E479 PolarHBondContact O-N 2.72Å; L476-A480 WeakPolarHBondContact O-CB 3.33Å; L476-A480 PolarHBondContact O-N 3.17Å
477	I	93.6	Very high	90.9	Very high	55 Å²	55	67.3 Å²	67.3	28%	0.282	34%	0.335	S	S	.	.	H	α-helix	trans	-63.6	-45.4	175.2	-56.5	175.3	0	0	0	109.7	L452 W472 H473 E479 A480 L481	L452-I477 HydrophobicContact CD1-CB 4.15Å; L452-I477 HydrophobicContact CD1-CG2 3.63Å; W472-I477 HydrophobicContact CB-CD1 4.43Å; W472-I477 HydrophobicContact CE3-CD1 4.14Å; W472-I477 WeakPolarHBondContact O-CD1 3.19Å; H473-I477 PolarHBondContact O-N 2.94Å; I477-E479 PolarHBondContact O-N 3.21Å; I477-A480 PolarHBondContact O-N 3.22Å; I477-L481 HydrophobicContact CG2-CD1 4.05Å; I477-L481 HydrophobicContact CG2-CG 4.21Å; I477-L481 WeakPolarHBondContact O-CG 3.37Å; I477-L481 PolarHBondContact O-N 3.08Å
478	A	91.6	Very high	91.4	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-44.2	175.4	0	0	0	0	0	112.8	L452 K453 P474 T475 F482	L452-A478 HydrophobicContact CB-CB 3.9Å; K453-A478 HydrophobicContact CG-CB 3.92Å; P474-A478 VanDerWaalsContact O-CB 3.28Å; P474-A478 WeakPolarHBondContact O-CB 3.48Å; P474-A478 PolarHBondContact O-N 2.73Å; T475-A478 PolarHBondContact O-N 3.32Å; A478-F482 WeakPolarHBondContact O-CB 3.29Å; A478-F482 PolarHBondContact O-N 3.3Å
479	E	90.1	Very high	91.7	Very high	68 Å²	68	53.9 Å²	53.9	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-62.3	-40.7	175.2	-76.3	179	-158	0	0	112.2	R466 T475 L476 I477 F482 A483	R466-E479 IonicContact CZ-OE2 2.8Å; R466-E479 VanDerWaalsContact NH1-CD 3.35Å; R466-E479 IonicContact NH1-OE1 2.73Å; R466-E479 PolarHBondContact NH1-OE1 3.14Å; R466-E479 VanDerWaalsContact NH1-OE1 3.07Å; R466-E479 IonicContact NH1-OE2 3.87Å; R466-E479 PolarHBondContact NH1-OE2 2.66Å; R466-E479 IonicContact NH2-OE2 3.07Å; R466-E479 PolarHBondContact NH2-OE2 3.14Å; T475-E479 WeakPolarHBondContact O-CG 3.47Å; T475-E479 PolarHBondContact O-N 3.02Å; L476-E479 PolarHBondContact O-N 2.72Å; I477-E479 PolarHBondContact O-N 3.21Å; E479-F482 PolarHBondContact O-N 3.27Å; E479-A483 WeakPolarHBondContact O-CB 3.47Å; E479-A483 PolarHBondContact O-N 2.99Å
480	A	93.1	Very high	92	Very high	51 Å²	51	55.6 Å²	55.6	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-67	-47.1	177.9	0	0	0	0	0	112.4	L476 I477 F482 A483 I484	L476-A480 WeakPolarHBondContact O-CB 3.33Å; L476-A480 PolarHBondContact O-N 3.17Å; I477-A480 PolarHBondContact O-N 3.22Å; A480-F482 VanDerWaalsContact C-N 3.32Å; A480-F482 PolarHBondContact O-N 2.91Å; A480-A483 PolarHBondContact O-N 3.37Å; A480-I484 WeakPolarHBondContact O-CG1 3.48Å; A480-I484 PolarHBondContact O-N 2.95Å
481	L	94.6	Very high	92.2	Very high	40 Å²	40	52.4 Å²	52.4	21%	0.209	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-36.2	176.1	-62.8	-177.5	0	0	0	111.7	L445 A448 L452 I477 I484 S485	L445-L481 HydrophobicContact CD2-CD2 4.02Å; A448-L481 HydrophobicContact CB-CD1 3.97Å; L452-L481 HydrophobicContact CD1-CD1 3.87Å; I477-L481 HydrophobicContact CG2-CD1 4.05Å; I477-L481 HydrophobicContact CG2-CG 4.21Å; I477-L481 WeakPolarHBondContact O-CG 3.37Å; I477-L481 PolarHBondContact O-N 3.08Å; L481-I484 PolarHBondContact O-N 3.41Å; L481-S485 WeakPolarHBondContact O-CB 3.38Å; L481-S485 PolarHBondContact O-N 3.3Å; L481-S485 PolarHBondContact O-OG 2.85Å
482	F	92.4	Very high	92.5	Very high	37 Å²	37	47.7 Å²	47.7	16%	0.162	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-44.8	173	-173.3	-121	0	0	0	111.5	L381 Y446 T449 A478 E479 A480 I484 S485 N486	L381-F482 HydrophobicContact CD2-CE2 4.18Å; L381-F482 HydrophobicContact CD2-CZ 3.88Å; Y446-F482 HydrophobicContact CD1-CD2 4.28Å; Y446-F482 HydrophobicContact CD1-CE2 4.44Å; Y446-F482 HydrophobicContact CE1-CD2 4Å; Y446-F482 AromaticContact CE1-CE2 3.94Å; Y446-F482 HydrophobicContact CE1-CE2 3.94Å; T449-F482 HydrophobicContact CG2-CB 3.76Å; T449-F482 HydrophobicContact CG2-CD2 4.03Å; T449-F482 HydrophobicContact CG2-CG 4.23Å; T449-F482 PolarHBondContact OG1-N 3.06Å; A478-F482 WeakPolarHBondContact O-CB 3.29Å; A478-F482 PolarHBondContact O-N 3.3Å; E479-F482 PolarHBondContact O-N 3.27Å; A480-F482 VanDerWaalsContact C-N 3.32Å; A480-F482 PolarHBondContact O-N 2.91Å; F482-I484 PolarHBondContact O-N 3.41Å; F482-S485 WeakPolarHBondContact O-CB 3.33Å; F482-S485 PolarHBondContact O-N 3.43Å; F482-N486 WeakPolarHBondContact CD1-ND2 3.48Å; F482-N486 WeakPolarHBondContact CE1-ND2 3.44Å; F482-N486 WeakPolarHBondContact O-CB 3.47Å; F482-N486 PolarHBondContact O-N 3.2Å; F482-N486 PolarHBondContact O-ND2 3.26Å; F482-N486 PolarHBondContact O-OD1 3.22Å
483	A	93.3	Very high	92.5	Very high	51 Å²	51	40.8 Å²	40.8	42%	0.421	23%	0.227	S	C	.	.	H	α-helix	trans	-61.1	-41.8	176.2	0	0	0	0	0	112.3	E479 A480 N486 I487	E479-A483 WeakPolarHBondContact O-CB 3.47Å; E479-A483 PolarHBondContact O-N 2.99Å; A480-A483 PolarHBondContact O-N 3.37Å; A483-N486 PolarHBondContact O-N 3.16Å; A483-I487 WeakPolarHBondContact O-CG1 3.48Å; A483-I487 PolarHBondContact O-N 3.14Å; A483-I487 VanDerWaalsContact O-N 3.08Å
484	I	94.8	Very high	92.6	Very high	82 Å²	82	43.6 Å²	43.6	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-65	-42.9	175.5	-62.9	165.9	0	0	0	111	L445 A480 L481 F482 N486 I487 L488	L445-I484 HydrophobicContact CD1-CG2 3.79Å; A480-I484 WeakPolarHBondContact O-CG1 3.48Å; A480-I484 PolarHBondContact O-N 2.95Å; L481-I484 PolarHBondContact O-N 3.41Å; F482-I484 PolarHBondContact O-N 3.41Å; I484-N486 VanDerWaalsContact C-N 3.29Å; I484-N486 PolarHBondContact O-N 3.06Å; I484-I487 WeakPolarHBondContact O-CB 3.33Å; I484-I487 PolarHBondContact O-N 2.82Å; I484-L488 PolarHBondContact O-N 2.99Å
485	S	93.5	Very high	92.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-41.9	175.5	-51.6	0	0	0	0	111.6	L445 Y446 L481 F482 I487 L488 S489	L445-S485 WeakPolarHBondContact CB-OG 3.45Å; Y446-S485 PolarHBondContact OH-O 3.43Å; L481-S485 WeakPolarHBondContact O-CB 3.38Å; L481-S485 PolarHBondContact O-N 3.3Å; L481-S485 PolarHBondContact O-OG 2.85Å; F482-S485 WeakPolarHBondContact O-CB 3.33Å; F482-S485 PolarHBondContact O-N 3.43Å; S485-I487 PolarHBondContact O-N 2.88Å; S485-L488 PolarHBondContact O-N 3.39Å; S485-S489 WeakPolarHBondContact O-CB 3.45Å; S485-S489 PolarHBondContact O-N 3.08Å; S485-S489 PolarHBondContact O-OG 3.44Å
486	N	92.9	Very high	92.6	Very high	36 Å²	36	44.9 Å²	44.9	19%	0.193	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-38.8	178.4	-64.7	-14.9	0	0	0	111.3	L381 Y446 F482 A483 I484 S489 S490	L381-N486 HydrophobicContact CD1-CB 4.41Å; L381-N486 WeakPolarHBondContact CD2-OD1 3.32Å; Y446-N486 PolarHBondContact OH-OD1 3.05Å; Y446-N486 VanDerWaalsContact OH-OD1 3.13Å; F482-N486 WeakPolarHBondContact CD1-ND2 3.48Å; F482-N486 WeakPolarHBondContact CE1-ND2 3.44Å; F482-N486 WeakPolarHBondContact O-CB 3.47Å; F482-N486 PolarHBondContact O-N 3.2Å; F482-N486 PolarHBondContact O-ND2 3.26Å; F482-N486 PolarHBondContact O-OD1 3.22Å; A483-N486 PolarHBondContact O-N 3.16Å; I484-N486 VanDerWaalsContact C-N 3.29Å; I484-N486 PolarHBondContact O-N 3.06Å; N486-S489 WeakPolarHBondContact CA-OG 3.37Å; N486-S489 PolarHBondContact O-N 2.92Å; N486-S489 PolarHBondContact O-OG 2.93Å; N486-S490 PolarHBondContact O-N 3.49Å; N486-S490 PolarHBondContact O-OG 3.4Å
487	I	95.4	Very high	92.7	Very high	99 Å²	99	47.1 Å²	47.1	51%	0.508	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-52.8	172.5	-68	165.5	0	0	0	110.5	A483 I484 S485 S489 S490 L491	A483-I487 WeakPolarHBondContact O-CG1 3.48Å; A483-I487 PolarHBondContact O-N 3.14Å; A483-I487 VanDerWaalsContact O-N 3.08Å; I484-I487 WeakPolarHBondContact O-CB 3.33Å; I484-I487 PolarHBondContact O-N 2.82Å; S485-I487 PolarHBondContact O-N 2.88Å; I487-S489 VanDerWaalsContact C-N 3.32Å; I487-S489 PolarHBondContact O-N 3.44Å; I487-S490 PolarHBondContact O-N 3.46Å; I487-S490 VanDerWaalsContact O-N 3.15Å; I487-S490 PolarHBondContact O-OG 3.02Å; I487-L491 HydrophobicContact CG2-CD1 3.93Å; I487-L491 WeakPolarHBondContact O-CG 3.39Å; I487-L491 PolarHBondContact O-N 3.48Å
488	L	94.2	Very high	92.7	Very high	37 Å²	37	45 Å²	45	19%	0.194	25%	0.245	C	C	.	.	H	α-helix	trans	-59	-41.4	179	-65.8	179.2	0	0	0	112.4	M438 A441 M442 L445 I484 S485 L491 R492	M438-L488 HydrophobicContact CG-CD2 4.35Å; A441-L488 HydrophobicContact CB-CD1 4.48Å; M442-L488 HydrophobicContact CB-CB 4.18Å; M442-L488 HydrophobicContact CB-CD1 4.44Å; M442-L488 HydrophobicContact CG-CB 4.41Å; L445-L488 HydrophobicContact CD1-CD1 3.79Å; I484-L488 PolarHBondContact O-N 2.99Å; S485-L488 PolarHBondContact O-N 3.39Å; L488-L491 PolarHBondContact O-N 3.08Å; L488-R492 PolarHBondContact O-N 2.93Å
489	S	93.3	Very high	92.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-39	176.1	71.9	0	0	0	0	113	Y374 L381 M442 Y446 S485 N486 I487 L491 R492	Y374-S489 WeakPolarHBondContact OH-CA 3.36Å; Y374-S489 WeakPolarHBondContact OH-CB 3.46Å; Y374-S489 PolarHBondContact OH-O 3.19Å; L381-S489 WeakPolarHBondContact CD1-OG 3.27Å; M442-S489 VanDerWaalsContact SD-CB 3.51Å; Y446-S489 PolarHBondContact OH-OG 3.17Å; S485-S489 WeakPolarHBondContact O-CB 3.45Å; S485-S489 PolarHBondContact O-N 3.08Å; S485-S489 PolarHBondContact O-OG 3.44Å; N486-S489 WeakPolarHBondContact CA-OG 3.37Å; N486-S489 PolarHBondContact O-N 2.92Å; N486-S489 PolarHBondContact O-OG 2.93Å; I487-S489 VanDerWaalsContact C-N 3.32Å; I487-S489 PolarHBondContact O-N 3.44Å; S489-L491 VanDerWaalsContact C-N 3.33Å; S489-L491 PolarHBondContact O-N 3.32Å; S489-R492 WeakPolarHBondContact O-CB 3.37Å; S489-R492 PolarHBondContact O-N 3.41Å
490	S	92.4	Very high	92.8	Very high	60 Å²	60	46.6 Å²	46.6	42%	0.42	26%	0.261	S	S	.	.	H	α-helix	trans	-65	-37.3	173.9	71.5	0	0	0	0	112.4	N486 I487 R492 L493	N486-S490 PolarHBondContact O-N 3.49Å; N486-S490 PolarHBondContact O-OG 3.4Å; I487-S490 PolarHBondContact O-N 3.46Å; I487-S490 VanDerWaalsContact O-N 3.15Å; I487-S490 PolarHBondContact O-OG 3.02Å; S490-R492 VanDerWaalsContact C-N 3.31Å; S490-R492 PolarHBondContact O-N 3.23Å; S490-L493 WeakPolarHBondContact O-CB 3.22Å; S490-L493 PolarHBondContact O-N 3.46Å
491	L	92.7	Very high	92.7	Very high	76 Å²	76	47.4 Å²	47.4	40%	0.398	26%	0.263	S	S	.	.	H	α-helix	trans	-67.5	-29.4	176.9	-74.1	169.1	0	0	0	112.6	I487 L488 S489 L493 I494	I487-L491 HydrophobicContact CG2-CD1 3.93Å; I487-L491 WeakPolarHBondContact O-CG 3.39Å; I487-L491 PolarHBondContact O-N 3.48Å; L488-L491 PolarHBondContact O-N 3.08Å; S489-L491 VanDerWaalsContact C-N 3.33Å; S489-L491 PolarHBondContact O-N 3.32Å; L491-L493 PolarHBondContact O-N 2.92Å; L491-L493 VanDerWaalsContact O-N 3.12Å; L491-I494 HydrophobicContact CD2-CD1 3.94Å; L491-I494 WeakPolarHBondContact O-CB 3.46Å; L491-I494 VanDerWaalsContact O-CG1 3.3Å; L491-I494 WeakPolarHBondContact O-CG1 3.42Å; L491-I494 PolarHBondContact O-N 3.15Å
492	R	92.7	Very high	92.5	Very high	50 Å²	50	52.9 Å²	52.9	19%	0.189	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-25.3	177.1	-173.2	54.6	166.2	136.6	-2.9	113.6	Y374 M438 D439 L488 S489 S490 I494 S495	Y374-R492 HydrophobicContact CE1-CB 4.27Å; Y374-R492 HydrophobicContact CE1-CG 4.43Å; Y374-R492 WeakPolarHBondContact OH-CB 3.09Å; M438-R492 HydrophobicContact CE-CB 3.76Å; M438-R492 HydrophobicContact CE-CG 4.27Å; D439-R492 WeakPolarHBondContact OD1-CD 3.25Å; D439-R492 IonicContact OD1-CZ 3.23Å; D439-R492 IonicContact OD1-NE 3.75Å; D439-R492 PolarHBondContact OD1-NE 2.96Å; D439-R492 IonicContact OD2-CZ 3.46Å; D439-R492 IonicContact OD2-NE 2.92Å; D439-R492 PolarHBondContact OD2-NE 3.29Å; D439-R492 IonicContact OD2-NH2 2.77Å; D439-R492 PolarHBondContact OD2-NH2 3.11Å; L488-R492 PolarHBondContact O-N 2.93Å; S489-R492 WeakPolarHBondContact O-CB 3.37Å; S489-R492 PolarHBondContact O-N 3.41Å; S490-R492 VanDerWaalsContact C-N 3.31Å; S490-R492 PolarHBondContact O-N 3.23Å; R492-I494 PolarHBondContact O-N 3.14Å; R492-I494 VanDerWaalsContact O-N 3.09Å; R492-S495 PolarHBondContact NH1-OG 3.49Å; R492-S495 PolarHBondContact O-N 3.45Å; R492-S495 VanDerWaalsContact O-N 3.11Å; R492-S495 PolarHBondContact O-OG 3.07Å
493	L	91.4	Very high	92.6	Very high	48 Å²	48	54.4 Å²	54.4	25%	0.251	30%	0.297	S	S	.	.	H	α-helix	trans	-55	-27.2	172.7	-71.5	-179.2	0	0	0	113.9	Y374 L375 L378 S490 L491 S495 L496	Y374-L493 HydrophobicContact CD1-CD2 3.79Å; Y374-L493 HydrophobicContact CE1-CD2 4.1Å; Y374-L493 HydrophobicContact CE1-CG 4.47Å; L375-L493 HydrophobicContact CD2-CD1 4.39Å; L375-L493 HydrophobicContact CD2-CD2 3.85Å; L378-L493 HydrophobicContact CD1-CD1 3.49Å; L378-L493 VanDerWaalsContact CD1-CD1 3.49Å; L378-L493 HydrophobicContact CD1-CD2 3.71Å; L378-L493 HydrophobicContact CD1-CG 3.52Å; S490-L493 WeakPolarHBondContact O-CB 3.22Å; S490-L493 PolarHBondContact O-N 3.46Å; L491-L493 PolarHBondContact O-N 2.92Å; L491-L493 VanDerWaalsContact O-N 3.12Å; L493-S495 PolarHBondContact O-N 3.4Å; L493-L496 HydrophobicContact CD2-CD1 3.92Å; L493-L496 WeakPolarHBondContact O-CB 3.5Å; L493-L496 PolarHBondContact O-N 3.25Å; L493-L496 VanDerWaalsContact O-N 3.16Å
494	I	92.4	Very high	92.6	Very high	63 Å²	63	52 Å²	52	32%	0.323	28%	0.277	S	S	.	.	H	α-helix	trans	-61.4	-31.3	-179.8	-63.3	169.1	0	0	0	111.2	W435 L491 R492 L496 F497 Q507	W435-I494 HydrophobicContact CH2-CB 3.93Å; W435-I494 HydrophobicContact CH2-CG2 3.91Å; W435-I494 HydrophobicContact CZ2-CG2 4.46Å; L491-I494 HydrophobicContact CD2-CD1 3.94Å; L491-I494 WeakPolarHBondContact O-CB 3.46Å; L491-I494 VanDerWaalsContact O-CG1 3.3Å; L491-I494 WeakPolarHBondContact O-CG1 3.42Å; L491-I494 PolarHBondContact O-N 3.15Å; R492-I494 PolarHBondContact O-N 3.14Å; R492-I494 VanDerWaalsContact O-N 3.09Å; I494-L496 VanDerWaalsContact C-N 3.28Å; I494-L496 PolarHBondContact O-N 3.43Å; I494-F497 HydrophobicContact CB-CD2 4.5Å; I494-F497 HydrophobicContact CG1-CE2 4.3Å; I494-F497 HydrophobicContact CG2-CD2 4.27Å; I494-F497 VanDerWaalsContact O-CB 3.31Å; I494-F497 WeakPolarHBondContact O-CB 3.44Å; I494-F497 PolarHBondContact O-N 3.5Å; I494-Q507 HydrophobicContact CG2-CG 3.78Å
495	S	89.6	Confident	92.6	Very high	11 Å²	11	49.2 Å²	49.2	8%	0.077	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-31.9	179	75.5	0	0	0	0	112.6	R492 L493 F497 T498	R492-S495 PolarHBondContact NH1-OG 3.49Å; R492-S495 PolarHBondContact O-N 3.45Å; R492-S495 VanDerWaalsContact O-N 3.11Å; R492-S495 PolarHBondContact O-OG 3.07Å; L493-S495 PolarHBondContact O-N 3.4Å; S495-F497 PolarHBondContact O-N 2.97Å; S495-T498 WeakPolarHBondContact O-CB 3.43Å; S495-T498 WeakPolarHBondContact O-CG2 3.43Å; S495-T498 PolarHBondContact O-N 2.77Å; S495-T498 PolarHBondContact O-OG1 3.35Å
496	L	90.8	Very high	92.5	Very high	38 Å²	38	54.1 Å²	54.1	20%	0.199	29%	0.29	C	S	.	.	H	α-helix	trans	-68.3	-19.1	178.8	-59.3	174.1	0	0	0	112.3	F367 T371 L493 I494 T498 A499	F367-L496 HydrophobicContact CE2-CD2 4.05Å; T371-L496 HydrophobicContact CG2-CD1 4Å; L493-L496 HydrophobicContact CD2-CD1 3.92Å; L493-L496 WeakPolarHBondContact O-CB 3.5Å; L493-L496 PolarHBondContact O-N 3.25Å; L493-L496 VanDerWaalsContact O-N 3.16Å; I494-L496 VanDerWaalsContact C-N 3.28Å; I494-L496 PolarHBondContact O-N 3.43Å; L496-T498 PolarHBondContact O-N 3.17Å; L496-A499 WeakPolarHBondContact O-CB 3.49Å; L496-A499 PolarHBondContact O-N 2.81Å; L496-A499 VanDerWaalsContact O-N 3.11Å
497	F	92.8	Very high	92.5	Very high	87 Å²	87	53.5 Å²	53.5	38%	0.382	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-63.5	-22.5	175.7	-63.3	-17	0	0	0	113	I494 S495 A499 N500 L503 G504 Q507	I494-F497 HydrophobicContact CB-CD2 4.5Å; I494-F497 HydrophobicContact CG1-CE2 4.3Å; I494-F497 HydrophobicContact CG2-CD2 4.27Å; I494-F497 VanDerWaalsContact O-CB 3.31Å; I494-F497 WeakPolarHBondContact O-CB 3.44Å; I494-F497 PolarHBondContact O-N 3.5Å; S495-F497 PolarHBondContact O-N 2.97Å; F497-A499 PolarHBondContact O-N 3.29Å; F497-N500 PolarHBondContact O-N 2.83Å; F497-L503 HydrophobicContact CB-CB 3.87Å; F497-L503 HydrophobicContact CD1-CD1 3.92Å; F497-L503 HydrophobicContact CD2-CD1 4.46Å; F497-L503 HydrophobicContact CE1-CD1 4.23Å; F497-L503 HydrophobicContact CG-CB 4.23Å; F497-L503 HydrophobicContact CG-CD1 4.05Å; F497-G504 WeakPolarHBondContact O-CA 3.48Å; F497-G504 PolarHBondContact O-N 3.15Å; F497-Q507 HydrophobicContact CB-CB 4.48Å
498	T	93.5	Very high	92.4	Very high	10 Å²	10	49.9 Å²	49.9	6%	0.061	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-57.7	-26.6	171.9	58.9	0	0	0	0	113.3	S495 L496 N500 I508 W639 L646	S495-T498 WeakPolarHBondContact O-CB 3.43Å; S495-T498 WeakPolarHBondContact O-CG2 3.43Å; S495-T498 PolarHBondContact O-N 2.77Å; S495-T498 PolarHBondContact O-OG1 3.35Å; L496-T498 PolarHBondContact O-N 3.17Å; T498-N500 VanDerWaalsContact C-N 3.31Å; T498-N500 PolarHBondContact O-N 3.49Å; T498-I508 HydrophobicContact CG2-CD1 4.32Å; T498-W639 PolarHBondContact O-NE1 2.73Å; T498-L646 VanDerWaalsContact OG1-CD1 3.26Å; T498-L646 WeakPolarHBondContact OG1-CD1 2.94Å
499	A	92	Very high	92.3	Very high	34 Å²	34	48.2 Å²	48.2	28%	0.281	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-73.6	-20.7	176	0	0	0	0	0	113.4	F367 L496 F497	F367-A499 HydrophobicContact CE1-CB 4.18Å; F367-A499 HydrophobicContact CE2-CB 4.34Å; F367-A499 HydrophobicContact CZ-CB 3.64Å; L496-A499 WeakPolarHBondContact O-CB 3.49Å; L496-A499 PolarHBondContact O-N 2.81Å; L496-A499 VanDerWaalsContact O-N 3.11Å; F497-A499 PolarHBondContact O-N 3.29Å
500	N	91.6	Very high	92.1	Very high	68 Å²	68	53.6 Å²	53.6	36%	0.364	29%	0.287	S	S	.	.	S	Bend	trans	-92.3	137.1	-178.3	-174.6	4.3	0	0	0	111.6	F497 T498 H502 L503 G504	F497-N500 PolarHBondContact O-N 2.83Å; T498-N500 VanDerWaalsContact C-N 3.31Å; T498-N500 PolarHBondContact O-N 3.49Å; N500-H502 VanDerWaalsContact C-N 3.31Å; N500-H502 PolarHBondContact O-N 3.18Å; N500-H502 PolarHBondContact OD1-N 2.91Å; N500-L503 HydrophobicContact CB-CB 4.39Å; N500-G504 WeakPolarHBondContact O-CA 3.32Å; N500-G504 PolarHBondContact O-N 3.34Å
501	S	90.8	Very high	92	Very high	68 Å²	68	52.3 Å²	52.3	48%	0.476	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.9	179.9	54.7	0	0	0	0	115.4	W639	S501-W639 VanDerWaalsContact CA-CZ2 3.47Å
502	H	90.2	Very high	91.9	Very high	156 Å²	156	52.5 Å²	52.5	72%	0.722	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-36.3	-179.8	-64.8	-73.2	0	0	0	113.3	N500	N500-H502 VanDerWaalsContact C-N 3.31Å; N500-H502 PolarHBondContact O-N 3.18Å; N500-H502 PolarHBondContact OD1-N 2.91Å
503	L	93.3	Very high	91.9	Very high	69 Å²	69	51.1 Å²	51.1	36%	0.361	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-24.1	-177.5	-59.7	177.2	0	0	0	113	F497 N500 L506 Q507	F497-L503 HydrophobicContact CB-CB 3.87Å; F497-L503 HydrophobicContact CD1-CD1 3.92Å; F497-L503 HydrophobicContact CD2-CD1 4.46Å; F497-L503 HydrophobicContact CE1-CD1 4.23Å; F497-L503 HydrophobicContact CG-CB 4.23Å; F497-L503 HydrophobicContact CG-CD1 4.05Å; N500-L503 HydrophobicContact CB-CB 4.39Å; L503-L506 PolarHBondContact O-N 3.19Å; L503-Q507 WeakPolarHBondContact O-CB 3.39Å; L503-Q507 PolarHBondContact O-N 3.31Å
504	G	94.4	Very high	91.9	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-56.3	-176.5	0	0	0	0	0	114.3	F497 N500 L506 Q507 I508 W639	F497-G504 WeakPolarHBondContact O-CA 3.48Å; F497-G504 PolarHBondContact O-N 3.15Å; N500-G504 WeakPolarHBondContact O-CA 3.32Å; N500-G504 PolarHBondContact O-N 3.34Å; G504-L506 VanDerWaalsContact C-N 3.27Å; G504-L506 PolarHBondContact O-N 3.43Å; G504-Q507 PolarHBondContact O-N 3.01Å; G504-I508 WeakPolarHBondContact O-CG1 3.39Å; G504-I508 PolarHBondContact O-N 3.44Å; G504-W639 VanDerWaalsContact CA-CD1 3.5Å
505	P	94.7	Very high	91.8	Very high	24 Å²	24	54 Å²	54	16%	0.156	29%	0.29	C	S	.	.	H	α-helix	trans	-58.8	-37.4	178.2	-25.9	35.4	0	0	0	113.4	I508 S509 W639	P505-I508 PolarHBondContact O-N 3Å; P505-S509 PolarHBondContact O-N 3.47Å; P505-S509 PolarHBondContact O-OG 3.24Å; P505-W639 HydrophobicContact CB-CB 4.45Å; P505-W639 HydrophobicContact CG-CB 4.04Å; P505-W639 HydrophobicContact CG-CD2 3.79Å; P505-W639 HydrophobicContact CG-CE3 3.83Å; P505-W639 HydrophobicContact CG-CG 3.85Å
506	L	91.6	Very high	91.9	Very high	103 Å²	103	55.2 Å²	55.2	54%	0.539	30%	0.296	S	S	.	.	H	α-helix	trans	-67.5	-38.7	177.4	-176.2	65.6	0	0	0	112.6	L503 G504 S509 L510	L503-L506 PolarHBondContact O-N 3.19Å; G504-L506 VanDerWaalsContact C-N 3.27Å; G504-L506 PolarHBondContact O-N 3.43Å; L506-S509 PolarHBondContact O-OG 3.18Å; L506-S509 VanDerWaalsContact O-OG 3.08Å; L506-L510 WeakPolarHBondContact O-CB 3.35Å; L506-L510 PolarHBondContact O-N 2.88Å
507	Q	93.6	Very high	92.1	Very high	22 Å²	22	55.8 Å²	55.8	10%	0.103	30%	0.299	C	S	.	.	H	α-helix	trans	-68	-40.7	175.4	179.7	-77.9	-44.8	0	0	111.3	I494 F497 L503 G504 L510 G511	I494-Q507 HydrophobicContact CG2-CG 3.78Å; F497-Q507 HydrophobicContact CB-CB 4.48Å; L503-Q507 WeakPolarHBondContact O-CB 3.39Å; L503-Q507 PolarHBondContact O-N 3.31Å; G504-Q507 PolarHBondContact O-N 3.01Å; Q507-L510 PolarHBondContact O-N 2.94Å; Q507-G511 PolarHBondContact O-N 3.42Å
508	I	92.6	Very high	92	Very high	23 Å²	23	55.8 Å²	55.8	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-68.6	-38.5	-179.6	-66.3	-68.6	0	0	0	111.9	T498 G504 P505 R512 E638 W639 A642	T498-I508 HydrophobicContact CG2-CD1 4.32Å; G504-I508 WeakPolarHBondContact O-CG1 3.39Å; G504-I508 PolarHBondContact O-N 3.44Å; P505-I508 PolarHBondContact O-N 3Å; I508-R512 WeakPolarHBondContact O-CG 3.25Å; I508-R512 PolarHBondContact O-N 2.9Å; I508-E638 HydrophobicContact CG2-CB 4.45Å; I508-W639 HydrophobicContact CG1-CB 4.38Å; I508-A642 HydrophobicContact CD1-CB 3.68Å; I508-A642 HydrophobicContact CG1-CB 4.49Å
509	S	91.3	Very high	91.9	Very high	3 Å²	3	61.6 Å²	61.6	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-67.3	-44.2	175	58.3	0	0	0	0	111.9	P505 L506 G511 R512 M513	P505-S509 PolarHBondContact O-N 3.47Å; P505-S509 PolarHBondContact O-OG 3.24Å; L506-S509 PolarHBondContact O-OG 3.18Å; L506-S509 VanDerWaalsContact O-OG 3.08Å; S509-G511 PolarHBondContact O-N 2.89Å; S509-R512 PolarHBondContact O-N 2.7Å; S509-R512 VanDerWaalsContact O-N 3.17Å; S509-M513 WeakPolarHBondContact O-CG 3.45Å; S509-M513 PolarHBondContact O-N 3.34Å; S509-M513 VanDerWaalsContact O-N 3.08Å
510	L	89.5	Confident	92	Very high	113 Å²	113	60.8 Å²	60.8	59%	0.592	32%	0.316	S	S	*	.	H	α-helix	trans	-56.4	-48.1	174	-175.1	156.1	0	0	0	112.1	L506 Q507 R512 M513 L514	L506-L510 WeakPolarHBondContact O-CB 3.35Å; L506-L510 PolarHBondContact O-N 2.88Å; Q507-L510 PolarHBondContact O-N 2.94Å; L510-R512 PolarHBondContact O-N 3.1Å; L510-R512 VanDerWaalsContact O-N 3.08Å; L510-M513 PolarHBondContact O-N 3.18Å; L510-L514 PolarHBondContact O-N 3.44Å; L510-L514 VanDerWaalsContact O-N 3.16Å
511	G	90.1	Very high	92	Very high	33 Å²	33	61.3 Å²	61.3	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-17.2	-179.2	0	0	0	0	0	114.7	Q507 S509	Q507-G511 PolarHBondContact O-N 3.42Å; S509-G511 PolarHBondContact O-N 2.89Å
512	R	90.6	Very high	92.2	Very high	79 Å²	79	64.5 Å²	64.5	30%	0.298	33%	0.325	S	S	.	.	H	α-helix	trans	-98.6	-40.8	179.4	-72.4	176.6	179.7	-147.3	5.9	113.7	I508 S509 L510 L514 L515 I631 E638	I508-R512 WeakPolarHBondContact O-CG 3.25Å; I508-R512 PolarHBondContact O-N 2.9Å; S509-R512 PolarHBondContact O-N 2.7Å; S509-R512 VanDerWaalsContact O-N 3.17Å; L510-R512 PolarHBondContact O-N 3.1Å; L510-R512 VanDerWaalsContact O-N 3.08Å; R512-L514 PolarHBondContact O-N 3.41Å; R512-L514 VanDerWaalsContact O-N 3.14Å; R512-L515 WeakPolarHBondContact O-CB 3.5Å; R512-L515 PolarHBondContact O-N 2.82Å; R512-I631 HydrophobicContact CB-CD1 3.77Å; R512-E638 IonicContact CZ-OE1 2.91Å; R512-E638 IonicContact CZ-OE2 3.89Å; R512-E638 IonicContact NH1-OE1 3.78Å; R512-E638 PolarHBondContact NH1-OE1 2.74Å; R512-E638 IonicContact NH1-OE2 3.98Å; R512-E638 PolarHBondContact NH1-OE2 2.98Å; R512-E638 IonicContact NH2-OE1 2.68Å; R512-E638 IonicContact NH2-OE2 2.66Å; R512-E638 PolarHBondContact NH2-OE2 2.9Å
513	M	93.7	Very high	92.4	Very high	22 Å²	22	61.1 Å²	61.1	11%	0.108	31%	0.311	C	S	.	.	H	α-helix	trans	-55.1	-29.1	168.2	-67.5	-174.8	-67.2	0	0	110.8	S509 L510 L515 D516 I517 M624 Y628 I631	S509-M513 WeakPolarHBondContact O-CG 3.45Å; S509-M513 PolarHBondContact O-N 3.34Å; S509-M513 VanDerWaalsContact O-N 3.08Å; L510-M513 PolarHBondContact O-N 3.18Å; M513-L515 VanDerWaalsContact C-N 3.25Å; M513-L515 PolarHBondContact O-N 3.46Å; M513-D516 PolarHBondContact O-N 3.17Å; M513-I517 VanDerWaalsContact O-CG1 3.3Å; M513-I517 WeakPolarHBondContact O-CG1 3.33Å; M513-I517 PolarHBondContact O-N 3.36Å; M513-M624 HydrophobicContact SD-CE 4.39Å; M513-Y628 HydrophobicContact CE-CD2 3.91Å; M513-Y628 HydrophobicContact SD-CD2 3.86Å; M513-Y628 HydrophobicContact SD-CG 4.28Å; M513-I631 HydrophobicContact CG-CD1 3.95Å
514	L	91.1	Very high	92.5	Very high	88 Å²	88	59.5 Å²	59.5	46%	0.461	30%	0.3	S	S	.	.	H	α-helix	trans	-53.8	-36.7	172.4	-167.5	67.1	0	0	0	113.7	L510 R512 D516 I517 L518	L510-L514 PolarHBondContact O-N 3.44Å; L510-L514 VanDerWaalsContact O-N 3.16Å; R512-L514 PolarHBondContact O-N 3.41Å; R512-L514 VanDerWaalsContact O-N 3.14Å; L514-D516 VanDerWaalsContact C-N 3.34Å; L514-D516 PolarHBondContact O-N 3.43Å; L514-I517 PolarHBondContact O-N 3.36Å; L514-L518 WeakPolarHBondContact O-CB 3.24Å; L514-L518 VanDerWaalsContact O-CG 3.27Å; L514-L518 WeakPolarHBondContact O-CG 3.4Å; L514-L518 PolarHBondContact O-N 2.93Å
515	L	89.6	Confident	92.6	Very high	84 Å²	84	61.9 Å²	61.9	44%	0.44	32%	0.316	S	S	.	.	H	α-helix	trans	-69.1	-32.2	177.3	-65.5	177.4	0	0	0	112.3	W434 R512 M513 K519	W434-L515 HydrophobicContact CZ2-CD2 4.45Å; R512-L515 WeakPolarHBondContact O-CB 3.5Å; R512-L515 PolarHBondContact O-N 2.82Å; M513-L515 VanDerWaalsContact C-N 3.25Å; M513-L515 PolarHBondContact O-N 3.46Å; L515-K519 WeakPolarHBondContact O-CG 3.43Å; L515-K519 PolarHBondContact O-N 3.27Å
516	D	92.8	Very high	92.6	Very high	36 Å²	36	65.2 Å²	65.2	19%	0.193	33%	0.332	C	S	.	.	H	α-helix	trans	-77.2	-38.5	174.6	-64	-30.2	0	0	0	111.2	M513 L514 L518 K519 F520 S627	M513-D516 PolarHBondContact O-N 3.17Å; L514-D516 VanDerWaalsContact C-N 3.34Å; L514-D516 PolarHBondContact O-N 3.43Å; D516-L518 VanDerWaalsContact C-N 3.29Å; D516-L518 PolarHBondContact O-N 3Å; D516-K519 PolarHBondContact O-N 3.28Å; D516-K519 IonicContact OD1-NZ 3.72Å; D516-K519 PolarHBondContact OD1-NZ 3.41Å; D516-F520 PolarHBondContact O-N 2.77Å; D516-S627 WeakPolarHBondContact OD2-CB 3.42Å; D516-S627 PolarHBondContact OD2-OG 2.92Å
517	I	93.6	Very high	92.9	Very high	50 Å²	50	61.8 Å²	61.8	26%	0.256	32%	0.315	S	S	.	.	H	α-helix	trans	-57.8	-41.7	171	-65.9	164.3	0	0	0	110.5	M513 L514 F520 L521 L620 M624	M513-I517 VanDerWaalsContact O-CG1 3.3Å; M513-I517 WeakPolarHBondContact O-CG1 3.33Å; M513-I517 PolarHBondContact O-N 3.36Å; L514-I517 PolarHBondContact O-N 3.36Å; I517-F520 PolarHBondContact O-N 3Å; I517-L521 VanDerWaalsContact O-CB 3.29Å; I517-L521 WeakPolarHBondContact O-CB 3.32Å; I517-L521 PolarHBondContact O-N 3.13Å; I517-L620 HydrophobicContact CG1-CD1 4.24Å; I517-M624 HydrophobicContact CD1-CE 3.96Å; I517-M624 HydrophobicContact CD1-SD 3.9Å; I517-M624 HydrophobicContact CG1-CG 4.26Å; I517-M624 HydrophobicContact CG1-SD 3.93Å
518	L	91.4	Very high	93	Very high	86 Å²	86	61.7 Å²	61.7	45%	0.45	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-39.8	177.6	-74.4	171.1	0	0	0	113	L514 D516 F520 L521 F522	L514-L518 WeakPolarHBondContact O-CB 3.24Å; L514-L518 VanDerWaalsContact O-CG 3.27Å; L514-L518 WeakPolarHBondContact O-CG 3.4Å; L514-L518 PolarHBondContact O-N 2.93Å; D516-L518 VanDerWaalsContact C-N 3.29Å; D516-L518 PolarHBondContact O-N 3Å; L518-F520 VanDerWaalsContact C-N 3.3Å; L518-F520 PolarHBondContact O-N 3.09Å; L518-L521 HydrophobicContact CD2-CD2 4.23Å; L518-L521 PolarHBondContact O-N 2.86Å; L518-F522 PolarHBondContact O-N 3.15Å
519	K	92.1	Very high	93.2	Very high	133 Å²	133	64.2 Å²	64.2	58%	0.578	33%	0.329	S	S	*	.	H	α-helix	trans	-60.9	-41.3	172.4	-64.9	164.6	-159.7	163.4	0	111.3	L515 D516 F522	L515-K519 WeakPolarHBondContact O-CG 3.43Å; L515-K519 PolarHBondContact O-N 3.27Å; D516-K519 PolarHBondContact O-N 3.28Å; D516-K519 IonicContact OD1-NZ 3.72Å; D516-K519 PolarHBondContact OD1-NZ 3.41Å; K519-F522 WeakPolarHBondContact O-CB 3.43Å
520	F	93.2	Very high	93.4	Very high	16 Å²	16	67 Å²	67	7%	0.07	35%	0.352	C	S	.	.	H	α-helix	trans	-71.1	-38.3	178.4	-167.6	-90.3	0	0	0	112.4	D516 I517 L518 F522 I523 Y524 L616 M619 L620 M623	D516-F520 PolarHBondContact O-N 2.77Å; I517-F520 PolarHBondContact O-N 3Å; L518-F520 VanDerWaalsContact C-N 3.3Å; L518-F520 PolarHBondContact O-N 3.09Å; F520-F522 PolarHBondContact O-N 3Å; F520-I523 WeakPolarHBondContact O-CB 3.45Å; F520-I523 PolarHBondContact O-N 3.07Å; F520-Y524 PolarHBondContact O-N 3.32Å; F520-L616 HydrophobicContact CE1-CB 3.99Å; F520-L616 HydrophobicContact CE1-CD2 4.4Å; F520-L616 WeakPolarHBondContact CE1-O 3.49Å; F520-L616 HydrophobicContact CE2-CD2 4.42Å; F520-L616 HydrophobicContact CZ-CB 3.79Å; F520-L616 HydrophobicContact CZ-CD2 3.7Å; F520-L616 HydrophobicContact CZ-CG 4.32Å; F520-L616 WeakPolarHBondContact CZ-O 3.38Å; F520-M619 HydrophobicContact CE2-CB 4.15Å; F520-M619 HydrophobicContact CZ-CB 4.27Å; F520-L620 HydrophobicContact CB-CD1 3.95Å; F520-L620 HydrophobicContact CD1-CB 3.95Å; F520-L620 HydrophobicContact CD1-CD1 3.85Å; F520-L620 HydrophobicContact CD1-CD2 4.2Å; F520-L620 HydrophobicContact CD1-CG 4.22Å; F520-L620 HydrophobicContact CE1-CB 3.8Å; F520-L620 HydrophobicContact CG-CB 4.4Å; F520-L620 HydrophobicContact CG-CD1 3.85Å; F520-L620 HydrophobicContact CZ-CB 4.12Å; F520-M623 HydrophobicContact CD2-CE 4.24Å
521	L	92.6	Very high	93.8	Very high	79 Å²	79	63.4 Å²	63.4	41%	0.414	33%	0.332	S	S	.	.	H	α-helix	trans	-58.5	-35	176.3	-175.7	66.3	0	0	0	111.4	I517 L518 I523 Y524 C525	I517-L521 VanDerWaalsContact O-CB 3.29Å; I517-L521 WeakPolarHBondContact O-CB 3.32Å; I517-L521 PolarHBondContact O-N 3.13Å; L518-L521 HydrophobicContact CD2-CD2 4.23Å; L518-L521 PolarHBondContact O-N 2.86Å; L521-I523 PolarHBondContact O-N 3.39Å; L521-Y524 HydrophobicContact CD1-CD1 3.93Å; L521-Y524 PolarHBondContact O-N 3.23Å; L521-C525 WeakPolarHBondContact O-CB 3.39Å; L521-C525 PolarHBondContact O-N 3.25Å; L521-C525 PolarHBondContact O-SG 3.2Å
522	F	95.1	Very high	94.1	Very high	136 Å²	136	61.9 Å²	61.9	60%	0.596	32%	0.315	S	S	*	.	H	α-helix	trans	-59.2	-45.1	173.3	-179.6	-102.7	0	0	0	112.6	L518 K519 F520 C525 L526	L518-F522 PolarHBondContact O-N 3.15Å; K519-F522 WeakPolarHBondContact O-CB 3.43Å; F520-F522 PolarHBondContact O-N 3Å; F522-C525 PolarHBondContact O-N 3.29Å; F522-L526 HydrophobicContact CD1-CD1 4.21Å; F522-L526 HydrophobicContact CE1-CD1 3.72Å; F522-L526 HydrophobicContact CE1-CG 4.4Å; F522-L526 HydrophobicContact CZ-CD1 4.13Å; F522-L526 HydrophobicContact CZ-CG 4.46Å; F522-L526 PolarHBondContact O-N 3.3Å
523	I	94.2	Very high	94.3	Very high	85 Å²	85	62.3 Å²	62.3	44%	0.436	32%	0.324	S	S	.	.	H	α-helix	trans	-62.9	-44.1	175.8	-58.2	172	0	0	0	110.2	F520 L521 C525 L526 V527	F520-I523 WeakPolarHBondContact O-CB 3.45Å; F520-I523 PolarHBondContact O-N 3.07Å; L521-I523 PolarHBondContact O-N 3.39Å; I523-C525 PolarHBondContact O-N 2.94Å; I523-L526 PolarHBondContact O-N 3.21Å; I523-V527 PolarHBondContact O-N 2.9Å; I523-V527 VanDerWaalsContact O-N 3.12Å
524	Y	95.3	Very high	94.5	Very high	35 Å²	35	62.3 Å²	62.3	14%	0.137	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-42.1	175.2	170.3	-94.1	0	0	0	112.4	F520 L521 L526 V527 L528 V579 Y608 L616	F520-Y524 PolarHBondContact O-N 3.32Å; L521-Y524 HydrophobicContact CD1-CD1 3.93Å; L521-Y524 PolarHBondContact O-N 3.23Å; Y524-L526 VanDerWaalsContact C-N 3.34Å; Y524-L526 PolarHBondContact O-N 3.1Å; Y524-V527 PolarHBondContact O-N 3.08Å; Y524-L528 HydrophobicContact CE1-CB 4.42Å; Y524-L528 HydrophobicContact CE1-CD1 3.82Å; Y524-L528 WeakPolarHBondContact O-CB 3.45Å; Y524-L528 PolarHBondContact O-N 2.66Å; Y524-L528 WeakPolarHBondContact OH-CD1 3.27Å; Y524-V579 HydrophobicContact CE2-CG2 4.2Å; Y524-V579 WeakPolarHBondContact OH-CG2 3.38Å; Y524-Y608 PolarHBondContact OH-OH 2.78Å; Y524-Y608 VanDerWaalsContact OH-OH 3.07Å; Y524-L616 HydrophobicContact CD2-CD1 4.15Å
525	C	95.4	Very high	94.6	Very high	50 Å²	50	58.1 Å²	58.1	34%	0.338	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-38.6	176.5	-74.3	0	0	0	0	112.3	L521 F522 I523 L528 L529	L521-C525 WeakPolarHBondContact O-CB 3.39Å; L521-C525 PolarHBondContact O-N 3.25Å; L521-C525 PolarHBondContact O-SG 3.2Å; F522-C525 PolarHBondContact O-N 3.29Å; I523-C525 PolarHBondContact O-N 2.94Å; C525-L528 PolarHBondContact O-N 3.34Å; C525-L529 WeakPolarHBondContact O-CB 3.4Å; C525-L529 WeakPolarHBondContact O-CD1 3.5Å; C525-L529 VanDerWaalsContact O-CG 3.3Å; C525-L529 WeakPolarHBondContact O-CG 3.46Å; C525-L529 PolarHBondContact O-N 3.38Å
526	L	95.9	Very high	94.9	Very high	93 Å²	93	55.5 Å²	55.5	49%	0.487	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-43.5	173.7	-69.3	174.9	0	0	0	111.9	F522 I523 Y524 L529 A530	F522-L526 HydrophobicContact CD1-CD1 4.21Å; F522-L526 HydrophobicContact CE1-CD1 3.72Å; F522-L526 HydrophobicContact CE1-CG 4.4Å; F522-L526 HydrophobicContact CZ-CD1 4.13Å; F522-L526 HydrophobicContact CZ-CG 4.46Å; F522-L526 PolarHBondContact O-N 3.3Å; I523-L526 PolarHBondContact O-N 3.21Å; Y524-L526 VanDerWaalsContact C-N 3.34Å; Y524-L526 PolarHBondContact O-N 3.1Å; L526-L529 PolarHBondContact O-N 3.26Å; L526-A530 WeakPolarHBondContact O-CB 3.44Å; L526-A530 PolarHBondContact O-N 2.98Å
527	V	96.4	Very high	95	Very high	31 Å²	31	59.8 Å²	59.8	19%	0.188	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-46.3	175.4	173.4	0	0	0	0	110.9	I523 Y524 L529 A530 F531 Y608 I611 L616	I523-V527 PolarHBondContact O-N 2.9Å; I523-V527 VanDerWaalsContact O-N 3.12Å; Y524-V527 PolarHBondContact O-N 3.08Å; V527-L529 PolarHBondContact O-N 3.06Å; V527-A530 PolarHBondContact O-N 2.89Å; V527-F531 HydrophobicContact CG1-CD2 3.79Å; V527-F531 HydrophobicContact CG1-CE2 3.98Å; V527-F531 WeakPolarHBondContact O-CD2 3.43Å; V527-F531 PolarHBondContact O-N 3.06Å; V527-Y608 HydrophobicContact CG1-CD2 4.46Å; V527-Y608 HydrophobicContact CG1-CE2 4.48Å; V527-I611 HydrophobicContact CG1-CG2 4.04Å; V527-L616 HydrophobicContact CB-CD1 4.42Å; V527-L616 HydrophobicContact CG1-CD1 4.44Å; V527-L616 HydrophobicContact CG2-CD1 4.26Å
528	L	96.2	Very high	95	Very high	20 Å²	20	59.3 Å²	59.3	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-40.7	178.4	178	144.1	0	0	0	111.8	Y524 C525 A532 L572 L575 F576	Y524-L528 HydrophobicContact CE1-CB 4.42Å; Y524-L528 HydrophobicContact CE1-CD1 3.82Å; Y524-L528 WeakPolarHBondContact O-CB 3.45Å; Y524-L528 PolarHBondContact O-N 2.66Å; Y524-L528 WeakPolarHBondContact OH-CD1 3.27Å; C525-L528 PolarHBondContact O-N 3.34Å; L528-A532 WeakPolarHBondContact O-CB 3.49Å; L528-A532 PolarHBondContact O-N 3.43Å; L528-L572 HydrophobicContact CD2-CB 4.48Å; L528-L572 HydrophobicContact CD2-CD2 3.33Å; L528-L572 HydrophobicContact CD2-CG 4.49Å; L528-L572 HydrophobicContact CG-CD2 4.43Å; L528-L575 HydrophobicContact CD1-CB 4.26Å; L528-L575 HydrophobicContact CG-CB 4.3Å; L528-F576 HydrophobicContact CD1-CB 4.34Å
529	L	96.3	Very high	95	Very high	77 Å²	77	55.8 Å²	55.8	40%	0.403	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-42.6	173.8	-76.2	163.3	0	0	0	112.4	C525 L526 V527 A532 N533 L572	C525-L529 WeakPolarHBondContact O-CB 3.4Å; C525-L529 WeakPolarHBondContact O-CD1 3.5Å; C525-L529 VanDerWaalsContact O-CG 3.3Å; C525-L529 WeakPolarHBondContact O-CG 3.46Å; C525-L529 PolarHBondContact O-N 3.38Å; L526-L529 PolarHBondContact O-N 3.26Å; V527-L529 PolarHBondContact O-N 3.06Å; L529-A532 PolarHBondContact O-N 3.26Å; L529-N533 WeakPolarHBondContact O-CB 3.22Å; L529-N533 VanDerWaalsContact O-CG 3.27Å; L529-N533 PolarHBondContact O-N 3.04Å; L529-N533 PolarHBondContact O-ND2 3.33Å; L529-L572 HydrophobicContact CD2-CD2 3.85Å; L529-L572 HydrophobicContact CG-CD2 4.45Å
530	A	97.1	Very high	95	Very high	60 Å²	60	54.7 Å²	54.7	50%	0.496	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-47.3	178.9	0	0	0	0	0	112.1	L526 V527 N533 G534	L526-A530 WeakPolarHBondContact O-CB 3.44Å; L526-A530 PolarHBondContact O-N 2.98Å; V527-A530 PolarHBondContact O-N 2.89Å; A530-N533 PolarHBondContact O-N 3.42Å; A530-G534 PolarHBondContact O-N 2.03Å; A530-G534 VanDerWaalsContact O-N 3.11Å
531	F	96.6	Very high	94.8	Very high	39 Å²	39	62.2 Å²	62.2	17%	0.171	32%	0.316	C	S	.	.	H	α-helix	trans	-70.3	-32.4	175.7	-81.5	-81	0	0	0	112.7	V527 G534 L535 L575 T607 Y608 I611	V527-F531 HydrophobicContact CG1-CD2 3.79Å; V527-F531 HydrophobicContact CG1-CE2 3.98Å; V527-F531 WeakPolarHBondContact O-CD2 3.43Å; V527-F531 PolarHBondContact O-N 3.06Å; F531-G534 PolarHBondContact O-N 3.46Å; F531-L535 WeakPolarHBondContact O-CB 3.4Å; F531-L535 PolarHBondContact O-N 3.01Å; F531-L575 HydrophobicContact CB-CD1 3.78Å; F531-T607 WeakPolarHBondContact CE1-OG1 3.43Å; F531-Y608 HydrophobicContact CB-CD2 3.81Å; F531-Y608 HydrophobicContact CB-CG 4.39Å; F531-Y608 AromaticContact CD2-CD2 3.75Å; F531-Y608 HydrophobicContact CD2-CD2 3.75Å; F531-Y608 HydrophobicContact CE2-CD2 4.48Å; F531-Y608 AromaticContact CG-CD2 3.78Å; F531-Y608 HydrophobicContact CG-CD2 3.78Å; F531-Y608 HydrophobicContact CG-CG 4.27Å; F531-I611 HydrophobicContact CE2-CD1 3.89Å; F531-I611 HydrophobicContact CZ-CD1 3.77Å
532	A	96.6	Very high	94.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.7	-43.3	174.4	0	0	0	0	0	112	L528 L529 G534 N536 L568 T571 L572 L575	L528-A532 WeakPolarHBondContact O-CB 3.49Å; L528-A532 PolarHBondContact O-N 3.43Å; L529-A532 PolarHBondContact O-N 3.26Å; A532-G534 VanDerWaalsContact C-N 3.34Å; A532-G534 PolarHBondContact O-N 3.35Å; A532-N536 WeakPolarHBondContact O-CB 3.39Å; A532-N536 PolarHBondContact O-N 3.21Å; A532-L568 HydrophobicContact CB-CD1 4.01Å; A532-T571 HydrophobicContact CB-CG2 3.88Å; A532-T571 WeakPolarHBondContact O-CG2 3.28Å; A532-L572 HydrophobicContact CB-CD2 3.41Å; A532-L572 VanDerWaalsContact CB-CD2 3.41Å; A532-L572 HydrophobicContact CB-CG 3.91Å; A532-L575 HydrophobicContact CB-CD1 3.97Å
533	N	96	Very high	93.8	Very high	88 Å²	88	59.8 Å²	59.8	47%	0.471	30%	0.302	S	S	.	.	H	α-helix	trans	-60.5	-45	173.9	-71.5	-20.1	0	0	0	111.1	L529 A530 Q537 L568	L529-N533 WeakPolarHBondContact O-CB 3.22Å; L529-N533 VanDerWaalsContact O-CG 3.27Å; L529-N533 PolarHBondContact O-N 3.04Å; L529-N533 PolarHBondContact O-ND2 3.33Å; A530-N533 PolarHBondContact O-N 3.42Å; N533-Q537 WeakPolarHBondContact O-CB 3.4Å; N533-Q537 PolarHBondContact O-N 2.9Å; N533-L568 WeakPolarHBondContact OD1-CD1 3.48Å
534	G	96.4	Very high	92.9	Very high	23 Å²	23	56.8 Å²	56.8	24%	0.237	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-47.3	178.8	0	0	0	0	0	114.1	A530 F531 A532 L538	A530-G534 PolarHBondContact O-N 2.03Å; A530-G534 VanDerWaalsContact O-N 3.11Å; F531-G534 PolarHBondContact O-N 3.46Å; A532-G534 VanDerWaalsContact C-N 3.34Å; A532-G534 PolarHBondContact O-N 3.35Å; G534-L538 PolarHBondContact O-N 2.87Å; G534-L538 VanDerWaalsContact O-N 3.14Å
535	L	94.9	Very high	91.6	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-72.1	-40.8	179.6	-73.9	167.2	0	0	0	112.3	F531 Q537 L538 Y539 F565 T571 L575 M604	F531-L535 WeakPolarHBondContact O-CB 3.4Å; F531-L535 PolarHBondContact O-N 3.01Å; L535-Q537 VanDerWaalsContact C-N 3.35Å; L535-Q537 PolarHBondContact O-N 3.26Å; L535-L538 PolarHBondContact O-N 3.5Å; L535-Y539 HydrophobicContact CD2-CD2 4.27Å; L535-Y539 HydrophobicContact CD2-CE2 3.92Å; L535-Y539 WeakPolarHBondContact O-CB 3.42Å; L535-Y539 WeakPolarHBondContact O-CD2 3.06Å; L535-Y539 PolarHBondContact O-N 2.88Å; L535-F565 HydrophobicContact CB-CD1 4.43Å; L535-F565 HydrophobicContact CD1-CD1 4.49Å; L535-F565 HydrophobicContact CD1-CE1 4.24Å; L535-T571 HydrophobicContact CB-CG2 3.98Å; L535-L575 HydrophobicContact CD1-CD1 4.26Å; L535-L575 HydrophobicContact CD1-CD2 3.72Å; L535-L575 HydrophobicContact CD1-CG 4.36Å; L535-M604 HydrophobicContact CD2-CB 3.91Å; L535-M604 HydrophobicContact CG-CB 4.47Å
536	N	95.1	Very high	90.1	Very high	28 Å²	28	63.3 Å²	63.3	15%	0.15	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-45.7	173.4	179.5	73.1	0	0	0	110.5	A532 L538 Y539 F540 T567 L568 T571	A532-N536 WeakPolarHBondContact O-CB 3.39Å; A532-N536 PolarHBondContact O-N 3.21Å; N536-L538 PolarHBondContact O-N 2.82Å; N536-Y539 PolarHBondContact O-N 3.14Å; N536-F540 WeakPolarHBondContact O-CA 3.04Å; N536-F540 WeakPolarHBondContact O-CB 3.47Å; N536-F540 PolarHBondContact O-N 3.48Å; N536-T567 WeakPolarHBondContact OD1-CA 3.39Å; N536-L568 HydrophobicContact CB-CD1 4.48Å; N536-L568 PolarHBondContact OD1-N 3.48Å; N536-T571 HydrophobicContact CB-CG2 4.45Å
537	Q	95.1	Very high	88.5	Confident	126 Å²	126	65.6 Å²	65.6	59%	0.589	32%	0.324	S	S	*	.	H	α-helix	trans	-60.5	-33	177.2	-174.9	61.9	27	0	0	113	N533 L535	N533-Q537 WeakPolarHBondContact O-CB 3.4Å; N533-Q537 PolarHBondContact O-N 2.9Å; L535-Q537 VanDerWaalsContact C-N 3.35Å; L535-Q537 PolarHBondContact O-N 3.26Å
538	L	93.7	Very high	87	Confident	41 Å²	41	68.7 Å²	68.7	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-76.2	-38.8	177.8	-171.7	67.4	0	0	0	112.7	G534 L535 N536 T597 V600 M604	G534-L538 PolarHBondContact O-N 2.87Å; G534-L538 VanDerWaalsContact O-N 3.14Å; L535-L538 PolarHBondContact O-N 3.5Å; N536-L538 PolarHBondContact O-N 2.82Å; L538-T597 HydrophobicContact CD1-CG2 3.81Å; L538-T597 HydrophobicContact CD2-CG2 4.34Å; L538-T597 HydrophobicContact CG-CG2 3.82Å; L538-V600 HydrophobicContact CD1-CG1 4.4Å; L538-V600 HydrophobicContact CD2-CB 4.39Å; L538-V600 HydrophobicContact CD2-CG1 3.99Å; L538-M604 HydrophobicContact CD2-SD 4.24Å
539	Y	92.1	Very high	85.7	Confident	12 Å²	12	68.6 Å²	68.6	5%	0.047	34%	0.338	C	S	.	.	H	α-helix	trans	-103.5	-9	-171.2	-73.2	-71.9	0	0	0	115.6	L535 N536 Y541 Y542 F565 T588 V590 G601	L535-Y539 HydrophobicContact CD2-CD2 4.27Å; L535-Y539 HydrophobicContact CD2-CE2 3.92Å; L535-Y539 WeakPolarHBondContact O-CB 3.42Å; L535-Y539 WeakPolarHBondContact O-CD2 3.06Å; L535-Y539 PolarHBondContact O-N 2.88Å; N536-Y539 PolarHBondContact O-N 3.14Å; Y539-Y541 PolarHBondContact O-N 2.77Å; Y539-Y541 VanDerWaalsContact O-N 3.14Å; Y539-Y542 HydrophobicContact CD1-CD2 4.1Å; Y539-Y542 PolarHBondContact O-N 3.31Å; Y539-F565 WeakPolarHBondContact CB-O 3.49Å; Y539-F565 HydrophobicContact CD2-CB 3.65Å; Y539-F565 AromaticContact CD2-CD2 3.67Å; Y539-F565 HydrophobicContact CD2-CD2 3.67Å; Y539-F565 AromaticContact CD2-CG 3.97Å; Y539-F565 HydrophobicContact CD2-CG 3.97Å; Y539-F565 AromaticContact CE2-CD2 3.75Å; Y539-F565 HydrophobicContact CE2-CD2 3.75Å; Y539-F565 HydrophobicContact CE2-CE2 4.39Å; Y539-F565 HydrophobicContact CE2-CG 4.45Å; Y539-F565 HydrophobicContact CG-CB 3.85Å; Y539-F565 HydrophobicContact CG-CD2 4.26Å; Y539-T588 WeakPolarHBondContact OH-CB 3.4Å; Y539-T588 PolarHBondContact OH-O 3Å; Y539-V590 HydrophobicContact CD1-CG2 4.08Å; Y539-V590 HydrophobicContact CE1-CG2 3.7Å; Y539-G601 WeakPolarHBondContact OH-CA 3.43Å
540	F	91.3	Very high	84.3	Confident	109 Å²	109	68 Å²	68	48%	0.478	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-50.1	-39.8	-179.8	173.8	-105.2	0	0	0	113.8	N536 Y542	N536-F540 WeakPolarHBondContact O-CA 3.04Å; N536-F540 WeakPolarHBondContact O-CB 3.47Å; N536-F540 PolarHBondContact O-N 3.48Å; F540-Y542 PolarHBondContact O-N 3.1Å
541	Y	89.3	Confident	82.8	Confident	174 Å²	174	72 Å²	72	68%	0.682	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-72.4	-9	-179.1	-62.9	-77	0	0	0	114.7	Y539	Y539-Y541 PolarHBondContact O-N 2.77Å; Y539-Y541 VanDerWaalsContact O-N 3.14Å
542	Y	85.6	Confident	81.8	Confident	67 Å²	67	75.8 Å²	75.8	26%	0.263	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-105.5	21.1	-176.8	-57.8	-62.3	0	0	0	113.5	Y539 F540 T544 V590 H594 T597	Y539-Y542 HydrophobicContact CD1-CD2 4.1Å; Y539-Y542 PolarHBondContact O-N 3.31Å; F540-Y542 PolarHBondContact O-N 3.1Å; Y542-T544 PolarHBondContact O-N 3.27Å; Y542-V590 HydrophobicContact CD1-CG1 3.37Å; Y542-V590 HydrophobicContact CD2-CG1 4.05Å; Y542-V590 HydrophobicContact CD2-CG2 4.06Å; Y542-V590 HydrophobicContact CE1-CG1 3.77Å; Y542-V590 HydrophobicContact CE2-CG1 4.39Å; Y542-V590 HydrophobicContact CE2-CG2 4.35Å; Y542-V590 HydrophobicContact CG-CG1 3.52Å; Y542-V590 HydrophobicContact CG-CG2 4.28Å; Y542-H594 AromaticContact CE1-CD2 3.66Å; Y542-H594 AromaticContact CZ-CD2 3.9Å; Y542-H594 PolarHBondContact OH-CD2 3.32Å; Y542-T597 HydrophobicContact CE2-CG2 3.65Å; Y542-T597 PolarHBondContact OH-OG1 3.39Å
543	E	81.3	Confident	81.1	Confident	98 Å²	98	78.3 Å²	78.3	46%	0.458	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-61.2	116.7	175.3	-175.9	175.6	-141.9	0	0	112.1	K554	E543-K554 IonicContact OE1-NZ 3.54Å; E543-K554 PolarHBondContact OE1-NZ 3.34Å
544	T	74.5	Confident	80.5	Confident	21 Å²	21	78.4 Å²	78.4	13%	0.129	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-89.2	146.5	168.7	68.4	0	0	0	0	111.1	Y542 E549 N563 K591	Y542-T544 PolarHBondContact O-N 3.27Å; T544-E549 PolarHBondContact OG1-OE1 3.26Å; T544-N563 PolarHBondContact O-ND2 2.69Å; T544-N563 VanDerWaalsContact O-ND2 3.08Å; T544-N563 PolarHBondContact OG1-ND2 3.09Å; T544-N563 PolarHBondContact OG1-OD1 3.35Å; T544-K591 HydrophobicContact CG2-CD 3.85Å; T544-K591 HydrophobicContact CG2-CG 4.48Å
545	R	67.9	Low	79.9	Confident	188 Å²	188	77.5 Å²	77.5	71%	0.709	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-77.2	148.6	176.1	-59.2	176.9	174.7	175.1	-1.4	109.1	I547 D548	R545-I547 PolarHBondContact O-N 3.27Å; R545-I547 VanDerWaalsContact O-N 3.08Å; R545-D548 WeakPolarHBondContact CB-OD2 3.24Å; R545-D548 PolarHBondContact N-OD2 2.81Å; R545-D548 WeakPolarHBondContact O-CB 3.34Å; R545-D548 PolarHBondContact O-N 3.19Å
546	A	63.5	Low	79.5	Confident	35 Å²	35	77.9 Å²	77.9	29%	0.289	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-59	-24.9	-179.7	0	0	0	0	0	113.4	D548 E549 N552 K554	A546-D548 VanDerWaalsContact C-N 3.27Å; A546-D548 PolarHBondContact O-N 3.36Å; A546-E549 PolarHBondContact O-N 3.11Å; A546-N552 WeakPolarHBondContact O-CA 3.36Å; A546-K554 HydrophobicContact CB-CB 4.21Å
547	I	62.3	Low	79	Confident	140 Å²	140	87 Å²	87	72%	0.718	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-68.2	-26.5	176.7	-51.3	168.8	0	0	0	111.7	R545 E549	R545-I547 PolarHBondContact O-N 3.27Å; R545-I547 VanDerWaalsContact O-N 3.08Å; I547-E549 VanDerWaalsContact C-N 3.3Å; I547-E549 PolarHBondContact O-N 3.19Å
548	D	66.3	Low	78.5	Confident	97 Å²	97	81.5 Å²	81.5	52%	0.519	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-90.5	8.1	-176.8	-48.7	-43	0	0	0	112.6	R545 A546 K591	R545-D548 WeakPolarHBondContact CB-OD2 3.24Å; R545-D548 PolarHBondContact N-OD2 2.81Å; R545-D548 WeakPolarHBondContact O-CB 3.34Å; R545-D548 PolarHBondContact O-N 3.19Å; A546-D548 VanDerWaalsContact C-N 3.27Å; A546-D548 PolarHBondContact O-N 3.36Å; D548-K591 PolarHBondContact O-NZ 3.47Å; D548-K591 VanDerWaalsContact O-NZ 3.15Å
549	E	68.9	Low	77.9	Confident	18 Å²	18	88 Å²	88	8%	0.084	42%	0.417	C	S	.	.	S	Bend	trans	-117.9	142.1	179.4	-65.2	-57	156.3	0	0	111.6	T544 A546 I547 N551 N552 N562 K591	T544-E549 PolarHBondContact OG1-OE1 3.26Å; A546-E549 PolarHBondContact O-N 3.11Å; I547-E549 VanDerWaalsContact C-N 3.3Å; I547-E549 PolarHBondContact O-N 3.19Å; E549-N551 PolarHBondContact O-N 3.49Å; E549-N552 PolarHBondContact O-N 3.23Å; E549-N562 WeakPolarHBondContact CG-ND2 3.3Å; E549-N562 PolarHBondContact OE2-ND2 3Å; E549-K591 WeakPolarHBondContact OE1-CE 3.32Å; E549-K591 IonicContact OE1-NZ 3.51Å; E549-K591 PolarHBondContact OE1-NZ 2.88Å; E549-K591 IonicContact OE2-NZ 3.24Å
550	P	65	Low	77.3	Confident	64 Å²	64	93.1 Å²	93.1	42%	0.416	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-61.5	137.6	176.3	27	-33.4	0	0	0	110.6	N552 K560	P550-N552 VanDerWaalsContact C-N 3.29Å; P550-N552 PolarHBondContact O-N 2.97Å; P550-K560 HydrophobicContact CG-CD 4.07Å
551	N	67.3	Low	76.9	Confident	144 Å²	144	89.3 Å²	89.3	77%	0.77	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	66.5	16.6	-177.8	-50.7	-18.1	0	0	0	115.6	E549 C553	E549-N551 PolarHBondContact O-N 3.49Å; N551-C553 PolarHBondContact O-N 3.22Å
552	N	75.5	Confident	76.6	Confident	118 Å²	118	82.5 Å²	82.5	63%	0.631	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	55.4	21	178.6	-64.8	-27.6	0	0	0	115	A546 E549 P550	A546-N552 WeakPolarHBondContact O-CA 3.36Å; E549-N552 PolarHBondContact O-N 3.23Å; P550-N552 VanDerWaalsContact C-N 3.29Å; P550-N552 PolarHBondContact O-N 2.97Å
553	C	81.6	Confident	76.5	Confident	54 Å²	54	80.7 Å²	80.7	37%	0.365	39%	0.393	S	S	.	.			trans	-94.7	123.6	-175.4	-163.3	0	0	0	0	110.8	N551 C558	N551-C553 PolarHBondContact O-N 3.22Å; C553-C558 VanDerWaalsContact CA-SG 3.58Å; C553-C558 HydrophobicContact CB-CB 3.88Å; C553-C558 WeakPolarHBondContact CB-SG 3.28Å; C553-C558 WeakPolarHBondContact SG-CB 3.45Å; C553-C558 CovalentContact SG-SG 2.03Å; C553-C558 PolarHBondContact SG-SG 3.22Å
554	K	82.9	Confident	76.7	Confident	90 Å²	90	76.1 Å²	76.1	39%	0.391	37%	0.372	S	S	.	.			trans	-116.6	143.3	177.3	-174.2	-177.4	179.5	-172.4	0	111.1	E543 A546 C558	E543-K554 IonicContact OE1-NZ 3.54Å; E543-K554 PolarHBondContact OE1-NZ 3.34Å; A546-K554 HydrophobicContact CB-CB 4.21Å; K554-C558 VanDerWaalsContact C-SG 3.51Å; K554-C558 PolarHBondContact N-SG 3.01Å; K554-C558 PolarHBondContact O-SG 3.1Å
555	G	84.4	Confident	77.5	Confident	3 Å²	3	75.3 Å²	75.3	3%	0.031	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	100.5	171.6	173.2	0	0	0	0	0	113.7	R557 C558 N562 E570	G555-R557 PolarHBondContact O-N 3Å; G555-R557 VanDerWaalsContact O-N 3.14Å; G555-C558 WeakPolarHBondContact O-CB 3.35Å; G555-C558 PolarHBondContact O-N 3.28Å; G555-N562 CarbonylContact C-O 3.58Å; G555-N562 VanDerWaalsContact C-O 3.25Å; G555-N562 VanDerWaalsContact CA-O 3.26Å; G555-N562 WeakPolarHBondContact CA-O 3.41Å; G555-N562 PolarHBondContact N-O 3.38Å; G555-E570 WeakPolarHBondContact CA-OE2 3.31Å
556	I	86.4	Confident	78.5	Confident	9 Å²	9	66.6 Å²	66.6	5%	0.046	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.8	-173.3	-175.2	170.8	0	0	0	114.3	C558 E570 Q573 S574 W577 L583	I556-C558 PolarHBondContact O-N 3.27Å; I556-E570 WeakPolarHBondContact CG2-OE2 3.45Å; I556-E570 PolarHBondContact N-OE2 2.93Å; I556-Q573 HydrophobicContact CG2-CG 4.13Å; I556-S574 WeakPolarHBondContact CD1-OG 3.28Å; I556-W577 HydrophobicContact CD1-CB 4.28Å; I556-L583 HydrophobicContact CD1-CD1 3.56Å; I556-L583 HydrophobicContact CD1-CD2 3.63Å; I556-L583 HydrophobicContact CD1-CG 3.6Å; I556-L583 HydrophobicContact CG1-CD2 4.14Å; I556-L583 HydrophobicContact CG1-CG 4.47Å
557	R	84.2	Confident	79.9	Confident	218 Å²	218	67.4 Å²	67.4	82%	0.823	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-3.7	-177.5	-59.2	178	71.9	161.8	1.1	113.6	G555	G555-R557 PolarHBondContact O-N 3Å; G555-R557 VanDerWaalsContact O-N 3.14Å
558	C	83.6	Confident	81.3	Confident	12 Å²	12	64 Å²	64	8%	0.081	32%	0.319	C	S	.	.	S	Bend	trans	-81.6	153.3	174.6	-60.6	0	0	0	0	111.8	C553 K554 G555 I556 K560 Q561	C553-C558 VanDerWaalsContact CA-SG 3.58Å; C553-C558 HydrophobicContact CB-CB 3.88Å; C553-C558 WeakPolarHBondContact CB-SG 3.28Å; C553-C558 WeakPolarHBondContact SG-CB 3.45Å; C553-C558 CovalentContact SG-SG 2.03Å; C553-C558 PolarHBondContact SG-SG 3.22Å; K554-C558 VanDerWaalsContact C-SG 3.51Å; K554-C558 PolarHBondContact N-SG 3.01Å; K554-C558 PolarHBondContact O-SG 3.1Å; G555-C558 WeakPolarHBondContact O-CB 3.35Å; G555-C558 PolarHBondContact O-N 3.28Å; I556-C558 PolarHBondContact O-N 3.27Å; C558-K560 PolarHBondContact O-N 3.34Å; C558-K560 VanDerWaalsContact O-N 3.15Å; C558-Q561 PolarHBondContact O-N 3.03Å
559	E	82	Confident	82.6	Confident	176 Å²	176	66 Å²	66	82%	0.822	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-37.3	-180	-173.1	-177	-177.7	0	0	113.6
560	K	79.4	Confident	83.6	Confident	121 Å²	121	67.1 Å²	67.1	53%	0.526	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	4.2	177.8	-66.5	-169.8	176.6	-174.5	0	115.1	P550 C558 N562 Y586	P550-K560 HydrophobicContact CG-CD 4.07Å; C558-K560 PolarHBondContact O-N 3.34Å; C558-K560 VanDerWaalsContact O-N 3.15Å; K560-N562 VanDerWaalsContact C-N 3.29Å; K560-N562 PolarHBondContact O-N 3.29Å; K560-N562 PolarHBondContact O-OD1 3.32Å; K560-Y586 WeakPolarHBondContact O-CE2 3.39Å
561	Q	81.9	Confident	85	Confident	28 Å²	28	64.1 Å²	64.1	13%	0.131	31%	0.309	C	S	.	.			trans	47.2	44.6	177.2	-56.3	-168.9	-43.6	0	0	114.8	C558 L582 N584 Y586 V587	C558-Q561 PolarHBondContact O-N 3.03Å; Q561-L582 PolarHBondContact NE2-O 3.47Å; Q561-N584 VanDerWaalsContact OE1-N 3.15Å; Q561-N584 PolarHBondContact OE1-ND2 2.88Å; Q561-Y586 HydrophobicContact CB-CE2 4.2Å; Q561-V587 HydrophobicContact CB-CG1 3.72Å
562	N	83.1	Confident	86.3	Confident	31 Å²	31	59.2 Å²	59.2	17%	0.166	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-72.8	147.2	-174.9	-68.1	-22.6	0	0	0	112.9	E549 G555 K560 A564	E549-N562 WeakPolarHBondContact CG-ND2 3.3Å; E549-N562 PolarHBondContact OE2-ND2 3Å; G555-N562 CarbonylContact C-O 3.58Å; G555-N562 VanDerWaalsContact C-O 3.25Å; G555-N562 VanDerWaalsContact CA-O 3.26Å; G555-N562 WeakPolarHBondContact CA-O 3.41Å; G555-N562 PolarHBondContact N-O 3.38Å; K560-N562 VanDerWaalsContact C-N 3.29Å; K560-N562 PolarHBondContact O-N 3.29Å; K560-N562 PolarHBondContact O-OD1 3.32Å; N562-A564 VanDerWaalsContact C-N 3.3Å; N562-A564 PolarHBondContact O-N 2.84Å
563	N	84.1	Confident	87.2	Confident	29 Å²	29	55.3 Å²	55.3	16%	0.155	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	31.4	170.9	-62.7	-19.9	0	0	0	115.7	T544 F565 S566	T544-N563 PolarHBondContact O-ND2 2.69Å; T544-N563 VanDerWaalsContact O-ND2 3.08Å; T544-N563 PolarHBondContact OG1-ND2 3.09Å; T544-N563 PolarHBondContact OG1-OD1 3.35Å; N563-F565 PolarHBondContact O-N 3.07Å; N563-F565 VanDerWaalsContact O-N 3.07Å; N563-S566 PolarHBondContact O-N 3Å; N563-S566 PolarHBondContact O-OG 3.41Å
564	A	86.4	Confident	87.7	Confident	2 Å²	2	52.8 Å²	52.8	2%	0.017	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-35.1	-178	0	0	0	0	0	114.7	N562 E570 T571 S574 V587	N562-A564 VanDerWaalsContact C-N 3.3Å; N562-A564 PolarHBondContact O-N 2.84Å; A564-E570 CarbonylContact O-C 3.25Å; A564-T571 WeakPolarHBondContact O-CA 3.24Å; A564-T571 PolarHBondContact O-N 3.41Å; A564-S574 WeakPolarHBondContact CB-OG 3.1Å; A564-S574 PolarHBondContact O-OG 3.12Å; A564-V587 HydrophobicContact CB-CB 4.01Å; A564-V587 HydrophobicContact CB-CG1 4.48Å
565	F	91.4	Very high	88.3	Confident	5 Å²	5	48.5 Å²	48.5	2%	0.022	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	17.2	-174.6	-50.1	-51.9	0	0	0	114.2	L535 Y539 N563 T571 V587 T588 F605	L535-F565 HydrophobicContact CB-CD1 4.43Å; L535-F565 HydrophobicContact CD1-CD1 4.49Å; L535-F565 HydrophobicContact CD1-CE1 4.24Å; Y539-F565 WeakPolarHBondContact CB-O 3.49Å; Y539-F565 HydrophobicContact CD2-CB 3.65Å; Y539-F565 AromaticContact CD2-CD2 3.67Å; Y539-F565 HydrophobicContact CD2-CD2 3.67Å; Y539-F565 AromaticContact CD2-CG 3.97Å; Y539-F565 HydrophobicContact CD2-CG 3.97Å; Y539-F565 AromaticContact CE2-CD2 3.75Å; Y539-F565 HydrophobicContact CE2-CD2 3.75Å; Y539-F565 HydrophobicContact CE2-CE2 4.39Å; Y539-F565 HydrophobicContact CE2-CG 4.45Å; Y539-F565 HydrophobicContact CG-CB 3.85Å; Y539-F565 HydrophobicContact CG-CD2 4.26Å; N563-F565 PolarHBondContact O-N 3.07Å; N563-F565 VanDerWaalsContact O-N 3.07Å; F565-T571 WeakPolarHBondContact CA-OG1 3.15Å; F565-T571 HydrophobicContact CD1-CG2 3.97Å; F565-V587 HydrophobicContact CE2-CG2 3.9Å; F565-V587 HydrophobicContact CZ-CG2 4Å; F565-T588 HydrophobicContact CE2-CG2 3.76Å; F565-T588 HydrophobicContact CZ-CG2 4.48Å; F565-F605 HydrophobicContact CZ-CD2 4.19Å; F565-F605 HydrophobicContact CZ-CE2 4.46Å
566	S	88.6	Confident	88.8	Confident	5 Å²	5	52.6 Å²	52.6	4%	0.035	24%	0.242	C	C	.	.	S	Bend	trans	-80.7	-22.4	-173.4	75.6	0	0	0	0	114.5	N563	N563-S566 PolarHBondContact O-N 3Å; N563-S566 PolarHBondContact O-OG 3.41Å
567	T	91.4	Very high	89.2	Confident	52 Å²	52	56.8 Å²	56.8	32%	0.319	26%	0.257	S	S	.	.	S	Bend	trans	-135.5	155	176.5	67.1	0	0	0	0	109.9	N536 F569 E570 T571	N536-T567 WeakPolarHBondContact OD1-CA 3.39Å; T567-F569 VanDerWaalsContact C-N 3.27Å; T567-F569 PolarHBondContact O-N 2.93Å; T567-E570 PolarHBondContact O-N 2.97Å; T567-E570 PolarHBondContact OG1-N 3.43Å; T567-T571 WeakPolarHBondContact O-CB 3.34Å; T567-T571 PolarHBondContact O-N 3.23Å; T567-T571 PolarHBondContact O-OG1 3.16Å
568	L	93.1	Very high	89.6	Confident	68 Å²	68	46.7 Å²	46.7	36%	0.356	22%	0.22	S	C	.	.	H	α-helix	trans	-57.7	-41.2	-179.7	-174.7	65.1	0	0	0	111.8	A532 N533 N536 T571 L572	A532-L568 HydrophobicContact CB-CD1 4.01Å; N533-L568 WeakPolarHBondContact OD1-CD1 3.48Å; N536-L568 HydrophobicContact CB-CD1 4.48Å; N536-L568 PolarHBondContact OD1-N 3.48Å; L568-T571 PolarHBondContact O-N 3.4Å; L568-L572 HydrophobicContact CD1-CG 4.44Å; L568-L572 HydrophobicContact CG-CD1 4.05Å; L568-L572 HydrophobicContact CG-CG 4.4Å; L568-L572 WeakPolarHBondContact O-CB 3.38Å; L568-L572 WeakPolarHBondContact O-CG 3.21Å; L568-L572 PolarHBondContact O-N 3.12Å
569	F	92.5	Very high	90.1	Very high	140 Å²	140	47.9 Å²	47.9	61%	0.614	23%	0.227	S	C	*	.	H	α-helix	trans	-65.9	-48.5	-180	-176	-96	0	0	0	112.9	T567 T571 L572 Q573	T567-F569 VanDerWaalsContact C-N 3.27Å; T567-F569 PolarHBondContact O-N 2.93Å; F569-T571 VanDerWaalsContact C-N 3.26Å; F569-T571 PolarHBondContact O-N 2.88Å; F569-L572 PolarHBondContact O-N 3.36Å; F569-Q573 WeakPolarHBondContact O-CB 3.28Å; F569-Q573 PolarHBondContact O-N 2.88Å
570	E	90.9	Very high	90.6	Very high	41 Å²	41	45.3 Å²	45.3	19%	0.192	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-35	174.4	-71.5	-69.5	141.6	0	0	111.2	G555 I556 A564 T567 Q573 S574	G555-E570 WeakPolarHBondContact CA-OE2 3.31Å; I556-E570 WeakPolarHBondContact CG2-OE2 3.45Å; I556-E570 PolarHBondContact N-OE2 2.93Å; A564-E570 CarbonylContact O-C 3.25Å; T567-E570 PolarHBondContact O-N 2.97Å; T567-E570 PolarHBondContact OG1-N 3.43Å; E570-Q573 PolarHBondContact O-N 3.28Å; E570-S574 VanDerWaalsContact O-CB 3.24Å; E570-S574 WeakPolarHBondContact O-CB 3.34Å; E570-S574 PolarHBondContact O-N 3.24Å; E570-S574 PolarHBondContact O-OG 3.43Å
571	T	94.3	Very high	91.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.4	-45.4	176.7	-53.9	0	0	0	0	111.6	A532 L535 N536 A564 F565 T567 L568 F569 S574 L575	A532-T571 HydrophobicContact CB-CG2 3.88Å; A532-T571 WeakPolarHBondContact O-CG2 3.28Å; L535-T571 HydrophobicContact CB-CG2 3.98Å; N536-T571 HydrophobicContact CB-CG2 4.45Å; A564-T571 WeakPolarHBondContact O-CA 3.24Å; A564-T571 PolarHBondContact O-N 3.41Å; F565-T571 WeakPolarHBondContact CA-OG1 3.15Å; F565-T571 HydrophobicContact CD1-CG2 3.97Å; T567-T571 WeakPolarHBondContact O-CB 3.34Å; T567-T571 PolarHBondContact O-N 3.23Å; T567-T571 PolarHBondContact O-OG1 3.16Å; L568-T571 PolarHBondContact O-N 3.4Å; F569-T571 VanDerWaalsContact C-N 3.26Å; F569-T571 PolarHBondContact O-N 2.88Å; T571-S574 WeakPolarHBondContact O-CB 3.32Å; T571-S574 PolarHBondContact O-N 3.46Å; T571-L575 HydrophobicContact CG2-CD1 4.47Å; T571-L575 WeakPolarHBondContact O-CG 3.45Å; T571-L575 PolarHBondContact O-N 2.9Å
572	L	94.9	Very high	91.7	Very high	42 Å²	42	46 Å²	46	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-45.8	175.4	-69.4	166.6	0	0	0	111.1	L528 L529 A532 L568 F569 S574 L575 F576	L528-L572 HydrophobicContact CD2-CB 4.48Å; L528-L572 HydrophobicContact CD2-CD2 3.33Å; L528-L572 HydrophobicContact CD2-CG 4.49Å; L528-L572 HydrophobicContact CG-CD2 4.43Å; L529-L572 HydrophobicContact CD2-CD2 3.85Å; L529-L572 HydrophobicContact CG-CD2 4.45Å; A532-L572 HydrophobicContact CB-CD2 3.41Å; A532-L572 VanDerWaalsContact CB-CD2 3.41Å; A532-L572 HydrophobicContact CB-CG 3.91Å; L568-L572 HydrophobicContact CD1-CG 4.44Å; L568-L572 HydrophobicContact CG-CD1 4.05Å; L568-L572 HydrophobicContact CG-CG 4.4Å; L568-L572 WeakPolarHBondContact O-CB 3.38Å; L568-L572 WeakPolarHBondContact O-CG 3.21Å; L568-L572 PolarHBondContact O-N 3.12Å; F569-L572 PolarHBondContact O-N 3.36Å; L572-S574 VanDerWaalsContact C-N 3.28Å; L572-S574 PolarHBondContact O-N 2.82Å; L572-L575 PolarHBondContact O-N 3.46Å; L572-F576 WeakPolarHBondContact O-CB 3.3Å; L572-F576 PolarHBondContact O-N 3.39Å
573	Q	93.4	Very high	92.1	Very high	36 Å²	36	45.5 Å²	45.5	17%	0.168	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-37.5	175.8	-173.6	173.3	-75.9	0	0	111.2	I556 F569 E570 W577	I556-Q573 HydrophobicContact CG2-CG 4.13Å; F569-Q573 WeakPolarHBondContact O-CB 3.28Å; F569-Q573 PolarHBondContact O-N 2.88Å; E570-Q573 PolarHBondContact O-N 3.28Å; Q573-W577 PolarHBondContact O-N 3.08Å
574	S	93.3	Very high	92.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.8	-54.6	176.7	-62.1	0	0	0	0	111.7	I556 A564 E570 T571 L572 F576 W577 S578 L583	I556-S574 WeakPolarHBondContact CD1-OG 3.28Å; A564-S574 WeakPolarHBondContact CB-OG 3.1Å; A564-S574 PolarHBondContact O-OG 3.12Å; E570-S574 VanDerWaalsContact O-CB 3.24Å; E570-S574 WeakPolarHBondContact O-CB 3.34Å; E570-S574 PolarHBondContact O-N 3.24Å; E570-S574 PolarHBondContact O-OG 3.43Å; T571-S574 WeakPolarHBondContact O-CB 3.32Å; T571-S574 PolarHBondContact O-N 3.46Å; L572-S574 VanDerWaalsContact C-N 3.28Å; L572-S574 PolarHBondContact O-N 2.82Å; S574-F576 PolarHBondContact O-N 2.85Å; S574-W577 PolarHBondContact O-N 2.85Å; S574-S578 PolarHBondContact O-N 3.36Å; S574-L583 VanDerWaalsContact C-CD1 3.5Å; S574-L583 WeakPolarHBondContact O-CD1 3.2Å
575	L	94.8	Very high	92.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-34.5	177.9	-67	-178.9	0	0	0	112.6	L528 F531 A532 L535 T571 L572 S578 F605 Y608	L528-L575 HydrophobicContact CD1-CB 4.26Å; L528-L575 HydrophobicContact CG-CB 4.3Å; F531-L575 HydrophobicContact CB-CD1 3.78Å; A532-L575 HydrophobicContact CB-CD1 3.97Å; L535-L575 HydrophobicContact CD1-CD1 4.26Å; L535-L575 HydrophobicContact CD1-CD2 3.72Å; L535-L575 HydrophobicContact CD1-CG 4.36Å; T571-L575 HydrophobicContact CG2-CD1 4.47Å; T571-L575 WeakPolarHBondContact O-CG 3.45Å; T571-L575 PolarHBondContact O-N 2.9Å; L572-L575 PolarHBondContact O-N 3.46Å; L575-S578 PolarHBondContact O-OG 2.73Å; L575-F605 HydrophobicContact CD2-CD2 3.98Å; L575-F605 HydrophobicContact CD2-CE2 4.24Å; L575-Y608 HydrophobicContact CB-CE1 4Å; L575-Y608 HydrophobicContact CB-CE2 4.38Å; L575-Y608 HydrophobicContact CD1-CE2 4.5Å; L575-Y608 HydrophobicContact CD2-CD1 3.64Å; L575-Y608 HydrophobicContact CD2-CD2 4.42Å; L575-Y608 HydrophobicContact CD2-CE1 3.81Å; L575-Y608 HydrophobicContact CD2-CG 3.96Å; L575-Y608 HydrophobicContact CG-CE1 4.46Å; L575-Y608 PolarHBondContact O-OH 2.93Å; L575-Y608 VanDerWaalsContact O-OH 3.05Å
576	F	94.5	Very high	92.2	Very high	89 Å²	89	57.9 Å²	57.9	39%	0.39	29%	0.294	S	S	.	.	H	α-helix	trans	-62	-48.3	171.1	176	-98.1	0	0	0	113	L528 L572 S574 S578 V579 F580	L528-F576 HydrophobicContact CD1-CB 4.34Å; L572-F576 WeakPolarHBondContact O-CB 3.3Å; L572-F576 PolarHBondContact O-N 3.39Å; S574-F576 PolarHBondContact O-N 2.85Å; F576-S578 VanDerWaalsContact C-N 3.33Å; F576-S578 PolarHBondContact O-N 3.04Å; F576-V579 PolarHBondContact O-N 3.06Å; F576-F580 HydrophobicContact CD1-CE2 4.34Å; F576-F580 HydrophobicContact CD2-CE2 4.49Å; F576-F580 AromaticContact CE1-CE2 3.81Å; F576-F580 HydrophobicContact CE1-CE2 3.81Å; F576-F580 AromaticContact CE2-CE2 3.99Å; F576-F580 HydrophobicContact CE2-CE2 3.99Å; F576-F580 HydrophobicContact CE2-CZ 4.47Å; F576-F580 AromaticContact CZ-CE2 3.63Å; F576-F580 HydrophobicContact CZ-CE2 3.63Å; F576-F580 HydrophobicContact CZ-CZ 4.19Å; F576-F580 WeakPolarHBondContact O-CD2 3.35Å
577	W	94.5	Very high	92.2	Very high	97 Å²	97	58.4 Å²	58.4	37%	0.367	30%	0.297	S	S	.	.	H	α-helix	trans	-71.9	-22.6	-179.3	-71.2	123.1	0	0	0	114.1	I556 Q573 S574 V579 F580 L582 L583	I556-W577 HydrophobicContact CD1-CB 4.28Å; Q573-W577 PolarHBondContact O-N 3.08Å; S574-W577 PolarHBondContact O-N 2.85Å; W577-V579 VanDerWaalsContact C-N 3.31Å; W577-V579 PolarHBondContact O-N 3.34Å; W577-F580 AromaticContact CE3-CD2 3.93Å; W577-F580 HydrophobicContact CE3-CD2 3.93Å; W577-F580 HydrophobicContact CZ3-CD2 4.35Å; W577-F580 PolarHBondContact O-N 3.4Å; W577-L582 HydrophobicContact CE3-CD1 3.78Å; W577-L582 HydrophobicContact CZ3-CD1 4.09Å; W577-L582 PolarHBondContact O-N 3.45Å; W577-L583 HydrophobicContact CB-CD1 4.39Å
578	S	93.6	Very high	92.2	Very high	6 Å²	6	56 Å²	56	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-70.3	-27.4	177.8	82.1	0	0	0	0	113.1	S574 L575 F576 F580 G581 Y608 N609	S574-S578 PolarHBondContact O-N 3.36Å; L575-S578 PolarHBondContact O-OG 2.73Å; F576-S578 VanDerWaalsContact C-N 3.33Å; F576-S578 PolarHBondContact O-N 3.04Å; S578-F580 PolarHBondContact O-N 2.57Å; S578-G581 PolarHBondContact O-N 2.77Å; S578-Y608 WeakPolarHBondContact OG-CE1 3.42Å; S578-N609 PolarHBondContact OG-OD1 3.02Å
579	V	93.4	Very high	92	Very high	37 Å²	37	57.5 Å²	57.5	22%	0.224	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27	172.8	172.8	0	0	0	0	112	Y524 F576 W577 Y608 L613	Y524-V579 HydrophobicContact CE2-CG2 4.2Å; Y524-V579 WeakPolarHBondContact OH-CG2 3.38Å; F576-V579 PolarHBondContact O-N 3.06Å; W577-V579 VanDerWaalsContact C-N 3.31Å; W577-V579 PolarHBondContact O-N 3.34Å; V579-Y608 HydrophobicContact CG2-CE1 4.27Å; V579-L613 HydrophobicContact CB-CD2 4.39Å; V579-L613 HydrophobicContact CG1-CD2 3.9Å; V579-L613 WeakPolarHBondContact O-CD2 3.5Å
580	F	93.8	Very high	91.7	Very high	123 Å²	123	51.9 Å²	51.9	54%	0.539	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	2.2	174	-56.9	-74.2	0	0	0	113.6	F576 W577 S578 L582	F576-F580 HydrophobicContact CD1-CE2 4.34Å; F576-F580 HydrophobicContact CD2-CE2 4.49Å; F576-F580 AromaticContact CE1-CE2 3.81Å; F576-F580 HydrophobicContact CE1-CE2 3.81Å; F576-F580 AromaticContact CE2-CE2 3.99Å; F576-F580 HydrophobicContact CE2-CE2 3.99Å; F576-F580 HydrophobicContact CE2-CZ 4.47Å; F576-F580 AromaticContact CZ-CE2 3.63Å; F576-F580 HydrophobicContact CZ-CE2 3.63Å; F576-F580 HydrophobicContact CZ-CZ 4.19Å; F576-F580 WeakPolarHBondContact O-CD2 3.35Å; W577-F580 AromaticContact CE3-CD2 3.93Å; W577-F580 HydrophobicContact CE3-CD2 3.93Å; W577-F580 HydrophobicContact CZ3-CD2 4.35Å; W577-F580 PolarHBondContact O-N 3.4Å; S578-F580 PolarHBondContact O-N 2.57Å; F580-L582 VanDerWaalsContact C-N 3.27Å; F580-L582 HydrophobicContact CB-CD1 4.25Å; F580-L582 HydrophobicContact CB-CG 4.09Å; F580-L582 PolarHBondContact O-N 3.26Å
581	G	91.9	Very high	91.3	Very high	63 Å²	63	56.4 Å²	56.4	65%	0.649	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	17.1	-177.2	0	0	0	0	0	114.7	S578 L583	S578-G581 PolarHBondContact O-N 2.77Å; G581-L583 VanDerWaalsContact C-N 3.3Å; G581-L583 PolarHBondContact O-N 3.26Å
582	L	91.4	Very high	90.8	Very high	101 Å²	101	58.4 Å²	58.4	53%	0.529	30%	0.303	S	S	.	.			trans	-86.7	2.5	-177.6	-61.8	180	0	0	0	114	Q561 W577 F580	Q561-L582 PolarHBondContact NE2-O 3.47Å; W577-L582 HydrophobicContact CE3-CD1 3.78Å; W577-L582 HydrophobicContact CZ3-CD1 4.09Å; W577-L582 PolarHBondContact O-N 3.45Å; F580-L582 VanDerWaalsContact C-N 3.27Å; F580-L582 HydrophobicContact CB-CD1 4.25Å; F580-L582 HydrophobicContact CB-CG 4.09Å; F580-L582 PolarHBondContact O-N 3.26Å
583	L	91.4	Very high	90.2	Very high	20 Å²	20	67.7 Å²	67.7	11%	0.105	34%	0.335	C	S	.	.			trans	-107.7	128.9	178	-101.5	159	0	0	0	111.6	I556 S574 W577 G581 V587 F605	I556-L583 HydrophobicContact CD1-CD1 3.56Å; I556-L583 HydrophobicContact CD1-CD2 3.63Å; I556-L583 HydrophobicContact CD1-CG 3.6Å; I556-L583 HydrophobicContact CG1-CD2 4.14Å; I556-L583 HydrophobicContact CG1-CG 4.47Å; S574-L583 VanDerWaalsContact C-CD1 3.5Å; S574-L583 WeakPolarHBondContact O-CD1 3.2Å; W577-L583 HydrophobicContact CB-CD1 4.39Å; G581-L583 VanDerWaalsContact C-N 3.3Å; G581-L583 PolarHBondContact O-N 3.26Å; L583-V587 HydrophobicContact CD2-CB 4.17Å; L583-V587 HydrophobicContact CD2-CG1 3.64Å; L583-V587 HydrophobicContact CD2-CG2 3.82Å; L583-F605 HydrophobicContact CB-CZ 4.38Å
584	N	89.3	Confident	90.1	Very high	77 Å²	77	70.3 Å²	70.3	41%	0.412	35%	0.347	S	S	.	.			trans	-82.6	153	174.5	-62.7	-73.5	0	0	0	111.2	Q561 Y586 V587	Q561-N584 VanDerWaalsContact OE1-N 3.15Å; Q561-N584 PolarHBondContact OE1-ND2 2.88Å; N584-Y586 VanDerWaalsContact C-N 3.27Å; N584-Y586 HydrophobicContact CB-CD1 3.51Å; N584-Y586 HydrophobicContact CB-CE1 3.16Å; N584-Y586 HydrophobicContact CB-CE2 4.31Å; N584-Y586 HydrophobicContact CB-CG 4.22Å; N584-Y586 PolarHBondContact ND2-OH 2.91Å; N584-Y586 PolarHBondContact O-N 2.74Å; N584-V587 WeakPolarHBondContact O-CG1 3.41Å; N584-V587 WeakPolarHBondContact O-CG2 3.48Å
585	L	87.1	Confident	90	Very high	119 Å²	119	77.5 Å²	77.5	62%	0.623	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-64.9	-29.6	-178.7	-167.8	68.3	0	0	0	113.1	V587 T588 F605	L585-V587 PolarHBondContact O-N 2.63Å; L585-T588 PolarHBondContact O-N 3.23Å; L585-T588 PolarHBondContact O-OG1 3.45Å; L585-F605 HydrophobicContact CD1-CD1 4.46Å
586	Y	87.8	Confident	89.9	Confident	100 Å²	100	85.1 Å²	85.1	39%	0.392	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-64.7	-10.4	-175.1	62.8	-110.7	0	0	0	114.6	K560 Q561 N584 T588 N589	K560-Y586 WeakPolarHBondContact O-CE2 3.39Å; Q561-Y586 HydrophobicContact CB-CE2 4.2Å; N584-Y586 VanDerWaalsContact C-N 3.27Å; N584-Y586 HydrophobicContact CB-CD1 3.51Å; N584-Y586 HydrophobicContact CB-CE1 3.16Å; N584-Y586 HydrophobicContact CB-CE2 4.31Å; N584-Y586 HydrophobicContact CB-CG 4.22Å; N584-Y586 PolarHBondContact ND2-OH 2.91Å; N584-Y586 PolarHBondContact O-N 2.74Å; Y586-T588 PolarHBondContact O-N 3.2Å; Y586-N589 VanDerWaalsContact O-CB 3.28Å; Y586-N589 WeakPolarHBondContact O-CB 3.36Å; Y586-N589 PolarHBondContact O-N 3.1Å
587	V	88.9	Confident	89.8	Confident	15 Å²	15	82 Å²	82	9%	0.091	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-67.8	-14.6	175.1	-58.1	0	0	0	0	114	Q561 A564 F565 L583 N584 L585 N589	Q561-V587 HydrophobicContact CB-CG1 3.72Å; A564-V587 HydrophobicContact CB-CB 4.01Å; A564-V587 HydrophobicContact CB-CG1 4.48Å; F565-V587 HydrophobicContact CE2-CG2 3.9Å; F565-V587 HydrophobicContact CZ-CG2 4Å; L583-V587 HydrophobicContact CD2-CB 4.17Å; L583-V587 HydrophobicContact CD2-CG1 3.64Å; L583-V587 HydrophobicContact CD2-CG2 3.82Å; N584-V587 WeakPolarHBondContact O-CG1 3.41Å; N584-V587 WeakPolarHBondContact O-CG2 3.48Å; L585-V587 PolarHBondContact O-N 2.63Å; V587-N589 VanDerWaalsContact C-N 3.33Å
588	T	90.8	Very high	89.7	Confident	3 Å²	3	79.3 Å²	79.3	2%	0.018	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-84.9	-7.5	170.5	55.9	0	0	0	0	112.7	Y539 F565 L585 Y586 A602 F605	Y539-T588 WeakPolarHBondContact OH-CB 3.4Å; Y539-T588 PolarHBondContact OH-O 3Å; F565-T588 HydrophobicContact CE2-CG2 3.76Å; F565-T588 HydrophobicContact CZ-CG2 4.48Å; L585-T588 PolarHBondContact O-N 3.23Å; L585-T588 PolarHBondContact O-OG1 3.45Å; Y586-T588 PolarHBondContact O-N 3.2Å; T588-A602 HydrophobicContact CG2-CB 4.36Å; T588-F605 HydrophobicContact CG2-CB 4.36Å; T588-F605 HydrophobicContact CG2-CD1 4.49Å
589	N	89.3	Confident	89.7	Confident	98 Å²	98	85.7 Å²	85.7	52%	0.524	42%	0.421	S	S	.	.			trans	-80.3	146.8	180	-59.4	2.3	0	0	0	110.5	Y586 V587 E598	Y586-N589 VanDerWaalsContact O-CB 3.28Å; Y586-N589 WeakPolarHBondContact O-CB 3.36Å; Y586-N589 PolarHBondContact O-N 3.1Å; V587-N589 VanDerWaalsContact C-N 3.33Å; N589-E598 VanDerWaalsContact CA-OE1 3.29Å; N589-E598 WeakPolarHBondContact CA-OE1 3.43Å
590	V	87.1	Confident	89.8	Confident	23 Å²	23	85.9 Å²	85.9	14%	0.139	42%	0.422	C	S	.	.			trans	-115.9	144.9	-175.9	-178.1	0	0	0	0	108.9	Y539 Y542 A592 E598	Y539-V590 HydrophobicContact CD1-CG2 4.08Å; Y539-V590 HydrophobicContact CE1-CG2 3.7Å; Y542-V590 HydrophobicContact CD1-CG1 3.37Å; Y542-V590 HydrophobicContact CD2-CG1 4.05Å; Y542-V590 HydrophobicContact CD2-CG2 4.06Å; Y542-V590 HydrophobicContact CE1-CG1 3.77Å; Y542-V590 HydrophobicContact CE2-CG1 4.39Å; Y542-V590 HydrophobicContact CE2-CG2 4.35Å; Y542-V590 HydrophobicContact CG-CG1 3.52Å; Y542-V590 HydrophobicContact CG-CG2 4.28Å; V590-A592 HydrophobicContact CG1-CB 4.22Å; V590-A592 PolarHBondContact O-N 3.06Å; V590-E598 HydrophobicContact CB-CG 4.29Å; V590-E598 HydrophobicContact CG2-CG 4.08Å; V590-E598 PolarHBondContact N-OE1 3.35Å
591	K	82.4	Confident	89.9	Confident	136 Å²	136	80 Å²	80	59%	0.591	40%	0.397	S	S	*	.	S	Bend	trans	-63.5	-26.1	177.8	-68.3	-168.6	-177.3	176.3	0	113.1	T544 D548 E549	T544-K591 HydrophobicContact CG2-CD 3.85Å; T544-K591 HydrophobicContact CG2-CG 4.48Å; D548-K591 PolarHBondContact O-NZ 3.47Å; D548-K591 VanDerWaalsContact O-NZ 3.15Å; E549-K591 WeakPolarHBondContact OE1-CE 3.32Å; E549-K591 IonicContact OE1-NZ 3.51Å; E549-K591 PolarHBondContact OE1-NZ 2.88Å; E549-K591 IonicContact OE2-NZ 3.24Å
592	A	82.9	Confident	90	Very high	41 Å²	41	78.5 Å²	78.5	34%	0.339	38%	0.378	S	S	.	.	S	Bend	trans	-88.8	143.5	173.8	0	0	0	0	0	110.9	V590 H594	V590-A592 HydrophobicContact CG1-CB 4.22Å; V590-A592 PolarHBondContact O-N 3.06Å; A592-H594 VanDerWaalsContact CB-CD2 3.47Å; A592-H594 WeakPolarHBondContact CB-CD2 3.46Å; A592-H594 PolarHBondContact O-N 3.24Å
593	R	83.3	Confident	90.1	Very high	238 Å²	238	76.7 Å²	76.7	90%	0.898	37%	0.371	S	S	*	.			trans	-73.6	71.2	-178.3	-65.3	-176.1	179.3	177.3	-1	112.1
594	H	91.7	Very high	90.4	Very high	90 Å²	90	78.1 Å²	78.1	42%	0.417	38%	0.378	S	S	.	.			trans	-116.8	64.1	178.5	-63.5	-50	0	0	0	110.8	Y542 A592 F596 T597 E598	Y542-H594 AromaticContact CE1-CD2 3.66Å; Y542-H594 AromaticContact CZ-CD2 3.9Å; Y542-H594 PolarHBondContact OH-CD2 3.32Å; A592-H594 VanDerWaalsContact CB-CD2 3.47Å; A592-H594 WeakPolarHBondContact CB-CD2 3.46Å; A592-H594 PolarHBondContact O-N 3.24Å; H594-F596 PolarHBondContact O-N 3.2Å; H594-T597 PolarHBondContact O-N 3.49Å; H594-E598 PolarHBondContact O-N 3.05Å; H594-E598 VanDerWaalsContact O-N 3.13Å
595	E	89.5	Confident	90.7	Very high	152 Å²	152	75 Å²	75	71%	0.71	36%	0.361	S	S	*	.	H	α-helix	trans	-51.3	-32.5	-177.6	-62.2	176.9	-175.1	0	0	113	F599	E595-F599 WeakPolarHBondContact O-CB 3.35Å; E595-F599 PolarHBondContact O-N 3.15Å
596	F	93.1	Very high	91.1	Very high	160 Å²	160	70.8 Å²	70.8	70%	0.702	35%	0.346	S	S	*	.	H	α-helix	trans	-63.9	-44	174.5	179.8	-101	0	0	0	112.7	H594 F599 V600	H594-F596 PolarHBondContact O-N 3.2Å; F596-F599 PolarHBondContact O-N 2.95Å; F596-V600 HydrophobicContact CD1-CG2 4.39Å; F596-V600 HydrophobicContact CD2-CG2 4.46Å; F596-V600 HydrophobicContact CE1-CG2 3.98Å; F596-V600 HydrophobicContact CE2-CG2 4.05Å; F596-V600 HydrophobicContact CZ-CG2 3.8Å; F596-V600 VanDerWaalsContact O-CG2 3.29Å; F596-V600 WeakPolarHBondContact O-CG2 3.49Å; F596-V600 PolarHBondContact O-N 3.08Å
597	T	92.3	Very high	91.5	Very high	22 Å²	22	69 Å²	69	14%	0.135	35%	0.345	C	S	.	.	H	α-helix	trans	-70	-42.1	179.5	-51.7	0	0	0	0	111	L538 Y542 H594 F599 V600 G601	L538-T597 HydrophobicContact CD1-CG2 3.81Å; L538-T597 HydrophobicContact CD2-CG2 4.34Å; L538-T597 HydrophobicContact CG-CG2 3.82Å; Y542-T597 HydrophobicContact CE2-CG2 3.65Å; Y542-T597 PolarHBondContact OH-OG1 3.39Å; H594-T597 PolarHBondContact O-N 3.49Å; T597-F599 VanDerWaalsContact C-N 3.35Å; T597-F599 PolarHBondContact O-N 3.45Å; T597-V600 PolarHBondContact O-N 3.36Å; T597-G601 PolarHBondContact O-N 3.26Å
598	E	92.6	Very high	91.8	Very high	42 Å²	42	68.2 Å²	68.2	20%	0.196	34%	0.341	C	S	.	.	H	α-helix	trans	-58.3	-47.1	173.2	-61.9	-178	142.3	0	0	110.8	N589 V590 H594 G601 A602	N589-E598 VanDerWaalsContact CA-OE1 3.29Å; N589-E598 WeakPolarHBondContact CA-OE1 3.43Å; V590-E598 HydrophobicContact CB-CG 4.29Å; V590-E598 HydrophobicContact CG2-CG 4.08Å; V590-E598 PolarHBondContact N-OE1 3.35Å; H594-E598 PolarHBondContact O-N 3.05Å; H594-E598 VanDerWaalsContact O-N 3.13Å; E598-G601 PolarHBondContact O-N 3.05Å; E598-A602 WeakPolarHBondContact O-CB 3.26Å; E598-A602 PolarHBondContact O-N 2.98Å
599	F	94.4	Very high	92.1	Very high	139 Å²	139	69.5 Å²	69.5	61%	0.61	35%	0.348	S	S	*	.	H	α-helix	trans	-62	-46.2	177.7	175.3	-101.7	0	0	0	112.7	E595 F596 T597 T603	E595-F599 WeakPolarHBondContact O-CB 3.35Å; E595-F599 PolarHBondContact O-N 3.15Å; F596-F599 PolarHBondContact O-N 2.95Å; T597-F599 VanDerWaalsContact C-N 3.35Å; T597-F599 PolarHBondContact O-N 3.45Å; F599-T603 VanDerWaalsContact O-CB 3.27Å; F599-T603 WeakPolarHBondContact O-CB 3.23Å; F599-T603 PolarHBondContact O-N 2.93Å; F599-T603 PolarHBondContact O-OG1 3.3Å
600	V	95.8	Very high	92.4	Very high	41 Å²	41	68.8 Å²	68.8	25%	0.248	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-45.1	177.9	170.8	0	0	0	0	110.6	L538 F596 T597 T603 M604	L538-V600 HydrophobicContact CD1-CG1 4.4Å; L538-V600 HydrophobicContact CD2-CB 4.39Å; L538-V600 HydrophobicContact CD2-CG1 3.99Å; F596-V600 HydrophobicContact CD1-CG2 4.39Å; F596-V600 HydrophobicContact CD2-CG2 4.46Å; F596-V600 HydrophobicContact CE1-CG2 3.98Å; F596-V600 HydrophobicContact CE2-CG2 4.05Å; F596-V600 HydrophobicContact CZ-CG2 3.8Å; F596-V600 VanDerWaalsContact O-CG2 3.29Å; F596-V600 WeakPolarHBondContact O-CG2 3.49Å; F596-V600 PolarHBondContact O-N 3.08Å; T597-V600 PolarHBondContact O-N 3.36Å; V600-T603 WeakPolarHBondContact O-CB 3.46Å; V600-T603 PolarHBondContact O-N 3.45Å; V600-M604 HydrophobicContact CG1-SD 4.11Å; V600-M604 WeakPolarHBondContact O-CG 3.22Å; V600-M604 PolarHBondContact O-N 2.9Å
601	G	94	Very high	92.8	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-70.9	-37.5	-179.5	0	0	0	0	0	113.5	Y539 T597 E598 T603 M604 F605	Y539-G601 WeakPolarHBondContact OH-CA 3.43Å; T597-G601 PolarHBondContact O-N 3.26Å; E598-G601 PolarHBondContact O-N 3.05Å; G601-T603 VanDerWaalsContact C-N 3.31Å; G601-M604 PolarHBondContact O-N 3.45Å; G601-F605 VanDerWaalsContact O-CB 3.29Å; G601-F605 WeakPolarHBondContact O-CB 3.11Å; G601-F605 PolarHBondContact O-N 3.41Å
602	A	94.3	Very high	93.4	Very high	31 Å²	31	64.2 Å²	64.2	26%	0.256	33%	0.328	S	S	.	.	H	α-helix	trans	-63.5	-36.8	170.1	0	0	0	0	0	111.9	T588 E598 G606	T588-A602 HydrophobicContact CG2-CB 4.36Å; E598-A602 WeakPolarHBondContact O-CB 3.26Å; E598-A602 PolarHBondContact O-N 2.98Å; A602-G606 PolarHBondContact O-N 3.12Å
603	T	95.2	Very high	93.9	Very high	63 Å²	63	65.2 Å²	65.2	39%	0.387	33%	0.327	S	S	.	.	H	α-helix	trans	-66.4	-47.1	173.5	-59.7	0	0	0	0	111.1	F599 V600 G601 F605 G606 T607	F599-T603 VanDerWaalsContact O-CB 3.27Å; F599-T603 WeakPolarHBondContact O-CB 3.23Å; F599-T603 PolarHBondContact O-N 2.93Å; F599-T603 PolarHBondContact O-OG1 3.3Å; V600-T603 WeakPolarHBondContact O-CB 3.46Å; V600-T603 PolarHBondContact O-N 3.45Å; G601-T603 VanDerWaalsContact C-N 3.31Å; T603-F605 PolarHBondContact O-N 2.72Å; T603-G606 PolarHBondContact O-N 3.09Å; T603-T607 WeakPolarHBondContact O-CG2 3.42Å; T603-T607 PolarHBondContact O-N 3.11Å; T603-T607 PolarHBondContact O-OG1 2.99Å
604	M	96	Very high	94.5	Very high	51 Å²	51	58 Å²	58	25%	0.251	31%	0.309	S	S	.	.	H	α-helix	trans	-59.8	-47.3	176.3	-72.5	177.8	73	0	0	111.5	L535 L538 V600 G601 G606 T607 Y608	L535-M604 HydrophobicContact CD2-CB 3.91Å; L535-M604 HydrophobicContact CG-CB 4.47Å; L538-M604 HydrophobicContact CD2-SD 4.24Å; V600-M604 HydrophobicContact CG1-SD 4.11Å; V600-M604 WeakPolarHBondContact O-CG 3.22Å; V600-M604 PolarHBondContact O-N 2.9Å; G601-M604 PolarHBondContact O-N 3.45Å; M604-G606 PolarHBondContact O-N 2.93Å; M604-T607 WeakPolarHBondContact CA-OG1 3.25Å; M604-T607 PolarHBondContact O-N 2.86Å; M604-T607 PolarHBondContact O-OG1 3.48Å; M604-Y608 PolarHBondContact O-N 3.08Å
605	F	95.9	Very high	94.7	Very high	11 Å²	11	56.7 Å²	56.7	5%	0.048	31%	0.308	C	S	.	.	H	α-helix	trans	-61.9	-40	174.5	-178.6	-114.8	0	0	0	112.4	F565 L575 L583 L585 T588 G601 T603 Y608 N609	F565-F605 HydrophobicContact CZ-CD2 4.19Å; F565-F605 HydrophobicContact CZ-CE2 4.46Å; L575-F605 HydrophobicContact CD2-CD2 3.98Å; L575-F605 HydrophobicContact CD2-CE2 4.24Å; L583-F605 HydrophobicContact CB-CZ 4.38Å; L585-F605 HydrophobicContact CD1-CD1 4.46Å; T588-F605 HydrophobicContact CG2-CB 4.36Å; T588-F605 HydrophobicContact CG2-CD1 4.49Å; G601-F605 VanDerWaalsContact O-CB 3.29Å; G601-F605 WeakPolarHBondContact O-CB 3.11Å; G601-F605 PolarHBondContact O-N 3.41Å; T603-F605 PolarHBondContact O-N 2.72Å; F605-Y608 WeakPolarHBondContact O-CB 3.32Å; F605-Y608 PolarHBondContact O-N 3.18Å; F605-N609 VanDerWaalsContact CE1-ND2 3.31Å; F605-N609 WeakPolarHBondContact CE1-ND2 3.32Å; F605-N609 VanDerWaalsContact CZ-ND2 3.32Å; F605-N609 WeakPolarHBondContact CZ-ND2 3.45Å; F605-N609 PolarHBondContact O-N 2.94Å; F605-N609 PolarHBondContact O-ND2 3.01Å
606	G	95.5	Very high	95	Very high	31 Å²	31	50.2 Å²	50.2	32%	0.32	28%	0.278	S	S	.	.	H	α-helix	trans	-60.4	-48.3	172.8	0	0	0	0	0	112.5	A602 T603 M604 Y608 N609 V610	A602-G606 PolarHBondContact O-N 3.12Å; T603-G606 PolarHBondContact O-N 3.09Å; M604-G606 PolarHBondContact O-N 2.93Å; G606-Y608 VanDerWaalsContact C-N 3.35Å; G606-Y608 PolarHBondContact O-N 3.37Å; G606-N609 PolarHBondContact O-N 2.8Å; G606-V610 WeakPolarHBondContact O-CG2 3.28Å; G606-V610 PolarHBondContact O-N 3.16Å
607	T	95.8	Very high	95	Very high	61 Å²	61	46.5 Å²	46.5	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-38.1	176.8	57.9	0	0	0	0	112.5	F531 T603 M604 V610 I611	F531-T607 WeakPolarHBondContact CE1-OG1 3.43Å; T603-T607 WeakPolarHBondContact O-CG2 3.42Å; T603-T607 PolarHBondContact O-N 3.11Å; T603-T607 PolarHBondContact O-OG1 2.99Å; M604-T607 WeakPolarHBondContact CA-OG1 3.25Å; M604-T607 PolarHBondContact O-N 2.86Å; M604-T607 PolarHBondContact O-OG1 3.48Å; T607-V610 PolarHBondContact O-N 3.39Å; T607-I611 WeakPolarHBondContact O-CB 3.47Å; T607-I611 VanDerWaalsContact O-CG1 3.29Å; T607-I611 WeakPolarHBondContact O-CG1 3.25Å; T607-I611 PolarHBondContact O-N 2.98Å
608	Y	96.9	Very high	95.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.8	-50.2	171.6	170.1	-98.2	0	0	0	111.5	Y524 V527 F531 L575 S578 V579 M604 F605 G606 V610 I611 S612	Y524-Y608 PolarHBondContact OH-OH 2.78Å; Y524-Y608 VanDerWaalsContact OH-OH 3.07Å; V527-Y608 HydrophobicContact CG1-CD2 4.46Å; V527-Y608 HydrophobicContact CG1-CE2 4.48Å; F531-Y608 HydrophobicContact CB-CD2 3.81Å; F531-Y608 HydrophobicContact CB-CG 4.39Å; F531-Y608 AromaticContact CD2-CD2 3.75Å; F531-Y608 HydrophobicContact CD2-CD2 3.75Å; F531-Y608 HydrophobicContact CE2-CD2 4.48Å; F531-Y608 AromaticContact CG-CD2 3.78Å; F531-Y608 HydrophobicContact CG-CD2 3.78Å; F531-Y608 HydrophobicContact CG-CG 4.27Å; L575-Y608 HydrophobicContact CB-CE1 4Å; L575-Y608 HydrophobicContact CB-CE2 4.38Å; L575-Y608 HydrophobicContact CD1-CE2 4.5Å; L575-Y608 HydrophobicContact CD2-CD1 3.64Å; L575-Y608 HydrophobicContact CD2-CD2 4.42Å; L575-Y608 HydrophobicContact CD2-CE1 3.81Å; L575-Y608 HydrophobicContact CD2-CG 3.96Å; L575-Y608 HydrophobicContact CG-CE1 4.46Å; L575-Y608 PolarHBondContact O-OH 2.93Å; L575-Y608 VanDerWaalsContact O-OH 3.05Å; S578-Y608 WeakPolarHBondContact OG-CE1 3.42Å; V579-Y608 HydrophobicContact CG2-CE1 4.27Å; M604-Y608 PolarHBondContact O-N 3.08Å; F605-Y608 WeakPolarHBondContact O-CB 3.32Å; F605-Y608 PolarHBondContact O-N 3.18Å; G606-Y608 VanDerWaalsContact C-N 3.35Å; G606-Y608 PolarHBondContact O-N 3.37Å; Y608-V610 VanDerWaalsContact C-N 3.34Å; Y608-V610 PolarHBondContact O-N 2.7Å; Y608-I611 PolarHBondContact O-N 2.88Å; Y608-S612 WeakPolarHBondContact O-CB 3.44Å; Y608-S612 PolarHBondContact O-N 2.79Å; Y608-S612 PolarHBondContact O-OG 3.45Å; Y608-S612 VanDerWaalsContact O-OG 3.1Å
609	N	95.2	Very high	95.1	Very high	30 Å²	30	53.1 Å²	53.1	16%	0.16	30%	0.299	C	S	.	.	H	α-helix	trans	-65.4	-34.6	-179.5	-69.9	-52	0	0	0	112.3	S578 F605 G606 L613	S578-N609 PolarHBondContact OG-OD1 3.02Å; F605-N609 VanDerWaalsContact CE1-ND2 3.31Å; F605-N609 WeakPolarHBondContact CE1-ND2 3.32Å; F605-N609 VanDerWaalsContact CZ-ND2 3.32Å; F605-N609 WeakPolarHBondContact CZ-ND2 3.45Å; F605-N609 PolarHBondContact O-N 2.94Å; F605-N609 PolarHBondContact O-ND2 3.01Å; G606-N609 PolarHBondContact O-N 2.8Å; N609-L613 HydrophobicContact CB-CD1 4.45Å; N609-L613 VanDerWaalsContact O-CB 3.23Å; N609-L613 WeakPolarHBondContact O-CB 3.46Å; N609-L613 PolarHBondContact O-N 2.79Å
610	V	96.6	Very high	95.1	Very high	82 Å²	82	48.1 Å²	48.1	50%	0.497	28%	0.278	S	S	.	.	I	π-helix	trans	-64.3	-46.9	171.9	171.9	0	0	0	0	110.9	G606 T607 Y608 V614 V615	G606-V610 WeakPolarHBondContact O-CG2 3.28Å; G606-V610 PolarHBondContact O-N 3.16Å; T607-V610 PolarHBondContact O-N 3.39Å; Y608-V610 VanDerWaalsContact C-N 3.34Å; Y608-V610 PolarHBondContact O-N 2.7Å; V610-V614 WeakPolarHBondContact O-CA 3.49Å; V610-V614 VanDerWaalsContact O-CB 3.24Å; V610-V614 WeakPolarHBondContact O-CB 3.36Å; V610-V614 PolarHBondContact O-N 3.1Å; V610-V615 PolarHBondContact O-N 3.14Å
611	I	96.3	Very high	95.1	Very high	58 Å²	58	50 Å²	50	30%	0.297	29%	0.286	S	S	.	.	I	π-helix	trans	-65.3	-45.7	179.7	-68.3	164.8	0	0	0	110.8	V527 F531 T607 Y608 V615 L616	V527-I611 HydrophobicContact CG1-CG2 4.04Å; F531-I611 HydrophobicContact CE2-CD1 3.89Å; F531-I611 HydrophobicContact CZ-CD1 3.77Å; T607-I611 WeakPolarHBondContact O-CB 3.47Å; T607-I611 VanDerWaalsContact O-CG1 3.29Å; T607-I611 WeakPolarHBondContact O-CG1 3.25Å; T607-I611 PolarHBondContact O-N 2.98Å; Y608-I611 PolarHBondContact O-N 2.88Å; I611-V615 WeakPolarHBondContact O-CB 3.49Å; I611-V615 PolarHBondContact O-N 3.4Å; I611-L616 HydrophobicContact CG2-CD1 4.2Å; I611-L616 HydrophobicContact CG2-CG 4.27Å; I611-L616 WeakPolarHBondContact O-CG 3.33Å; I611-L616 PolarHBondContact O-N 2.85Å
612	S	94.1	Very high	95.1	Very high	5 Å²	5	53 Å²	53	4%	0.035	31%	0.31	C	S	.	.	I	π-helix	trans	-72.9	-50	-177	65.9	0	0	0	0	112.9	Y608 L617	Y608-S612 WeakPolarHBondContact O-CB 3.44Å; Y608-S612 PolarHBondContact O-N 2.79Å; Y608-S612 PolarHBondContact O-OG 3.45Å; Y608-S612 VanDerWaalsContact O-OG 3.1Å; S612-L617 PolarHBondContact O-N 3.08Å
613	L	94.5	Very high	95	Very high	63 Å²	63	55.7 Å²	55.7	33%	0.33	32%	0.319	S	S	.	.	I	π-helix	trans	-86.5	-33.5	-172.6	-61.5	173.8	0	0	0	114	V579 N609 L617	V579-L613 HydrophobicContact CB-CD2 4.39Å; V579-L613 HydrophobicContact CG1-CD2 3.9Å; V579-L613 WeakPolarHBondContact O-CD2 3.5Å; N609-L613 HydrophobicContact CB-CD1 4.45Å; N609-L613 VanDerWaalsContact O-CB 3.23Å; N609-L613 WeakPolarHBondContact O-CB 3.46Å; N609-L613 PolarHBondContact O-N 2.79Å; L613-L617 WeakPolarHBondContact O-CB 3.11Å
614	V	95.1	Very high	94.9	Very high	86 Å²	86	55.5 Å²	55.5	52%	0.521	31%	0.314	S	S	.	.	I	π-helix	trans	-97.7	-39	-176	-170.7	0	0	0	0	111.7	V610 N618	V610-V614 WeakPolarHBondContact O-CA 3.49Å; V610-V614 VanDerWaalsContact O-CB 3.24Å; V610-V614 WeakPolarHBondContact O-CB 3.36Å; V610-V614 PolarHBondContact O-N 3.1Å; V614-N618 WeakPolarHBondContact O-CB 3.25Å; V614-N618 PolarHBondContact O-ND2 3.15Å
615	V	95.9	Very high	94.8	Very high	63 Å²	63	57.7 Å²	57.7	38%	0.382	33%	0.327	S	S	.	.	I	π-helix	trans	-90.7	-64.3	-179.4	-173.7	0	0	0	0	111.1	V610 I611 N618 M619	V610-V615 PolarHBondContact O-N 3.14Å; I611-V615 WeakPolarHBondContact O-CB 3.49Å; I611-V615 PolarHBondContact O-N 3.4Å; V615-N618 PolarHBondContact O-N 3.27Å; V615-M619 HydrophobicContact CG1-CE 4.15Å; V615-M619 HydrophobicContact CG1-SD 4.03Å; V615-M619 WeakPolarHBondContact O-CB 3.49Å; V615-M619 WeakPolarHBondContact O-CG 3.16Å; V615-M619 PolarHBondContact O-N 2.9Å
616	L	94.9	Very high	94.6	Very high	16 Å²	16	61.6 Å²	61.6	8%	0.084	35%	0.348	C	S	.	.	I	π-helix	trans	-66.1	-45.3	-170.9	-67.5	178.3	0	0	0	112.5	F520 Y524 V527 I611 N618 M619 L620	F520-L616 HydrophobicContact CE1-CB 3.99Å; F520-L616 HydrophobicContact CE1-CD2 4.4Å; F520-L616 WeakPolarHBondContact CE1-O 3.49Å; F520-L616 HydrophobicContact CE2-CD2 4.42Å; F520-L616 HydrophobicContact CZ-CB 3.79Å; F520-L616 HydrophobicContact CZ-CD2 3.7Å; F520-L616 HydrophobicContact CZ-CG 4.32Å; F520-L616 WeakPolarHBondContact CZ-O 3.38Å; Y524-L616 HydrophobicContact CD2-CD1 4.15Å; V527-L616 HydrophobicContact CB-CD1 4.42Å; V527-L616 HydrophobicContact CG1-CD1 4.44Å; V527-L616 HydrophobicContact CG2-CD1 4.26Å; I611-L616 HydrophobicContact CG2-CD1 4.2Å; I611-L616 HydrophobicContact CG2-CG 4.27Å; I611-L616 WeakPolarHBondContact O-CG 3.33Å; I611-L616 PolarHBondContact O-N 2.85Å; L616-N618 PolarHBondContact O-N 3.34Å; L616-M619 PolarHBondContact O-N 3.22Å; L616-L620 WeakPolarHBondContact O-CB 3.46Å; L616-L620 PolarHBondContact O-N 2.9Å
617	L	93.6	Very high	94.5	Very high	82 Å²	82	60.7 Å²	60.7	43%	0.429	34%	0.337	S	S	.	.	H	α-helix	trans	-60.4	-42.7	178.8	-170.6	67.8	0	0	0	112.5	S612 L613 L620 I621	S612-L617 PolarHBondContact O-N 3.08Å; L613-L617 WeakPolarHBondContact O-CB 3.11Å; L617-L620 PolarHBondContact O-N 3.29Å; L617-I621 HydrophobicContact CG-CD1 4.33Å; L617-I621 VanDerWaalsContact O-CG1 3.31Å; L617-I621 WeakPolarHBondContact O-CG1 3.48Å; L617-I621 PolarHBondContact O-N 3.17Å
618	N	94.4	Very high	94.3	Very high	92 Å²	92	62.9 Å²	62.9	49%	0.492	34%	0.339	S	S	.	.	H	α-helix	trans	-69.9	-36.7	177.7	-75.4	-40.6	0	0	0	112.4	V614 V615 L616 I621 A622	V614-N618 WeakPolarHBondContact O-CB 3.25Å; V614-N618 PolarHBondContact O-ND2 3.15Å; V615-N618 PolarHBondContact O-N 3.27Å; L616-N618 PolarHBondContact O-N 3.34Å; N618-I621 PolarHBondContact O-N 3.03Å; N618-A622 WeakPolarHBondContact O-CB 3.35Å; N618-A622 PolarHBondContact O-N 3.48Å
619	M	93.3	Very high	94.1	Very high	111 Å²	111	68.7 Å²	68.7	55%	0.547	37%	0.366	S	S	.	.	H	α-helix	trans	-63.6	-40.5	171.9	-76.6	-174.7	166.6	0	0	112.1	F520 V615 L616 A622 M623	F520-M619 HydrophobicContact CE2-CB 4.15Å; F520-M619 HydrophobicContact CZ-CB 4.27Å; V615-M619 HydrophobicContact CG1-CE 4.15Å; V615-M619 HydrophobicContact CG1-SD 4.03Å; V615-M619 WeakPolarHBondContact O-CB 3.49Å; V615-M619 WeakPolarHBondContact O-CG 3.16Å; V615-M619 PolarHBondContact O-N 2.9Å; L616-M619 PolarHBondContact O-N 3.22Å; M619-A622 PolarHBondContact O-N 3.45Å; M619-M623 WeakPolarHBondContact O-CB 3.37Å; M619-M623 PolarHBondContact O-N 3.02Å
620	L	93.8	Very high	93.9	Very high	33 Å²	33	72.6 Å²	72.6	17%	0.173	39%	0.387	C	S	.	.	H	α-helix	trans	-61.8	-45.9	174.9	179	60.4	0	0	0	111.5	I517 F520 L616 L617 A622 M623 M624	I517-L620 HydrophobicContact CG1-CD1 4.24Å; F520-L620 HydrophobicContact CB-CD1 3.95Å; F520-L620 HydrophobicContact CD1-CB 3.95Å; F520-L620 HydrophobicContact CD1-CD1 3.85Å; F520-L620 HydrophobicContact CD1-CD2 4.2Å; F520-L620 HydrophobicContact CD1-CG 4.22Å; F520-L620 HydrophobicContact CE1-CB 3.8Å; F520-L620 HydrophobicContact CG-CB 4.4Å; F520-L620 HydrophobicContact CG-CD1 3.85Å; F520-L620 HydrophobicContact CZ-CB 4.12Å; L616-L620 WeakPolarHBondContact O-CB 3.46Å; L616-L620 PolarHBondContact O-N 2.9Å; L617-L620 PolarHBondContact O-N 3.29Å; L620-A622 VanDerWaalsContact C-N 3.35Å; L620-A622 PolarHBondContact O-N 3.48Å; L620-M623 PolarHBondContact O-N 3.18Å; L620-M624 HydrophobicContact CD1-CG 4.13Å; L620-M624 HydrophobicContact CD1-SD 4.22Å; L620-M624 HydrophobicContact CG-CG 4.46Å; L620-M624 HydrophobicContact CG-SD 4.15Å; L620-M624 WeakPolarHBondContact O-CB 3.41Å; L620-M624 WeakPolarHBondContact O-CG 3.42Å; L620-M624 PolarHBondContact O-N 3.03Å
621	I	94.9	Very high	93.6	Very high	82 Å²	82	69.8 Å²	69.8	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-60.3	-44.4	176.5	-67.4	162.8	0	0	0	110.9	L617 N618 M624 N625	L617-I621 HydrophobicContact CG-CD1 4.33Å; L617-I621 VanDerWaalsContact O-CG1 3.31Å; L617-I621 WeakPolarHBondContact O-CG1 3.48Å; L617-I621 PolarHBondContact O-N 3.17Å; N618-I621 PolarHBondContact O-N 3.03Å; I621-M624 PolarHBondContact O-N 3.45Å; I621-N625 WeakPolarHBondContact O-CB 3.28Å; I621-N625 VanDerWaalsContact O-CG 3.28Å; I621-N625 PolarHBondContact O-N 2.94Å; I621-N625 PolarHBondContact O-ND2 3.45Å
622	A	94.6	Very high	93.3	Very high	62 Å²	62	69 Å²	69	51%	0.512	37%	0.37	S	S	.	.	H	α-helix	trans	-62.7	-43.8	177.3	0	0	0	0	0	112.3	N618 M619 L620 N625 N626	N618-A622 WeakPolarHBondContact O-CB 3.35Å; N618-A622 PolarHBondContact O-N 3.48Å; M619-A622 PolarHBondContact O-N 3.45Å; L620-A622 VanDerWaalsContact C-N 3.35Å; L620-A622 PolarHBondContact O-N 3.48Å; A622-N625 PolarHBondContact O-N 2.92Å; A622-N626 PolarHBondContact O-N 3.09Å
623	M	92.1	Very high	93.1	Very high	88 Å²	88	74.9 Å²	74.9	43%	0.433	40%	0.402	S	S	.	.	H	α-helix	trans	-65	-43.7	177.1	-172.5	-179.5	-66.4	0	0	111.9	F520 M619 L620 N625 N626 S627	F520-M623 HydrophobicContact CD2-CE 4.24Å; M619-M623 WeakPolarHBondContact O-CB 3.37Å; M619-M623 PolarHBondContact O-N 3.02Å; L620-M623 PolarHBondContact O-N 3.18Å; M623-N625 VanDerWaalsContact C-N 3.35Å; M623-N625 PolarHBondContact O-N 3.18Å; M623-N626 PolarHBondContact O-N 2.91Å; M623-S627 WeakPolarHBondContact O-CB 3.43Å; M623-S627 PolarHBondContact O-N 3.3Å
624	M	93.4	Very high	92.9	Very high	59 Å²	59	75.6 Å²	75.6	29%	0.291	40%	0.403	S	S	.	.	H	α-helix	trans	-62.2	-39.3	176	-76.6	-176.7	64	0	0	112.3	M513 I517 L620 I621 S627 Y628	M513-M624 HydrophobicContact SD-CE 4.39Å; I517-M624 HydrophobicContact CD1-CE 3.96Å; I517-M624 HydrophobicContact CD1-SD 3.9Å; I517-M624 HydrophobicContact CG1-CG 4.26Å; I517-M624 HydrophobicContact CG1-SD 3.93Å; L620-M624 HydrophobicContact CD1-CG 4.13Å; L620-M624 HydrophobicContact CD1-SD 4.22Å; L620-M624 HydrophobicContact CG-CG 4.46Å; L620-M624 HydrophobicContact CG-SD 4.15Å; L620-M624 WeakPolarHBondContact O-CB 3.41Å; L620-M624 WeakPolarHBondContact O-CG 3.42Å; L620-M624 PolarHBondContact O-N 3.03Å; I621-M624 PolarHBondContact O-N 3.45Å; M624-S627 PolarHBondContact O-N 2.89Å; M624-Y628 VanDerWaalsContact O-CB 3.26Å; M624-Y628 WeakPolarHBondContact O-CB 3.38Å; M624-Y628 PolarHBondContact O-N 3.06Å
625	N	93.1	Very high	92.8	Very high	97 Å²	97	72 Å²	72	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-63.1	-42.9	177.2	-75.8	-24.3	0	0	0	112.2	I621 A622 M623 Q629	I621-N625 WeakPolarHBondContact O-CB 3.28Å; I621-N625 VanDerWaalsContact O-CG 3.28Å; I621-N625 PolarHBondContact O-N 2.94Å; I621-N625 PolarHBondContact O-ND2 3.45Å; A622-N625 PolarHBondContact O-N 2.92Å; M623-N625 VanDerWaalsContact C-N 3.35Å; M623-N625 PolarHBondContact O-N 3.18Å; N625-Q629 WeakPolarHBondContact O-CG 3.36Å; N625-Q629 PolarHBondContact O-N 2.9Å
626	N	92.4	Very high	92.6	Very high	93 Å²	93	72.8 Å²	72.8	50%	0.497	38%	0.384	S	S	.	.	H	α-helix	trans	-69.4	-45.2	176.5	-169.5	24.6	0	0	0	111.7	A622 M623 Y628 Q629 L630	A622-N626 PolarHBondContact O-N 3.09Å; M623-N626 PolarHBondContact O-N 2.91Å; N626-Y628 VanDerWaalsContact C-N 3.33Å; N626-Y628 PolarHBondContact O-N 3.26Å; N626-Q629 PolarHBondContact O-N 3.36Å; N626-L630 WeakPolarHBondContact O-CG 3.5Å; N626-L630 PolarHBondContact O-N 2.9Å; N626-L630 VanDerWaalsContact O-N 3.14Å
627	S	93	Very high	92.6	Very high	11 Å²	11	74.4 Å²	74.4	8%	0.077	39%	0.392	C	S	.	.	H	α-helix	trans	-58.3	-43.8	175.7	-179.6	0	0	0	0	111.6	D516 M623 M624 Q629 L630 I631	D516-S627 WeakPolarHBondContact OD2-CB 3.42Å; D516-S627 PolarHBondContact OD2-OG 2.92Å; M623-S627 WeakPolarHBondContact O-CB 3.43Å; M623-S627 PolarHBondContact O-N 3.3Å; M624-S627 PolarHBondContact O-N 2.89Å; S627-Q629 PolarHBondContact O-N 3.46Å; S627-L630 PolarHBondContact O-N 3.23Å; S627-I631 WeakPolarHBondContact O-CB 3.19Å; S627-I631 WeakPolarHBondContact O-CD1 3.5Å; S627-I631 WeakPolarHBondContact O-CG1 3.47Å; S627-I631 PolarHBondContact O-N 3.47Å; S627-I631 WeakPolarHBondContact OG-CD1 3.47Å
628	Y	92.6	Very high	92.6	Very high	107 Å²	107	71.3 Å²	71.3	42%	0.42	38%	0.376	S	S	.	.	H	α-helix	trans	-59.3	-43.2	175.5	-177.1	-97.2	0	0	0	112.6	M513 M624 N626 I631 A632	M513-Y628 HydrophobicContact CE-CD2 3.91Å; M513-Y628 HydrophobicContact SD-CD2 3.86Å; M513-Y628 HydrophobicContact SD-CG 4.28Å; M624-Y628 VanDerWaalsContact O-CB 3.26Å; M624-Y628 WeakPolarHBondContact O-CB 3.38Å; M624-Y628 PolarHBondContact O-N 3.06Å; N626-Y628 VanDerWaalsContact C-N 3.33Å; N626-Y628 PolarHBondContact O-N 3.26Å; Y628-I631 PolarHBondContact O-N 3.33Å; Y628-A632 HydrophobicContact CE1-CB 4.27Å; Y628-A632 WeakPolarHBondContact O-CB 3.46Å; Y628-A632 PolarHBondContact O-N 2.88Å
629	Q	92.4	Very high	92.6	Very high	123 Å²	123	67.7 Å²	67.7	58%	0.575	36%	0.355	S	S	*	.	H	α-helix	trans	-60.8	-51	178.3	-73.8	174.1	-0.3	0	0	111.2	N625 N626 S627 I631 A632 D633	N625-Q629 WeakPolarHBondContact O-CG 3.36Å; N625-Q629 PolarHBondContact O-N 2.9Å; N626-Q629 PolarHBondContact O-N 3.36Å; S627-Q629 PolarHBondContact O-N 3.46Å; Q629-I631 VanDerWaalsContact C-N 3.29Å; Q629-I631 PolarHBondContact O-N 2.93Å; Q629-A632 PolarHBondContact O-N 2.79Å; Q629-A632 VanDerWaalsContact O-N 3.17Å; Q629-D633 PolarHBondContact O-N 3.27Å
630	L	90.3	Very high	92.7	Very high	112 Å²	112	64.8 Å²	64.8	59%	0.586	34%	0.34	S	S	*	.	H	α-helix	trans	-61.5	-35.2	178.5	-63.7	171.9	0	0	0	113.1	N626 S627	N626-L630 WeakPolarHBondContact O-CG 3.5Å; N626-L630 PolarHBondContact O-N 2.9Å; N626-L630 VanDerWaalsContact O-N 3.14Å; S627-L630 PolarHBondContact O-N 3.23Å
631	I	90.6	Very high	92.8	Very high	23 Å²	23	64.2 Å²	64.2	12%	0.118	34%	0.336	C	S	.	.	H	α-helix	trans	-76.7	-34.2	177.3	-65.9	162.3	0	0	0	111.4	R512 M513 S627 Y628 Q629 D633 H634 A635	R512-I631 HydrophobicContact CB-CD1 3.77Å; M513-I631 HydrophobicContact CG-CD1 3.95Å; S627-I631 WeakPolarHBondContact O-CB 3.19Å; S627-I631 WeakPolarHBondContact O-CD1 3.5Å; S627-I631 WeakPolarHBondContact O-CG1 3.47Å; S627-I631 PolarHBondContact O-N 3.47Å; S627-I631 WeakPolarHBondContact OG-CD1 3.47Å; Y628-I631 PolarHBondContact O-N 3.33Å; Q629-I631 VanDerWaalsContact C-N 3.29Å; Q629-I631 PolarHBondContact O-N 2.93Å; I631-D633 VanDerWaalsContact C-N 3.35Å; I631-D633 PolarHBondContact O-N 3.38Å; I631-H634 PolarHBondContact O-N 3.01Å; I631-A635 WeakPolarHBondContact O-CB 3.39Å; I631-A635 PolarHBondContact O-N 2.98Å
632	A	89.8	Confident	92.7	Very high	41 Å²	41	61.6 Å²	61.6	34%	0.339	33%	0.326	S	S	.	.	H	α-helix	trans	-62.4	-39.2	-176.3	0	0	0	0	0	112.6	Y628 Q629 H634 A635	Y628-A632 HydrophobicContact CE1-CB 4.27Å; Y628-A632 WeakPolarHBondContact O-CB 3.46Å; Y628-A632 PolarHBondContact O-N 2.88Å; Q629-A632 PolarHBondContact O-N 2.79Å; Q629-A632 VanDerWaalsContact O-N 3.17Å; A632-H634 PolarHBondContact O-N 2.98Å; A632-A635 PolarHBondContact O-N 3.07Å
633	D	89.9	Confident	92.7	Very high	129 Å²	129	60.3 Å²	60.3	69%	0.69	31%	0.308	S	S	*	.	H	α-helix	trans	-56.3	-33.1	179	-68.2	-23.4	0	0	0	112.9	Q629 I631	Q629-D633 PolarHBondContact O-N 3.27Å; I631-D633 VanDerWaalsContact C-N 3.35Å; I631-D633 PolarHBondContact O-N 3.38Å
634	H	90.2	Very high	92.8	Very high	77 Å²	77	56.1 Å²	56.1	36%	0.356	29%	0.287	S	S	.	.	H	α-helix	trans	-106	-10.7	-178.6	-61	88.8	0	0	0	113.6	I631 A632 D636 I637 E638	I631-H634 PolarHBondContact O-N 3.01Å; A632-H634 PolarHBondContact O-N 2.98Å; H634-D636 PolarHBondContact O-N 2.9Å; H634-I637 WeakPolarHBondContact O-CB 3.5Å; H634-I637 PolarHBondContact O-N 2.93Å; H634-E638 HydrophobicContact CB-CG 4.4Å; H634-E638 WeakPolarHBondContact O-CG 3.49Å; H634-E638 PolarHBondContact O-N 3.5Å
635	A	92.8	Very high	92.7	Very high	10 Å²	10	57.8 Å²	57.8	8%	0.083	29%	0.293	C	S	.	.	H	α-helix	trans	-51.9	-35.6	-169.4	0	0	0	0	0	113.8	I631 A632 E638 W639	I631-A635 WeakPolarHBondContact O-CB 3.39Å; I631-A635 PolarHBondContact O-N 2.98Å; A632-A635 PolarHBondContact O-N 3.07Å; A635-E638 PolarHBondContact O-N 3.28Å; A635-W639 VanDerWaalsContact O-CB 3.24Å; A635-W639 WeakPolarHBondContact O-CB 3.39Å; A635-W639 PolarHBondContact O-N 3.22Å
636	D	93.4	Very high	92.6	Very high	80 Å²	80	54.6 Å²	54.6	43%	0.428	28%	0.276	S	S	.	.	H	α-helix	trans	-73.2	-35.3	-177.1	-139.8	51	0	0	0	113.3	H634 E638 K640	H634-D636 PolarHBondContact O-N 2.9Å; D636-E638 VanDerWaalsContact C-N 3.35Å; D636-K640 WeakPolarHBondContact O-CD 3.46Å; D636-K640 WeakPolarHBondContact O-CE 3.24Å; D636-K640 WeakPolarHBondContact O-CG 3.38Å; D636-K640 PolarHBondContact O-N 2.97Å; D636-K640 WeakPolarHBondContact OD2-CE 3.45Å; D636-K640 IonicContact OD2-NZ 2.77Å; D636-K640 PolarHBondContact OD2-NZ 3.39Å
637	I	93.8	Very high	92.5	Very high	50 Å²	50	50.8 Å²	50.8	26%	0.256	25%	0.254	S	S	.	.	H	α-helix	trans	-67	-42.7	172.8	-67.9	169.4	0	0	0	109.2	K299 E300 A303 H634 K640 F641	K299-I637 HydrophobicContact CB-CG2 4.13Å; E300-I637 HydrophobicContact CG-CG2 4.23Å; A303-I637 HydrophobicContact CB-CB 4.19Å; A303-I637 HydrophobicContact CB-CG1 4.41Å; A303-I637 HydrophobicContact CB-CG2 3.74Å; H634-I637 WeakPolarHBondContact O-CB 3.5Å; H634-I637 PolarHBondContact O-N 2.93Å; I637-K640 WeakPolarHBondContact O-CB 3.39Å; I637-K640 PolarHBondContact O-N 2.99Å; I637-F641 PolarHBondContact O-N 3.28Å
638	E	93.3	Very high	92.3	Very high	18 Å²	18	51 Å²	51	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-83.3	-29.4	-170	-57.1	-161.3	-88	0	0	112.5	K299 I508 R512 H634 A635 D636 F641 A642	K299-E638 HydrophobicContact CD-CG 3.95Å; K299-E638 WeakPolarHBondContact CD-OE2 3.49Å; K299-E638 VanDerWaalsContact CE-OE2 3.28Å; K299-E638 WeakPolarHBondContact CE-OE2 3.26Å; K299-E638 IonicContact NZ-OE2 3.46Å; K299-E638 PolarHBondContact NZ-OE2 2.65Å; I508-E638 HydrophobicContact CG2-CB 4.45Å; R512-E638 IonicContact CZ-OE1 2.91Å; R512-E638 IonicContact CZ-OE2 3.89Å; R512-E638 IonicContact NH1-OE1 3.78Å; R512-E638 PolarHBondContact NH1-OE1 2.74Å; R512-E638 IonicContact NH1-OE2 3.98Å; R512-E638 PolarHBondContact NH1-OE2 2.98Å; R512-E638 IonicContact NH2-OE1 2.68Å; R512-E638 IonicContact NH2-OE2 2.66Å; R512-E638 PolarHBondContact NH2-OE2 2.9Å; H634-E638 HydrophobicContact CB-CG 4.4Å; H634-E638 WeakPolarHBondContact O-CG 3.49Å; H634-E638 PolarHBondContact O-N 3.5Å; A635-E638 PolarHBondContact O-N 3.28Å; D636-E638 VanDerWaalsContact C-N 3.35Å; E638-F641 PolarHBondContact O-N 3.3Å; E638-A642 WeakPolarHBondContact O-CB 3.26Å; E638-A642 PolarHBondContact O-N 2.74Å
639	W	95.4	Very high	92	Very high	15 Å²	15	49.3 Å²	49.3	6%	0.057	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-46.3	161.8	165.9	57.4	0	0	0	112	T498 S501 G504 P505 I508 A635 F641 A642 R643	T498-W639 PolarHBondContact O-NE1 2.73Å; S501-W639 VanDerWaalsContact CA-CZ2 3.47Å; G504-W639 VanDerWaalsContact CA-CD1 3.5Å; P505-W639 HydrophobicContact CB-CB 4.45Å; P505-W639 HydrophobicContact CG-CB 4.04Å; P505-W639 HydrophobicContact CG-CD2 3.79Å; P505-W639 HydrophobicContact CG-CE3 3.83Å; P505-W639 HydrophobicContact CG-CG 3.85Å; I508-W639 HydrophobicContact CG1-CB 4.38Å; A635-W639 VanDerWaalsContact O-CB 3.24Å; A635-W639 WeakPolarHBondContact O-CB 3.39Å; A635-W639 PolarHBondContact O-N 3.22Å; W639-F641 VanDerWaalsContact C-N 3.3Å; W639-F641 PolarHBondContact O-N 2.9Å; W639-A642 PolarHBondContact O-N 3.47Å; W639-R643 VanDerWaalsContact O-CB 3.25Å; W639-R643 WeakPolarHBondContact O-CB 3.41Å; W639-R643 PolarHBondContact O-N 3.19Å
640	K	95.6	Very high	91.8	Very high	50 Å²	50	45.4 Å²	45.4	22%	0.217	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-41.9	176.6	-73.3	160.3	-163	150.2	0	111.3	A303 D636 I637 R643 T644	A303-K640 HydrophobicContact CB-CB 4Å; A303-K640 HydrophobicContact CB-CD 4.18Å; D636-K640 WeakPolarHBondContact O-CD 3.46Å; D636-K640 WeakPolarHBondContact O-CE 3.24Å; D636-K640 WeakPolarHBondContact O-CG 3.38Å; D636-K640 PolarHBondContact O-N 2.97Å; D636-K640 WeakPolarHBondContact OD2-CE 3.45Å; D636-K640 IonicContact OD2-NZ 2.77Å; D636-K640 PolarHBondContact OD2-NZ 3.39Å; I637-K640 WeakPolarHBondContact O-CB 3.39Å; I637-K640 PolarHBondContact O-N 2.99Å; K640-R643 PolarHBondContact O-N 2.74Å; K640-T644 WeakPolarHBondContact O-CB 3.47Å; K640-T644 PolarHBondContact O-N 2.87Å; K640-T644 PolarHBondContact O-OG1 3.28Å
641	F	95.5	Very high	91.6	Very high	22 Å²	22	41.9 Å²	41.9	10%	0.096	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-51.2	174.1	-179.5	-98.8	0	0	0	112.4	I294 K299 V302 I637 E638 W639 R643 T644 K645	I294-F641 HydrophobicContact CB-CE2 4.48Å; I294-F641 HydrophobicContact CG1-CE2 4.32Å; I294-F641 HydrophobicContact CG2-CE2 4.44Å; I294-F641 HydrophobicContact CG2-CZ 4.15Å; K299-F641 HydrophobicContact CB-CB 4.23Å; K299-F641 HydrophobicContact CB-CD2 4.2Å; K299-F641 HydrophobicContact CB-CG 4.2Å; K299-F641 HydrophobicContact CG-CB 4.32Å; K299-F641 HydrophobicContact CG-CD1 4.09Å; K299-F641 HydrophobicContact CG-CD2 4.02Å; K299-F641 HydrophobicContact CG-CE1 4.42Å; K299-F641 HydrophobicContact CG-CE2 4.32Å; K299-F641 HydrophobicContact CG-CG 3.88Å; V302-F641 HydrophobicContact CB-CD2 4.04Å; V302-F641 HydrophobicContact CG1-CD2 4.25Å; V302-F641 HydrophobicContact CG2-CD2 4.11Å; V302-F641 HydrophobicContact CG2-CE2 4.3Å; I637-F641 PolarHBondContact O-N 3.28Å; E638-F641 PolarHBondContact O-N 3.3Å; W639-F641 VanDerWaalsContact C-N 3.3Å; W639-F641 PolarHBondContact O-N 2.9Å; F641-R643 VanDerWaalsContact C-N 3.35Å; F641-R643 PolarHBondContact O-N 3.28Å; F641-T644 PolarHBondContact O-N 3.13Å; F641-T644 VanDerWaalsContact O-N 3.15Å; F641-K645 PolarHBondContact O-N 3.44Å
642	A	93.3	Very high	90.8	Very high	26 Å²	26	42.9 Å²	42.9	22%	0.215	23%	0.225	C	C	.	.	H	α-helix	trans	-61.3	-41.7	178.3	0	0	0	0	0	112.3	I508 E638 W639 T644 K645 L646	I508-A642 HydrophobicContact CD1-CB 3.68Å; I508-A642 HydrophobicContact CG1-CB 4.49Å; E638-A642 WeakPolarHBondContact O-CB 3.26Å; E638-A642 PolarHBondContact O-N 2.74Å; W639-A642 PolarHBondContact O-N 3.47Å; A642-T644 VanDerWaalsContact C-N 3.34Å; A642-T644 PolarHBondContact O-N 3.41Å; A642-K645 PolarHBondContact O-N 3.29Å; A642-L646 PolarHBondContact O-N 3.41Å
643	R	94.8	Very high	89.6	Confident	35 Å²	35	45.9 Å²	45.9	13%	0.132	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-40.3	173.8	-173.9	-175	73.1	-162.6	2.6	111.9	W639 K640 F641 L646 W647	W639-R643 VanDerWaalsContact O-CB 3.25Å; W639-R643 WeakPolarHBondContact O-CB 3.41Å; W639-R643 PolarHBondContact O-N 3.19Å; K640-R643 PolarHBondContact O-N 2.74Å; F641-R643 VanDerWaalsContact C-N 3.35Å; F641-R643 PolarHBondContact O-N 3.28Å; R643-L646 PolarHBondContact O-N 3.45Å; R643-W647 HydrophobicContact CG-CD2 4.37Å; R643-W647 HydrophobicContact CG-CZ2 4.06Å; R643-W647 PolarHBondContact O-N 3.48Å
644	T	93.6	Very high	88.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.9	-38	175.2	-66.9	0	0	0	0	111.9	L290 I294 V302 Q308 L311 K640 F641 A642 L646 W647 M648	L290-T644 HydrophobicContact CD2-CG2 4.23Å; I294-T644 HydrophobicContact CD1-CG2 4.17Å; V302-T644 HydrophobicContact CG1-CG2 3.61Å; Q308-T644 PolarHBondContact NE2-OG1 3.39Å; L311-T644 HydrophobicContact CD1-CG2 3.72Å; K640-T644 WeakPolarHBondContact O-CB 3.47Å; K640-T644 PolarHBondContact O-N 2.87Å; K640-T644 PolarHBondContact O-OG1 3.28Å; F641-T644 PolarHBondContact O-N 3.13Å; F641-T644 VanDerWaalsContact O-N 3.15Å; A642-T644 VanDerWaalsContact C-N 3.34Å; A642-T644 PolarHBondContact O-N 3.41Å; T644-L646 VanDerWaalsContact C-N 3.33Å; T644-L646 PolarHBondContact O-N 3.37Å; T644-W647 PolarHBondContact O-N 3.01Å; T644-M648 WeakPolarHBondContact O-CB 3.42Å; T644-M648 PolarHBondContact O-N 2.98Å
645	K	91.1	Very high	87.3	Confident	95 Å²	95	39.2 Å²	39.2	41%	0.413	21%	0.214	S	C	.	.	H	α-helix	trans	-57.4	-46.7	171	-169.7	-173.6	177.4	-171.6	0	110.8	D433 F641 A642 M648 S649	D433-K645 IonicContact OD2-NZ 3.01Å; D433-K645 PolarHBondContact OD2-NZ 2.6Å; F641-K645 PolarHBondContact O-N 3.44Å; A642-K645 PolarHBondContact O-N 3.29Å; K645-M648 PolarHBondContact O-N 2.79Å; K645-S649 PolarHBondContact O-N 3.16Å
646	L	90.8	Very high	86.5	Confident	29 Å²	29	39.3 Å²	39.3	15%	0.152	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-41.8	175	-176	154.2	0	0	0	112.3	F367 T498 A642 R643 T644 M648 S649 Y650	F367-L646 HydrophobicContact CD2-CD2 4.08Å; F367-L646 HydrophobicContact CE2-CD2 3.99Å; T498-L646 VanDerWaalsContact OG1-CD1 3.26Å; T498-L646 WeakPolarHBondContact OG1-CD1 2.94Å; A642-L646 PolarHBondContact O-N 3.41Å; R643-L646 PolarHBondContact O-N 3.45Å; T644-L646 VanDerWaalsContact C-N 3.33Å; T644-L646 PolarHBondContact O-N 3.37Å; L646-M648 VanDerWaalsContact C-N 3.31Å; L646-M648 PolarHBondContact O-N 3.08Å; L646-S649 PolarHBondContact O-OG 2.85Å; L646-Y650 HydrophobicContact CD2-CD2 4.23Å; L646-Y650 HydrophobicContact CD2-CE2 4.01Å; L646-Y650 HydrophobicContact CG-CE2 4.33Å; L646-Y650 VanDerWaalsContact O-CD2 3.23Å; L646-Y650 WeakPolarHBondContact O-CD2 3.45Å
647	W	91.3	Very high	86	Confident	13 Å²	13	36.5 Å²	36.5	5%	0.049	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-35.4	177.1	-70.1	-1.4	0	0	0	112.3	L311 A312 W315 R643 T644 S649 Y650 F651	L311-W647 HydrophobicContact CB-CE3 4.11Å; L311-W647 HydrophobicContact CB-CZ3 4.06Å; A312-W647 HydrophobicContact CB-CH2 4.3Å; A312-W647 HydrophobicContact CB-CZ3 4.28Å; W315-W647 HydrophobicContact CB-CD2 4.47Å; W315-W647 HydrophobicContact CB-CE3 4.27Å; W315-W647 HydrophobicContact CB-CZ3 4.39Å; W315-W647 AromaticContact CD2-CD1 3.9Å; W315-W647 AromaticContact CD2-CD2 3.95Å; W315-W647 HydrophobicContact CD2-CD2 3.95Å; W315-W647 AromaticContact CD2-CG 3.9Å; W315-W647 HydrophobicContact CD2-CG 3.9Å; W315-W647 AromaticContact CD2-NE1 3.96Å; W315-W647 AromaticContact CE2-CD1 3.89Å; W315-W647 AromaticContact CE2-NE1 3.73Å; W315-W647 HydrophobicContact CE3-CB 3.72Å; W315-W647 AromaticContact CE3-CD1 3.76Å; W315-W647 HydrophobicContact CE3-CD2 4.03Å; W315-W647 AromaticContact CE3-CG 3.56Å; W315-W647 HydrophobicContact CE3-CG 3.56Å; W315-W647 HydrophobicContact CG-CD2 4.14Å; W315-W647 HydrophobicContact CG-CE3 4.4Å; W315-W647 HydrophobicContact CG-CZ2 4.38Å; W315-W647 AromaticContact CH2-CD1 3.64Å; W315-W647 HydrophobicContact CH2-CG 4.22Å; W315-W647 AromaticContact CZ2-CD1 3.78Å; W315-W647 AromaticContact CZ2-NE1 3.89Å; W315-W647 HydrophobicContact CZ3-CB 3.73Å; W315-W647 AromaticContact CZ3-CD1 3.63Å; W315-W647 AromaticContact CZ3-CG 3.73Å; W315-W647 HydrophobicContact CZ3-CG 3.73Å; R643-W647 HydrophobicContact CG-CD2 4.37Å; R643-W647 HydrophobicContact CG-CZ2 4.06Å; R643-W647 PolarHBondContact O-N 3.48Å; T644-W647 PolarHBondContact O-N 3.01Å; W647-S649 PolarHBondContact O-N 3.38Å; W647-Y650 PolarHBondContact O-N 3.14Å; W647-F651 HydrophobicContact CB-CE2 4.08Å; W647-F651 HydrophobicContact CB-CZ 4.43Å; W647-F651 WeakPolarHBondContact O-CD2 3.1Å; W647-F651 PolarHBondContact O-N 2.9Å
648	M	88.4	Confident	85.7	Confident	15 Å²	15	34.1 Å²	34.1	7%	0.074	19%	0.186	C	C	.	.	H	α-helix	trans	-63.4	-39.4	-177.9	-153.7	69.8	-145.5	0	0	112.6	D286 L287 L290 K291 I294 T644 K645 L646 Y650 F651	D286-M648 WeakPolarHBondContact O-CE 3.47Å; L287-M648 HydrophobicContact CB-CE 3.92Å; L287-M648 HydrophobicContact CD1-CE 4.11Å; L287-M648 HydrophobicContact CD1-SD 4.29Å; L290-M648 HydrophobicContact CD2-SD 4.37Å; K291-M648 HydrophobicContact CD-CE 4.2Å; K291-M648 HydrophobicContact CG-CE 3.87Å; K291-M648 HydrophobicContact CG-CG 4.35Å; K291-M648 HydrophobicContact CG-SD 4.46Å; I294-M648 HydrophobicContact CD1-CB 4.4Å; I294-M648 HydrophobicContact CD1-CG 4.36Å; T644-M648 WeakPolarHBondContact O-CB 3.42Å; T644-M648 PolarHBondContact O-N 2.98Å; K645-M648 PolarHBondContact O-N 2.79Å; L646-M648 VanDerWaalsContact C-N 3.31Å; L646-M648 PolarHBondContact O-N 3.08Å; M648-Y650 PolarHBondContact O-N 3.1Å; M648-F651 HydrophobicContact CE-CB 4.34Å; M648-F651 HydrophobicContact CE-CD2 4.22Å; M648-F651 PolarHBondContact O-N 3.18Å; M648-F651 VanDerWaalsContact O-N 3.1Å; M648-F651 HydrophobicContact SD-CD2 3.8Å
649	S	85.6	Confident	85.3	Confident	73 Å²	73	33.9 Å²	33.9	51%	0.51	19%	0.186	S	C	.	.	H	α-helix	trans	-64.5	-23.1	177.9	64.6	0	0	0	0	113.7	K645 L646 W647	K645-S649 PolarHBondContact O-N 3.16Å; L646-S649 PolarHBondContact O-OG 2.85Å; W647-S649 PolarHBondContact O-N 3.38Å
650	Y	88.3	Confident	84.8	Confident	40 Å²	40	34.1 Å²	34.1	16%	0.157	19%	0.189	C	C	.	.	H	α-helix	trans	-95.7	-9.4	173.6	-63.1	-75.9	0	0	0	114.2	W315 K366 F367 H370 L646 W647 M648	W315-Y650 AromaticContact CH2-CD2 4Å; W315-Y650 HydrophobicContact CH2-CD2 4Å; W315-Y650 HydrophobicContact CH2-CG 4.34Å; W315-Y650 HydrophobicContact CZ3-CD2 4.41Å; K366-Y650 HydrophobicContact CB-CD1 3.84Å; K366-Y650 WeakPolarHBondContact CD-O 3.47Å; K366-Y650 WeakPolarHBondContact CE-O 3.46Å; K366-Y650 PolarHBondContact NZ-O 3.18Å; F367-Y650 HydrophobicContact CB-CD2 4.31Å; F367-Y650 HydrophobicContact CB-CE2 4.37Å; F367-Y650 HydrophobicContact CB-CG 4.42Å; F367-Y650 HydrophobicContact CD2-CD2 4.27Å; F367-Y650 AromaticContact CD2-CE2 3.67Å; F367-Y650 HydrophobicContact CD2-CE2 3.67Å; F367-Y650 AromaticContact CD2-CZ 3.96Å; F367-Y650 HydrophobicContact CG-CE2 4.5Å; H370-Y650 HydrophobicContact CB-CE1 4.14Å; H370-Y650 AromaticContact CD2-CE1 3.6Å; H370-Y650 AromaticContact CG-CE1 3.99Å; L646-Y650 HydrophobicContact CD2-CD2 4.23Å; L646-Y650 HydrophobicContact CD2-CE2 4.01Å; L646-Y650 HydrophobicContact CG-CE2 4.33Å; L646-Y650 VanDerWaalsContact O-CD2 3.23Å; L646-Y650 WeakPolarHBondContact O-CD2 3.45Å; W647-Y650 PolarHBondContact O-N 3.14Å; M648-Y650 PolarHBondContact O-N 3.1Å
651	F	86.3	Confident	84.3	Confident	39 Å²	39	33.4 Å²	33.4	17%	0.171	19%	0.187	C	C	.	.	H	α-helix	trans	-72.1	-41.6	172.8	-74	-46.9	0	0	0	111.2	L287 L311 L314 W315 P363 K366 W647 M648	L287-F651 HydrophobicContact CD1-CD2 4.29Å; L287-F651 HydrophobicContact CD1-CE2 4.33Å; L311-F651 HydrophobicContact CD2-CE2 3.83Å; L311-F651 HydrophobicContact CD2-CZ 4.36Å; L314-F651 HydrophobicContact CB-CE1 3.94Å; L314-F651 HydrophobicContact CB-CZ 4.07Å; W315-F651 HydrophobicContact CB-CE1 4.48Å; W315-F651 HydrophobicContact CB-CZ 4.33Å; W315-F651 HydrophobicContact CE3-CE1 4.08Å; W315-F651 HydrophobicContact CE3-CZ 4.11Å; P363-F651 HydrophobicContact CB-CD1 3.71Å; P363-F651 HydrophobicContact CB-CE1 3.96Å; P363-F651 HydrophobicContact CG-CD1 3.7Å; P363-F651 HydrophobicContact CG-CE1 3.64Å; K366-F651 PolarHBondContact NZ-O 3.4Å; W647-F651 HydrophobicContact CB-CE2 4.08Å; W647-F651 HydrophobicContact CB-CZ 4.43Å; W647-F651 WeakPolarHBondContact O-CD2 3.1Å; W647-F651 PolarHBondContact O-N 2.9Å; M648-F651 HydrophobicContact CE-CB 4.34Å; M648-F651 HydrophobicContact CE-CD2 4.22Å; M648-F651 PolarHBondContact O-N 3.18Å; M648-F651 VanDerWaalsContact O-N 3.1Å; M648-F651 HydrophobicContact SD-CD2 3.8Å
652	D	74.3	Confident	83.8	Confident	44 Å²	44	34.2 Å²	34.2	24%	0.235	19%	0.192	C	C	.	.	S	Bend	trans	-59.2	145.3	-179.2	-77.6	-37.1	0	0	0	112.9	K291 K366 G654	K291-D652 IonicContact NZ-OD1 3.87Å; K291-D652 PolarHBondContact NZ-OD1 3.42Å; K291-D652 IonicContact NZ-OD2 2.63Å; K291-D652 PolarHBondContact NZ-OD2 3.11Å; K366-D652 PolarHBondContact NZ-O 3.31Å; D652-G654 PolarHBondContact O-N 2.9Å
653	E	64.1	Low	83.2	Confident	104 Å²	104	36 Å²	36	49%	0.486	20%	0.197	S	C	.	.	S	Bend	trans	-72.8	-2.2	179.4	-68.5	-157	116.8	0	0	114.2	K361 T656	K361-E653 IonicContact NZ-OE1 2.69Å; K361-E653 PolarHBondContact NZ-OE1 3.37Å; E653-T656 WeakPolarHBondContact O-CG2 3.46Å
654	G	64.4	Low	82.2	Confident	31 Å²	31	38.4 Å²	38.4	32%	0.32	21%	0.211	S	C	.	.	S	Bend	trans	-76	153.2	169.9	0	0	0	0	0	112	D652 T656	D652-G654 PolarHBondContact O-N 2.9Å; G654-T656 VanDerWaalsContact C-N 3.33Å; G654-T656 PolarHBondContact O-N 3.21Å
655	G	68	Low	80.8	Confident	34 Å²	34	41.3 Å²	41.3	35%	0.351	23%	0.231	S	C	.	.			trans	66.4	27.2	168.9	0	0	0	0	0	115.4	H370 L657	H370-G655 PolarHBondContact NE2-O 2.87Å; G655-L657 PolarHBondContact O-N 3.27Å
656	T	75.7	Confident	79.5	Confident	13 Å²	13	39.2 Å²	39.2	8%	0.08	23%	0.228	C	C	.	.			trans	-65.5	-22.7	-178.5	53.2	0	0	0	0	114.4	Y348 K366 E653 G654	Y348-T656 WeakPolarHBondContact CE1-OG1 3.3Å; Y348-T656 VanDerWaalsContact CZ-OG1 3.32Å; Y348-T656 PolarHBondContact OH-OG1 3.44Å; K366-T656 HydrophobicContact CD-CG2 4.38Å; E653-T656 WeakPolarHBondContact O-CG2 3.46Å; G654-T656 VanDerWaalsContact C-N 3.33Å; G654-T656 PolarHBondContact O-N 3.21Å
657	L	82.6	Confident	78	Confident	21 Å²	21	42.6 Å²	42.6	11%	0.11	25%	0.251	C	S	.	.	S	Bend	trans	-94.4	127.6	178.4	-74.1	172.3	0	0	0	110.5	Y348 H370 G655 F661	Y348-L657 HydrophobicContact CD1-CD1 4.48Å; Y348-L657 HydrophobicContact CD1-CD2 3.79Å; Y348-L657 HydrophobicContact CD1-CG 4.04Å; Y348-L657 HydrophobicContact CE1-CD2 4.45Å; Y348-L657 HydrophobicContact CE1-CG 4.2Å; H370-L657 PolarHBondContact CE1-O 3.17Å; G655-L657 PolarHBondContact O-N 3.27Å; L657-F661 HydrophobicContact CD2-CB 4.38Å
658	P	86.7	Confident	76.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-69.9	149.4	170.7	31.2	-34.6	0	0	0	111	F341 C369 H370 F661 N662	F341-P658 HydrophobicContact CD2-CG 4.26Å; C369-P658 HydrophobicContact CB-CG 4.38Å; H370-P658 VanDerWaalsContact CE1-CA 3.48Å; H370-P658 WeakPolarHBondContact CE1-CA 3.45Å; P658-F661 HydrophobicContact CG-CD2 4.48Å; P658-F661 PolarHBondContact O-N 3.03Å; P658-N662 PolarHBondContact O-N 3.26Å
659	P	86.2	Confident	75.3	Confident	13 Å²	13	50.5 Å²	50.5	8%	0.084	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	140.6	157.8	-24.5	35.4	0	0	0	109.1	S373 F414	S373-P659 WeakPolarHBondContact CB-O 3.35Å; S373-P659 PolarHBondContact OG-O 2.96Å; F414-P659 HydrophobicContact CD1-CB 4.19Å; F414-P659 HydrophobicContact CD1-CG 3.8Å; F414-P659 HydrophobicContact CE1-CB 3.99Å; F414-P659 HydrophobicContact CE1-CG 3.81Å
660	P	84.7	Confident	74.1	Confident	19 Å²	19	53.2 Å²	53.2	12%	0.123	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	cis	-84.4	-10.2	3.9	35.4	-34.2	0	0	0	113.7	P409 W410 N662 I663	P409-P660 HydrophobicContact CB-CB 3.56Å; P409-P660 WeakPolarHBondContact O-CB 3.47Å; W410-P660 HydrophobicContact CD2-CB 4.2Å; W410-P660 HydrophobicContact CD2-CG 4.17Å; W410-P660 HydrophobicContact CE3-CB 4.33Å; W410-P660 HydrophobicContact CE3-CG 4.28Å; W410-P660 HydrophobicContact CG-CB 4.47Å; W410-P660 HydrophobicContact CH2-CG 4.32Å; W410-P660 HydrophobicContact CZ2-CG 4.2Å; W410-P660 HydrophobicContact CZ3-CG 4.35Å; P660-N662 PolarHBondContact O-N 3.41Å; P660-N662 VanDerWaalsContact O-N 3.15Å; P660-I663 PolarHBondContact O-N 3.14Å
661	F	85.6	Confident	72.8	Confident	36 Å²	36	57 Å²	57	16%	0.158	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-67.3	-16.7	-171.9	-57.1	-69.1	0	0	0	114.2	F341 P342 I346 L657 P658 I663 I664	F341-F661 HydrophobicContact CD2-CE2 4.46Å; F341-F661 HydrophobicContact CE2-CE2 4.02Å; P342-F661 HydrophobicContact CB-CE2 4.27Å; P342-F661 HydrophobicContact CB-CZ 4.08Å; I346-F661 HydrophobicContact CD1-CE1 4.38Å; I346-F661 HydrophobicContact CG1-CE1 4.13Å; L657-F661 HydrophobicContact CD2-CB 4.38Å; P658-F661 HydrophobicContact CG-CD2 4.48Å; P658-F661 PolarHBondContact O-N 3.03Å; F661-I663 PolarHBondContact O-N 3.2Å; F661-I664 HydrophobicContact CD1-CD1 4.32Å; F661-I664 PolarHBondContact O-N 3.23Å
662	N	84.4	Confident	71.8	Confident	38 Å²	38	63.3 Å²	63.3	20%	0.203	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-61.4	-23.3	176.6	-166.9	32	0	0	0	114.2	P658 P660	P658-N662 PolarHBondContact O-N 3.26Å; P660-N662 PolarHBondContact O-N 3.41Å; P660-N662 VanDerWaalsContact O-N 3.15Å
663	I	80.2	Confident	71.5	Confident	64 Å²	64	65.5 Å²	65.5	33%	0.328	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-72.9	-33.1	178.5	-57.9	168	0	0	0	111.5	P409 L412 P660 F661 P665	P409-I663 WeakPolarHBondContact O-CD1 3.31Å; L412-I663 HydrophobicContact CB-CD1 3.48Å; L412-I663 VanDerWaalsContact CB-CD1 3.48Å; L412-I663 HydrophobicContact CB-CG1 4.4Å; P660-I663 PolarHBondContact O-N 3.14Å; F661-I663 PolarHBondContact O-N 3.2Å; I663-P665 WeakPolarHBondContact O-CD 3.33Å; I663-P665 VanDerWaalsContact O-N 3.09Å
664	I	74.1	Confident	71.6	Confident	85 Å²	85	62.4 Å²	62.4	44%	0.436	35%	0.349	S	S	.	.	S	Bend	trans	-70	108.9	-171.9	-54.2	175.1	0	0	0	108.2	L349 F661 S666	L349-I664 HydrophobicContact CD1-CB 3.87Å; L349-I664 HydrophobicContact CD1-CD1 4.09Å; L349-I664 HydrophobicContact CD1-CG2 3.78Å; F661-I664 HydrophobicContact CD1-CD1 4.32Å; F661-I664 PolarHBondContact O-N 3.23Å; I664-S666 PolarHBondContact O-N 3.44Å
665	P	65.1	Low	71.7	Confident	62 Å²	62	65.7 Å²	65.7	40%	0.403	36%	0.359	S	S	.	.			trans	-71.8	136	-169	-13.9	29.1	0	0	0	109.8	I663 F670	I663-P665 WeakPolarHBondContact O-CD 3.33Å; I663-P665 VanDerWaalsContact O-N 3.09Å; P665-F670 HydrophobicContact CB-CD2 3.98Å; P665-F670 HydrophobicContact CB-CE2 3.56Å; P665-F670 HydrophobicContact CB-CZ 4.03Å; P665-F670 HydrophobicContact CG-CE2 3.74Å; P665-F670 HydrophobicContact CG-CZ 3.77Å
666	S	61.9	Low	71.8	Confident	50 Å²	50	70.7 Å²	70.7	35%	0.35	37%	0.367	S	S	.	.			trans	-61.8	150.4	173.2	82.2	0	0	0	0	110	I664 K668 S669 F670	I664-S666 PolarHBondContact O-N 3.44Å; S666-K668 PolarHBondContact O-N 3.23Å; S666-K668 PolarHBondContact OG-N 2.77Å; S666-S669 WeakPolarHBondContact O-CA 3.34Å; S666-S669 VanDerWaalsContact O-CB 3.29Å; S666-S669 WeakPolarHBondContact O-CB 3.28Å; S666-S669 PolarHBondContact O-N 2.92Å; S666-S669 PolarHBondContact OG-N 3.3Å; S666-S669 PolarHBondContact OG-OG 3.47Å; S666-F670 PolarHBondContact O-N 2.95Å
667	P	60.6	Low	71.5	Confident	100 Å²	100	74.9 Å²	74.9	65%	0.649	38%	0.384	S	S	*	.	H	α-helix	trans	-55.8	-25	174.5	-27.9	35.7	0	0	0	113.6
668	K	59	Low	70.6	Confident	140 Å²	140	78.2 Å²	78.2	61%	0.609	40%	0.403	S	S	*	.	H	α-helix	trans	-74.1	-35.6	172.3	-63.1	-174.8	178	-175.2	0	112.7	S666 F670 L671 Y672	S666-K668 PolarHBondContact O-N 3.23Å; S666-K668 PolarHBondContact OG-N 2.77Å; K668-F670 VanDerWaalsContact C-N 3.31Å; K668-F670 PolarHBondContact O-N 2.87Å; K668-L671 PolarHBondContact O-N 3.45Å; K668-L671 VanDerWaalsContact O-N 3.13Å; K668-Y672 HydrophobicContact CB-CD2 4.35Å; K668-Y672 HydrophobicContact CB-CE2 4.28Å; K668-Y672 WeakPolarHBondContact O-CD2 3.46Å; K668-Y672 PolarHBondContact O-N 3.3Å
669	S	63.6	Low	69.6	Low	55 Å²	55	86.3 Å²	86.3	39%	0.385	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-39.7	178.7	-54.5	0	0	0	0	111.3	S666 Y672 L673	S666-S669 WeakPolarHBondContact O-CA 3.34Å; S666-S669 VanDerWaalsContact O-CB 3.29Å; S666-S669 WeakPolarHBondContact O-CB 3.28Å; S666-S669 PolarHBondContact O-N 2.92Å; S666-S669 PolarHBondContact OG-N 3.3Å; S666-S669 PolarHBondContact OG-OG 3.47Å; S669-Y672 PolarHBondContact O-N 2.96Å; S669-L673 VanDerWaalsContact O-CB 3.24Å; S669-L673 WeakPolarHBondContact O-CB 3.45Å; S669-L673 PolarHBondContact O-N 3.32Å
670	F	60.8	Low	68.7	Low	130 Å²	130	89.6 Å²	89.6	57%	0.57	46%	0.458	S	S	*	.	H	α-helix	trans	-63.5	-38.4	172.4	-78.7	-73.2	0	0	0	113.1	P665 S666 K668 G674	P665-F670 HydrophobicContact CB-CD2 3.98Å; P665-F670 HydrophobicContact CB-CE2 3.56Å; P665-F670 HydrophobicContact CB-CZ 4.03Å; P665-F670 HydrophobicContact CG-CE2 3.74Å; P665-F670 HydrophobicContact CG-CZ 3.77Å; S666-F670 PolarHBondContact O-N 2.95Å; K668-F670 VanDerWaalsContact C-N 3.31Å; K668-F670 PolarHBondContact O-N 2.87Å; F670-G674 PolarHBondContact O-N 3.21Å
671	L	61.3	Low	67.9	Low	119 Å²	119	96.1 Å²	96.1	62%	0.623	48%	0.484	S	S	*	.	H	α-helix	trans	-69.4	-37.7	175.3	-68.5	171.2	0	0	0	112.4	K668 N675	K668-L671 PolarHBondContact O-N 3.45Å; K668-L671 VanDerWaalsContact O-N 3.13Å; L671-N675 VanDerWaalsContact O-CB 3.29Å; L671-N675 WeakPolarHBondContact O-CB 3.35Å; L671-N675 VanDerWaalsContact O-CG 3.26Å; L671-N675 PolarHBondContact O-N 3.48Å; L671-N675 PolarHBondContact O-ND2 2.95Å
672	Y	64.7	Low	66.3	Low	171 Å²	171	97.9 Å²	97.9	67%	0.671	50%	0.501	S	S	*	.	H	α-helix	trans	-69.2	-44.4	174.2	-76.7	-60.2	0	0	0	112.2	K668 S669 N675 W676	K668-Y672 HydrophobicContact CB-CD2 4.35Å; K668-Y672 HydrophobicContact CB-CE2 4.28Å; K668-Y672 WeakPolarHBondContact O-CD2 3.46Å; K668-Y672 PolarHBondContact O-N 3.3Å; S669-Y672 PolarHBondContact O-N 2.96Å; Y672-N675 PolarHBondContact O-N 2.97Å; Y672-W676 VanDerWaalsContact O-CB 3.3Å; Y672-W676 WeakPolarHBondContact O-CB 3.39Å; Y672-W676 PolarHBondContact O-N 3.28Å
673	L	67.1	Low	64.7	Low	91 Å²	91	101.5 Å²	101.5	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-44.5	175.4	-169.7	69.2	0	0	0	110.6	S669 W676 F677	S669-L673 VanDerWaalsContact O-CB 3.24Å; S669-L673 WeakPolarHBondContact O-CB 3.45Å; S669-L673 PolarHBondContact O-N 3.32Å; L673-W676 HydrophobicContact CD1-CE3 4.38Å; L673-W676 PolarHBondContact O-N 2.85Å; L673-F677 HydrophobicContact CD1-CD2 4.21Å; L673-F677 HydrophobicContact CD1-CE2 4.05Å; L673-F677 HydrophobicContact CG-CD2 4.03Å; L673-F677 HydrophobicContact CG-CE2 4.11Å; L673-F677 WeakPolarHBondContact O-CD2 3.49Å; L673-F677 PolarHBondContact O-N 3.01Å
674	G	66.3	Low	63.5	Low	38 Å²	38	107.2 Å²	107.2	39%	0.392	55%	0.549	S	S	.	.	H	α-helix	trans	-60.4	-45	173.9	0	0	0	0	0	112.8	F670 W676 N678	F670-G674 PolarHBondContact O-N 3.21Å; G674-W676 VanDerWaalsContact C-N 3.34Å; G674-N678 VanDerWaalsContact O-CB 3.24Å; G674-N678 WeakPolarHBondContact O-CB 3.49Å; G674-N678 PolarHBondContact O-N 2.96Å
675	N	66.4	Low	62.2	Low	100 Å²	100	115.2 Å²	115.2	54%	0.535	57%	0.573	S	S	.	*	H	α-helix	trans	-67.4	-32.7	175.3	-78.3	-17	0	0	0	113	L671 Y672 K679	L671-N675 VanDerWaalsContact O-CB 3.29Å; L671-N675 WeakPolarHBondContact O-CB 3.35Å; L671-N675 VanDerWaalsContact O-CG 3.26Å; L671-N675 PolarHBondContact O-N 3.48Å; L671-N675 PolarHBondContact O-ND2 2.95Å; Y672-N675 PolarHBondContact O-N 2.97Å; N675-K679 WeakPolarHBondContact O-CB 3.44Å; N675-K679 WeakPolarHBondContact O-CG 3.45Å; N675-K679 PolarHBondContact O-N 2.73Å
676	W	70	Confident	61.3	Low	139 Å²	139	117.9 Å²	117.9	53%	0.527	58%	0.584	S	S	.	*	H	α-helix	trans	-67.3	-53.7	174.2	178.8	84.8	0	0	0	110.3	Y672 L673 G674 N678 K679 T680	Y672-W676 VanDerWaalsContact O-CB 3.3Å; Y672-W676 WeakPolarHBondContact O-CB 3.39Å; Y672-W676 PolarHBondContact O-N 3.28Å; L673-W676 HydrophobicContact CD1-CE3 4.38Å; L673-W676 PolarHBondContact O-N 2.85Å; G674-W676 VanDerWaalsContact C-N 3.34Å; W676-N678 VanDerWaalsContact C-N 3.26Å; W676-N678 PolarHBondContact O-N 3.35Å; W676-K679 WeakPolarHBondContact O-CA 3.39Å; W676-K679 WeakPolarHBondContact O-CB 3.18Å; W676-K679 PolarHBondContact O-N 3.17Å; W676-T680 PolarHBondContact O-N 3.05Å; W676-T680 PolarHBondContact O-OG1 3.12Å
677	F	69.6	Low	60.6	Low	101 Å²	101	121.4 Å²	121.4	44%	0.443	61%	0.606	S	S	.	*	H	α-helix	trans	-53.1	-43.8	172.2	-93.5	-87.3	0	0	0	111.8	L673 K679 T680 F681	L673-F677 HydrophobicContact CD1-CD2 4.21Å; L673-F677 HydrophobicContact CD1-CE2 4.05Å; L673-F677 HydrophobicContact CG-CD2 4.03Å; L673-F677 HydrophobicContact CG-CE2 4.11Å; L673-F677 WeakPolarHBondContact O-CD2 3.49Å; L673-F677 PolarHBondContact O-N 3.01Å; F677-K679 PolarHBondContact O-N 3.47Å; F677-T680 PolarHBondContact O-N 3.45Å; F677-F681 AromaticContact CD1-CD2 3.84Å; F677-F681 HydrophobicContact CD1-CD2 3.84Å; F677-F681 AromaticContact CD1-CE2 3.58Å; F677-F681 HydrophobicContact CD1-CE2 3.58Å; F677-F681 AromaticContact CE1-CE2 3.86Å; F677-F681 HydrophobicContact CE1-CE2 3.86Å; F677-F681 WeakPolarHBondContact O-CB 3.48Å; F677-F681 WeakPolarHBondContact O-CD2 3.36Å; F677-F681 PolarHBondContact O-N 3.37Å
678	N	65.3	Low	60.2	Low	92 Å²	92	121.4 Å²	121.4	49%	0.492	60%	0.601	S	S	.	*	H	α-helix	trans	-67	-34.2	179.1	-151.1	1.2	0	0	0	112.3	G674 W676 C682	G674-N678 VanDerWaalsContact O-CB 3.24Å; G674-N678 WeakPolarHBondContact O-CB 3.49Å; G674-N678 PolarHBondContact O-N 2.96Å; W676-N678 VanDerWaalsContact C-N 3.26Å; W676-N678 PolarHBondContact O-N 3.35Å; N678-C682 CarbonylContact O-C 3.4Å; N678-C682 VanDerWaalsContact O-C 3.25Å; N678-C682 VanDerWaalsContact O-CA 3.29Å; N678-C682 WeakPolarHBondContact O-CA 3.09Å; N678-C682 WeakPolarHBondContact O-CB 3.44Å; N678-C682 PolarHBondContact O-N 2.69Å
679	K	64.4	Low	59.6	Low	169 Å²	169	117.2 Å²	117.2	74%	0.735	60%	0.597	S	S	*	*	H	α-helix	trans	-68.5	-41.4	170.7	-84	-173.6	172.5	-171.3	0	112.7	N675 W676 F677	N675-K679 WeakPolarHBondContact O-CB 3.44Å; N675-K679 WeakPolarHBondContact O-CG 3.45Å; N675-K679 PolarHBondContact O-N 2.73Å; W676-K679 WeakPolarHBondContact O-CA 3.39Å; W676-K679 WeakPolarHBondContact O-CB 3.18Å; W676-K679 PolarHBondContact O-N 3.17Å; F677-K679 PolarHBondContact O-N 3.47Å
680	T	67.8	Low	58.7	Low	82 Å²	82	126.3 Å²	126.3	50%	0.503	62%	0.623	S	S	.	*	H	α-helix	trans	-71.3	-37.8	-177.2	-49.8	0	0	0	0	112.2	W676 F677	W676-T680 PolarHBondContact O-N 3.05Å; W676-T680 PolarHBondContact O-OG1 3.12Å; F677-T680 PolarHBondContact O-N 3.45Å
681	F	68.4	Low	58	Low	156 Å²	156	128.3 Å²	128.3	68%	0.684	63%	0.627	S	S	*	*	H	α-helix	trans	-97.3	-19.5	-178.9	-73.3	-86.7	0	0	0	114.4	F677	F677-F681 AromaticContact CD1-CD2 3.84Å; F677-F681 HydrophobicContact CD1-CD2 3.84Å; F677-F681 AromaticContact CD1-CE2 3.58Å; F677-F681 HydrophobicContact CD1-CE2 3.58Å; F677-F681 AromaticContact CE1-CE2 3.86Å; F677-F681 HydrophobicContact CE1-CE2 3.86Å; F677-F681 WeakPolarHBondContact O-CB 3.48Å; F677-F681 WeakPolarHBondContact O-CD2 3.36Å; F677-F681 PolarHBondContact O-N 3.37Å
682	C	51	Low	57.3	Low	74 Å²	74	131.3 Å²	131.3	50%	0.5	63%	0.63	S	S	.	*			trans	-143	78.1	-178.7	-94.2	0	0	0	0	112.3	N678 K684	N678-C682 CarbonylContact O-C 3.4Å; N678-C682 VanDerWaalsContact O-C 3.25Å; N678-C682 VanDerWaalsContact O-CA 3.29Å; N678-C682 WeakPolarHBondContact O-CA 3.09Å; N678-C682 WeakPolarHBondContact O-CB 3.44Å; N678-C682 PolarHBondContact O-N 2.69Å; C682-K684 PolarHBondContact O-N 3.07Å
683	P	52	Low	56.5	Low	114 Å²	114	133.7 Å²	133.7	74%	0.74	64%	0.638	S	S	*	*			trans	-68.3	88.5	176.3	28.9	-35.3	0	0	0	111.5	R685	P683-R685 PolarHBondContact O-N 2.8Å
684	K	53.6	Low	55.6	Low	184 Å²	184	137 Å²	137	80%	0.8	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-66.5	124.1	170.4	-73.6	-174.3	176.9	-179.3	0	110	C682 D686	C682-K684 PolarHBondContact O-N 3.07Å; K684-D686 PolarHBondContact O-N 3.2Å
685	R	46.8	Very low	55.2	Low	252 Å²	252	139.5 Å²	139.5	95%	0.951	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-56.9	118	160.2	-100.8	176.9	166.3	160.4	-4.6	108.4	P683	P683-R685 PolarHBondContact O-N 2.8Å
686	D	47.7	Very low	55	Low	119 Å²	119	139.8 Å²	139.8	64%	0.636	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-67.2	136.3	178.7	-127.5	-23.4	0	0	0	109.7	K684 D688 R691	K684-D686 PolarHBondContact O-N 3.2Å; D686-D688 PolarHBondContact O-N 3.48Å; D686-R691 IonicContact OD1-NH1 2.75Å
687	P	46	Very low	54.7	Low	124 Å²	124	141.3 Å²	141.3	81%	0.805	66%	0.661	S	S	*	*			trans	-78.3	74.7	176.1	32.2	-34.2	0	0	0	110
688	D	52.2	Low	54.5	Low	100 Å²	100	138.2 Å²	138.2	54%	0.535	65%	0.652	S	S	.	*			trans	-84.2	135.5	-170.9	-160.3	15.4	0	0	0	113.1	D686	D686-D688 PolarHBondContact O-N 3.48Å
689	G	47.2	Very low	54.6	Low	52 Å²	52	139.8 Å²	139.8	54%	0.536	66%	0.655	S	S	.	*	S	Bend	trans	160.3	-45.2	-177.7	0	0	0	0	0	114.4
690	R	44	Very low	55	Low	245 Å²	245	135.5 Å²	135.5	93%	0.925	64%	0.643	S	S	*	*	S	Bend	trans	-88.2	-24.7	176.8	-74.1	-171.8	-179.5	-174	1.4	114.3
691	R	46.8	Very low	55.3	Low	172 Å²	172	135.6 Å²	135.6	65%	0.649	64%	0.638	S	S	*	*	H	α-helix	trans	-74.1	-36.7	178	-77.6	179.5	170.3	164.7	-3	113.3	D686 R693 H694 N695	D686-R691 IonicContact OD1-NH1 2.75Å; R691-R693 VanDerWaalsContact C-N 3.28Å; R691-R693 PolarHBondContact O-N 2.89Å; R691-R693 VanDerWaalsContact O-N 3.17Å; R691-H694 PolarHBondContact O-N 3.29Å; R691-N695 PolarHBondContact O-N 2.93Å; R691-N695 VanDerWaalsContact O-N 3.14Å
692	R	46.5	Very low	55.4	Low	182 Å²	182	134 Å²	134	69%	0.687	63%	0.627	S	S	*	*	H	α-helix	trans	-55.6	-34.6	-176.1	-120.8	171.5	175.3	-179.9	-0.9	114.4	N695 L696	R692-N695 PolarHBondContact O-N 3.26Å; R692-L696 PolarHBondContact O-N 3.47Å
693	R	46.8	Very low	56.5	Low	222 Å²	222	135.5 Å²	135.5	84%	0.838	63%	0.627	S	S	*	*	H	α-helix	trans	-72.9	-32.7	-178.6	-127.5	176.2	-173.7	174.3	2	113.9	R691	R691-R693 VanDerWaalsContact C-N 3.28Å; R691-R693 PolarHBondContact O-N 2.89Å; R691-R693 VanDerWaalsContact O-N 3.17Å
694	H	49.6	Very low	57.8	Low	159 Å²	159	132.2 Å²	132.2	74%	0.736	61%	0.609	S	S	*	*	H	α-helix	trans	-77.3	-32.5	172.6	-119.3	-75.3	0	0	0	111.7	R691 S698	R691-H694 PolarHBondContact O-N 3.29Å; H694-S698 PolarHBondContact O-N 2.76Å; H694-S698 PolarHBondContact O-OG 2.96Å
695	N	57.1	Low	58.9	Low	92 Å²	92	127.2 Å²	127.2	49%	0.492	59%	0.591	S	S	.	*	H	α-helix	trans	-67.2	-37	172.6	-74.2	-0.6	0	0	0	111.9	R691 R692 R697 S698 F699	R691-N695 PolarHBondContact O-N 2.93Å; R691-N695 VanDerWaalsContact O-N 3.14Å; R692-N695 PolarHBondContact O-N 3.26Å; N695-R697 PolarHBondContact O-N 3.09Å; N695-S698 PolarHBondContact O-N 3.41Å; N695-S698 PolarHBondContact O-OG 3.24Å; N695-F699 WeakPolarHBondContact O-CB 3.44Å; N695-F699 PolarHBondContact O-N 2.87Å
696	L	61.5	Low	60.4	Low	106 Å²	106	116.3 Å²	116.3	56%	0.555	55%	0.553	S	S	*	*	H	α-helix	trans	-60.2	-46.2	179.7	-174.4	65	0	0	0	112.5	R692 F699 T700	R692-L696 PolarHBondContact O-N 3.47Å; L696-F699 WeakPolarHBondContact O-CB 3.16Å; L696-F699 PolarHBondContact O-N 3.29Å; L696-T700 PolarHBondContact O-N 3.25Å; L696-T700 PolarHBondContact O-OG1 2.97Å
697	R	65.2	Low	62	Low	170 Å²	170	114.4 Å²	114.4	64%	0.642	54%	0.543	S	S	*	.	H	α-helix	trans	-62.8	-47.8	178.3	179.4	174.6	171.4	164.2	3.4	112	N695 F699 T700 E701	N695-R697 PolarHBondContact O-N 3.09Å; R697-F699 PolarHBondContact O-N 3.36Å; R697-T700 WeakPolarHBondContact CA-OG1 3.38Å; R697-T700 PolarHBondContact O-N 2.88Å; R697-T700 PolarHBondContact O-OG1 3.21Å; R697-E701 WeakPolarHBondContact CG-OE1 3.42Å; R697-E701 IonicContact CZ-OE1 3.39Å; R697-E701 IonicContact NE-OE1 2.66Å; R697-E701 PolarHBondContact NE-OE1 3.49Å; R697-E701 IonicContact NH2-OE1 3.2Å; R697-E701 PolarHBondContact NH2-OE1 3.43Å; R697-E701 WeakPolarHBondContact O-CB 3.42Å; R697-E701 WeakPolarHBondContact O-CG 3.47Å; R697-E701 PolarHBondContact O-N 2.98Å
698	S	64.3	Low	63.8	Low	36 Å²	36	112.5 Å²	112.5	25%	0.252	53%	0.525	S	S	.	.	H	α-helix	trans	-69.5	-20.7	177.3	61.7	0	0	0	0	113.1	H694 N695 R702	H694-S698 PolarHBondContact O-N 2.76Å; H694-S698 PolarHBondContact O-OG 2.96Å; N695-S698 PolarHBondContact O-N 3.41Å; N695-S698 PolarHBondContact O-OG 3.24Å; S698-R702 VanDerWaalsContact O-CB 3.32Å; S698-R702 WeakPolarHBondContact O-CB 3.41Å; S698-R702 VanDerWaalsContact O-CG 3.25Å; S698-R702 WeakPolarHBondContact O-CG 3.47Å; S698-R702 PolarHBondContact O-N 3.11Å; S698-R702 VanDerWaalsContact O-N 3.1Å; S698-R702 PolarHBondContact O-NE 3.43Å; S698-R702 PolarHBondContact OG-NH2 2.92Å
699	F	68.1	Low	65.2	Low	126 Å²	126	111 Å²	111	55%	0.553	52%	0.515	S	S	*	.	H	α-helix	trans	-77	-42.3	171.5	179.4	-90.4	0	0	0	111.2	N695 L696 R697 R702 H703	N695-F699 WeakPolarHBondContact O-CB 3.44Å; N695-F699 PolarHBondContact O-N 2.87Å; L696-F699 WeakPolarHBondContact O-CB 3.16Å; L696-F699 PolarHBondContact O-N 3.29Å; R697-F699 PolarHBondContact O-N 3.36Å; F699-R702 PolarHBondContact O-N 3.4Å; F699-H703 WeakPolarHBondContact O-CB 3.38Å; F699-H703 PolarHBondContact O-N 2.94Å
700	T	73.3	Confident	67	Low	78 Å²	78	110 Å²	110	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-66.1	-37.2	173.1	49.3	0	0	0	0	112.5	L696 R697 H703 A704	L696-T700 PolarHBondContact O-N 3.25Å; L696-T700 PolarHBondContact O-OG1 2.97Å; R697-T700 WeakPolarHBondContact CA-OG1 3.38Å; R697-T700 PolarHBondContact O-N 2.88Å; R697-T700 PolarHBondContact O-OG1 3.21Å; T700-H703 PolarHBondContact O-N 3.3Å; T700-A704 WeakPolarHBondContact O-CB 3.48Å; T700-A704 PolarHBondContact O-N 3.32Å
701	E	74.2	Confident	69.1	Low	85 Å²	85	104.8 Å²	104.8	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-64	-47.6	172.7	-72.2	163.5	173	0	0	110	R697 H703 A704 D705	R697-E701 WeakPolarHBondContact CG-OE1 3.42Å; R697-E701 IonicContact CZ-OE1 3.39Å; R697-E701 IonicContact NE-OE1 2.66Å; R697-E701 PolarHBondContact NE-OE1 3.49Å; R697-E701 IonicContact NH2-OE1 3.2Å; R697-E701 PolarHBondContact NH2-OE1 3.43Å; R697-E701 WeakPolarHBondContact O-CB 3.42Å; R697-E701 WeakPolarHBondContact O-CG 3.47Å; R697-E701 PolarHBondContact O-N 2.98Å; E701-H703 PolarHBondContact O-N 3.15Å; E701-A704 WeakPolarHBondContact O-CB 3.4Å; E701-A704 PolarHBondContact O-N 2.95Å; E701-D705 PolarHBondContact O-N 3.25Å
702	R	69.8	Low	71.1	Confident	121 Å²	121	100.8 Å²	100.8	46%	0.457	47%	0.472	S	S	.	.	H	α-helix	trans	-59.9	-39.8	174.2	-83.5	175.4	-86.5	175.8	-9	114.2	S698 F699 D705 S706	S698-R702 VanDerWaalsContact O-CB 3.32Å; S698-R702 WeakPolarHBondContact O-CB 3.41Å; S698-R702 VanDerWaalsContact O-CG 3.25Å; S698-R702 WeakPolarHBondContact O-CG 3.47Å; S698-R702 PolarHBondContact O-N 3.11Å; S698-R702 VanDerWaalsContact O-N 3.1Å; S698-R702 PolarHBondContact O-NE 3.43Å; S698-R702 PolarHBondContact OG-NH2 2.92Å; F699-R702 PolarHBondContact O-N 3.4Å; R702-D705 PolarHBondContact O-N 2.98Å; R702-S706 PolarHBondContact O-N 3.34Å
703	H	74.4	Confident	73.2	Confident	107 Å²	107	92.2 Å²	92.2	50%	0.495	44%	0.439	S	S	.	.	H	α-helix	trans	-69.7	-37.5	177.8	-172.2	58.2	0	0	0	111.3	F699 T700 E701 L707	F699-H703 WeakPolarHBondContact O-CB 3.38Å; F699-H703 PolarHBondContact O-N 2.94Å; T700-H703 PolarHBondContact O-N 3.3Å; E701-H703 PolarHBondContact O-N 3.15Å; H703-L707 WeakPolarHBondContact O-CB 3.39Å; H703-L707 VanDerWaalsContact O-CG 3.24Å; H703-L707 WeakPolarHBondContact O-CG 3.38Å; H703-L707 PolarHBondContact O-N 2.67Å
704	A	77.7	Confident	75.4	Confident	45 Å²	45	85.4 Å²	85.4	37%	0.372	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-43.1	171.3	0	0	0	0	0	111.9	T700 E701 L707 I708	T700-A704 WeakPolarHBondContact O-CB 3.48Å; T700-A704 PolarHBondContact O-N 3.32Å; E701-A704 WeakPolarHBondContact O-CB 3.4Å; E701-A704 PolarHBondContact O-N 2.95Å; A704-L707 PolarHBondContact O-N 3.22Å; A704-I708 WeakPolarHBondContact O-CD1 3.19Å; A704-I708 VanDerWaalsContact O-CG1 3.24Å; A704-I708 WeakPolarHBondContact O-CG1 3.37Å; A704-I708 PolarHBondContact O-N 3.25Å
705	D	77.6	Confident	77.4	Confident	79 Å²	79	82.4 Å²	82.4	42%	0.422	40%	0.403	S	S	.	.	H	α-helix	trans	-62.6	-44	177	-69.4	-26.7	0	0	0	112.2	E701 R702 I708 Q709	E701-D705 PolarHBondContact O-N 3.25Å; R702-D705 PolarHBondContact O-N 2.98Å; D705-I708 PolarHBondContact O-N 3.28Å; D705-Q709 WeakPolarHBondContact O-CB 3.48Å; D705-Q709 PolarHBondContact O-N 3.36Å
706	S	78.4	Confident	79.2	Confident	23 Å²	23	78.7 Å²	78.7	16%	0.161	38%	0.384	C	S	.	.	H	α-helix	trans	-60.7	-46.8	173.6	140	0	0	0	0	111.3	D274 R702 I708 Q709 N710	D274-S706 PolarHBondContact OD1-OG 3.12Å; R702-S706 PolarHBondContact O-N 3.34Å; S706-I708 VanDerWaalsContact C-N 3.33Å; S706-I708 PolarHBondContact O-N 3.49Å; S706-Q709 PolarHBondContact O-N 2.94Å; S706-N710 WeakPolarHBondContact O-CB 3.48Å; S706-N710 PolarHBondContact O-N 3.27Å; S706-N710 PolarHBondContact O-ND2 2.91Å
707	L	81.7	Confident	80.7	Confident	79 Å²	79	73.9 Å²	73.9	41%	0.414	36%	0.359	S	S	.	.	H	α-helix	trans	-59.9	-40.9	177	-73.1	170.7	0	0	0	112.4	H703 A704 N710 Q711	H703-L707 WeakPolarHBondContact O-CB 3.39Å; H703-L707 VanDerWaalsContact O-CG 3.24Å; H703-L707 WeakPolarHBondContact O-CG 3.38Å; H703-L707 PolarHBondContact O-N 2.67Å; A704-L707 PolarHBondContact O-N 3.22Å; L707-N710 PolarHBondContact O-N 3.33Å; L707-Q711 WeakPolarHBondContact O-CB 3.23Å; L707-Q711 VanDerWaalsContact O-CG 3.29Å; L707-Q711 WeakPolarHBondContact O-CG 3.48Å; L707-Q711 PolarHBondContact O-N 3.32Å
708	I	83.9	Confident	82.1	Confident	84 Å²	84	73.1 Å²	73.1	43%	0.431	36%	0.356	S	S	.	.	H	α-helix	trans	-65.5	-44	175.7	-69.5	162.5	0	0	0	110.7	A704 D705 S706 N710 Q711 H712	A704-I708 WeakPolarHBondContact O-CD1 3.19Å; A704-I708 VanDerWaalsContact O-CG1 3.24Å; A704-I708 WeakPolarHBondContact O-CG1 3.37Å; A704-I708 PolarHBondContact O-N 3.25Å; D705-I708 PolarHBondContact O-N 3.28Å; S706-I708 VanDerWaalsContact C-N 3.33Å; S706-I708 PolarHBondContact O-N 3.49Å; I708-N710 VanDerWaalsContact C-N 3.33Å; I708-N710 PolarHBondContact O-N 2.93Å; I708-Q711 PolarHBondContact O-N 2.93Å; I708-H712 PolarHBondContact O-CD2 3.22Å; I708-H712 VanDerWaalsContact O-CD2 3.3Å; I708-H712 PolarHBondContact O-N 3.46Å
709	Q	81.6	Confident	83.6	Confident	68 Å²	68	73.8 Å²	73.8	32%	0.318	36%	0.357	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.4	-175.9	173.9	-4.5	0	0	111.7	D705 S706 H712 Y713	D705-Q709 WeakPolarHBondContact O-CB 3.48Å; D705-Q709 PolarHBondContact O-N 3.36Å; S706-Q709 PolarHBondContact O-N 2.94Å; Q709-H712 PolarHBondContact O-N 2.79Å; Q709-Y713 WeakPolarHBondContact O-CB 3.19Å; Q709-Y713 PolarHBondContact O-N 3.35Å
710	N	85.6	Confident	84.9	Confident	32 Å²	32	67.8 Å²	67.8	17%	0.171	33%	0.331	C	S	.	.	H	α-helix	trans	-66.9	-42.7	176.7	-72.1	-16.7	0	0	0	112.1	H271 D274 S706 L707 I708 Y713 Q714	H271-N710 PolarHBondContact CE1-OD1 3.47Å; D274-N710 PolarHBondContact OD2-ND2 2.83Å; S706-N710 WeakPolarHBondContact O-CB 3.48Å; S706-N710 PolarHBondContact O-N 3.27Å; S706-N710 PolarHBondContact O-ND2 2.91Å; L707-N710 PolarHBondContact O-N 3.33Å; I708-N710 VanDerWaalsContact C-N 3.33Å; I708-N710 PolarHBondContact O-N 2.93Å; N710-Y713 PolarHBondContact O-N 3.47Å; N710-Q714 WeakPolarHBondContact O-CB 3.35Å; N710-Q714 WeakPolarHBondContact O-CG 3.47Å; N710-Q714 PolarHBondContact O-N 3.48Å
711	Q	87.6	Confident	85.9	Confident	135 Å²	135	65 Å²	65	63%	0.631	31%	0.314	S	S	*	.	H	α-helix	trans	-61	-46	174.3	-75.7	175.7	6.7	0	0	111.8	L707 I708 Q714 E715	L707-Q711 WeakPolarHBondContact O-CB 3.23Å; L707-Q711 VanDerWaalsContact O-CG 3.29Å; L707-Q711 WeakPolarHBondContact O-CG 3.48Å; L707-Q711 PolarHBondContact O-N 3.32Å; I708-Q711 PolarHBondContact O-N 2.93Å; Q711-Q714 PolarHBondContact O-N 2.89Å; Q711-E715 PolarHBondContact O-N 2.88Å
712	H	88.5	Confident	86.9	Confident	87 Å²	87	68.6 Å²	68.6	40%	0.403	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-40.1	175.2	-75.3	-45.2	0	0	0	112.6	I708 Q709 E715 V716	I708-H712 PolarHBondContact O-CD2 3.22Å; I708-H712 VanDerWaalsContact O-CD2 3.3Å; I708-H712 PolarHBondContact O-N 3.46Å; Q709-H712 PolarHBondContact O-N 2.79Å; H712-E715 PolarHBondContact O-N 3.06Å; H712-V716 WeakPolarHBondContact O-CG2 3.32Å; H712-V716 PolarHBondContact O-N 2.94Å
713	Y	90.1	Very high	88.2	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-47.7	175.1	176.2	-107.4	0	0	0	111.8	D215 I267 I268 H271 K289 Q709 N710 E715 V716 I717	D215-Y713 PolarHBondContact OD1-OH 3.11Å; D215-Y713 VanDerWaalsContact OD1-OH 3.07Å; D215-Y713 PolarHBondContact OD2-OH 3.15Å; D215-Y713 VanDerWaalsContact OD2-OH 3.07Å; I267-Y713 HydrophobicContact CG2-CD2 4.29Å; I268-Y713 HydrophobicContact CB-CE2 4.5Å; I268-Y713 HydrophobicContact CG1-CE2 4.47Å; I268-Y713 HydrophobicContact CG2-CE2 4.44Å; H271-Y713 HydrophobicContact CB-CD2 3.76Å; H271-Y713 HydrophobicContact CB-CE2 3.89Å; H271-Y713 HydrophobicContact CB-CG 4.23Å; H271-Y713 AromaticContact CE1-CD1 3.33Å; H271-Y713 WeakPolarHBondContact CE1-CD1 3.43Å; H271-Y713 AromaticContact CE1-CE1 3.83Å; H271-Y713 AromaticContact CE1-CG 3.66Å; H271-Y713 AromaticContact CG-CD1 3.91Å; H271-Y713 AromaticContact CG-CD2 3.74Å; H271-Y713 AromaticContact CG-CE2 3.93Å; H271-Y713 AromaticContact CG-CG 3.73Å; H271-Y713 WeakPolarHBondContact ND1-CB 3.3Å; H271-Y713 AromaticContact ND1-CD1 3.37Å; H271-Y713 WeakPolarHBondContact ND1-CD1 3.26Å; H271-Y713 AromaticContact ND1-CD2 3.66Å; H271-Y713 AromaticContact ND1-CE1 3.96Å; H271-Y713 AromaticContact ND1-CG 3.18Å; H271-Y713 AromaticContact NE2-CD1 3.85Å; H271-Y713 AromaticContact NE2-CE1 3.86Å; K289-Y713 PolarHBondContact NZ-OH 3.12Å; K289-Y713 VanDerWaalsContact NZ-OH 3.09Å; Q709-Y713 WeakPolarHBondContact O-CB 3.19Å; Q709-Y713 PolarHBondContact O-N 3.35Å; N710-Y713 PolarHBondContact O-N 3.47Å; Y713-E715 VanDerWaalsContact C-N 3.33Å; Y713-E715 PolarHBondContact O-N 2.71Å; Y713-V716 PolarHBondContact O-N 2.86Å; Y713-V716 VanDerWaalsContact O-N 3.14Å; Y713-I717 HydrophobicContact CD1-CG1 4.17Å; Y713-I717 HydrophobicContact CD2-CG1 4.21Å; Y713-I717 HydrophobicContact CE1-CD1 4.47Å; Y713-I717 HydrophobicContact CE1-CG1 3.73Å; Y713-I717 HydrophobicContact CE2-CD1 3.87Å; Y713-I717 HydrophobicContact CE2-CG1 3.75Å; Y713-I717 HydrophobicContact CG-CG1 4.4Å; Y713-I717 VanDerWaalsContact CZ-CG1 3.5Å; Y713-I717 WeakPolarHBondContact O-CG1 3.41Å; Y713-I717 PolarHBondContact O-N 2.81Å
714	Q	92.4	Very high	89.2	Confident	79 Å²	79	61.5 Å²	61.5	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-62.9	-37.3	177.5	-75.8	-62.6	-22	0	0	112.5	E214 N710 Q711 R718	E214-Q714 PolarHBondContact O-NE2 3.34Å; E214-Q714 PolarHBondContact O-OE1 3.29Å; N710-Q714 WeakPolarHBondContact O-CB 3.35Å; N710-Q714 WeakPolarHBondContact O-CG 3.47Å; N710-Q714 PolarHBondContact O-N 3.48Å; Q711-Q714 PolarHBondContact O-N 2.89Å; Q714-R718 VanDerWaalsContact O-CB 3.25Å; Q714-R718 WeakPolarHBondContact O-CB 3.4Å; Q714-R718 PolarHBondContact O-N 3.15Å
715	E	92.8	Very high	90	Very high	96 Å²	96	59.8 Å²	59.8	45%	0.449	28%	0.282	S	S	.	.	H	α-helix	trans	-63.2	-43.1	171.9	179.6	167.8	-143.3	0	0	112.3	Q711 H712 Y713 R718 N719	Q711-E715 PolarHBondContact O-N 2.88Å; H712-E715 PolarHBondContact O-N 3.06Å; Y713-E715 VanDerWaalsContact C-N 3.33Å; Y713-E715 PolarHBondContact O-N 2.71Å; E715-R718 IonicContact OE1-NH2 2.73Å; E715-N719 WeakPolarHBondContact O-CB 3.49Å; E715-N719 VanDerWaalsContact O-CG 3.29Å; E715-N719 PolarHBondContact O-N 3.25Å; E715-N719 PolarHBondContact O-ND2 3.35Å; E715-N719 VanDerWaalsContact O-ND2 3.09Å
716	V	94.4	Very high	90.7	Very high	14 Å²	14	59 Å²	59	9%	0.085	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-49.7	175.8	171.2	0	0	0	0	110.7	E264 I267 I268 H712 Y713 R718 N719 L720	E264-V716 HydrophobicContact CB-CG1 4.09Å; E264-V716 HydrophobicContact CG-CG1 4.18Å; E264-V716 HydrophobicContact CG-CG2 4.28Å; I267-V716 HydrophobicContact CD1-CG2 4.25Å; I267-V716 HydrophobicContact CG2-CG2 4.34Å; I268-V716 HydrophobicContact CD1-CG1 4.05Å; I268-V716 HydrophobicContact CG1-CG1 3.94Å; H712-V716 WeakPolarHBondContact O-CG2 3.32Å; H712-V716 PolarHBondContact O-N 2.94Å; Y713-V716 PolarHBondContact O-N 2.86Å; Y713-V716 VanDerWaalsContact O-N 3.14Å; V716-R718 PolarHBondContact O-N 3.02Å; V716-N719 WeakPolarHBondContact O-CB 3.36Å; V716-N719 PolarHBondContact O-N 3.09Å; V716-N719 VanDerWaalsContact O-N 3.11Å; V716-L720 HydrophobicContact CG1-CD1 3.89Å; V716-L720 HydrophobicContact CG1-CG 4.27Å; V716-L720 VanDerWaalsContact O-CG 3.31Å; V716-L720 WeakPolarHBondContact O-CG 3.48Å; V716-L720 PolarHBondContact O-N 2.91Å
717	I	93.8	Very high	91.4	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-49	177	-72.3	-55.5	0	0	0	111.2	P216 I217 Y713 N719 L720 V721	P216-I717 HydrophobicContact CG-CG2 4Å; I217-I717 HydrophobicContact CD1-CD1 3.94Å; I217-I717 HydrophobicContact CG1-CD1 4.49Å; Y713-I717 HydrophobicContact CD1-CG1 4.17Å; Y713-I717 HydrophobicContact CD2-CG1 4.21Å; Y713-I717 HydrophobicContact CE1-CD1 4.47Å; Y713-I717 HydrophobicContact CE1-CG1 3.73Å; Y713-I717 HydrophobicContact CE2-CD1 3.87Å; Y713-I717 HydrophobicContact CE2-CG1 3.75Å; Y713-I717 HydrophobicContact CG-CG1 4.4Å; Y713-I717 VanDerWaalsContact CZ-CG1 3.5Å; Y713-I717 WeakPolarHBondContact O-CG1 3.41Å; Y713-I717 PolarHBondContact O-N 2.81Å; I717-N719 VanDerWaalsContact C-N 3.28Å; I717-N719 PolarHBondContact O-N 2.82Å; I717-L720 HydrophobicContact CD1-CD1 4.25Å; I717-L720 PolarHBondContact O-N 2.91Å; I717-L720 VanDerWaalsContact O-N 3.09Å; I717-V721 HydrophobicContact CG2-CG2 4.2Å; I717-V721 WeakPolarHBondContact O-CG2 3.41Å; I717-V721 PolarHBondContact O-N 2.93Å
718	R	94.6	Very high	91.8	Very high	153 Å²	153	56.9 Å²	56.9	58%	0.577	28%	0.276	S	S	*	.	H	α-helix	trans	-56.1	-41.7	175.8	-178.6	-172.3	65	132.1	-2.5	112.2	Q714 E715 V716 K722	Q714-R718 VanDerWaalsContact O-CB 3.25Å; Q714-R718 WeakPolarHBondContact O-CB 3.4Å; Q714-R718 PolarHBondContact O-N 3.15Å; E715-R718 IonicContact OE1-NH2 2.73Å; V716-R718 PolarHBondContact O-N 3.02Å; R718-K722 VanDerWaalsContact O-CB 3.32Å; R718-K722 WeakPolarHBondContact O-CB 3.24Å; R718-K722 PolarHBondContact O-N 2.85Å
719	N	94.9	Very high	92.1	Very high	51 Å²	51	55.2 Å²	55.2	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-38.2	177.1	-75.7	-35.3	0	0	0	112.3	E715 V716 I717 R723	E715-N719 WeakPolarHBondContact O-CB 3.49Å; E715-N719 VanDerWaalsContact O-CG 3.29Å; E715-N719 PolarHBondContact O-N 3.25Å; E715-N719 PolarHBondContact O-ND2 3.35Å; E715-N719 VanDerWaalsContact O-ND2 3.09Å; V716-N719 WeakPolarHBondContact O-CB 3.36Å; V716-N719 PolarHBondContact O-N 3.09Å; V716-N719 VanDerWaalsContact O-N 3.11Å; I717-N719 VanDerWaalsContact C-N 3.28Å; I717-N719 PolarHBondContact O-N 2.82Å; N719-R723 WeakPolarHBondContact O-CG 3.29Å; N719-R723 PolarHBondContact O-N 2.9Å; N719-R723 VanDerWaalsContact O-N 3.1Å
720	L	94.9	Very high	92.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.6	-49.4	175.8	-66.7	170	0	0	0	111.8	L255 Q258 A259 I268 V716 I717 K722 R723 Y724	L255-L720 HydrophobicContact CD1-CB 3.87Å; L255-L720 HydrophobicContact CG-CB 4.46Å; Q258-L720 HydrophobicContact CB-CD2 3.84Å; Q258-L720 WeakPolarHBondContact O-CD2 3.5Å; A259-L720 HydrophobicContact CB-CD2 4Å; A259-L720 VanDerWaalsContact N-CD2 3.32Å; I268-L720 HydrophobicContact CD1-CD1 3.48Å; I268-L720 VanDerWaalsContact CD1-CD1 3.48Å; I268-L720 HydrophobicContact CG1-CD1 4.21Å; V716-L720 HydrophobicContact CG1-CD1 3.89Å; V716-L720 HydrophobicContact CG1-CG 4.27Å; V716-L720 VanDerWaalsContact O-CG 3.31Å; V716-L720 WeakPolarHBondContact O-CG 3.48Å; V716-L720 PolarHBondContact O-N 2.91Å; I717-L720 HydrophobicContact CD1-CD1 4.25Å; I717-L720 PolarHBondContact O-N 2.91Å; I717-L720 VanDerWaalsContact O-N 3.09Å; L720-K722 VanDerWaalsContact C-N 3.31Å; L720-K722 PolarHBondContact O-N 3.31Å; L720-R723 CarbonylContact O-C 3.55Å; L720-R723 WeakPolarHBondContact O-CB 3.29Å; L720-R723 PolarHBondContact O-N 3.45Å; L720-R723 VanDerWaalsContact O-N 3.1Å; L720-Y724 WeakPolarHBondContact O-CB 3.33Å; L720-Y724 PolarHBondContact O-N 2.86Å
721	V	95.9	Very high	92.3	Very high	20 Å²	20	63.3 Å²	63.3	12%	0.121	30%	0.299	C	S	.	.	H	α-helix	trans	-57.3	-45.9	177.3	170.9	0	0	0	0	110.2	A210 P216 L255 I717 R723 Y724 V725	A210-V721 HydrophobicContact CB-CG1 3.98Å; A210-V721 WeakPolarHBondContact O-CG1 3.47Å; P216-V721 HydrophobicContact CG-CG2 3.94Å; L255-V721 HydrophobicContact CD1-CG2 4.14Å; I717-V721 HydrophobicContact CG2-CG2 4.2Å; I717-V721 WeakPolarHBondContact O-CG2 3.41Å; I717-V721 PolarHBondContact O-N 2.93Å; V721-R723 VanDerWaalsContact C-N 3.34Å; V721-R723 PolarHBondContact O-N 2.89Å; V721-Y724 PolarHBondContact O-N 2.8Å; V721-V725 HydrophobicContact CG1-CG2 4.34Å; V721-V725 WeakPolarHBondContact O-CG2 3.29Å; V721-V725 PolarHBondContact O-N 3.25Å
722	K	94.9	Very high	91.9	Very high	160 Å²	160	59 Å²	59	70%	0.696	28%	0.284	S	S	*	.	H	α-helix	trans	-61	-39	176.3	-172.6	175.7	-178	178.5	0	113	R718 L720 A726	R718-K722 VanDerWaalsContact O-CB 3.32Å; R718-K722 WeakPolarHBondContact O-CB 3.24Å; R718-K722 PolarHBondContact O-N 2.85Å; L720-K722 VanDerWaalsContact C-N 3.31Å; L720-K722 PolarHBondContact O-N 3.31Å; K722-A726 WeakPolarHBondContact O-CB 3.18Å; K722-A726 PolarHBondContact O-N 3.47Å
723	R	95.7	Very high	91.1	Very high	57 Å²	57	62.4 Å²	62.4	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-68.4	-42.8	174.4	-71.3	167.9	-164.6	169.9	10.5	111.3	Q258 E264 N719 L720 V721 A726 A727	Q258-R723 HydrophobicContact CB-CB 3.87Å; Q258-R723 HydrophobicContact CG-CB 4.15Å; Q258-R723 WeakPolarHBondContact O-CD 3.3Å; Q258-R723 PolarHBondContact O-NH1 3.36Å; E264-R723 VanDerWaalsContact CD-NH1 3.35Å; E264-R723 IonicContact OE1-CZ 2.67Å; E264-R723 IonicContact OE1-NH1 2.69Å; E264-R723 PolarHBondContact OE1-NH1 2.88Å; E264-R723 VanDerWaalsContact OE1-NH1 3.11Å; E264-R723 IonicContact OE1-NH2 3.63Å; E264-R723 PolarHBondContact OE1-NH2 3.47Å; E264-R723 IonicContact OE2-CZ 2.76Å; E264-R723 IonicContact OE2-NH1 3.38Å; E264-R723 PolarHBondContact OE2-NH1 3.45Å; E264-R723 IonicContact OE2-NH2 3.57Å; N719-R723 WeakPolarHBondContact O-CG 3.29Å; N719-R723 PolarHBondContact O-N 2.9Å; N719-R723 VanDerWaalsContact O-N 3.1Å; L720-R723 CarbonylContact O-C 3.55Å; L720-R723 WeakPolarHBondContact O-CB 3.29Å; L720-R723 PolarHBondContact O-N 3.45Å; L720-R723 VanDerWaalsContact O-N 3.1Å; V721-R723 VanDerWaalsContact C-N 3.34Å; V721-R723 PolarHBondContact O-N 2.89Å; R723-A726 PolarHBondContact O-N 2.95Å; R723-A727 WeakPolarHBondContact O-CB 3.24Å; R723-A727 PolarHBondContact O-N 2.83Å
724	Y	95.7	Very high	90.2	Very high	22 Å²	22	66.8 Å²	66.8	9%	0.086	33%	0.325	C	S	.	.	H	α-helix	trans	-61.9	-52.5	-179.6	174.9	-95.1	0	0	0	111	P206 F251 D254 L255 L720 V721 A726 A727 M728	P206-Y724 HydrophobicContact CB-CE1 4.26Å; F251-Y724 AromaticContact CD2-CE1 3.81Å; F251-Y724 HydrophobicContact CD2-CE1 3.81Å; F251-Y724 HydrophobicContact CD2-CE2 4.24Å; F251-Y724 AromaticContact CD2-CZ 3.63Å; F251-Y724 HydrophobicContact CE2-CD1 4.04Å; F251-Y724 AromaticContact CE2-CE1 3.62Å; F251-Y724 HydrophobicContact CE2-CE1 3.62Å; F251-Y724 AromaticContact CE2-CZ 3.94Å; D254-Y724 HydrophobicContact CB-CD2 4.32Å; D254-Y724 HydrophobicContact CB-CE2 3.81Å; L255-Y724 HydrophobicContact CD1-CG 4.18Å; L720-Y724 WeakPolarHBondContact O-CB 3.33Å; L720-Y724 PolarHBondContact O-N 2.86Å; V721-Y724 PolarHBondContact O-N 2.8Å; Y724-A726 VanDerWaalsContact C-N 3.31Å; Y724-A726 PolarHBondContact O-N 3.08Å; Y724-A727 PolarHBondContact O-N 2.82Å; Y724-A727 VanDerWaalsContact O-N 3.1Å; Y724-M728 HydrophobicContact CE1-CB 4.4Å; Y724-M728 HydrophobicContact CE1-SD 3.82Å; Y724-M728 VanDerWaalsContact O-CB 3.31Å; Y724-M728 WeakPolarHBondContact O-CB 3.45Å; Y724-M728 PolarHBondContact O-N 3.06Å
725	V	94.6	Very high	89.1	Confident	9 Å²	9	69.1 Å²	69.1	6%	0.055	34%	0.34	C	S	.	.	H	α-helix	trans	-59.3	-43	177.7	174	0	0	0	0	111.1	Y155 A210 V721 A727 M728 I729	Y155-V725 HydrophobicContact CD1-CG1 3.81Å; Y155-V725 HydrophobicContact CD2-CG1 3.69Å; Y155-V725 HydrophobicContact CD2-CG2 3.95Å; Y155-V725 HydrophobicContact CE1-CG1 3.86Å; Y155-V725 HydrophobicContact CE2-CB 4.35Å; Y155-V725 HydrophobicContact CE2-CG1 3.73Å; Y155-V725 HydrophobicContact CE2-CG2 3.72Å; Y155-V725 HydrophobicContact CG-CG1 3.72Å; A210-V725 HydrophobicContact CB-CG2 4.21Å; V721-V725 HydrophobicContact CG1-CG2 4.34Å; V721-V725 WeakPolarHBondContact O-CG2 3.29Å; V721-V725 PolarHBondContact O-N 3.25Å; V725-A727 VanDerWaalsContact C-N 3.35Å; V725-A727 PolarHBondContact O-N 3.13Å; V725-M728 PolarHBondContact O-N 3.45Å; V725-I729 HydrophobicContact CG1-CD1 3.64Å; V725-I729 HydrophobicContact CG1-CG1 4.35Å; V725-I729 WeakPolarHBondContact O-CB 3.42Å; V725-I729 VanDerWaalsContact O-CG1 3.29Å; V725-I729 WeakPolarHBondContact O-CG1 3.34Å; V725-I729 PolarHBondContact O-N 2.93Å
726	A	93.2	Very high	88.1	Confident	62 Å²	62	71 Å²	71	51%	0.512	35%	0.348	S	S	.	.	H	α-helix	trans	-65.2	-35.3	176.5	0	0	0	0	0	113.3	K722 R723 Y724 R730	K722-A726 WeakPolarHBondContact O-CB 3.18Å; K722-A726 PolarHBondContact O-N 3.47Å; R723-A726 PolarHBondContact O-N 2.95Å; Y724-A726 VanDerWaalsContact C-N 3.31Å; Y724-A726 PolarHBondContact O-N 3.08Å; A726-R730 VanDerWaalsContact O-CB 3.31Å; A726-R730 WeakPolarHBondContact O-CB 3.09Å; A726-R730 PolarHBondContact O-N 3.45Å
727	A	92.4	Very high	87.2	Confident	26 Å²	26	73 Å²	73	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-72.3	-43.5	175.2	0	0	0	0	0	111.9	R723 Y724 V725 R730 N731	R723-A727 WeakPolarHBondContact O-CB 3.24Å; R723-A727 PolarHBondContact O-N 2.83Å; Y724-A727 PolarHBondContact O-N 2.82Å; Y724-A727 VanDerWaalsContact O-N 3.1Å; V725-A727 VanDerWaalsContact C-N 3.35Å; V725-A727 PolarHBondContact O-N 3.13Å; A727-R730 PolarHBondContact O-N 3.37Å; A727-N731 WeakPolarHBondContact O-CB 3.4Å; A727-N731 PolarHBondContact O-N 2.79Å; A727-N731 PolarHBondContact O-OD1 3.31Å
728	M	90.9	Very high	86.7	Confident	32 Å²	32	80.6 Å²	80.6	16%	0.158	41%	0.412	C	S	.	.	H	α-helix	trans	-59.5	-53.2	177.3	179.5	-174	75.4	0	0	111.4	S207 Y724 V725 R730 N731 S732	S207-M728 WeakPolarHBondContact OG-CE 3.29Å; Y724-M728 HydrophobicContact CE1-CB 4.4Å; Y724-M728 HydrophobicContact CE1-SD 3.82Å; Y724-M728 VanDerWaalsContact O-CB 3.31Å; Y724-M728 WeakPolarHBondContact O-CB 3.45Å; Y724-M728 PolarHBondContact O-N 3.06Å; V725-M728 PolarHBondContact O-N 3.45Å; M728-R730 VanDerWaalsContact C-N 3.26Å; M728-R730 PolarHBondContact O-N 2.92Å; M728-N731 PolarHBondContact O-N 3.44Å; M728-N731 VanDerWaalsContact O-N 3.15Å; M728-S732 WeakPolarHBondContact O-CB 3.22Å; M728-S732 PolarHBondContact O-N 2.96Å
729	I	88.8	Confident	86.2	Confident	48 Å²	48	76.6 Å²	76.6	25%	0.246	41%	0.405	C	S	.	.	H	α-helix	trans	-59.7	-37.9	177.6	-66.5	168.7	0	0	0	111.1	Y155 V725 K733	Y155-I729 HydrophobicContact CD1-CD1 4.33Å; V725-I729 HydrophobicContact CG1-CD1 3.64Å; V725-I729 HydrophobicContact CG1-CG1 4.35Å; V725-I729 WeakPolarHBondContact O-CB 3.42Å; V725-I729 VanDerWaalsContact O-CG1 3.29Å; V725-I729 WeakPolarHBondContact O-CG1 3.34Å; V725-I729 PolarHBondContact O-N 2.93Å; I729-K733 HydrophobicContact CG2-CD 4.3Å; I729-K733 WeakPolarHBondContact O-CG 3.45Å; I729-K733 PolarHBondContact O-N 3.25Å
730	R	87.3	Confident	85.6	Confident	185 Å²	185	80.9 Å²	80.9	70%	0.698	42%	0.423	S	S	*	.	H	α-helix	trans	-68.9	-41.1	177.1	-175.5	175.8	-177.3	164.2	2.5	112.2	A726 A727 M728 T734	A726-R730 VanDerWaalsContact O-CB 3.31Å; A726-R730 WeakPolarHBondContact O-CB 3.09Å; A726-R730 PolarHBondContact O-N 3.45Å; A727-R730 PolarHBondContact O-N 3.37Å; M728-R730 VanDerWaalsContact C-N 3.26Å; M728-R730 PolarHBondContact O-N 2.92Å; R730-T734 WeakPolarHBondContact O-CG2 3.45Å; R730-T734 PolarHBondContact O-N 3.35Å; R730-T734 PolarHBondContact O-OG1 3.26Å
731	N	85.4	Confident	84.8	Confident	86 Å²	86	85.1 Å²	85.1	46%	0.46	44%	0.443	S	S	.	.	H	α-helix	trans	-73.3	-38.8	-177.1	-70.8	-6.7	0	0	0	112	A727 M728 T734 N735	A727-N731 WeakPolarHBondContact O-CB 3.4Å; A727-N731 PolarHBondContact O-N 2.79Å; A727-N731 PolarHBondContact O-OD1 3.31Å; M728-N731 PolarHBondContact O-N 3.44Å; M728-N731 VanDerWaalsContact O-N 3.15Å; N731-T734 PolarHBondContact O-N 3.26Å; N731-T734 PolarHBondContact O-OG1 3.15Å; N731-T734 VanDerWaalsContact O-OG1 3.08Å; N731-N735 WeakPolarHBondContact O-CB 3.35Å; N731-N735 PolarHBondContact O-N 3.29Å; N731-N735 PolarHBondContact O-ND2 2.9Å
732	S	78.2	Confident	84.2	Confident	44 Å²	44	87.4 Å²	87.4	31%	0.308	46%	0.455	S	S	.	.	H	α-helix	trans	-53.4	-57.6	170.8	142	0	0	0	0	109.8	M728 T734 N735 E736	M728-S732 WeakPolarHBondContact O-CB 3.22Å; M728-S732 PolarHBondContact O-N 2.96Å; S732-T734 PolarHBondContact O-N 3.36Å; S732-N735 PolarHBondContact O-N 3.03Å; S732-E736 WeakPolarHBondContact CA-OE1 3.5Å; S732-E736 WeakPolarHBondContact CB-OE1 3.44Å; S732-E736 PolarHBondContact O-N 2.84Å; S732-E736 PolarHBondContact OG-OE1 3.2Å
733	K	72.3	Confident	83.8	Confident	159 Å²	159	86.3 Å²	86.3	69%	0.691	45%	0.45	S	S	*	.	H	α-helix	trans	-59.5	-13.6	178	-69.1	-177.4	179.8	-169.1	0	116	I729	I729-K733 HydrophobicContact CG2-CD 4.3Å; I729-K733 WeakPolarHBondContact O-CG 3.45Å; I729-K733 PolarHBondContact O-N 3.25Å
734	T	71.8	Confident	83.1	Confident	94 Å²	94	86.8 Å²	86.8	58%	0.577	45%	0.454	S	S	*	.	H	α-helix	trans	-106.7	-19.8	174.9	55.6	0	0	0	0	114.5	R730 N731 S732	R730-T734 WeakPolarHBondContact O-CG2 3.45Å; R730-T734 PolarHBondContact O-N 3.35Å; R730-T734 PolarHBondContact O-OG1 3.26Å; N731-T734 PolarHBondContact O-N 3.26Å; N731-T734 PolarHBondContact O-OG1 3.15Å; N731-T734 VanDerWaalsContact O-OG1 3.08Å; S732-T734 PolarHBondContact O-N 3.36Å
735	N	67.6	Low	82.5	Confident	127 Å²	127	88.9 Å²	88.9	68%	0.679	46%	0.464	S	S	*	.	H	α-helix	trans	-105.1	-22.8	-172.8	-64.6	-8.3	0	0	0	112.7	N731 S732	N731-N735 WeakPolarHBondContact O-CB 3.35Å; N731-N735 PolarHBondContact O-N 3.29Å; N731-N735 PolarHBondContact O-ND2 2.9Å; S732-N735 PolarHBondContact O-N 3.03Å
736	E	73.6	Confident	82.2	Confident	135 Å²	135	93.1 Å²	93.1	63%	0.631	49%	0.486	S	S	*	.	S	Bend	trans	-70.2	127.2	173.1	-75.1	153.7	-141.5	0	0	110.5	S732	S732-E736 WeakPolarHBondContact CA-OE1 3.5Å; S732-E736 WeakPolarHBondContact CB-OE1 3.44Å; S732-E736 PolarHBondContact O-N 2.84Å; S732-E736 PolarHBondContact OG-OE1 3.2Å
737	G	75	Confident	82	Confident	58 Å²	58	96.7 Å²	96.7	60%	0.598	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-73.8	154.2	172.8	0	0	0	0	0	111.3	T739	G737-T739 PolarHBondContact O-N 2.73Å; G737-T739 VanDerWaalsContact O-N 3.15Å
738	L	83.8	Confident	81.7	Confident	164 Å²	164	96 Å²	96	86%	0.859	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-62.9	116	171.9	-70.2	167.5	0	0	0	109.9
739	T	83.1	Confident	81.5	Confident	70 Å²	70	98.2 Å²	98.2	43%	0.429	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-82.5	169.7	175.3	79.8	0	0	0	0	111.1	G737 E741 N742	G737-T739 PolarHBondContact O-N 2.73Å; G737-T739 VanDerWaalsContact O-N 3.15Å; T739-E741 PolarHBondContact O-N 2.75Å; T739-E741 WeakPolarHBondContact OG1-CB 3.16Å; T739-E741 PolarHBondContact OG1-N 3.4Å; T739-E741 VanDerWaalsContact OG1-N 3.1Å; T739-N742 PolarHBondContact OG1-N 3.15Å; T739-N742 PolarHBondContact OG1-OD1 2.89Å
740	E	83.4	Confident	81.6	Confident	140 Å²	140	101.2 Å²	101.2	65%	0.654	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-27.8	170.1	-168.7	-174.6	135.9	0	0	111.8	F743 K744	E740-F743 WeakPolarHBondContact O-CB 3.38Å; E740-F743 PolarHBondContact O-N 2.89Å; E740-F743 VanDerWaalsContact O-N 3.15Å; E740-K744 PolarHBondContact O-N 2.95Å; E740-K744 VanDerWaalsContact OE1-CE 3.22Å; E740-K744 WeakPolarHBondContact OE1-CE 3.48Å; E740-K744 IonicContact OE1-NZ 3.91Å
741	E	77.5	Confident	81.5	Confident	90 Å²	90	93.1 Å²	93.1	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-67.6	-46.1	-177.1	-49.4	-163.8	164	0	0	110.7	K106 T739 F743 K744 E745	K106-E741 IonicContact NZ-OE1 3.4Å; K106-E741 PolarHBondContact NZ-OE1 3.05Å; K106-E741 IonicContact NZ-OE2 3.87Å; K106-E741 PolarHBondContact NZ-OE2 3.09Å; T739-E741 PolarHBondContact O-N 2.75Å; T739-E741 WeakPolarHBondContact OG1-CB 3.16Å; T739-E741 PolarHBondContact OG1-N 3.4Å; T739-E741 VanDerWaalsContact OG1-N 3.1Å; E741-F743 PolarHBondContact O-N 2.97Å; E741-F743 VanDerWaalsContact O-N 3.1Å; E741-K744 WeakPolarHBondContact O-CA 3.16Å; E741-K744 WeakPolarHBondContact O-CB 3.35Å; E741-K744 PolarHBondContact O-N 3.14Å; E741-E745 PolarHBondContact O-N 3.03Å
742	N	83.2	Confident	81.5	Confident	68 Å²	68	90.1 Å²	90.1	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-58	-26.5	173	-50.5	27.4	0	0	0	112.4	T739 L746	T739-N742 PolarHBondContact OG1-N 3.15Å; T739-N742 PolarHBondContact OG1-OD1 2.89Å; N742-L746 PolarHBondContact O-N 3.02Å
743	F	85.8	Confident	82	Confident	136 Å²	136	94.2 Å²	94.2	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-81.9	-32.2	174	-178.7	-98.8	0	0	0	112.6	E740 E741 K747	E740-F743 WeakPolarHBondContact O-CB 3.38Å; E740-F743 PolarHBondContact O-N 2.89Å; E740-F743 VanDerWaalsContact O-N 3.15Å; E741-F743 PolarHBondContact O-N 2.97Å; E741-F743 VanDerWaalsContact O-N 3.1Å; F743-K747 WeakPolarHBondContact O-CB 3.39Å; F743-K747 PolarHBondContact O-N 3.44Å
744	K	82.3	Confident	82.7	Confident	68 Å²	68	92.6 Å²	92.6	30%	0.296	47%	0.47	S	S	.	.	H	α-helix	trans	-66.5	-44.7	171.6	-70.1	175.6	-178.6	172.9	0	111.1	E79 E740 E741 K747 Q748	E79-K744 IonicContact OE1-NZ 2.67Å; E740-K744 PolarHBondContact O-N 2.95Å; E740-K744 VanDerWaalsContact OE1-CE 3.22Å; E740-K744 WeakPolarHBondContact OE1-CE 3.48Å; E740-K744 IonicContact OE1-NZ 3.91Å; E741-K744 WeakPolarHBondContact O-CA 3.16Å; E741-K744 WeakPolarHBondContact O-CB 3.35Å; E741-K744 PolarHBondContact O-N 3.14Å; K744-K747 WeakPolarHBondContact O-CB 3.44Å; K744-K747 PolarHBondContact O-N 2.53Å; K744-Q748 WeakPolarHBondContact O-CB 3.37Å; K744-Q748 PolarHBondContact O-N 3.35Å
745	E	82.6	Confident	83.3	Confident	66 Å²	66	90.7 Å²	90.7	31%	0.308	45%	0.453	S	S	.	.	H	α-helix	trans	-50.2	-62.6	171	-178.8	-155.1	157.7	0	0	110.8	E81 E741 K747 Q748 D749	E81-E745 HydrophobicContact CB-CG 4.47Å; E81-E745 HydrophobicContact CG-CG 4.45Å; E741-E745 PolarHBondContact O-N 3.03Å; E745-K747 VanDerWaalsContact C-N 3.27Å; E745-K747 PolarHBondContact O-N 2.91Å; E745-Q748 WeakPolarHBondContact O-CA 3.28Å; E745-Q748 WeakPolarHBondContact O-CB 3.5Å; E745-Q748 PolarHBondContact O-N 2.73Å; E745-D749 PolarHBondContact O-N 3.39Å
746	L	88.3	Confident	84.1	Confident	97 Å²	97	89.4 Å²	89.4	51%	0.508	44%	0.443	S	S	.	.	H	α-helix	trans	-57.6	-37.7	179.6	-179.9	64.2	0	0	0	113.2	N742 Q748 I750	N742-L746 PolarHBondContact O-N 3.02Å; L746-Q748 VanDerWaalsContact C-N 3.32Å; L746-I750 HydrophobicContact CD1-CD1 4.3Å; L746-I750 HydrophobicContact CG-CD1 4.2Å; L746-I750 WeakPolarHBondContact O-CD1 3.43Å; L746-I750 VanDerWaalsContact O-CG1 3.26Å; L746-I750 WeakPolarHBondContact O-CG1 3.29Å; L746-I750 PolarHBondContact O-N 3.12Å
747	K	88.8	Confident	84.8	Confident	138 Å²	138	85.4 Å²	85.4	60%	0.6	43%	0.427	S	S	*	.	H	α-helix	trans	-66.4	-35.5	175	176.9	-166.5	167.2	-152.5	0	111.3	F743 K744 E745 S751	F743-K747 WeakPolarHBondContact O-CB 3.39Å; F743-K747 PolarHBondContact O-N 3.44Å; K744-K747 WeakPolarHBondContact O-CB 3.44Å; K744-K747 PolarHBondContact O-N 2.53Å; E745-K747 VanDerWaalsContact C-N 3.27Å; E745-K747 PolarHBondContact O-N 2.91Å; K747-S751 WeakPolarHBondContact O-CB 3.37Å; K747-S751 PolarHBondContact O-N 3.5Å; K747-S751 VanDerWaalsContact O-N 3.13Å
748	Q	85.7	Confident	85.2	Confident	11 Å²	11	86.1 Å²	86.1	5%	0.051	42%	0.417	C	S	.	.	H	α-helix	trans	-69.5	-47.5	177.5	-173.3	75.8	-44.9	0	0	111.2	V40 E41 K42 N80 K744 E745 L746 I750 S751 S752	V40-Q748 PolarHBondContact O-NE2 2.91Å; E41-Q748 PolarHBondContact O-NE2 3.09Å; E41-Q748 PolarHBondContact O-OE1 3.12Å; E41-Q748 VanDerWaalsContact O-OE1 3.07Å; K42-Q748 PolarHBondContact O-OE1 3.21Å; N80-Q748 HydrophobicContact CB-CB 4.22Å; N80-Q748 HydrophobicContact CB-CG 3.89Å; K744-Q748 WeakPolarHBondContact O-CB 3.37Å; K744-Q748 PolarHBondContact O-N 3.35Å; E745-Q748 WeakPolarHBondContact O-CA 3.28Å; E745-Q748 WeakPolarHBondContact O-CB 3.5Å; E745-Q748 PolarHBondContact O-N 2.73Å; L746-Q748 VanDerWaalsContact C-N 3.32Å; Q748-I750 VanDerWaalsContact C-N 3.25Å; Q748-I750 PolarHBondContact O-N 3.11Å; Q748-S751 CarbonylContact O-C 3.6Å; Q748-S751 VanDerWaalsContact O-CA 3.31Å; Q748-S751 WeakPolarHBondContact O-CA 3.41Å; Q748-S751 VanDerWaalsContact O-CB 3.29Å; Q748-S751 WeakPolarHBondContact O-CB 3.22Å; Q748-S751 PolarHBondContact O-N 3.18Å; Q748-S752 PolarHBondContact O-N 3.01Å; Q748-S752 PolarHBondContact O-OG 2.87Å
749	D	87.1	Confident	85	Confident	78 Å²	78	81.7 Å²	81.7	42%	0.417	39%	0.394	S	S	.	.	H	α-helix	trans	-56.2	-41.2	177.5	-77.1	-8.7	0	0	0	112.2	E745 S751 S752 F753	E745-D749 PolarHBondContact O-N 3.39Å; D749-S751 VanDerWaalsContact C-N 3.29Å; D749-S751 PolarHBondContact O-N 2.87Å; D749-S752 WeakPolarHBondContact CA-OG 3.45Å; D749-S752 PolarHBondContact O-OG 2.89Å; D749-S752 VanDerWaalsContact O-OG 3.1Å; D749-F753 WeakPolarHBondContact O-CB 3.07Å; D749-F753 PolarHBondContact O-N 2.89Å
750	I	90.3	Very high	85.1	Confident	111 Å²	111	84.8 Å²	84.8	57%	0.569	41%	0.407	S	S	*	.	H	α-helix	trans	-66.9	-32.1	174.4	-65.2	166.5	0	0	0	111.3	L746 Q748 R754	L746-I750 HydrophobicContact CD1-CD1 4.3Å; L746-I750 HydrophobicContact CG-CD1 4.2Å; L746-I750 WeakPolarHBondContact O-CD1 3.43Å; L746-I750 VanDerWaalsContact O-CG1 3.26Å; L746-I750 WeakPolarHBondContact O-CG1 3.29Å; L746-I750 PolarHBondContact O-N 3.12Å; Q748-I750 VanDerWaalsContact C-N 3.25Å; Q748-I750 PolarHBondContact O-N 3.11Å; I750-R754 VanDerWaalsContact O-CB 3.23Å; I750-R754 WeakPolarHBondContact O-CB 3.45Å; I750-R754 PolarHBondContact O-N 3.24Å
751	S	85.5	Confident	85	Confident	16 Å²	16	83.8 Å²	83.8	11%	0.112	41%	0.406	C	S	.	.	H	α-helix	trans	-75.2	-49	178.7	-172.1	0	0	0	0	112.3	K42 K747 Q748 D749 R754 Y755	K42-S751 WeakPolarHBondContact O-CB 3.3Å; K42-S751 PolarHBondContact O-OG 3Å; K747-S751 WeakPolarHBondContact O-CB 3.37Å; K747-S751 PolarHBondContact O-N 3.5Å; K747-S751 VanDerWaalsContact O-N 3.13Å; Q748-S751 CarbonylContact O-C 3.6Å; Q748-S751 VanDerWaalsContact O-CA 3.31Å; Q748-S751 WeakPolarHBondContact O-CA 3.41Å; Q748-S751 VanDerWaalsContact O-CB 3.29Å; Q748-S751 WeakPolarHBondContact O-CB 3.22Å; Q748-S751 PolarHBondContact O-N 3.18Å; D749-S751 VanDerWaalsContact C-N 3.29Å; D749-S751 PolarHBondContact O-N 2.87Å; S751-R754 WeakPolarHBondContact O-CB 3.18Å; S751-R754 PolarHBondContact O-N 2.99Å; S751-R754 PolarHBondContact OG-NH2 3.22Å; S751-Y755 WeakPolarHBondContact O-CD2 3.46Å; S751-Y755 PolarHBondContact O-N 3.39Å; S751-Y755 WeakPolarHBondContact OG-CE2 3.36Å
752	S	86	Confident	84.3	Confident	23 Å²	23	82.6 Å²	82.6	16%	0.161	42%	0.417	C	S	.	.	H	α-helix	trans	-61.1	-50.5	177.1	54.1	0	0	0	0	110.6	G43 Q748 D749 R754 Y755 E756	G43-S752 WeakPolarHBondContact O-CA 3.48Å; Q748-S752 PolarHBondContact O-N 3.01Å; Q748-S752 PolarHBondContact O-OG 2.87Å; D749-S752 WeakPolarHBondContact CA-OG 3.45Å; D749-S752 PolarHBondContact O-OG 2.89Å; D749-S752 VanDerWaalsContact O-OG 3.1Å; S752-R754 VanDerWaalsContact C-N 3.27Å; S752-R754 PolarHBondContact O-N 2.86Å; S752-Y755 WeakPolarHBondContact O-CA 3.32Å; S752-Y755 PolarHBondContact O-N 3.39Å; S752-E756 PolarHBondContact O-N 3.31Å
753	F	88.3	Confident	83	Confident	130 Å²	130	85 Å²	85	57%	0.57	43%	0.43	S	S	*	.	H	α-helix	trans	-56.1	-40.8	175.2	178.5	-110.9	0	0	0	112.2	D749 Y755 E756 V757	D749-F753 WeakPolarHBondContact O-CB 3.07Å; D749-F753 PolarHBondContact O-N 2.89Å; F753-Y755 PolarHBondContact O-N 3.4Å; F753-E756 PolarHBondContact O-N 2.87Å; F753-V757 HydrophobicContact CD1-CG2 4.4Å; F753-V757 HydrophobicContact CD2-CG2 4.12Å; F753-V757 HydrophobicContact CE1-CG2 4Å; F753-V757 HydrophobicContact CE2-CG2 3.7Å; F753-V757 HydrophobicContact CG-CG2 4.45Å; F753-V757 HydrophobicContact CZ-CG2 3.64Å; F753-V757 WeakPolarHBondContact O-CB 3.42Å; F753-V757 VanDerWaalsContact O-CG2 3.26Å; F753-V757 WeakPolarHBondContact O-CG2 3.35Å; F753-V757 PolarHBondContact O-N 2.94Å
754	R	87.9	Confident	81.5	Confident	125 Å²	125	83 Å²	83	47%	0.472	42%	0.419	S	S	.	.	H	α-helix	trans	-62.8	-41.3	174.4	178	-165.3	64.4	-173.9	-8.5	111.9	I750 S751 S752 L758	I750-R754 VanDerWaalsContact O-CB 3.23Å; I750-R754 WeakPolarHBondContact O-CB 3.45Å; I750-R754 PolarHBondContact O-N 3.24Å; S751-R754 WeakPolarHBondContact O-CB 3.18Å; S751-R754 PolarHBondContact O-N 2.99Å; S751-R754 PolarHBondContact OG-NH2 3.22Å; S752-R754 VanDerWaalsContact C-N 3.27Å; S752-R754 PolarHBondContact O-N 2.86Å; R754-L758 HydrophobicContact CG-CD1 4.11Å; R754-L758 WeakPolarHBondContact O-CB 3.29Å; R754-L758 WeakPolarHBondContact O-CD1 3.36Å; R754-L758 WeakPolarHBondContact O-CG 3.4Å; R754-L758 PolarHBondContact O-N 3.35Å; R754-L758 VanDerWaalsContact O-N 3.08Å
755	Y	83	Confident	79.7	Confident	54 Å²	54	89.3 Å²	89.3	21%	0.212	45%	0.446	C	S	.	.	H	α-helix	trans	-68.5	-42.1	177.9	-77.8	-66	0	0	0	112	K42 D44 S751 S752 F753 L758 D759	K42-Y755 HydrophobicContact CB-CE2 4.04Å; D44-Y755 HydrophobicContact CB-CD1 4.24Å; D44-Y755 HydrophobicContact CB-CD2 4.07Å; D44-Y755 HydrophobicContact CB-CE2 4.38Å; D44-Y755 HydrophobicContact CB-CG 4.02Å; S751-Y755 WeakPolarHBondContact O-CD2 3.46Å; S751-Y755 PolarHBondContact O-N 3.39Å; S751-Y755 WeakPolarHBondContact OG-CE2 3.36Å; S752-Y755 WeakPolarHBondContact O-CA 3.32Å; S752-Y755 PolarHBondContact O-N 3.39Å; F753-Y755 PolarHBondContact O-N 3.4Å; Y755-L758 PolarHBondContact O-N 3.25Å; Y755-D759 PolarHBondContact O-N 3.02Å
756	E	85.3	Confident	77.4	Confident	100 Å²	100	94.2 Å²	94.2	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-49.6	174.7	-167.5	-163.7	177.4	0	0	111.5	S752 F753 L758 D759 L760	S752-E756 PolarHBondContact O-N 3.31Å; F753-E756 PolarHBondContact O-N 2.87Å; E756-L758 VanDerWaalsContact C-N 3.3Å; E756-L758 PolarHBondContact O-N 3.41Å; E756-D759 WeakPolarHBondContact O-CB 3.44Å; E756-D759 PolarHBondContact O-N 3.43Å; E756-D759 VanDerWaalsContact O-N 3.08Å; E756-L760 HydrophobicContact CG-CD1 4.37Å; E756-L760 WeakPolarHBondContact O-CG 3.27Å; E756-L760 PolarHBondContact O-N 3.49Å
757	V	87.3	Confident	75.1	Confident	51 Å²	51	95.4 Å²	95.4	31%	0.309	48%	0.482	S	S	.	.	H	α-helix	trans	-60.5	-38.3	176.5	169.4	0	0	0	0	111.9	F753 D759 L761	F753-V757 HydrophobicContact CD1-CG2 4.4Å; F753-V757 HydrophobicContact CD2-CG2 4.12Å; F753-V757 HydrophobicContact CE1-CG2 4Å; F753-V757 HydrophobicContact CE2-CG2 3.7Å; F753-V757 HydrophobicContact CG-CG2 4.45Å; F753-V757 HydrophobicContact CZ-CG2 3.64Å; F753-V757 WeakPolarHBondContact O-CB 3.42Å; F753-V757 VanDerWaalsContact O-CG2 3.26Å; F753-V757 WeakPolarHBondContact O-CG2 3.35Å; F753-V757 PolarHBondContact O-N 2.94Å; V757-D759 VanDerWaalsContact C-N 3.33Å; V757-L761 HydrophobicContact CG1-CD1 3.8Å; V757-L761 HydrophobicContact CG1-CG 4.48Å; V757-L761 WeakPolarHBondContact O-CB 3.49Å; V757-L761 WeakPolarHBondContact O-CD1 3.46Å; V757-L761 WeakPolarHBondContact O-CG 3.41Å; V757-L761 PolarHBondContact O-N 3.46Å
758	L	84.9	Confident	72.3	Confident	73 Å²	73	100 Å²	100	38%	0.382	50%	0.496	S	S	.	.	H	α-helix	trans	-68.7	-31.1	175.9	-75.1	170.3	0	0	0	113	R754 Y755 E756 G762 N763	R754-L758 HydrophobicContact CG-CD1 4.11Å; R754-L758 WeakPolarHBondContact O-CB 3.29Å; R754-L758 WeakPolarHBondContact O-CD1 3.36Å; R754-L758 WeakPolarHBondContact O-CG 3.4Å; R754-L758 PolarHBondContact O-N 3.35Å; R754-L758 VanDerWaalsContact O-N 3.08Å; Y755-L758 PolarHBondContact O-N 3.25Å; E756-L758 VanDerWaalsContact C-N 3.3Å; E756-L758 PolarHBondContact O-N 3.41Å; L758-G762 PolarHBondContact O-N 3.37Å; L758-N763 HydrophobicContact CD2-CB 4.46Å; L758-N763 PolarHBondContact O-N 3.42Å
759	D	79.6	Confident	69.9	Low	70 Å²	70	111.3 Å²	111.3	37%	0.374	54%	0.538	S	S	.	.	H	α-helix	trans	-72.1	-48.2	176.2	-149.9	59.8	0	0	0	111.2	Y755 E756 V757 L761 G762 R764	Y755-D759 PolarHBondContact O-N 3.02Å; E756-D759 WeakPolarHBondContact O-CB 3.44Å; E756-D759 PolarHBondContact O-N 3.43Å; E756-D759 VanDerWaalsContact O-N 3.08Å; V757-D759 VanDerWaalsContact C-N 3.33Å; D759-L761 PolarHBondContact O-N 2.91Å; D759-G762 WeakPolarHBondContact O-CA 3.46Å; D759-G762 PolarHBondContact O-N 3.31Å; D759-R764 IonicContact OD1-CZ 3.95Å; D759-R764 IonicContact OD1-NE 3.82Å; D759-R764 PolarHBondContact OD1-NE 3.2Å; D759-R764 IonicContact OD1-NH2 4Å
760	L	84.1	Confident	67	Low	136 Å²	136	112.9 Å²	112.9	71%	0.712	56%	0.555	S	S	*	*	H	α-helix	trans	-59.8	-32.7	174.2	-68.4	174.5	0	0	0	112.8	E756 G762	E756-L760 HydrophobicContact CG-CD1 4.37Å; E756-L760 WeakPolarHBondContact O-CG 3.27Å; E756-L760 PolarHBondContact O-N 3.49Å; L760-G762 PolarHBondContact O-N 2.96Å
761	L	82.1	Confident	64.2	Low	119 Å²	119	116.8 Å²	116.8	62%	0.623	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	3.6	173.9	-68.5	171.3	0	0	0	113.6	V757 D759 N763	V757-L761 HydrophobicContact CG1-CD1 3.8Å; V757-L761 HydrophobicContact CG1-CG 4.48Å; V757-L761 WeakPolarHBondContact O-CB 3.49Å; V757-L761 WeakPolarHBondContact O-CD1 3.46Å; V757-L761 WeakPolarHBondContact O-CG 3.41Å; V757-L761 PolarHBondContact O-N 3.46Å; D759-L761 PolarHBondContact O-N 2.91Å; L761-N763 PolarHBondContact O-N 3.01Å
762	G	62.5	Low	61.4	Low	64 Å²	64	121.2 Å²	121.2	66%	0.66	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.7	18.3	175.6	0	0	0	0	0	114.7	L758 D759 L760 R764	L758-G762 PolarHBondContact O-N 3.37Å; D759-G762 WeakPolarHBondContact O-CA 3.46Å; D759-G762 PolarHBondContact O-N 3.31Å; L760-G762 PolarHBondContact O-N 2.96Å; G762-R764 VanDerWaalsContact C-N 3.29Å; G762-R764 PolarHBondContact O-N 3.17Å
763	N	55.5	Low	58.7	Low	118 Å²	118	126.9 Å²	126.9	63%	0.631	63%	0.633	S	S	*	*			trans	-90.2	23.3	-164.2	-115.3	-25.5	0	0	0	114.3	L758 L761 K765	L758-N763 HydrophobicContact CD2-CB 4.46Å; L758-N763 PolarHBondContact O-N 3.42Å; L761-N763 PolarHBondContact O-N 3.01Å; N763-K765 PolarHBondContact O-N 2.95Å; N763-K765 VanDerWaalsContact O-N 3.12Å
764	R	54.1	Low	55.8	Low	96 Å²	96	126 Å²	126	36%	0.362	64%	0.643	S	S	.	*			trans	-73.9	96.9	171.8	-72.6	-168.5	-179	-113.1	-23.3	110.8	D44 T47 D759 G762 H766	D44-R764 IonicContact OD1-CZ 2.67Å; D44-R764 IonicContact OD1-NH2 2.61Å; D44-R764 PolarHBondContact OD1-NH2 3.13Å; D44-R764 IonicContact OD2-NH2 2.67Å; T47-R764 PolarHBondContact OG1-NH1 3.42Å; T47-R764 PolarHBondContact OG1-NH2 3.47Å; D759-R764 IonicContact OD1-CZ 3.95Å; D759-R764 IonicContact OD1-NE 3.82Å; D759-R764 PolarHBondContact OD1-NE 3.2Å; D759-R764 IonicContact OD1-NH2 4Å; G762-R764 VanDerWaalsContact C-N 3.29Å; G762-R764 PolarHBondContact O-N 3.17Å; R764-H766 PolarHBondContact O-N 3.11Å
765	K	44.1	Very low	53.1	Low	199 Å²	199	125.8 Å²	125.8	87%	0.865	66%	0.66	S	S	*	*			trans	-65.8	111.3	153.9	-77.9	-177.1	179.2	174.6	0	108	N763	N763-K765 PolarHBondContact O-N 2.95Å; N763-K765 VanDerWaalsContact O-N 3.12Å
766	H	35.3	Very low	50.5	Low	170 Å²	170	128 Å²	128	79%	0.787	69%	0.69	S	S	*	*			trans	-48.8	138.2	173.2	-75.4	-74.7	0	0	0	111.3	R764 R768	R764-H766 PolarHBondContact O-N 3.11Å; H766-R768 PolarHBondContact O-N 3.36Å
767	P	39.1	Very low	47.8	Very low	122 Å²	122	132.2 Å²	132.2	79%	0.792	71%	0.71	S	S	*	*			trans	-63.5	111.7	166.7	27.3	-32	0	0	0	108.2	R769	P767-R769 PolarHBondContact O-N 3.17Å
768	R	31.1	Very low	44.9	Very low	235 Å²	235	138.6 Å²	138.6	89%	0.887	73%	0.734	S	S	*	*			trans	-62.6	120.1	170.1	-81.4	-176.9	174.2	170.1	-2.3	108	H766 S770	H766-R768 PolarHBondContact O-N 3.36Å; R768-S770 PolarHBondContact O-N 3.37Å
769	R	35.3	Very low	42.2	Very low	248 Å²	248	140.4 Å²	140.4	94%	0.936	75%	0.752	S	S	*	*			trans	-50.1	110.5	161.1	-73.7	178.4	173	168.1	-2.8	108.5	P767	P767-R769 PolarHBondContact O-N 3.17Å
770	S	26.7	Very low	39.8	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	77%	0.768	S	S	*	*			trans	-112.3	69.8	168.4	58.6	0	0	0	0	109.6	R768 S772	R768-S770 PolarHBondContact O-N 3.37Å; S770-S772 PolarHBondContact O-N 3.13Å
771	F	30.7	Very low	37.1	Very low	194 Å²	194	149.4 Å²	149.4	85%	0.851	78%	0.778	S	S	*	*			trans	-72.5	108.6	152.8	-99.4	-89.5	0	0	0	107.8
772	S	26.9	Very low	34.5	Very low	109 Å²	109	150.2 Å²	150.2	76%	0.762	78%	0.783	S	S	*	*			trans	-150.3	93.6	164.4	-71.4	0	0	0	0	107.7	S770 S774	S770-S772 PolarHBondContact O-N 3.13Å; S772-S774 PolarHBondContact O-N 2.93Å
773	T	29.6	Very low	32.8	Very low	142 Å²	142	153.9 Å²	153.9	87%	0.871	79%	0.787	S	S	*	*			trans	-60.6	121.9	171.5	11	0	0	0	0	110.2
774	S	27.9	Very low	31.6	Very low	111 Å²	111	154.6 Å²	154.6	78%	0.776	80%	0.796	S	S	*	*			trans	-137.2	93	154.8	64.2	0	0	0	0	108.9	S772	S772-S774 PolarHBondContact O-N 2.93Å
775	S	30.4	Very low	30.3	Very low	120 Å²	120	156 Å²	156	84%	0.839	81%	0.811	S	S	*	*			trans	-54	136.1	166.7	43.5	0	0	0	0	111.3
776	A	27.8	Very low	29.5	Very low	101 Å²	101	153 Å²	153	84%	0.835	81%	0.805	S	S	*	*			trans	-130.6	118	161.2	0	0	0	0	0	108
777	E	28.8	Very low	29.1	Very low	189 Å²	189	148.3 Å²	148.3	88%	0.883	80%	0.802	S	S	*	*			trans	-75.4	157.5	-175.7	-64.5	174.2	124.9	0	0	112.3
778	F	26.6	Very low	28.4	Very low	184 Å²	184	149 Å²	149	81%	0.807	81%	0.809	S	S	*	*			trans	-70.9	124.1	168.8	175.2	-89.5	0	0	0	110.5	Q780	F778-Q780 HydrophobicContact CE1-CG 4.03Å; F778-Q780 HydrophobicContact CZ-CG 4Å
779	S	27.5	Very low	28.1	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	80%	0.802	S	S	*	*			trans	-148.3	140.9	155	56.2	0	0	0	0	111.5
780	Q	30.2	Very low	27.6	Very low	149 Å²	149	133.3 Å²	133.3	70%	0.696	80%	0.798	S	S	*	*			trans	-76.2	153.9	-174.5	-60.8	158.7	-70.3	0	0	111.9	F778	F778-Q780 HydrophobicContact CE1-CG 4.03Å; F778-Q780 HydrophobicContact CZ-CG 4Å
781	R	27.5	Very low	27.7	Very low	247 Å²	247	132.8 Å²	132.8	93%	0.932	80%	0.801	S	S	*	*			trans	-158.5	129.3	131.5	-110.3	165.4	-163.7	-173.1	4	111.3
782	D	26.1	Very low	27.5	Very low	135 Å²	135	135.2 Å²	135.2	72%	0.722	80%	0.804	S	S	*	*			trans	-78.9	174.1	171.7	-74.3	-61.3	0	0	0	112.1
783	D	27.8	Very low	27.6	Very low	141 Å²	141	134.2 Å²	134.2	75%	0.754	80%	0.802	S	S	*	*			trans	97.7	123.6	143.2	-82.9	-30.1	0	0	0	122.2
784	T	29.7	Very low	27.5	Very low	133 Å²	133	137.1 Å²	137.1	82%	0.816	80%	0.803	S	S	*	*			trans	68.4	157.2	152.4	64.2	0	0	0	0	119.5
785	N	27.3	Very low	27.4	Very low	125 Å²	125	136.3 Å²	136.3	67%	0.668	80%	0.797	S	S	*	*			cis	-163.7	164.3	-39.1	-171.9	28	0	0	0	106.1
786	D	27.7	Very low	27.4	Very low	138 Å²	138	140 Å²	140	74%	0.738	80%	0.798	S	S	*	*			trans	52.3	116.8	161.3	-70.2	-31.2	0	0	0	120.3
787	G	25.8	Very low	27.2	Very low	70 Å²	70	140 Å²	140	72%	0.722	79%	0.792	S	S	*	*				102.7	105.4	93.9	0	0	0	0	0	119.1
788	S	24.9	Very low	27.2	Very low	137 Å²	137	137.5 Å²	137.5	96%	0.958	79%	0.79	S	S	*	*			trans	76.9	147.4	141.7	-160.9	0	0	0	0	120.4
789	G	25.3	Very low	27	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	78%	0.782	S	S	*	*			trans	106.8	58.2	143.3	0	0	0	0	0	117.6
790	G	24.5	Very low	26.9	Very low	82 Å²	82	137.7 Å²	137.7	85%	0.845	79%	0.788	S	S	*	*			trans	-67.6	166.9	178	0	0	0	0	0	116.3
791	A	27.9	Very low	26.7	Very low	100 Å²	100	138.4 Å²	138.4	83%	0.826	80%	0.797	S	S	*	*			trans	-163.3	120.1	144.8	0	0	0	0	0	114.2
792	R	27.1	Very low	26.7	Very low	244 Å²	244	135 Å²	135	92%	0.921	80%	0.796	S	S	*	*			trans	38	106.8	140.2	-79.5	179	165.7	170.4	-3	121.5
793	A	28.8	Very low	26.7	Very low	88 Å²	88	132.4 Å²	132.4	73%	0.727	80%	0.801	S	S	*	*				101.9	152.4	99.8	0	0	0	0	0	121.5
794	K	28.6	Very low	26.6	Very low	204 Å²	204	131 Å²	131	89%	0.887	80%	0.801	S	S	*	*			trans	78.6	137.3	178.2	-56.5	-178.9	-176.1	176.7	0	115.2
795	S	26.2	Very low	26.5	Very low	93 Å²	93	133.7 Å²	133.7	65%	0.65	80%	0.801	S	S	*	*			cis	-172.4	153.5	-14.1	54.3	0	0	0	0	110.9
796	K	29	Very low	26.4	Very low	197 Å²	197	136.6 Å²	136.6	86%	0.857	81%	0.808	S	S	*	*			trans	68.9	144.9	167.3	-60.7	176.5	-178.8	-179.7	0	115.3
797	S	24.6	Very low	26.3	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	81%	0.813	S	S	*	*			cis	-165	142.4	-8.1	39.2	0	0	0	0	112.2
798	V	27.3	Very low	26.3	Very low	136 Å²	136	140.7 Å²	140.7	82%	0.824	82%	0.818	S	S	*	*			trans	60.5	103.5	156	-174.4	0	0	0	0	118.3
799	S	23.2	Very low	26.3	Very low	93 Å²	93	140.7 Å²	140.7	65%	0.65	82%	0.816	S	S	*	*			trans	-78.9	163.1	159.7	54.1	0	0	0	0	113.3
800	F	25.6	Very low	26.3	Very low	206 Å²	206	146.8 Å²	146.8	90%	0.904	83%	0.826	S	S	*	*				-143.9	123.2	121.4	-97.9	-75	0	0	0	109.9
801	N	24.9	Very low	26.3	Very low	164 Å²	164	146.3 Å²	146.3	88%	0.877	82%	0.821	S	S	*	*			trans	-149.8	125.7	170.2	-138.4	-8.9	0	0	0	107.6
802	L	27.7	Very low	26.2	Very low	175 Å²	175	146.5 Å²	146.5	92%	0.916	82%	0.822	S	S	*	*			trans	-110.4	92.3	-172.1	-167.6	74.9	0	0	0	110.5
803	G	26.6	Very low	26.8	Very low	80 Å²	80	140.7 Å²	140.7	83%	0.825	82%	0.816	S	S	*	*			trans	-112.1	109.8	171.5	0	0	0	0	0	110.6
804	C	26.9	Very low	26.7	Very low	112 Å²	112	144.3 Å²	144.3	76%	0.757	82%	0.822	S	S	*	*			trans	-99.7	132.6	-174.9	-177.2	0	0	0	0	112.2
805	K	25.8	Very low	26.7	Very low	190 Å²	190	141.8 Å²	141.8	83%	0.826	82%	0.817	S	S	*	*				160.1	113.1	128.2	-89.4	171.4	-179.3	175.5	0	113.1
806	K	25.7	Very low	26.7	Very low	185 Å²	185	147.6 Å²	147.6	80%	0.804	82%	0.824	S	S	*	*				174.7	131.8	107.5	-99.5	175.5	179.8	168.3	0	114.8
807	K	26.4	Very low	26.6	Very low	195 Å²	195	143.2 Å²	143.2	85%	0.848	81%	0.814	S	S	*	*			trans	76.3	144.9	141.1	-73.7	-172.1	171.4	-171.5	0	122.4
808	A	25	Very low	26.9	Very low	100 Å²	100	146.3 Å²	146.3	83%	0.826	82%	0.819	S	S	*	*			trans	80.7	108.8	159.7	0	0	0	0	0	118.6
809	C	25.5	Very low	27.6	Very low	136 Å²	136	145.4 Å²	145.4	92%	0.919	82%	0.816	S	S	*	*			trans	-125.1	135.1	159.1	-76.5	0	0	0	0	109.8
810	H	25.4	Very low	27.8	Very low	200 Å²	200	152.7 Å²	152.7	93%	0.926	83%	0.829	S	S	*	*			trans	-118.2	137	163.2	-97.5	-72.3	0	0	0	108.9
811	G	24.3	Very low	27.9	Very low	72 Å²	72	147.6 Å²	147.6	74%	0.742	83%	0.825	S	S	*	*				83	121.8	128.1	0	0	0	0	0	120.8
812	A	25.5	Very low	28	Very low	103 Å²	103	142.8 Å²	142.8	85%	0.851	82%	0.815	S	S	*	*			trans	80.7	120.6	144.6	0	0	0	0	0	120.3
813	P	40.9	Very low	28	Very low	122 Å²	122	142.3 Å²	142.3	79%	0.792	81%	0.813	S	S	*	*			trans	-105.2	160	164.6	39	-31.3	0	0	0	112.4
814	L	25.8	Very low	28.1	Very low	164 Å²	164	142.5 Å²	142.5	86%	0.859	81%	0.807	S	S	*	*			trans	-168.1	154.2	157.2	-114.8	166.9	0	0	0	113.7
815	I	28.4	Very low	28.1	Very low	152 Å²	152	146.3 Å²	146.3	78%	0.779	81%	0.813	S	S	*	*			trans	78	140.2	164.5	-58.2	159.4	0	0	0	116.2
816	R	26	Very low	28.2	Very low	215 Å²	215	140.7 Å²	140.7	81%	0.811	81%	0.809	S	S	*	*			cis	161.1	115.5	-33.9	-172.1	-169.5	-175.2	163.7	2.5	106
817	T	27	Very low	28.3	Very low	104 Å²	104	141.5 Å²	141.5	64%	0.638	81%	0.813	S	S	*	*			trans	44.8	135	153.1	63.7	0	0	0	0	122.2
818	M	30.1	Very low	28.2	Very low	169 Å²	169	136.9 Å²	136.9	83%	0.833	81%	0.805	S	S	*	*				-175.3	166.4	102.1	-92.3	-51.3	178.2	0	0	110.2
819	P	43.4	Very low	28.4	Very low	116 Å²	116	141.7 Å²	141.7	75%	0.753	81%	0.807	S	S	*	*			trans	-125.6	-176.6	-141	43.8	-30.4	0	0	0	114.9
820	R	26.9	Very low	28.6	Very low	247 Å²	247	139.3 Å²	139.3	93%	0.932	80%	0.797	S	S	*	*			trans	-146.6	135.5	156.3	-151.7	169.6	178.6	160.7	-1.1	112.2
821	A	28.4	Very low	28.6	Very low	99 Å²	99	138.9 Å²	138.9	82%	0.818	80%	0.796	S	S	*	*			trans	-83.9	173.1	170.2	0	0	0	0	0	110.4
822	G	27.4	Very low	28.6	Very low	63 Å²	63	140.1 Å²	140.1	65%	0.649	79%	0.793	S	S	*	*			cis	179.9	-148.6	7.5	0	0	0	0	0	112
823	D	25.9	Very low	28.6	Very low	165 Å²	165	140.4 Å²	140.4	88%	0.882	79%	0.789	S	S	*	*			trans	73.6	114.9	176.7	-59.8	-25.1	0	0	0	116.5
824	A	28.8	Very low	27.9	Very low	84 Å²	84	139 Å²	139	69%	0.694	78%	0.782	S	S	*	*				94.8	141.4	56.5	0	0	0	0	0	111.1
825	Q	28.3	Very low	28	Very low	192 Å²	192	140.6 Å²	140.6	90%	0.897	78%	0.782	S	S	*	*			cis	-163.2	148.2	14	-134.6	173.4	39.6	0	0	111.6
826	G	27	Very low	27.8	Very low	72 Å²	72	144.6 Å²	144.6	74%	0.742	79%	0.787	S	S	*	*			trans	64.2	155.2	140	0	0	0	0	0	122.2
827	K	27.7	Very low	27.8	Very low	202 Å²	202	139.5 Å²	139.5	88%	0.878	79%	0.785	S	S	*	*			cis	-163.7	142.2	0.3	-111	176.1	-178.9	171.8	0	112.3
828	S	25.5	Very low	27.7	Very low	97 Å²	97	144 Å²	144	68%	0.678	80%	0.796	S	S	*	*			trans	12.1	143.6	145.2	67	0	0	0	0	121.8
829	K	27.6	Very low	27.5	Very low	201 Å²	201	145.5 Å²	145.5	87%	0.874	80%	0.803	S	S	*	*				-177.2	175.8	59.7	-84.8	-172.3	177.6	177.2	0	108.7
830	A	29.5	Very low	26.6	Very low	86 Å²	86	142.8 Å²	142.8	71%	0.711	80%	0.796	S	S	*	*			cis	-176.2	174	-31.1	0	0	0	0	0	108.8
831	E	25.3	Very low	27.2	Very low	191 Å²	191	136.9 Å²	136.9	89%	0.893	79%	0.79	S	S	*	*			trans	84.7	147.6	176.2	-58.7	-173.7	-178.3	0	0	118.9
832	S	26.1	Very low	27.2	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	78%	0.781	S	S	*	*			cis	-162.3	161.4	-33.2	70.1	0	0	0	0	112.5
833	S	25.6	Very low	27.2	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	79%	0.785	S	S	*	*			trans	88.7	123.6	153.9	84	0	0	0	0	123.3
834	S	25.3	Very low	27.3	Very low	91 Å²	91	141.2 Å²	141.2	64%	0.636	78%	0.776	S	S	*	*			trans	57	112.7	132.2	159	0	0	0	0	119.9
835	K	27	Very low	27.3	Very low	198 Å²	198	145.9 Å²	145.9	86%	0.861	78%	0.781	S	S	*	*				-175.3	172.8	63.4	-119	154.8	-163.5	172.4	0	113.8
836	R	25.8	Very low	27.4	Very low	236 Å²	236	143.9 Å²	143.9	89%	0.891	78%	0.775	S	S	*	*			trans	-48.3	164	173.4	-59	167.5	176.8	166.2	-3.7	113.6
837	S	25.3	Very low	27.4	Very low	109 Å²	109	143.5 Å²	143.5	76%	0.762	77%	0.772	S	S	*	*			cis	-163.1	140.3	25.2	-0.1	0	0	0	0	109.9
838	F	24.5	Very low	27.4	Very low	198 Å²	198	142 Å²	142	87%	0.868	77%	0.773	S	S	*	*				72.5	100.8	88.8	-143.6	-78.8	0	0	0	115.5
839	M	26.1	Very low	27.6	Very low	200 Å²	200	144.4 Å²	144.4	99%	0.985	78%	0.777	S	S	*	*			trans	-161.6	139.6	142.2	-129.2	-175.7	176.9	0	0	115.6
840	G	24.1	Very low	27.7	Very low	59 Å²	59	143.5 Å²	143.5	61%	0.608	77%	0.773	S	S	*	*			trans	161.6	159.2	173.9	0	0	0	0	0	108
841	P	40.7	Very low	27.5	Very low	124 Å²	124	145.2 Å²	145.2	81%	0.805	78%	0.78	S	S	*	*			cis	-132.4	176.2	6.5	41.9	-25.5	0	0	0	115.7
842	S	27.1	Very low	27.6	Very low	90 Å²	90	145.1 Å²	145.1	63%	0.629	78%	0.777	S	S	*	*			trans	20	138.9	139.9	-166.4	0	0	0	0	121.4
843	F	27	Very low	27.6	Very low	165 Å²	165	150.5 Å²	150.5	72%	0.724	79%	0.788	S	S	*	*				-179	130.8	104.5	-109	-94.7	0	0	0	114.3
844	K	29.3	Very low	27.6	Very low	162 Å²	162	153.9 Å²	153.9	70%	0.704	80%	0.797	S	S	*	*			trans	18.6	149.5	143.1	-54.9	-179.5	-168.1	175.6	0	119.7
845	K	29.5	Very low	27.6	Very low	182 Å²	182	152.4 Å²	152.4	79%	0.791	80%	0.797	S	S	*	*			cis	-166.6	165.4	20.1	-128.2	171	173	-170.2	0	106.2
846	L	29.9	Very low	27.6	Very low	150 Å²	150	152 Å²	152	79%	0.785	80%	0.798	S	S	*	*				178.3	156.3	57.8	-165.8	81	0	0	0	109.7
847	G	26.9	Very low	27.6	Very low	65 Å²	65	148.7 Å²	148.7	67%	0.67	80%	0.798	S	S	*	*			trans	72.8	101.3	159.7	0	0	0	0	0	116.5
848	L	28.1	Very low	27.6	Very low	171 Å²	171	148.6 Å²	148.6	90%	0.895	80%	0.797	S	S	*	*			cis	67.8	87.4	30.5	-125.9	166.3	0	0	0	113.2
849	L	29.1	Very low	27.7	Very low	147 Å²	147	147.7 Å²	147.7	77%	0.77	80%	0.795	S	S	*	*			trans	-167	148.6	143.3	-104.3	167.7	0	0	0	110.9
850	F	29.2	Very low	27.9	Very low	182 Å²	182	144.1 Å²	144.1	80%	0.798	79%	0.787	S	S	*	*			trans	65.6	74.8	175.2	-62.6	-73.1	0	0	0	119.9
851	S	24.6	Very low	27.9	Very low	122 Å²	122	147.7 Å²	147.7	85%	0.853	80%	0.798	S	S	*	*			trans	-108.3	94.8	138.6	59.1	0	0	0	0	110.4
852	K	27.7	Very low	27.2	Very low	188 Å²	188	147.4 Å²	147.4	82%	0.817	80%	0.798	S	S	*	*			trans	-174.1	101.6	161.9	-117.3	-178.4	179.7	-176.7	0	110.4
853	F	25.9	Very low	27.2	Very low	212 Å²	212	152 Å²	152	93%	0.93	81%	0.81	S	S	*	*			trans	-178.6	86.8	136.1	-108.1	-72.3	0	0	0	108
854	N	26.7	Very low	27.2	Very low	180 Å²	180	150 Å²	150	96%	0.963	81%	0.813	S	S	*	*			trans	-97.6	94	165.7	-136.8	26.6	0	0	0	106.2
855	G	25.9	Very low	27	Very low	61 Å²	61	151.2 Å²	151.2	63%	0.629	82%	0.824	S	S	*	*			trans	-100.2	127.2	177.5	0	0	0	0	0	110.1
856	H	26.5	Very low	26.8	Very low	190 Å²	190	151.8 Å²	151.8	88%	0.88	82%	0.823	S	S	*	*			trans	-53.4	136.4	166	-111.3	-84.9	0	0	0	110.1
857	N	26.3	Very low	26.5	Very low	165 Å²	165	150.6 Å²	150.6	88%	0.882	82%	0.821	S	S	*	*			trans	-142.4	141.8	149.7	-98	-20.9	0	0	0	109
858	S	25.3	Very low	26.4	Very low	107 Å²	107	155.5 Å²	155.5	75%	0.748	83%	0.831	S	S	*	*			trans	-89.7	144.7	-167.9	45.4	0	0	0	0	113.1
859	E	26.2	Very low	26.4	Very low	179 Å²	179	152.3 Å²	152.3	84%	0.836	82%	0.822	S	S	*	*			trans	-62.6	135.9	163.6	-65.6	166.4	125.5	0	0	110.6	T861	E859-T861 PolarHBondContact O-N 3.13Å
860	P	28.9	Very low	26.2	Very low	126 Å²	126	153.6 Å²	153.6	82%	0.818	83%	0.83	S	S	*	*			trans	-84.1	107.4	167.2	31.6	-29.4	0	0	0	110.2
861	T	24.3	Very low	26	Very low	134 Å²	134	147.8 Å²	147.8	82%	0.822	82%	0.822	S	S	*	*			trans	-72.5	121.3	167.3	47.4	0	0	0	0	110.6	E859	E859-T861 PolarHBondContact O-N 3.13Å
862	S	26.6	Very low	26	Very low	117 Å²	117	150.5 Å²	150.5	82%	0.818	83%	0.825	S	S	*	*			trans	-99.6	110.5	172	56.9	0	0	0	0	111.3
863	E	26.3	Very low	25.8	Very low	187 Å²	187	144.7 Å²	144.7	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-81.7	147.8	168.7	-68.5	-174.4	155.8	0	0	111.3
864	P	28.9	Very low	25.7	Very low	122 Å²	122	142.3 Å²	142.3	79%	0.792	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81	144.1	178.2	32.8	-34.3	0	0	0	112.4
865	M	23.1	Very low	25.5	Very low	189 Å²	189	140.2 Å²	140.2	93%	0.931	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-98.2	145.4	177	-162.8	170.9	-70.8	0	0	111.6
866	Y	26.1	Very low	25.3	Very low	194 Å²	194	143.4 Å²	143.4	76%	0.761	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-72.1	150.1	-168.6	-80.3	-98.1	0	0	0	115.3
867	T	23.6	Very low	25.2	Very low	124 Å²	124	142.8 Å²	142.8	76%	0.761	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-79	151.8	162.8	43.4	0	0	0	0	112.2
868	I	25.2	Very low	25	Very low	169 Å²	169	140.4 Å²	140.4	87%	0.867	76%	0.762	S	S	*	*			trans	-123.1	130.4	162.8	-66.2	177	0	0	0	107.1
869	S	28.4	Very low	24.9	Very low	103 Å²	103	144.6 Å²	144.6	72%	0.72	76%	0.762	S	S	*	*			trans	-114.9	142.2	170.7	-66.7	0	0	0	0	109.8
870	D	25	Very low	24.8	Very low	174 Å²	174	142.4 Å²	142.4	93%	0.93	75%	0.752	S	S	*	*			trans	-171	141.2	151.1	-91.1	-31.4	0	0	0	104.7
871	G	24.9	Very low	24.4	Very low	60 Å²	60	141.4 Å²	141.4	62%	0.619	74%	0.739	S	S	*	*			cis	160.6	177.4	2.1	0	0	0	0	0	108.5
872	I	24.4	Very low	24.5	Very low	180 Å²	180	143.4 Å²	143.4	92%	0.923	74%	0.743	S	S	*	*			trans	77.1	139.1	172	-48.1	166.9	0	0	0	115.3
873	A	23.2	Very low	24.4	Very low	66 Å²	66	146 Å²	146	55%	0.545	74%	0.735	S	S	.	*			cis	-174.9	144.4	-30.8	0	0	0	0	0	109.3
874	Q	24	Very low	24.3	Very low	161 Å²	161	146.4 Å²	146.4	75%	0.752	73%	0.73	S	S	*	*			trans	60.9	152.4	146.9	-65.8	177.4	-63.7	0	0	118.8
875	Q	22.5	Very low	24.1	Very low	136 Å²	136	145.2 Å²	145.2	64%	0.636	72%	0.724	S	S	*	*			cis	-162.6	161.8	-5.3	-119.6	171.8	-27.1	0	0	110.4
876	H	21.9	Very low	24.2	Very low	128 Å²	128	144 Å²	144	59%	0.593	72%	0.717	S	S	*	*			trans	27.2	144.1	142.4	-66.1	-43.8	0	0	0	121
877	Y	23.9	Very low	24.2	Very low	178 Å²	178	140.7 Å²	140.7	70%	0.698	71%	0.71	S	S	*	*			cis	-177.9	176.5	14.5	-103.6	-27.9	0	0	0	106.4
878	M	22.4	Very low	24.2	Very low	114 Å²	114	143.8 Å²	143.8	56%	0.562	72%	0.715	S	S	*	*			cis	176.3	164.9	-21.9	-172.6	174.1	34.7	0	0	107.9
879	W	23.3	Very low	24.2	Very low	195 Å²	195	146.4 Å²	146.4	74%	0.739	71%	0.714	S	S	*	*			trans	72.3	145.2	173.7	-60.1	85.7	0	0	0	117
880	Q	23	Very low	24.1	Very low	133 Å²	133	145.1 Å²	145.1	62%	0.621	72%	0.717	S	S	*	*			cis	-160.8	157.8	-26.3	-135.2	-161.1	-14.8	0	0	111.6
881	D	22	Very low	24.2	Very low	105 Å²	105	147.1 Å²	147.1	56%	0.561	72%	0.718	S	S	*	*			trans	11.2	136.6	151	-67	-53.9	0	0	0	122.4
882	I	26.1	Very low	24.2	Very low	176 Å²	176	148.4 Å²	148.4	90%	0.903	72%	0.723	S	S	*	*				-154.6	146.5	114.3	-99.4	153.2	0	0	0	110.5
883	R	23.4	Very low	24.5	Very low	171 Å²	171	149.4 Å²	149.4	65%	0.645	72%	0.723	S	S	*	*			trans	-105.4	144.5	-168.1	-83.3	-169.8	-171.6	178.8	2.5	114.2
884	Y	25.4	Very low	24.6	Very low	196 Å²	196	151 Å²	151	77%	0.769	74%	0.737	S	S	*	*			trans	57.7	131.8	139.6	-80.5	-112.8	0	0	0	121.2
885	S	23.8	Very low	24.7	Very low	97 Å²	97	149.3 Å²	149.3	68%	0.678	74%	0.741	S	S	*	*				-172.5	129.5	103.6	61.6	0	0	0	0	110.3
886	Q	25.7	Very low	24.8	Very low	165 Å²	165	147.1 Å²	147.1	77%	0.771	74%	0.741	S	S	*	*				71.1	145.7	105.8	-65.1	-172.8	-14.7	0	0	115.6
887	M	25.7	Very low	25	Very low	124 Å²	124	150 Å²	150	61%	0.611	75%	0.754	S	S	*	*			cis	-159.7	143.9	-5.6	-121	166.9	104.3	0	0	109.7	R889	M887-R889 HydrophobicContact CE-CG 4.22Å
888	E	24.1	Very low	25.1	Very low	188 Å²	188	145.7 Å²	145.7	88%	0.879	75%	0.751	S	S	*	*			trans	-77.3	149.9	148.7	-71.9	-174.9	126.3	0	0	109.6
889	R	24.9	Very low	25.3	Very low	225 Å²	225	148.5 Å²	148.5	85%	0.849	76%	0.762	S	S	*	*			trans	-144.7	109.7	165.8	-137.7	177.5	-162.8	-178.2	6	111.3	M887	M887-R889 HydrophobicContact CE-CG 4.22Å
890	G	26.8	Very low	25.5	Very low	76 Å²	76	145.6 Å²	145.6	78%	0.784	76%	0.759	S	S	*	*			trans	-70.8	160.5	172.3	0	0	0	0	0	112.7
891	K	26.2	Very low	25.7	Very low	216 Å²	216	144.8 Å²	144.8	94%	0.939	76%	0.759	S	S	*	*			trans	-93.2	139.3	172.6	-72.3	176.4	174.7	175.6	0	110.4
892	A	26.5	Very low	26	Very low	87 Å²	87	147.2 Å²	147.2	72%	0.719	77%	0.771	S	S	*	*			trans	-141.4	133.5	161.4	0	0	0	0	0	109.9
893	E	29.1	Very low	26.1	Very low	200 Å²	200	142.8 Å²	142.8	94%	0.935	76%	0.755	S	S	*	*			trans	62.2	145.8	153.9	-62.6	177.8	170.9	0	0	120.5
894	A	26	Very low	26.4	Very low	101 Å²	101	143 Å²	143	84%	0.835	76%	0.763	S	S	*	*			trans	-138.9	135.4	-178.3	0	0	0	0	0	109.8
895	C	25.5	Very low	26.5	Very low	124 Å²	124	138.8 Å²	138.8	84%	0.838	76%	0.758	S	S	*	*			trans	-154.3	143.1	160.9	-157.2	0	0	0	0	111.9
896	S	25.7	Very low	26.7	Very low	91 Å²	91	142 Å²	142	64%	0.636	76%	0.763	S	S	*	*			trans	54.7	119.9	159	60.1	0	0	0	0	121.9
897	Q	26.2	Very low	26.8	Very low	187 Å²	187	142 Å²	142	87%	0.874	77%	0.767	S	S	*	*			trans	66.6	147.2	137.2	-66.8	173	-15.7	0	0	118.4
898	S	26.3	Very low	26.8	Very low	88 Å²	88	139.4 Å²	139.4	62%	0.615	77%	0.772	S	S	*	*			cis	-173.6	146.3	-11.9	46	0	0	0	0	109.1
899	E	26.8	Very low	26.9	Very low	173 Å²	173	139.1 Å²	139.1	81%	0.808	77%	0.771	S	S	*	*			trans	63.7	155.9	161.6	-62.4	178.5	-177.4	0	0	117.1
900	M	27	Very low	27	Very low	134 Å²	134	135.5 Å²	135.5	66%	0.66	77%	0.767	S	S	*	*			cis	-160.1	157.6	-16.8	-117.7	-161.3	-47.4	0	0	109.5
901	N	26.2	Very low	27	Very low	116 Å²	116	143.5 Å²	143.5	62%	0.62	77%	0.773	S	S	*	*			trans	67.2	113.7	148.5	-61	-10.4	0	0	0	119.9
902	L	29.2	Very low	27	Very low	157 Å²	157	136.8 Å²	136.8	82%	0.822	77%	0.765	S	S	*	*				82.1	144.5	102	-93.4	78.2	0	0	0	113.9
903	S	27.4	Very low	26.9	Very low	82 Å²	82	137.6 Å²	137.6	57%	0.573	77%	0.772	S	S	*	*			cis	-165	158.5	3.6	35.6	0	0	0	0	111.7
904	E	30	Very low	26.8	Very low	175 Å²	175	133 Å²	133	82%	0.818	77%	0.769	S	S	*	*			trans	65.1	152.9	141.3	-77.8	175.3	150.2	0	0	120.7
905	V	27.5	Very low	26.8	Very low	109 Å²	109	131.4 Å²	131.4	66%	0.661	76%	0.762	S	S	*	*			cis	-162.4	147.9	-22.4	90.7	0	0	0	0	108.5
906	E	27.3	Very low	26.7	Very low	165 Å²	165	131.2 Å²	131.2	77%	0.771	76%	0.762	S	S	*	*			trans	32	156.5	143.9	-76.5	-178.6	165.2	0	0	122.9
907	L	27.8	Very low	26.7	Very low	163 Å²	163	131.8 Å²	131.8	85%	0.853	77%	0.766	S	S	*	*			cis	-173.2	171.6	-10.2	-167.6	85.9	0	0	0	105.4
908	G	26.1	Very low	26.7	Very low	70 Å²	70	132.4 Å²	132.4	72%	0.722	77%	0.768	S	S	*	*			trans	123	105.3	147	0	0	0	0	0	118
909	E	27.2	Very low	26.7	Very low	183 Å²	183	131.8 Å²	131.8	86%	0.855	78%	0.776	S	S	*	*			trans	-60.7	166.5	170.2	-51	167.5	123.3	0	0	115
910	I	26.7	Very low	26.5	Very low	148 Å²	148	127.9 Å²	127.9	76%	0.759	77%	0.774	S	S	*	*				172.6	129.8	109.3	-87.1	168.6	0	0	0	113.6
911	R	26.1	Very low	26.4	Very low	244 Å²	244	129.8 Å²	129.8	92%	0.921	79%	0.786	S	S	*	*			trans	15.8	145.3	151.2	-56.5	171.8	168.5	167.6	-4.3	122.8
912	G	25.6	Very low	26.3	Very low	75 Å²	75	129.1 Å²	129.1	77%	0.773	80%	0.796	S	S	*	*				154.8	89.3	127.6	0	0	0	0	0	121.8
913	A	26.1	Very low	26	Very low	104 Å²	104	127.2 Å²	127.2	86%	0.86	80%	0.795	S	S	*	*			trans	48.9	133.5	137.1	0	0	0	0	0	125.8
914	A	26.6	Very low	25.8	Very low	105 Å²	105	128.4 Å²	128.4	87%	0.868	80%	0.803	S	S	*	*			trans	76.7	128.9	135.3	0	0	0	0	0	123.9
915	G	24.9	Very low	25.5	Very low	67 Å²	67	124.9 Å²	124.9	69%	0.691	80%	0.797	S	S	*	*				118.7	92.9	114	0	0	0	0	0	122
916	S	24.3	Very low	25.3	Very low	120 Å²	120	124.5 Å²	124.5	84%	0.839	80%	0.8	S	S	*	*			trans	70	147	136.6	58.4	0	0	0	0	125.2
917	S	25.4	Very low	25.2	Very low	102 Å²	102	123.3 Å²	123.3	71%	0.713	80%	0.798	S	S	*	*			trans	85.7	113.8	149.7	66.1	0	0	0	0	123.2
918	E	27.3	Very low	25.2	Very low	200 Å²	200	124.2 Å²	124.2	94%	0.935	80%	0.797	S	S	*	*			trans	62.2	140.7	132.7	-60.1	-173.7	163.9	0	0	123.3
919	G	24.4	Very low	25.1	Very low	75 Å²	75	124.3 Å²	124.3	77%	0.773	80%	0.798	S	S	*	*			trans	133.1	73.7	144.5	0	0	0	0	0	120.4
920	A	23.8	Very low	24.9	Very low	92 Å²	92	120 Å²	120	76%	0.76	79%	0.794	S	S	*	*			trans	41.3	131.1	140.9	0	0	0	0	0	124.3
921	L	24.5	Very low	24.8	Very low	174 Å²	174	118.8 Å²	118.8	91%	0.911	80%	0.799	S	S	*	*			trans	51.9	112.9	139.3	-80.9	143.5	0	0	0	120.8
922	A	24.4	Very low	24.7	Very low	101 Å²	101	110.9 Å²	110.9	84%	0.835	79%	0.793	S	S	*	*				172.5	166.4	106.9	0	0	0	0	0	113.7
923	C	22	Very low	24.7	Very low	118 Å²	118	115 Å²	115	80%	0.797	80%	0.796	S	S	*	*			trans	-43.4	158	-173.1	-65.7	0	0	0	0	121
924	S	22.9	Very low	24.7	Very low	107 Å²	107	115.7 Å²	115.7	75%	0.748	79%	0.793	S	S	*	*			trans	94.5	123.4	136	70.5	0	0	0	0	121.1
925	S	24.8	Very low	24.5	Very low	100 Å²	100	116.1 Å²	116.1	70%	0.699	79%	0.789	S	S	*	*			trans	57.9	110.5	138	61	0	0	0	0	120.7
926	S	24	Very low	24.6	Very low	101 Å²	101	117.8 Å²	117.8	71%	0.706	79%	0.791	S	S	*	*				119.5	137.8	106.4	74.3	0	0	0	0	120
927	L	24.9	Very low	24.8	Very low	140 Å²	140	120.3 Å²	120.3	73%	0.733	80%	0.795	S	S	*	*			trans	73.4	123.2	142.8	-69.2	158.5	0	0	0	121.9
928	H	26.2	Very low	25	Very low	182 Å²	182	120.4 Å²	120.4	84%	0.843	80%	0.796	S	S	*	*			trans	55.3	122.9	146.8	-70.8	-59.5	0	0	0	121.5
929	G	24.1	Very low	25.1	Very low	72 Å²	72	120.7 Å²	120.7	74%	0.742	79%	0.794	S	S	*	*				140.5	121.2	108.8	0	0	0	0	0	117.8
930	A	23.3	Very low	25.2	Very low	93 Å²	93	125.1 Å²	125.1	77%	0.769	80%	0.799	S	S	*	*			trans	66.6	112.5	144.5	0	0	0	0	0	121.2
931	S	25.2	Very low	25.5	Very low	123 Å²	123	128.8 Å²	128.8	86%	0.86	81%	0.805	S	S	*	*				56.5	128.7	128.5	65	0	0	0	0	121.6
932	G	24.1	Very low	25.7	Very low	78 Å²	78	129.8 Å²	129.8	80%	0.804	81%	0.805	S	S	*	*			trans	169.4	43.7	164.2	0	0	0	0	0	120.3
933	I	26.3	Very low	25.9	Very low	162 Å²	162	129.6 Å²	129.6	83%	0.831	80%	0.797	S	S	*	*			trans	20	128.4	151.2	-65.3	168.8	0	0	0	120.3
934	C	24.6	Very low	26.4	Very low	117 Å²	117	129.2 Å²	129.2	79%	0.791	80%	0.796	S	S	*	*			trans	95	143.3	148.2	-89.7	0	0	0	0	122.8
935	S	24	Very low	26.9	Very low	114 Å²	114	132 Å²	132	80%	0.797	80%	0.797	S	S	*	*			trans	73.3	132.2	174.9	85.5	0	0	0	0	114.5
936	S	26.6	Very low	27.2	Very low	103 Å²	103	133.2 Å²	133.2	72%	0.72	80%	0.796	S	S	*	*			cis	-147.7	134.7	6.8	-56.9	0	0	0	0	112.2
937	N	27.1	Very low	27.9	Very low	172 Å²	172	133.9 Å²	133.9	92%	0.92	80%	0.795	S	S	*	*			trans	-80.5	115.5	158.3	-88.5	-19.3	0	0	0	109.2
938	S	29.8	Very low	28.3	Very low	105 Å²	105	136 Å²	136	73%	0.734	80%	0.799	S	S	*	*			trans	179.7	119.7	145	36.9	0	0	0	0	111.9
939	K	29.1	Very low	28.7	Very low	206 Å²	206	135 Å²	135	90%	0.896	80%	0.795	S	S	*	*			trans	128.4	85.5	163.4	-75.2	174.9	175.3	-172.2	0	112.5
940	L	26.4	Very low	29.2	Very low	168 Å²	168	136 Å²	136	88%	0.88	79%	0.787	S	S	*	*			trans	-139.3	84.4	156.8	-89.1	175.9	0	0	0	108.2
941	L	31.9	Very low	29.7	Very low	169 Å²	169	142 Å²	142	89%	0.885	79%	0.79	S	S	*	*			trans	-153.9	74.8	162.5	-89.8	-176.3	0	0	0	107
942	E	28.9	Very low	30.2	Very low	194 Å²	194	138.1 Å²	138.1	91%	0.907	77%	0.768	S	S	*	*			trans	178.2	102.2	158.5	-105.7	161.4	-172.9	0	0	108.9
943	S	27.6	Very low	30.8	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	76%	0.763	S	S	*	*			trans	-177.4	72.5	160.3	58.4	0	0	0	0	108.4
944	S	32.4	Very low	31.3	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	75%	0.745	S	S	*	*			trans	-118.5	14.7	173.1	59	0	0	0	0	112.9
945	E	34	Very low	31.8	Very low	166 Å²	166	134.4 Å²	134.4	78%	0.776	73%	0.732	S	S	*	*	S	Bend	trans	-105.3	-23.6	-179.4	-66.8	-172.3	132.7	0	0	112.9	V947 F948	E945-V947 PolarHBondContact O-N 2.74Å; E945-F948 PolarHBondContact O-N 3.08Å
946	D	31.5	Very low	32.4	Very low	125 Å²	125	134.5 Å²	134.5	67%	0.668	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	7.4	-178.7	-57.6	-24.3	0	0	0	115.3
947	V	37.2	Very low	33	Very low	115 Å²	115	136.1 Å²	136.1	70%	0.697	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-11.9	179.1	-178.4	0	0	0	0	112.2	E945	E945-V947 PolarHBondContact O-N 2.74Å
948	F	34.8	Very low	33.4	Very low	185 Å²	185	134.7 Å²	134.7	81%	0.811	72%	0.715	S	S	*	*	S	Bend	trans	-95.7	-20	-178.1	-103.2	-84.2	0	0	0	115.3	E945	E945-F948 PolarHBondContact O-N 3.08Å
949	E	34.2	Very low	33.8	Very low	161 Å²	161	137 Å²	137	75%	0.752	72%	0.716	S	S	*	*	S	Bend	trans	-82.5	-31.6	178.8	-65.1	-160.7	143.1	0	0	113.3	W951 G952	E949-W951 PolarHBondContact O-N 3.2Å; E949-W951 VanDerWaalsContact O-N 3.09Å; E949-G952 PolarHBondContact O-N 3.31Å
950	T	34	Very low	34	Very low	94 Å²	94	135.5 Å²	135.5	58%	0.577	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-11.5	-176.1	-20.2	0	0	0	0	114.5
951	W	34.1	Very low	34.4	Very low	219 Å²	219	136.6 Å²	136.6	83%	0.83	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-14.3	172.8	-100.4	46	0	0	0	113.7	E949	E949-W951 PolarHBondContact O-N 3.2Å; E949-W951 VanDerWaalsContact O-N 3.09Å
952	G	36.1	Very low	34.4	Very low	40 Å²	40	140.4 Å²	140.4	41%	0.412	71%	0.713	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	-57	173.9	0	0	0	0	0	111.5	E949 A954 C955	E949-G952 PolarHBondContact O-N 3.31Å; G952-A954 PolarHBondContact O-N 3.06Å; G952-A954 VanDerWaalsContact O-N 3.15Å; G952-C955 PolarHBondContact O-N 2.97Å
953	E	35.8	Very low	34.7	Very low	148 Å²	148	134.4 Å²	134.4	69%	0.692	70%	0.702	S	S	*	*	H	α-helix	trans	-62.3	-26.8	-174.7	-61.2	-171.2	133.3	0	0	113.8	C955 L957	E953-C955 VanDerWaalsContact C-N 3.34Å; E953-L957 PolarHBondContact O-N 3.02Å
954	A	37.1	Very low	34.9	Very low	56 Å²	56	137.8 Å²	137.8	46%	0.463	71%	0.713	S	S	.	*	H	α-helix	trans	-71.1	-25.6	176.4	0	0	0	0	0	113.5	G952	G952-A954 PolarHBondContact O-N 3.06Å; G952-A954 VanDerWaalsContact O-N 3.15Å
955	C	35.7	Very low	34.7	Very low	76 Å²	76	136.5 Å²	136.5	51%	0.514	72%	0.717	S	S	.	*	H	α-helix	trans	-80.7	-39.8	178.9	-71.1	0	0	0	0	112.2	G952 E953 L957 L958 M959	G952-C955 PolarHBondContact O-N 2.97Å; E953-C955 VanDerWaalsContact C-N 3.34Å; C955-L957 VanDerWaalsContact C-N 3.34Å; C955-L957 PolarHBondContact O-N 3.22Å; C955-L958 PolarHBondContact O-N 3.32Å; C955-L958 VanDerWaalsContact O-N 3.14Å; C955-M959 PolarHBondContact O-N 3.04Å; C955-M959 VanDerWaalsContact O-N 3.12Å
956	D	35.8	Very low	34.6	Very low	115 Å²	115	137.6 Å²	137.6	62%	0.615	72%	0.722	S	S	*	*	H	α-helix	trans	-67.4	-35	-179.5	-73.1	-25.8	0	0	0	112.2	L958 M959 H960	D956-L958 VanDerWaalsContact C-N 3.25Å; D956-L958 PolarHBondContact O-N 3.2Å; D956-M959 PolarHBondContact O-N 3.47Å; D956-H960 PolarHBondContact O-N 3.03Å
957	L	38.9	Very low	34.7	Very low	138 Å²	138	141 Å²	141	72%	0.723	73%	0.734	S	S	*	*	H	α-helix	trans	-65.9	-23.9	173.4	-109.3	160.2	0	0	0	113.9	E953 C955	E953-L957 PolarHBondContact O-N 3.02Å; C955-L957 VanDerWaalsContact C-N 3.34Å; C955-L957 PolarHBondContact O-N 3.22Å
958	L	36.2	Very low	34.4	Very low	141 Å²	141	139.2 Å²	139.2	74%	0.738	74%	0.739	S	S	*	*	H	α-helix	trans	-86.3	-35.1	176.2	-96.3	162.9	0	0	0	112.6	C955 D956	C955-L958 PolarHBondContact O-N 3.32Å; C955-L958 VanDerWaalsContact O-N 3.14Å; D956-L958 VanDerWaalsContact C-N 3.25Å; D956-L958 PolarHBondContact O-N 3.2Å
959	M	37.5	Very low	34.3	Very low	154 Å²	154	139.4 Å²	139.4	76%	0.759	74%	0.742	S	S	*	*	H	α-helix	trans	-71	-34.8	176.9	-77.1	-70.3	-75.4	0	0	112.9	C955 D956 K961	C955-M959 PolarHBondContact O-N 3.04Å; C955-M959 VanDerWaalsContact O-N 3.12Å; D956-M959 PolarHBondContact O-N 3.47Å; M959-K961 VanDerWaalsContact C-N 3.26Å; M959-K961 PolarHBondContact O-N 2.99Å
960	H	34.7	Very low	34.1	Very low	175 Å²	175	137.7 Å²	137.7	81%	0.81	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-3.8	-175.9	-110.7	-70.4	0	0	0	115.8	D956	D956-H960 PolarHBondContact O-N 3.03Å
961	K	35.1	Very low	34	Very low	190 Å²	190	139 Å²	139	83%	0.826	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	7.5	-176.4	-141.4	174.5	-173.8	176.4	0	114.8	M959	M959-K961 VanDerWaalsContact C-N 3.26Å; M959-K961 PolarHBondContact O-N 2.99Å
962	W	31.2	Very low	34.2	Very low	250 Å²	250	135 Å²	135	95%	0.947	75%	0.75	S	S	*	*	S	Bend	trans	-118.7	35.5	-178.5	-138.5	18.5	0	0	0	112.7
963	G	34.8	Very low	34	Very low	67 Å²	67	144.4 Å²	144.4	69%	0.691	77%	0.773	S	S	*	*	S	Bend	trans	-114.3	-24.7	-176	0	0	0	0	0	116.7
964	D	32.7	Very low	34	Very low	169 Å²	169	149.4 Å²	149.4	90%	0.904	80%	0.803	S	S	*	*			trans	-114.2	95.3	-175.9	-85	-39.2	0	0	0	112.2
965	G	27.7	Very low	33.8	Very low	83 Å²	83	154.1 Å²	154.1	86%	0.856	82%	0.82	S	S	*	*			trans	-117.5	85.6	166.1	0	0	0	0	0	110
966	Q	31.5	Very low	33.7	Very low	188 Å²	188	158.2 Å²	158.2	88%	0.879	84%	0.837	S	S	*	*			trans	-99.3	149.9	177	-149.5	170.3	21.1	0	0	111.7
967	E	34.2	Very low	33.6	Very low	198 Å²	198	160.6 Å²	160.6	93%	0.925	85%	0.849	S	S	*	*			trans	-69.3	144.9	-161.5	-57.2	170.3	127.2	0	0	114.4
968	G	29.6	Very low	33.3	Very low	77 Å²	77	161.9 Å²	161.9	79%	0.794	86%	0.856	S	S	*	*			trans	-160.9	89.8	175.5	0	0	0	0	0	112.5
969	Q	34.1	Very low	33.1	Very low	189 Å²	189	163.2 Å²	163.2	88%	0.883	86%	0.864	S	S	*	*			trans	-64.5	150.9	165.3	-64.8	175	-16.1	0	0	110.2
970	V	29.5	Very low	32.8	Very low	124 Å²	124	163.8 Å²	163.8	75%	0.752	87%	0.871	S	S	*	*				175.9	115.5	121.3	151.7	0	0	0	0	112
971	T	31.1	Very low	32.7	Very low	123 Å²	123	163 Å²	163	76%	0.755	88%	0.875	S	S	*	*			trans	40.5	124.4	152	67.1	0	0	0	0	122.8
972	T	39.4	Very low	32.5	Very low	134 Å²	134	160.9 Å²	160.9	82%	0.822	88%	0.879	S	S	*	*			trans	-52.1	144.5	147.8	43.1	0	0	0	0	114.3
973	R	31.2	Very low	32.6	Very low	238 Å²	238	153.5 Å²	153.5	90%	0.898	87%	0.873	S	S	*	*			trans	-169.7	120.3	136.5	-109.8	171.5	-172.6	-168.7	2.2	112.6
974	L	35.9	Very low	32.4	Very low	252 Å²	252	161.4 Å²	161.4	100%	1.319	89%	0.89	S	S	*	*			trans	53.1	0	162.7	-73.1	162	0	0	0	117.4

Retrieved 974 of 974 residues in 232.2 ms (Link to these results)

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