A0A087XSI3_POEFO Loading...

General transcription factor IIIC, polypeptide 3

AlphaFold DB , UniProt , Accession A0A087XSI3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 898 aa.

						>A0A087XSI3_POEFO|A0A087XSI3
MSGFSAELIDYLEGRITFEEFDRRRDERKAEDSEELTEDENKPSTSAQTKATVEDGVSPGVQQAFASILGETAAAASSEEEDSLSYVDDKDDRDFNVEEEEEAKGVSKERKRRLRQGGKRGLKSKLEEEEEEEEDMTVGDVFKLEMELNRENRRLMKGRRHGSKLPQALRGLMGEANIRYARGEKEDAILMCMEIIRQSPLAYEPFSTLAMIYEDNGDVDKALQFGLIAAHLNPSDCEEWIRLADMSLEQDNVRQAIICYTKAIKYDPTNVRYLWERSSLQMRLGEHKQCMDGYRKILSLLPQEDGEHFMQLSKDMAKSYYESNDLPSALSVIEEGLARHPGLVSDDFLNMAAELYICNRQYKKTLQVLVKFADIVLIREESPSESSALSMKDLGTEEQQKEGEEGTKSNTAEDNDEILDLHVPDSVPVDLRAKLIVCLIQLNVFTPSEGLVSTLMEQSPEEIGDLYLDVAEAYLEQGRYTSALPLLSALVVSEKYDLAVVWLRHAECLKALGHMKEAAESYTKVVEMAPLHLEARLSLATVQQQLGRMDCALKALESMYDSDTLAQDSSAAQKELKLLLHRSTLLKTQGKMEDYLDAMITMISMLLKVAMQRAKVCVRSVTLAGQNHLRLVKIEDMLPEIADHESAYLDNMCKTNVLSKEDWWQLLLSCLLGLCDLQRFEEVDLLVESAMEFYSFYDNKPRRKELEFFGLSATILNQNYYKAYNYIRLMLIENVDLPQFWNIFHQLTISSQHQRHHRFCLRLLLKHPDNHALCVLCGHNAMVSGSFKHALGQYVQALKTHPENPLHSLYVGLTFFHMASQKYVAKRHALVLQNFVLVFLGIFLLVAIRGAAWRVSGEHVQSGPSTAPDGPYTFGHSLLPKGVVPTCMEPGWNFRRSG
					

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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	34.6	Very low	57.6	Low	160 Å²	160	58.4 Å²	58.4	79%	0.788	37%	0.372	S	S	*	.				0	-39.2	0	-60	-34.4	-138.6	0	0	114.1	G3 F4	M1-G3 PolarHBondContact O-N 3.48Å; M1-F4 PolarHBondContact O-N 3.35Å; M1-F4 HydrophobicContact SD-CD2 4.21Å; M1-F4 HydrophobicContact SD-CE2 3.9Å
2	S	33.5	Very low	58.3	Low	138 Å²	138	57.9 Å²	57.9	97%	0.965	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	9.3	-175.7	50.4	0	0	0	0	118
3	G	43.1	Very low	59.3	Low	61 Å²	61	61.5 Å²	61.5	63%	0.629	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	2.5	-179.8	0	0	0	0	0	115.1	M1	M1-G3 PolarHBondContact O-N 3.48Å
4	F	50	Low	59.7	Low	45 Å²	45	61.2 Å²	61.2	20%	0.197	39%	0.389	C	S	.	.	S	Bend	trans	-97.6	154.3	176	-59.5	-63.9	0	0	0	110.7	M1 L8 I9 I196 P200	M1-F4 PolarHBondContact O-N 3.35Å; M1-F4 HydrophobicContact SD-CD2 4.21Å; M1-F4 HydrophobicContact SD-CE2 3.9Å; F4-L8 HydrophobicContact CB-CD2 4.31Å; F4-L8 HydrophobicContact CD1-CD2 3.84Å; F4-L8 HydrophobicContact CG-CD2 4.4Å; F4-I9 HydrophobicContact CB-CD1 4.13Å; F4-I9 HydrophobicContact CB-CG1 3.76Å; F4-I196 HydrophobicContact CE1-CG2 4.18Å; F4-I196 HydrophobicContact CZ-CG2 3.83Å; F4-P200 HydrophobicContact CD1-CB 4.16Å; F4-P200 HydrophobicContact CE1-CB 3.66Å
5	S	59.9	Low	60.6	Low	45 Å²	45	67.6 Å²	67.6	32%	0.315	40%	0.403	S	S	.	.			trans	-67.9	147	168.7	52.7	0	0	0	0	110.3	E7 L8 I9	S5-E7 VanDerWaalsContact CB-OE1 3.3Å; S5-E7 WeakPolarHBondContact CB-OE1 3.39Å; S5-E7 PolarHBondContact O-N 2.9Å; S5-E7 WeakPolarHBondContact OG-CG 3.44Å; S5-E7 PolarHBondContact OG-OE1 3.37Å; S5-L8 WeakPolarHBondContact O-CB 3.42Å; S5-L8 PolarHBondContact O-N 3.01Å; S5-I9 PolarHBondContact O-N 3.11Å
6	A	67	Low	61.6	Low	69 Å²	69	64.9 Å²	64.9	57%	0.57	39%	0.385	S	S	*	.	H	α-helix	trans	-57.1	-38.9	-175.1	0	0	0	0	0	112.5	L8 I9 D10	A6-L8 VanDerWaalsContact C-N 3.31Å; A6-L8 PolarHBondContact O-N 3.31Å; A6-I9 PolarHBondContact O-N 3.44Å; A6-D10 PolarHBondContact O-N 3.34Å
7	E	66.9	Low	62.4	Low	10 Å²	10	65.8 Å²	65.8	5%	0.047	39%	0.392	C	S	.	.	H	α-helix	trans	-57	-37.6	172.5	71.6	-152.1	163.1	0	0	113.6	S5 D10 Y11 F21 R25 R28	S5-E7 VanDerWaalsContact CB-OE1 3.3Å; S5-E7 WeakPolarHBondContact CB-OE1 3.39Å; S5-E7 PolarHBondContact O-N 2.9Å; S5-E7 WeakPolarHBondContact OG-CG 3.44Å; S5-E7 PolarHBondContact OG-OE1 3.37Å; E7-D10 PolarHBondContact O-N 3.41Å; E7-Y11 WeakPolarHBondContact O-CB 3.43Å; E7-Y11 PolarHBondContact O-N 3.14Å; E7-F21 HydrophobicContact CB-CD2 4.13Å; E7-F21 HydrophobicContact CG-CD2 3.83Å; E7-F21 HydrophobicContact CG-CE2 3.82Å; E7-R25 WeakPolarHBondContact OE2-CA 3.43Å; E7-R25 PolarHBondContact OE2-N 2.95Å; E7-R28 IonicContact OE1-CZ 3.29Å; E7-R28 IonicContact OE1-NH1 2.65Å; E7-R28 PolarHBondContact OE1-NH1 3.03Å; E7-R28 IonicContact OE1-NH2 2.9Å; E7-R28 IonicContact OE2-CZ 3.7Å; E7-R28 VanDerWaalsContact OE2-CZ 3.25Å; E7-R28 IonicContact OE2-NH1 2.65Å; E7-R28 PolarHBondContact OE2-NH1 3.28Å; E7-R28 IonicContact OE2-NH2 3.16Å; E7-R28 PolarHBondContact OE2-NH2 3.35Å
8	L	65.3	Low	62.7	Low	24 Å²	24	62.3 Å²	62.3	13%	0.126	37%	0.371	C	S	.	.	H	α-helix	trans	-75.7	-32.2	-178.9	-177.9	57.5	0	0	0	110.7	F4 S5 A6 L12 F21 I228	F4-L8 HydrophobicContact CB-CD2 4.31Å; F4-L8 HydrophobicContact CD1-CD2 3.84Å; F4-L8 HydrophobicContact CG-CD2 4.4Å; S5-L8 WeakPolarHBondContact O-CB 3.42Å; S5-L8 PolarHBondContact O-N 3.01Å; A6-L8 VanDerWaalsContact C-N 3.31Å; A6-L8 PolarHBondContact O-N 3.31Å; L8-L12 HydrophobicContact CD1-CD1 4.22Å; L8-L12 HydrophobicContact CD1-CG 4.38Å; L8-L12 HydrophobicContact CG-CD1 4.14Å; L8-L12 VanDerWaalsContact O-CB 3.32Å; L8-L12 WeakPolarHBondContact O-CB 3.32Å; L8-L12 VanDerWaalsContact O-CG 3.29Å; L8-L12 WeakPolarHBondContact O-CG 3.27Å; L8-L12 PolarHBondContact O-N 2.93Å; L8-F21 HydrophobicContact CB-CE2 3.91Å; L8-F21 HydrophobicContact CD1-CE2 3.82Å; L8-F21 HydrophobicContact CD1-CZ 4.05Å; L8-F21 HydrophobicContact CG-CE2 4.45Å; L8-I228 HydrophobicContact CD1-CD1 3.81Å; L8-I228 HydrophobicContact CD1-CG1 4Å
9	I	70.1	Confident	63.1	Low	40 Å²	40	62.5 Å²	62.5	21%	0.205	37%	0.368	C	S	.	.	H	α-helix	trans	-68.5	-49	171.3	-58.9	170.5	0	0	0	109.5	F4 S5 A6 Y11 L12 E13	F4-I9 HydrophobicContact CB-CD1 4.13Å; F4-I9 HydrophobicContact CB-CG1 3.76Å; S5-I9 PolarHBondContact O-N 3.11Å; A6-I9 PolarHBondContact O-N 3.44Å; I9-Y11 VanDerWaalsContact C-N 3.26Å; I9-Y11 PolarHBondContact O-N 2.99Å; I9-L12 PolarHBondContact O-N 3.14Å; I9-E13 HydrophobicContact CG2-CG 4.42Å; I9-E13 WeakPolarHBondContact CG2-OE1 3.28Å; I9-E13 WeakPolarHBondContact O-CB 3.31Å; I9-E13 WeakPolarHBondContact O-CG 3.5Å; I9-E13 PolarHBondContact O-N 3.45Å
10	D	72.8	Confident	63.6	Low	36 Å²	36	61.5 Å²	61.5	19%	0.193	36%	0.359	C	S	.	.	H	α-helix	trans	-60.5	-34.7	176.9	-76.7	-30.9	0	0	0	112.2	A6 E7 G14 R15 I16 R24	A6-D10 PolarHBondContact O-N 3.34Å; E7-D10 PolarHBondContact O-N 3.41Å; D10-G14 PolarHBondContact O-N 2.89Å; D10-R15 HydrophobicContact CB-CB 4.28Å; D10-R15 WeakPolarHBondContact O-CA 3.25Å; D10-R15 WeakPolarHBondContact O-CB 3.39Å; D10-R15 PolarHBondContact O-N 3.14Å; D10-R15 WeakPolarHBondContact OD1-CD 3.44Å; D10-R15 IonicContact OD1-CZ 2.71Å; D10-R15 IonicContact OD1-NE 3.46Å; D10-R15 IonicContact OD1-NH1 3.52Å; D10-R15 PolarHBondContact OD1-NH1 3.3Å; D10-I16 HydrophobicContact CB-CD1 3.99Å; D10-I16 HydrophobicContact CB-CG1 4.01Å; D10-I16 HydrophobicContact CB-CG2 4.3Å; D10-I16 PolarHBondContact O-N 3.47Å; D10-R24 IonicContact OD2-NH1 2.74Å
11	Y	70.9	Confident	64.3	Low	14 Å²	14	59 Å²	59	6%	0.055	34%	0.344	C	S	.	.	H	α-helix	trans	-70.3	-48.5	174.7	178.6	-115.4	0	0	0	112.5	E7 I9 E13 G14 F18 F21 Q224 L227 I228	E7-Y11 WeakPolarHBondContact O-CB 3.43Å; E7-Y11 PolarHBondContact O-N 3.14Å; I9-Y11 VanDerWaalsContact C-N 3.26Å; I9-Y11 PolarHBondContact O-N 2.99Å; Y11-E13 PolarHBondContact O-N 3.36Å; Y11-G14 PolarHBondContact O-N 3.17Å; Y11-F18 HydrophobicContact CE1-CD2 4.38Å; Y11-F18 HydrophobicContact CE2-CB 3.73Å; Y11-F18 HydrophobicContact CE2-CD2 4.17Å; Y11-F18 HydrophobicContact CE2-CG 4.47Å; Y11-F18 AromaticContact CZ-CD2 3.87Å; Y11-F21 HydrophobicContact CD2-CB 4.25Å; Y11-F21 HydrophobicContact CG-CB 4.22Å; Y11-F21 HydrophobicContact CG-CD2 4.37Å; Y11-F21 HydrophobicContact CG-CG 4.18Å; Y11-Q224 HydrophobicContact CE1-CB 4.41Å; Y11-Q224 HydrophobicContact CE1-CG 4.36Å; Y11-L227 WeakPolarHBondContact OH-CD1 3.4Å; Y11-I228 HydrophobicContact CE1-CD1 4.43Å; Y11-I228 HydrophobicContact CE1-CG1 4.45Å
12	L	65.6	Low	65.8	Low	53 Å²	53	52 Å²	52	28%	0.277	31%	0.31	S	S	.	.	H	α-helix	trans	-66.2	-23.7	177.4	-75.6	169	0	0	0	113.3	L8 I9 G14 F225 I228	L8-L12 HydrophobicContact CD1-CD1 4.22Å; L8-L12 HydrophobicContact CD1-CG 4.38Å; L8-L12 HydrophobicContact CG-CD1 4.14Å; L8-L12 VanDerWaalsContact O-CB 3.32Å; L8-L12 WeakPolarHBondContact O-CB 3.32Å; L8-L12 VanDerWaalsContact O-CG 3.29Å; L8-L12 WeakPolarHBondContact O-CG 3.27Å; L8-L12 PolarHBondContact O-N 2.93Å; I9-L12 PolarHBondContact O-N 3.14Å; L12-G14 VanDerWaalsContact C-N 3.32Å; L12-F225 HydrophobicContact CD2-CE1 4.02Å; L12-I228 HydrophobicContact CD1-CD1 4.41Å; L12-I228 HydrophobicContact CD2-CD1 3.66Å; L12-I228 HydrophobicContact CG-CD1 4.14Å
13	E	72.1	Confident	67.9	Low	104 Å²	104	51.2 Å²	51.2	49%	0.486	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	4.5	170.8	-69.3	-171.6	-149.3	0	0	113.3	I9 Y11 R15	I9-E13 HydrophobicContact CG2-CG 4.42Å; I9-E13 WeakPolarHBondContact CG2-OE1 3.28Å; I9-E13 WeakPolarHBondContact O-CB 3.31Å; I9-E13 WeakPolarHBondContact O-CG 3.5Å; I9-E13 PolarHBondContact O-N 3.45Å; Y11-E13 PolarHBondContact O-N 3.36Å; E13-R15 HydrophobicContact CB-CG 3.95Å; E13-R15 PolarHBondContact O-N 2.88Å; E13-R15 IonicContact OE1-NH2 3.03Å; E13-R15 IonicContact OE2-CZ 2.69Å; E13-R15 IonicContact OE2-NE 2.65Å; E13-R15 PolarHBondContact OE2-NE 3.28Å; E13-R15 IonicContact OE2-NH2 3.93Å; E13-R15 PolarHBondContact OE2-NH2 3.23Å
14	G	63.8	Low	69.4	Low	58 Å²	58	52.4 Å²	52.4	60%	0.598	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	16.9	177.6	0	0	0	0	0	114.9	D10 Y11 L12	D10-G14 PolarHBondContact O-N 2.89Å; Y11-G14 PolarHBondContact O-N 3.17Å; L12-G14 VanDerWaalsContact C-N 3.32Å
15	R	73.9	Confident	70.3	Confident	157 Å²	157	52.7 Å²	52.7	59%	0.592	27%	0.271	S	S	*	.	S	Bend	trans	-82.9	-21.8	-176.6	-55.8	173.5	-178.7	-171.1	-3.2	113.3	D10 E13	D10-R15 HydrophobicContact CB-CB 4.28Å; D10-R15 WeakPolarHBondContact O-CA 3.25Å; D10-R15 WeakPolarHBondContact O-CB 3.39Å; D10-R15 PolarHBondContact O-N 3.14Å; D10-R15 WeakPolarHBondContact OD1-CD 3.44Å; D10-R15 IonicContact OD1-CZ 2.71Å; D10-R15 IonicContact OD1-NE 3.46Å; D10-R15 IonicContact OD1-NH1 3.52Å; D10-R15 PolarHBondContact OD1-NH1 3.3Å; E13-R15 HydrophobicContact CB-CG 3.95Å; E13-R15 PolarHBondContact O-N 2.88Å; E13-R15 IonicContact OE1-NH2 3.03Å; E13-R15 IonicContact OE2-CZ 2.69Å; E13-R15 IonicContact OE2-NE 2.65Å; E13-R15 PolarHBondContact OE2-NE 3.28Å; E13-R15 IonicContact OE2-NH2 3.93Å; E13-R15 PolarHBondContact OE2-NH2 3.23Å
16	I	76.4	Confident	70.7	Confident	24 Å²	24	53.4 Å²	53.4	12%	0.123	27%	0.271	C	S	.	.	S	Bend	trans	-133	152.2	175.6	64.4	176.6	0	0	0	110.7	D10 E20 F21	D10-I16 HydrophobicContact CB-CD1 3.99Å; D10-I16 HydrophobicContact CB-CG1 4.01Å; D10-I16 HydrophobicContact CB-CG2 4.3Å; D10-I16 PolarHBondContact O-N 3.47Å; I16-E20 HydrophobicContact CB-CB 4.16Å; I16-E20 HydrophobicContact CB-CG 3.98Å; I16-E20 HydrophobicContact CD1-CG 4.46Å; I16-E20 HydrophobicContact CG2-CG 4.09Å; I16-F21 HydrophobicContact CD1-CB 3.93Å; I16-F21 HydrophobicContact CG1-CB 4.42Å
17	T	74.4	Confident	71	Confident	81 Å²	81	54.1 Å²	54.1	50%	0.497	26%	0.263	S	S	.	.			trans	-71.7	162.1	172.7	59.3	0	0	0	0	111.1	E19 E20 F21	T17-E19 PolarHBondContact O-N 2.95Å; T17-E20 PolarHBondContact O-N 3.47Å; T17-E20 PolarHBondContact OG1-N 2.89Å; T17-F21 PolarHBondContact O-N 2.97Å
18	F	68.9	Low	71.3	Confident	3 Å²	3	58 Å²	58	1%	0.013	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-35.5	172.1	-179	-109.4	0	0	0	112.4	Y11 E20 F21 D22 L227 H231 W240 Q255 I258	Y11-F18 HydrophobicContact CE1-CD2 4.38Å; Y11-F18 HydrophobicContact CE2-CB 3.73Å; Y11-F18 HydrophobicContact CE2-CD2 4.17Å; Y11-F18 HydrophobicContact CE2-CG 4.47Å; Y11-F18 AromaticContact CZ-CD2 3.87Å; F18-E20 PolarHBondContact O-N 3.39Å; F18-F21 AromaticContact CD2-CD1 3.95Å; F18-F21 HydrophobicContact CD2-CD1 3.95Å; F18-F21 HydrophobicContact CE2-CD1 4.05Å; F18-F21 HydrophobicContact CE2-CE1 4.24Å; F18-F21 PolarHBondContact O-N 3.3Å; F18-D22 PolarHBondContact O-N 3.27Å; F18-L227 HydrophobicContact CD1-CD1 4.31Å; F18-L227 HydrophobicContact CD2-CB 4.19Å; F18-L227 HydrophobicContact CD2-CD1 3.87Å; F18-L227 HydrophobicContact CD2-CG 4.49Å; F18-L227 HydrophobicContact CE1-CD1 4.47Å; F18-L227 HydrophobicContact CE1-CD2 4.04Å; F18-L227 HydrophobicContact CE2-CB 3.71Å; F18-L227 HydrophobicContact CE2-CD1 4.07Å; F18-L227 HydrophobicContact CE2-CD2 4.19Å; F18-L227 HydrophobicContact CE2-CG 4.21Å; F18-L227 HydrophobicContact CG-CD1 3.99Å; F18-L227 HydrophobicContact CZ-CB 4.15Å; F18-L227 HydrophobicContact CZ-CD1 4.35Å; F18-L227 HydrophobicContact CZ-CD2 3.8Å; F18-L227 HydrophobicContact CZ-CG 4.32Å; F18-H231 AromaticContact CE2-CD2 3.69Å; F18-H231 AromaticContact CE2-NE2 3.37Å; F18-H231 WeakPolarHBondContact CE2-NE2 3.09Å; F18-H231 AromaticContact CZ-CD2 3.89Å; F18-H231 AromaticContact CZ-CE1 3.93Å; F18-H231 AromaticContact CZ-NE2 3.22Å; F18-H231 WeakPolarHBondContact CZ-NE2 3.42Å; F18-W240 HydrophobicContact CZ-CZ3 4.49Å; F18-Q255 HydrophobicContact CD1-CG 3.87Å; F18-Q255 HydrophobicContact CG-CG 4.48Å; F18-I258 HydrophobicContact CE1-CG2 3.85Å
19	E	69	Low	71.1	Confident	66 Å²	66	60.7 Å²	60.7	31%	0.308	29%	0.288	S	S	.	.	H	α-helix	trans	-56.1	-49.9	174.2	-46.4	178.5	154.3	0	0	111.3	T17 R23 R254 I258	T17-E19 PolarHBondContact O-N 2.95Å; E19-R23 WeakPolarHBondContact O-CB 3.49Å; E19-R23 PolarHBondContact O-N 2.95Å; E19-R254 WeakPolarHBondContact OE1-CB 3.22Å; E19-R254 WeakPolarHBondContact OE1-CD 3.38Å; E19-R254 IonicContact OE2-NH1 2.85Å; E19-I258 HydrophobicContact CB-CD1 4.21Å; E19-I258 HydrophobicContact CG-CD1 3.92Å
20	E	74.8	Confident	70.8	Confident	41 Å²	41	61 Å²	61	19%	0.192	30%	0.296	C	S	.	.	H	α-helix	trans	-72.2	-32.6	-178	-179.8	66.7	177.4	0	0	112.2	I16 T17 F18 R23 R24	I16-E20 HydrophobicContact CB-CB 4.16Å; I16-E20 HydrophobicContact CB-CG 3.98Å; I16-E20 HydrophobicContact CD1-CG 4.46Å; I16-E20 HydrophobicContact CG2-CG 4.09Å; T17-E20 PolarHBondContact O-N 3.47Å; T17-E20 PolarHBondContact OG1-N 2.89Å; F18-E20 PolarHBondContact O-N 3.39Å; E20-R23 IonicContact OE1-CZ 3.3Å; E20-R23 IonicContact OE1-NH2 3.14Å; E20-R23 PolarHBondContact OE1-NH2 3.31Å; E20-R23 IonicContact OE2-CZ 2.72Å; E20-R23 IonicContact OE2-NE 3.88Å; E20-R23 PolarHBondContact OE2-NE 2.88Å; E20-R23 IonicContact OE2-NH2 3.17Å; E20-R23 PolarHBondContact OE2-NH2 3.49Å; E20-R24 WeakPolarHBondContact O-CB 3.26Å; E20-R24 VanDerWaalsContact O-CG 3.27Å; E20-R24 WeakPolarHBondContact O-CG 3.35Å; E20-R24 PolarHBondContact O-N 3.26Å; E20-R24 IonicContact OE1-CZ 2.72Å; E20-R24 IonicContact OE1-NE 3.12Å; E20-R24 PolarHBondContact OE1-NE 3.06Å; E20-R24 IonicContact OE1-NH2 3.49Å; E20-R24 PolarHBondContact OE1-NH2 3.34Å
21	F	77.6	Confident	70.1	Confident	10 Å²	10	65.2 Å²	65.2	4%	0.044	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-53.6	172	162.7	-98.2	0	0	0	112.1	E7 L8 Y11 I16 T17 F18 R23 R25 H231	E7-F21 HydrophobicContact CB-CD2 4.13Å; E7-F21 HydrophobicContact CG-CD2 3.83Å; E7-F21 HydrophobicContact CG-CE2 3.82Å; L8-F21 HydrophobicContact CB-CE2 3.91Å; L8-F21 HydrophobicContact CD1-CE2 3.82Å; L8-F21 HydrophobicContact CD1-CZ 4.05Å; L8-F21 HydrophobicContact CG-CE2 4.45Å; Y11-F21 HydrophobicContact CD2-CB 4.25Å; Y11-F21 HydrophobicContact CG-CB 4.22Å; Y11-F21 HydrophobicContact CG-CD2 4.37Å; Y11-F21 HydrophobicContact CG-CG 4.18Å; I16-F21 HydrophobicContact CD1-CB 3.93Å; I16-F21 HydrophobicContact CG1-CB 4.42Å; T17-F21 PolarHBondContact O-N 2.97Å; F18-F21 AromaticContact CD2-CD1 3.95Å; F18-F21 HydrophobicContact CD2-CD1 3.95Å; F18-F21 HydrophobicContact CE2-CD1 4.05Å; F18-F21 HydrophobicContact CE2-CE1 4.24Å; F18-F21 PolarHBondContact O-N 3.3Å; F21-R23 VanDerWaalsContact C-N 3.33Å; F21-R23 PolarHBondContact O-N 2.97Å; F21-R25 WeakPolarHBondContact O-CB 3.24Å; F21-R25 PolarHBondContact O-N 3.34Å; F21-R25 VanDerWaalsContact O-N 3.13Å; F21-H231 AromaticContact CE1-CD2 3.75Å; F21-H231 AromaticContact CE1-NE2 3.94Å
22	D	67.1	Low	69.3	Low	13 Å²	13	69.2 Å²	69.2	7%	0.07	34%	0.337	C	S	.	.	H	α-helix	trans	-70.9	-30.9	-177.9	-171.7	61.3	0	0	0	111.3	F18 R25 D26 H231 K262	F18-D22 PolarHBondContact O-N 3.27Å; D22-R25 IonicContact OD1-NH1 2.66Å; D22-R25 PolarHBondContact OD1-NH1 2.88Å; D22-D26 WeakPolarHBondContact O-CB 3.45Å; D22-D26 PolarHBondContact O-N 2.93Å; D22-H231 IonicContact OD1-CE1 2.83Å; D22-H231 PolarHBondContact OD1-CE1 2.72Å; D22-H231 IonicContact OD1-NE2 3.62Å; D22-H231 PolarHBondContact OD1-NE2 3.41Å; D22-K262 IonicContact OD1-NZ 3.75Å; D22-K262 PolarHBondContact OD1-NZ 3.45Å; D22-K262 WeakPolarHBondContact OD2-CE 3.46Å; D22-K262 IonicContact OD2-NZ 2.95Å; D22-K262 PolarHBondContact OD2-NZ 3.34Å
23	R	75.8	Confident	68.4	Low	121 Å²	121	69.7 Å²	69.7	46%	0.457	35%	0.345	S	S	.	.	H	α-helix	trans	-60.3	-59.6	170	-175.7	177.2	76.3	90.6	-5.2	112.5	E19 E20 F21 R25 D26 E27	E19-R23 WeakPolarHBondContact O-CB 3.49Å; E19-R23 PolarHBondContact O-N 2.95Å; E20-R23 IonicContact OE1-CZ 3.3Å; E20-R23 IonicContact OE1-NH2 3.14Å; E20-R23 PolarHBondContact OE1-NH2 3.31Å; E20-R23 IonicContact OE2-CZ 2.72Å; E20-R23 IonicContact OE2-NE 3.88Å; E20-R23 PolarHBondContact OE2-NE 2.88Å; E20-R23 IonicContact OE2-NH2 3.17Å; E20-R23 PolarHBondContact OE2-NH2 3.49Å; F21-R23 VanDerWaalsContact C-N 3.33Å; F21-R23 PolarHBondContact O-N 2.97Å; R23-R25 PolarHBondContact O-N 3.43Å; R23-R25 VanDerWaalsContact O-N 3.16Å; R23-D26 PolarHBondContact O-N 3.36Å; R23-D26 VanDerWaalsContact O-N 3.1Å; R23-E27 HydrophobicContact CG-CG 4.41Å; R23-E27 VanDerWaalsContact CG-OE1 3.32Å; R23-E27 WeakPolarHBondContact CG-OE1 3.28Å; R23-E27 IonicContact CZ-OE1 2.97Å; R23-E27 IonicContact CZ-OE2 2.63Å; R23-E27 IonicContact NE-OE1 3.98Å; R23-E27 IonicContact NH1-OE1 2.99Å; R23-E27 PolarHBondContact NH1-OE1 3.47Å; R23-E27 IonicContact NH1-OE2 3.96Å; R23-E27 PolarHBondContact NH1-OE2 3.16Å; R23-E27 WeakPolarHBondContact O-CB 3.37Å; R23-E27 WeakPolarHBondContact O-CG 3.32Å; R23-E27 PolarHBondContact O-N 3.12Å
24	R	76	Confident	67.2	Low	86 Å²	86	71 Å²	71	33%	0.325	35%	0.351	S	S	.	.	H	α-helix	trans	-58.3	-31.6	-179.7	-71.7	175.6	-172.8	-176.8	8	112.7	D10 E20 R28	D10-R24 IonicContact OD2-NH1 2.74Å; E20-R24 WeakPolarHBondContact O-CB 3.26Å; E20-R24 VanDerWaalsContact O-CG 3.27Å; E20-R24 WeakPolarHBondContact O-CG 3.35Å; E20-R24 PolarHBondContact O-N 3.26Å; E20-R24 IonicContact OE1-CZ 2.72Å; E20-R24 IonicContact OE1-NE 3.12Å; E20-R24 PolarHBondContact OE1-NE 3.06Å; E20-R24 IonicContact OE1-NH2 3.49Å; E20-R24 PolarHBondContact OE1-NH2 3.34Å; R24-R28 PolarHBondContact O-N 3.14Å; R24-R28 VanDerWaalsContact O-N 3.1Å
25	R	67.8	Low	66.2	Low	51 Å²	51	75.7 Å²	75.7	19%	0.192	36%	0.357	C	S	.	.	H	α-helix	trans	-73.4	-41	177.1	178.6	-168.5	175.3	-146	15.4	112.8	E7 F21 D22 R23 K29 H231	E7-R25 WeakPolarHBondContact OE2-CA 3.43Å; E7-R25 PolarHBondContact OE2-N 2.95Å; F21-R25 WeakPolarHBondContact O-CB 3.24Å; F21-R25 PolarHBondContact O-N 3.34Å; F21-R25 VanDerWaalsContact O-N 3.13Å; D22-R25 IonicContact OD1-NH1 2.66Å; D22-R25 PolarHBondContact OD1-NH1 2.88Å; R23-R25 PolarHBondContact O-N 3.43Å; R23-R25 VanDerWaalsContact O-N 3.16Å; R25-K29 WeakPolarHBondContact O-CG 3.14Å; R25-K29 PolarHBondContact O-N 2.9Å; R25-H231 PolarHBondContact NH1-CD2 3.25Å; R25-H231 PolarHBondContact NH1-CE1 3.28Å; R25-H231 VanDerWaalsContact NH1-CG 3.28Å; R25-H231 PolarHBondContact NH1-ND1 2.86Å; R25-H231 PolarHBondContact NH1-NE2 2.98Å; R25-H231 PolarHBondContact NH2-O 3.05Å
26	D	68.3	Low	64.7	Low	61 Å²	61	74.2 Å²	74.2	33%	0.326	36%	0.36	S	S	.	.	H	α-helix	trans	-75.2	-31.6	175.3	-81.4	-3.5	0	0	0	111.3	D22 R23 K29 A30 K262	D22-D26 WeakPolarHBondContact O-CB 3.45Å; D22-D26 PolarHBondContact O-N 2.93Å; R23-D26 PolarHBondContact O-N 3.36Å; R23-D26 VanDerWaalsContact O-N 3.1Å; D26-K29 PolarHBondContact O-N 3.24Å; D26-K29 WeakPolarHBondContact OD1-CD 3.37Å; D26-K29 WeakPolarHBondContact OD1-CE 3.43Å; D26-K29 IonicContact OD1-NZ 3.62Å; D26-K29 PolarHBondContact OD1-NZ 3.39Å; D26-A30 PolarHBondContact O-N 3.24Å; D26-A30 VanDerWaalsContact O-N 3.12Å; D26-K262 IonicContact OD2-NZ 3.72Å
27	E	74.4	Confident	62.9	Low	84 Å²	84	77.9 Å²	77.9	39%	0.393	38%	0.384	S	S	.	.	H	α-helix	trans	-58.4	-52.5	168.8	-74.9	167.9	173.9	0	0	111.4	R23 K29 A30 E31	R23-E27 HydrophobicContact CG-CG 4.41Å; R23-E27 VanDerWaalsContact CG-OE1 3.32Å; R23-E27 WeakPolarHBondContact CG-OE1 3.28Å; R23-E27 IonicContact CZ-OE1 2.97Å; R23-E27 IonicContact CZ-OE2 2.63Å; R23-E27 IonicContact NE-OE1 3.98Å; R23-E27 IonicContact NH1-OE1 2.99Å; R23-E27 PolarHBondContact NH1-OE1 3.47Å; R23-E27 IonicContact NH1-OE2 3.96Å; R23-E27 PolarHBondContact NH1-OE2 3.16Å; R23-E27 WeakPolarHBondContact O-CB 3.37Å; R23-E27 WeakPolarHBondContact O-CG 3.32Å; R23-E27 PolarHBondContact O-N 3.12Å; E27-K29 VanDerWaalsContact C-N 3.27Å; E27-K29 PolarHBondContact O-N 3.35Å; E27-A30 WeakPolarHBondContact O-CB 3.35Å; E27-A30 PolarHBondContact O-N 3.41Å; E27-E31 PolarHBondContact O-N 3.48Å; E27-E31 VanDerWaalsContact O-N 3.09Å
28	R	72.5	Confident	61	Low	91 Å²	91	81.2 Å²	81.2	34%	0.343	39%	0.394	S	S	.	.	H	α-helix	trans	-59.8	-35.7	176.1	-168.1	-173.2	-52.6	103.1	20.1	113.1	E7 R24 A30 E31 D32	E7-R28 IonicContact OE1-CZ 3.29Å; E7-R28 IonicContact OE1-NH1 2.65Å; E7-R28 PolarHBondContact OE1-NH1 3.03Å; E7-R28 IonicContact OE1-NH2 2.9Å; E7-R28 IonicContact OE2-CZ 3.7Å; E7-R28 VanDerWaalsContact OE2-CZ 3.25Å; E7-R28 IonicContact OE2-NH1 2.65Å; E7-R28 PolarHBondContact OE2-NH1 3.28Å; E7-R28 IonicContact OE2-NH2 3.16Å; E7-R28 PolarHBondContact OE2-NH2 3.35Å; R24-R28 PolarHBondContact O-N 3.14Å; R24-R28 VanDerWaalsContact O-N 3.1Å; R28-A30 VanDerWaalsContact C-N 3.26Å; R28-A30 PolarHBondContact O-N 3.28Å; R28-E31 PolarHBondContact O-N 3.41Å; R28-D32 VanDerWaalsContact O-CB 3.29Å; R28-D32 WeakPolarHBondContact O-CB 3.43Å; R28-D32 PolarHBondContact O-N 3.35Å
29	K	60.3	Low	59.3	Low	81 Å²	81	88.2 Å²	88.2	35%	0.352	43%	0.431	S	S	.	.	H	α-helix	trans	-65.6	-30.3	176.2	-72	168.5	-158.8	156.2	0	112.4	R25 D26 E27 S33	R25-K29 WeakPolarHBondContact O-CG 3.14Å; R25-K29 PolarHBondContact O-N 2.9Å; D26-K29 PolarHBondContact O-N 3.24Å; D26-K29 WeakPolarHBondContact OD1-CD 3.37Å; D26-K29 WeakPolarHBondContact OD1-CE 3.43Å; D26-K29 IonicContact OD1-NZ 3.62Å; D26-K29 PolarHBondContact OD1-NZ 3.39Å; E27-K29 VanDerWaalsContact C-N 3.27Å; E27-K29 PolarHBondContact O-N 3.35Å; K29-S33 WeakPolarHBondContact O-CB 3.35Å; K29-S33 PolarHBondContact O-N 3.49Å; K29-S33 PolarHBondContact O-OG 2.96Å
30	A	63.5	Low	57.6	Low	45 Å²	45	93.9 Å²	93.9	37%	0.372	46%	0.458	S	S	.	.	H	α-helix	trans	-69.9	-50.4	173.3	0	0	0	0	0	109.9	D26 E27 R28 D32 S33 E34	D26-A30 PolarHBondContact O-N 3.24Å; D26-A30 VanDerWaalsContact O-N 3.12Å; E27-A30 WeakPolarHBondContact O-CB 3.35Å; E27-A30 PolarHBondContact O-N 3.41Å; R28-A30 VanDerWaalsContact C-N 3.26Å; R28-A30 PolarHBondContact O-N 3.28Å; A30-D32 PolarHBondContact O-N 3.08Å; A30-S33 CarbonylContact O-C 3.57Å; A30-S33 WeakPolarHBondContact O-CA 3.46Å; A30-S33 WeakPolarHBondContact O-CB 3.46Å; A30-S33 PolarHBondContact O-N 3.45Å; A30-S33 PolarHBondContact O-OG 3.1Å; A30-E34 PolarHBondContact O-N 3.15Å
31	E	59.6	Low	55.5	Low	126 Å²	126	98.8 Å²	98.8	59%	0.589	49%	0.486	S	S	*	.	H	α-helix	trans	-55.2	-50.6	175.5	-63	175.3	147.3	0	0	112.1	E27 R28 S33 E34 E35	E27-E31 PolarHBondContact O-N 3.48Å; E27-E31 VanDerWaalsContact O-N 3.09Å; R28-E31 PolarHBondContact O-N 3.41Å; E31-S33 PolarHBondContact O-N 3.08Å; E31-E34 PolarHBondContact O-N 3.25Å; E31-E35 PolarHBondContact O-N 3.05Å; E31-E35 VanDerWaalsContact O-N 3.14Å
32	D	53	Low	53.2	Low	97 Å²	97	106.6 Å²	106.6	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-57.3	-17.4	174.1	-83.4	-32.1	0	0	0	113.3	R28 A30 L36	R28-D32 VanDerWaalsContact O-CB 3.29Å; R28-D32 WeakPolarHBondContact O-CB 3.43Å; R28-D32 PolarHBondContact O-N 3.35Å; A30-D32 PolarHBondContact O-N 3.08Å; D32-L36 WeakPolarHBondContact O-CD1 3.47Å
33	S	47.9	Very low	51.5	Low	64 Å²	64	112 Å²	112	45%	0.448	56%	0.555	S	S	.	*	H	α-helix	trans	-102.6	-30.7	179.9	77.5	0	0	0	0	113.9	K29 A30 E31	K29-S33 WeakPolarHBondContact O-CB 3.35Å; K29-S33 PolarHBondContact O-N 3.49Å; K29-S33 PolarHBondContact O-OG 2.96Å; A30-S33 CarbonylContact O-C 3.57Å; A30-S33 WeakPolarHBondContact O-CA 3.46Å; A30-S33 WeakPolarHBondContact O-CB 3.46Å; A30-S33 PolarHBondContact O-N 3.45Å; A30-S33 PolarHBondContact O-OG 3.1Å; E31-S33 PolarHBondContact O-N 3.08Å
34	E	46.4	Very low	49	Very low	132 Å²	132	111.1 Å²	111.1	62%	0.617	57%	0.568	S	S	*	*	H	α-helix	trans	-75.7	-40.1	176.7	-69.8	-174.5	160.7	0	0	111.3	A30 E31 L36 T37	A30-E34 PolarHBondContact O-N 3.15Å; E31-E34 PolarHBondContact O-N 3.25Å; E34-L36 PolarHBondContact O-N 3.39Å; E34-L36 VanDerWaalsContact O-N 3.07Å; E34-T37 PolarHBondContact O-N 3.22Å; E34-T37 PolarHBondContact O-OG1 3.02Å
35	E	43.5	Very low	46.6	Very low	155 Å²	155	112.8 Å²	112.8	72%	0.724	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-27.7	173.6	-76.6	-161	155.8	0	0	112.7	E31 T37	E31-E35 PolarHBondContact O-N 3.05Å; E31-E35 VanDerWaalsContact O-N 3.14Å; E35-T37 PolarHBondContact O-N 3.47Å
36	L	41.9	Very low	44.6	Very low	126 Å²	126	116 Å²	116	66%	0.66	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-5.1	177.9	-67.8	173.2	0	0	0	114.1	D32 E34	D32-L36 WeakPolarHBondContact O-CD1 3.47Å; E34-L36 PolarHBondContact O-N 3.39Å; E34-L36 VanDerWaalsContact O-N 3.07Å
37	T	38.5	Very low	42.5	Very low	102 Å²	102	117.6 Å²	117.6	63%	0.626	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	-23.3	-177.1	66.5	0	0	0	0	114.6	E34 E35	E34-T37 PolarHBondContact O-N 3.22Å; E34-T37 PolarHBondContact O-OG1 3.02Å; E35-T37 PolarHBondContact O-N 3.47Å
38	E	34.7	Very low	40.2	Very low	151 Å²	151	122.8 Å²	122.8	71%	0.706	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-78.6	-19.4	-178.3	-65.1	-150.3	132.7	0	0	114.4	E40	E38-E40 PolarHBondContact O-N 3.2Å
39	D	32.4	Very low	37.8	Very low	149 Å²	149	124.9 Å²	124.9	80%	0.797	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-80.6	-10.8	-164.6	-134	16	0	0	0	114.6
40	E	33.2	Very low	36.1	Very low	185 Å²	185	131.4 Å²	131.4	86%	0.864	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-91.1	-14	178.7	-71.3	-150.2	141.5	0	0	115.3	E38	E38-E40 PolarHBondContact O-N 3.2Å
41	N	30.3	Very low	34.2	Very low	145 Å²	145	133.1 Å²	133.1	78%	0.775	73%	0.729	S	S	*	*			trans	-117.3	77	-169.4	-88.2	-60.5	0	0	0	115.5
42	K	31.1	Very low	32.4	Very low	174 Å²	174	133.5 Å²	133.5	76%	0.757	74%	0.74	S	S	*	*			trans	-138.3	134.8	156.6	-64.9	-172.5	179.1	78.9	0	109
43	P	31.3	Very low	31.1	Very low	127 Å²	127	134.5 Å²	134.5	83%	0.825	75%	0.75	S	S	*	*				-152.9	178.5	95.5	40.2	-23.1	0	0	0	117
44	S	22.8	Very low	30	Very low	102 Å²	102	139.5 Å²	139.5	71%	0.713	77%	0.766	S	S	*	*			trans	89.6	82.8	147.7	-126.9	0	0	0	0	120.9
45	T	25.9	Very low	29.1	Very low	121 Å²	121	140.7 Å²	140.7	74%	0.742	78%	0.777	S	S	*	*				22.3	137.2	126.1	55.1	0	0	0	0	122.6
46	S	24.5	Very low	28.3	Very low	117 Å²	117	136.1 Å²	136.1	82%	0.818	77%	0.771	S	S	*	*			trans	80.8	121.4	141.3	75.7	0	0	0	0	120.9
47	A	25.4	Very low	27.6	Very low	95 Å²	95	137 Å²	137	79%	0.785	78%	0.782	S	S	*	*			trans	-167.4	126.6	135.8	0	0	0	0	0	110.5
48	Q	25.7	Very low	27.2	Very low	193 Å²	193	136.4 Å²	136.4	90%	0.902	78%	0.781	S	S	*	*			trans	-107.3	128	157.9	-85.5	-173.9	-31.8	0	0	108.3
49	T	21.6	Very low	27.4	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	78%	0.78	S	S	*	*			trans	-160	125	164.3	19.6	0	0	0	0	111.6
50	K	24.6	Very low	27.6	Very low	218 Å²	218	129.4 Å²	129.4	95%	0.948	77%	0.766	S	S	*	*			trans	-169.3	154.7	135.6	-107.7	171	-175.5	-178.9	0	109.4
51	A	22.9	Very low	27.9	Very low	81 Å²	81	125.7 Å²	125.7	67%	0.669	76%	0.756	S	S	*	*			trans	-133.6	142	-162.9	0	0	0	0	0	112.8
52	T	22.5	Very low	28.4	Very low	134 Å²	134	126.6 Å²	126.6	82%	0.822	76%	0.755	S	S	*	*			trans	60.7	164.6	134.2	56	0	0	0	0	122.5
53	V	25	Very low	28.7	Very low	119 Å²	119	126 Å²	126	72%	0.721	76%	0.755	S	S	*	*			trans	86.4	93.8	-173.7	-172.3	0	0	0	0	111
54	E	26.3	Very low	28.9	Very low	168 Å²	168	123 Å²	123	79%	0.785	74%	0.741	S	S	*	*				72.1	142.9	68.4	-61.8	171.4	162.4	0	0	111.8
55	D	26.4	Very low	29.3	Very low	158 Å²	158	126 Å²	126	85%	0.845	74%	0.741	S	S	*	*			cis	-146.3	177.2	16.5	-153.2	-7.2	0	0	0	112.7
56	G	26.6	Very low	30	Very low	59 Å²	59	124.4 Å²	124.4	61%	0.608	74%	0.741	S	S	*	*			trans	-141.1	157	179.5	0	0	0	0	0	114.9
57	V	27	Very low	30.6	Very low	145 Å²	145	123.9 Å²	123.9	88%	0.879	74%	0.737	S	S	*	*			trans	-124.7	146.7	177.8	-177.7	0	0	0	0	110.6
58	S	31.8	Very low	30.9	Very low	88 Å²	88	125.5 Å²	125.5	62%	0.615	73%	0.731	S	S	*	*			trans	-96.1	159.5	-155.2	59.9	0	0	0	0	115.3	G60	S58-G60 PolarHBondContact O-N 2.96Å
59	P	37.9	Very low	31.2	Very low	105 Å²	105	124 Å²	124	68%	0.682	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	21.4	-169.6	30.3	-37.3	0	0	0	116.1
60	G	37.8	Very low	31.6	Very low	48 Å²	48	121.1 Å²	121.1	50%	0.495	73%	0.726	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.8	-27.9	174.9	0	0	0	0	0	114	S58 Q62 Q63	S58-G60 PolarHBondContact O-N 2.96Å; G60-Q62 PolarHBondContact O-N 3.36Å; G60-Q63 PolarHBondContact O-N 3.22Å
61	V	39.3	Very low	31.9	Very low	108 Å²	108	119.8 Å²	119.8	66%	0.655	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-31.9	-173.1	-174.8	0	0	0	0	112.4	Q63 A64	V61-Q63 VanDerWaalsContact C-N 3.3Å; V61-Q63 PolarHBondContact O-N 2.86Å; V61-A64 PolarHBondContact O-N 3.21Å
62	Q	40	Very low	32.1	Very low	163 Å²	163	122.4 Å²	122.4	76%	0.762	73%	0.731	S	S	*	*	H	α-helix	trans	-70.5	-24	-179.4	-72.1	177.4	-24.3	0	0	113.2	G60 A64	G60-Q62 PolarHBondContact O-N 3.36Å; Q62-A64 VanDerWaalsContact C-N 3.3Å; Q62-A64 PolarHBondContact O-N 3.29Å
63	Q	37.6	Very low	32.2	Very low	162 Å²	162	120.9 Å²	120.9	76%	0.757	73%	0.732	S	S	*	*	H	α-helix	trans	-77	-12.8	177.7	-70.8	-173.4	-30.6	0	0	113.7	G60 V61	G60-Q63 PolarHBondContact O-N 3.22Å; V61-Q63 VanDerWaalsContact C-N 3.3Å; V61-Q63 PolarHBondContact O-N 2.86Å
64	A	34.5	Very low	32.2	Very low	64 Å²	64	120.4 Å²	120.4	53%	0.529	74%	0.74	S	S	.	*	H	α-helix	trans	-76.5	-35.4	179	0	0	0	0	0	113.5	V61 Q62	V61-A64 PolarHBondContact O-N 3.21Å; Q62-A64 VanDerWaalsContact C-N 3.3Å; Q62-A64 PolarHBondContact O-N 3.29Å
65	F	32.3	Very low	32.1	Very low	165 Å²	165	117.3 Å²	117.3	72%	0.724	74%	0.743	S	S	*	*	H	α-helix	trans	-78.1	-23.6	-176	-97.4	-91.4	0	0	0	114.1	S67 I68	F65-S67 PolarHBondContact O-N 3Å; F65-S67 VanDerWaalsContact O-N 3.1Å; F65-I68 PolarHBondContact O-N 3.46Å
66	A	41.3	Very low	32	Very low	88 Å²	88	114 Å²	114	73%	0.727	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-8.3	175.5	0	0	0	0	0	113.8
67	S	35.7	Very low	31.9	Very low	106 Å²	106	116 Å²	116	74%	0.741	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	3.6	-177.1	-169.4	0	0	0	0	114.9	F65	F65-S67 PolarHBondContact O-N 3Å; F65-S67 VanDerWaalsContact O-N 3.1Å
68	I	31.9	Very low	31.7	Very low	129 Å²	129	114 Å²	114	66%	0.662	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-27.1	-171.3	-62.9	178.3	0	0	0	113.2	F65 G70	F65-I68 PolarHBondContact O-N 3.46Å; I68-G70 VanDerWaalsContact C-N 3.35Å; I68-G70 PolarHBondContact O-N 2.8Å; I68-G70 VanDerWaalsContact O-N 3.1Å
69	L	33.1	Very low	31.5	Very low	162 Å²	162	118.9 Å²	118.9	85%	0.848	75%	0.748	S	S	*	*			trans	-87.2	69.9	178.4	-66.2	174.7	0	0	0	111.4	E71	L69-E71 PolarHBondContact O-N 3.19Å
70	G	30	Very low	31	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	76%	0.758	S	S	*	*			trans	-72.5	117.8	-179.6	0	0	0	0	0	113.5	I68	I68-G70 VanDerWaalsContact C-N 3.35Å; I68-G70 PolarHBondContact O-N 2.8Å; I68-G70 VanDerWaalsContact O-N 3.1Å
71	E	30.9	Very low	30.5	Very low	189 Å²	189	130.1 Å²	130.1	88%	0.883	78%	0.779	S	S	*	*			trans	-82	130.1	170.8	-64.1	-172.6	146.4	0	0	111.9	L69	L69-E71 PolarHBondContact O-N 3.19Å
72	T	26.9	Very low	29.9	Very low	137 Å²	137	133 Å²	133	84%	0.84	79%	0.79	S	S	*	*			trans	-139.4	89.5	160	57.9	0	0	0	0	113.1
73	A	24.6	Very low	29.3	Very low	102 Å²	102	130.9 Å²	130.9	84%	0.843	79%	0.794	S	S	*	*			trans	63.6	143.5	132.8	0	0	0	0	0	123.3
74	A	24.8	Very low	28.8	Very low	109 Å²	109	131 Å²	131	90%	0.901	80%	0.799	S	S	*	*			trans	79.9	147.5	154.6	0	0	0	0	0	119.6
75	A	24.9	Very low	28.5	Very low	103 Å²	103	133.1 Å²	133.1	85%	0.851	81%	0.81	S	S	*	*			trans	-143	155.8	-169	0	0	0	0	0	111.6
76	A	24	Very low	28.5	Very low	89 Å²	89	134.8 Å²	134.8	74%	0.736	81%	0.812	S	S	*	*			trans	-159.8	131.9	161.1	0	0	0	0	0	113.2
77	S	23	Very low	28	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	81%	0.81	S	S	*	*			trans	49.1	116.7	141.2	63.6	0	0	0	0	122.9
78	S	23.6	Very low	27.7	Very low	104 Å²	104	137.1 Å²	137.1	73%	0.727	81%	0.808	S	S	*	*				53.2	138.9	128.2	64.2	0	0	0	0	120.6
79	E	26.8	Very low	27.7	Very low	190 Å²	190	135.8 Å²	135.8	89%	0.888	80%	0.803	S	S	*	*				-147.3	-163	54.2	-81	-179.7	164	0	0	113.7
80	E	27.9	Very low	27.7	Very low	189 Å²	189	135.9 Å²	135.9	88%	0.883	80%	0.796	S	S	*	*			trans	-97.2	151.4	-161.7	-52.9	172	142.8	0	0	113.9
81	E	28.6	Very low	28	Very low	200 Å²	200	138.9 Å²	138.9	94%	0.935	79%	0.794	S	S	*	*			trans	-139.1	148.5	154.5	-82.7	-156.6	142.3	0	0	111.2
82	D	26.4	Very low	28.3	Very low	167 Å²	167	133.4 Å²	133.4	89%	0.893	77%	0.771	S	S	*	*			trans	-70.9	140.4	-167.8	-84	-57	0	0	0	115.5	L84	D82-L84 PolarHBondContact O-N 3.27Å
83	S	26.1	Very low	28.7	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	77%	0.771	S	S	*	*			trans	-85.8	106.9	172.2	-173.6	0	0	0	0	111.9
84	L	28	Very low	29.3	Very low	165 Å²	165	138.3 Å²	138.3	86%	0.864	76%	0.762	S	S	*	*			trans	-85.3	111.9	167.4	-80.8	170.6	0	0	0	110.2	D82 Y86	D82-L84 PolarHBondContact O-N 3.27Å; L84-Y86 PolarHBondContact O-N 3.41Å; L84-Y86 VanDerWaalsContact O-N 3.13Å
85	S	28.8	Very low	29.5	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	74%	0.741	S	S	*	*			trans	-67.1	108.8	-177.6	57.3	0	0	0	0	112.4
86	Y	30.6	Very low	29.7	Very low	199 Å²	199	140.7 Å²	140.7	78%	0.78	74%	0.74	S	S	*	*			trans	-70.5	130.8	167.5	-125.5	-97.5	0	0	0	110.2	L84	L84-Y86 PolarHBondContact O-N 3.41Å; L84-Y86 VanDerWaalsContact O-N 3.13Å
87	V	31.8	Very low	29.9	Very low	112 Å²	112	140.8 Å²	140.8	68%	0.679	73%	0.731	S	S	*	*			trans	-86.9	132.5	169.6	-177.8	0	0	0	0	108.3
88	D	28.7	Very low	30.1	Very low	131 Å²	131	144.3 Å²	144.3	70%	0.701	74%	0.737	S	S	*	*			trans	-92.3	101.4	-174.6	-174.8	40.8	0	0	0	111.6
89	D	31.5	Very low	30.2	Very low	102 Å²	102	148.2 Å²	148.2	55%	0.545	74%	0.743	S	S	.	*			trans	-82.5	112.6	174.9	-71	-45.8	0	0	0	110.5	D91 R758	D89-D91 PolarHBondContact O-N 2.83Å; D89-R758 IonicContact OD2-NH2 3.19Å
90	K	33.8	Very low	30.1	Very low	164 Å²	164	148.8 Å²	148.8	71%	0.713	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	7.8	-160.9	-65.8	-176.9	175.6	178.4	0	117.8
91	D	36.5	Very low	30	Very low	136 Å²	136	148.7 Å²	148.7	73%	0.727	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-5.9	-172	-69.1	-5.8	0	0	0	114	D89 R93	D89-D91 PolarHBondContact O-N 2.83Å; D91-R93 VanDerWaalsContact C-N 3.33Å; D91-R93 PolarHBondContact O-N 2.79Å; D91-R93 VanDerWaalsContact O-N 3.1Å
92	D	36.2	Very low	29.9	Very low	75 Å²	75	148.7 Å²	148.7	40%	0.401	75%	0.745	S	S	.	*			trans	-87.1	54.9	-173.8	-124.1	-21.7	0	0	0	111.9	R758 R762	D92-R758 IonicContact OD2-NH1 2.73Å; D92-R758 PolarHBondContact OD2-NH1 3.17Å; D92-R762 VanDerWaalsContact CG-NH2 3.29Å; D92-R762 IonicContact OD1-CZ 3.19Å; D92-R762 IonicContact OD1-NH1 3.66Å; D92-R762 PolarHBondContact OD1-NH1 3.29Å; D92-R762 IonicContact OD1-NH2 3.63Å; D92-R762 IonicContact OD2-CZ 2.81Å; D92-R762 IonicContact OD2-NH1 3.61Å; D92-R762 IonicContact OD2-NH2 3.91Å; D92-R762 PolarHBondContact OD2-NH2 3.06Å
93	R	36.8	Very low	29.9	Very low	222 Å²	222	145.1 Å²	145.1	84%	0.838	74%	0.74	S	S	*	*			trans	-92.9	-7.3	-176	-67.3	-156.2	-163.6	-174.9	9.5	116.9	D91 F95	D91-R93 VanDerWaalsContact C-N 3.33Å; D91-R93 PolarHBondContact O-N 2.79Å; D91-R93 VanDerWaalsContact O-N 3.1Å; R93-F95 VanDerWaalsContact C-N 3.3Å; R93-F95 PolarHBondContact O-N 3.41Å
94	D	36.1	Very low	29.8	Very low	119 Å²	119	149.3 Å²	149.3	64%	0.636	74%	0.743	S	S	*	*			trans	-81.7	50.9	-175.6	-64.5	-6.1	0	0	0	113.7	R728	D94-R728 IonicContact OD2-CZ 2.65Å; D94-R728 IonicContact OD2-NH1 3.47Å; D94-R728 IonicContact OD2-NH2 3.9Å; D94-R728 PolarHBondContact OD2-NH2 3.18Å; D94-R728 VanDerWaalsContact OD2-NH2 3.14Å
95	F	29.7	Very low	29.6	Very low	108 Å²	108	145 Å²	145	47%	0.474	74%	0.738	S	S	.	*			trans	-154.7	65.7	177.8	-139.7	-94.9	0	0	0	116.1	R93 V97	R93-F95 VanDerWaalsContact C-N 3.3Å; R93-F95 PolarHBondContact O-N 3.41Å; F95-V97 HydrophobicContact CE1-CG2 4.23Å
96	N	29.6	Very low	29.4	Very low	155 Å²	155	146.4 Å²	146.4	83%	0.829	74%	0.742	S	S	*	*			trans	-96.7	142.4	149.7	-101	8.3	0	0	0	108.9
97	V	27.5	Very low	29	Very low	90 Å²	90	142.6 Å²	142.6	55%	0.545	74%	0.744	S	S	.	*			trans	-105.7	119.1	166.1	178.1	0	0	0	0	106.5	F95 E99	F95-V97 HydrophobicContact CE1-CG2 4.23Å; V97-E99 HydrophobicContact CG1-CG 4.48Å
98	E	26.7	Very low	28.6	Very low	175 Å²	175	146.7 Å²	146.7	82%	0.818	75%	0.753	S	S	*	*			trans	-92.7	130	165.4	-63.8	-175.4	162.8	0	0	107.4
99	E	26.1	Very low	28.4	Very low	185 Å²	185	149 Å²	149	86%	0.864	76%	0.759	S	S	*	*			trans	-94.1	123	173.9	-66.4	-176.7	141.2	0	0	108.3	V97 E101	V97-E99 HydrophobicContact CG1-CG 4.48Å; E99-E101 PolarHBondContact O-N 3.1Å
100	E	24.6	Very low	28	Very low	202 Å²	202	155.3 Å²	155.3	94%	0.944	78%	0.775	S	S	*	*			trans	-77.2	103.6	179.8	-67	-176.9	136.5	0	0	111.1
101	E	26.5	Very low	27.6	Very low	187 Å²	187	156.3 Å²	156.3	87%	0.874	78%	0.78	S	S	*	*			trans	-97	127	157.2	-77.3	-155.4	144.4	0	0	110.8	E99 A103	E99-E101 PolarHBondContact O-N 3.1Å; E101-A103 PolarHBondContact O-N 3.26Å
102	E	26.4	Very low	27	Very low	200 Å²	200	161.4 Å²	161.4	94%	0.935	79%	0.789	S	S	*	*			trans	-70.3	91.9	-179.2	-69.1	-167.3	140.2	0	0	113.2
103	A	25.5	Very low	26.4	Very low	93 Å²	93	169.9 Å²	169.9	77%	0.769	82%	0.815	S	S	*	*			trans	-93.2	111.6	174	0	0	0	0	0	112.8	E101 G105	E101-A103 PolarHBondContact O-N 3.26Å; A103-G105 PolarHBondContact O-N 3.28Å
104	K	24.9	Very low	25.7	Very low	208 Å²	208	167.7 Å²	167.7	90%	0.904	82%	0.819	S	S	*	*			trans	-68.6	114.5	178.5	-67.8	177.7	179.5	171.8	0	112.2
105	G	23.2	Very low	25.2	Very low	75 Å²	75	173.6 Å²	173.6	77%	0.773	83%	0.832	S	S	*	*			trans	-75.9	128.8	178.3	0	0	0	0	0	114.4	A103	A103-G105 PolarHBondContact O-N 3.28Å
106	V	24.1	Very low	25	Very low	137 Å²	137	178.2 Å²	178.2	83%	0.83	86%	0.856	S	S	*	*			trans	-134.9	102	159	178.8	0	0	0	0	108.3
107	S	22.6	Very low	24.7	Very low	118 Å²	118	174.8 Å²	174.8	83%	0.825	86%	0.857	S	S	*	*			trans	-83.8	120.7	-176.6	48.8	0	0	0	0	112.3
108	K	23.4	Very low	24.5	Very low	198 Å²	198	174.4 Å²	174.4	86%	0.861	87%	0.871	S	S	*	*			trans	-129.7	90.3	160.8	-87.4	-172.7	174	176.4	0	109.7
109	E	24.4	Very low	24.5	Very low	179 Å²	179	175.8 Å²	175.8	84%	0.836	88%	0.875	S	S	*	*			trans	-70.1	134.2	177.8	-159.9	-163.8	159.9	0	0	111
110	R	24.4	Very low	24.4	Very low	235 Å²	235	179.3 Å²	179.3	89%	0.887	88%	0.88	S	S	*	*			trans	-132.1	96.1	180	-161.3	176.7	-169.1	-176.4	4.6	111.3	R112	R110-R112 PolarHBondContact O-N 3.49Å
111	K	23.7	Very low	24.4	Very low	185 Å²	185	172.6 Å²	172.6	80%	0.804	87%	0.865	S	S	*	*			trans	-49.2	125.8	179.5	-70.6	170.8	178.6	167.1	0	112.4
112	R	23.8	Very low	24.3	Very low	244 Å²	244	171.8 Å²	171.8	92%	0.921	87%	0.866	S	S	*	*			trans	-127.8	110.9	159.9	-88.9	-175.3	164	179.7	-4.1	109	R110	R110-R112 PolarHBondContact O-N 3.49Å
113	R	25	Very low	24.4	Very low	253 Å²	253	170.1 Å²	170.1	96%	0.955	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-91.2	133	166.1	-77.5	-177.2	169.9	177.7	-3.6	109.1
114	L	22.7	Very low	24.5	Very low	175 Å²	175	168.6 Å²	168.6	92%	0.916	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-96.6	144.8	168	-90.7	160.2	0	0	0	110.3
115	R	24.3	Very low	24.4	Very low	243 Å²	243	168.4 Å²	168.4	92%	0.917	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-98.6	142.9	170.9	-84	172.5	144.6	-178.3	-5.8	109.5
116	Q	24.8	Very low	24.6	Very low	206 Å²	206	169.6 Å²	169.6	96%	0.963	83%	0.826	S	S	*	*			trans	-153.7	164.7	140.7	-107.3	175.3	25.5	0	0	108.6
117	G	23.3	Very low	24.8	Very low	82 Å²	82	169.7 Å²	169.7	85%	0.845	82%	0.818	S	S	*	*			trans	-158	172.2	-174.9	0	0	0	0	0	113.2
118	G	23.3	Very low	25.1	Very low	83 Å²	83	171.9 Å²	171.9	86%	0.856	82%	0.815	S	S	*	*			trans	-144.6	142.9	-175.3	0	0	0	0	0	113.1
119	K	27.1	Very low	25.1	Very low	204 Å²	204	170.8 Å²	170.8	89%	0.887	81%	0.813	S	S	*	*			trans	-92.2	154.3	-170.9	-59	172.6	176.1	178.5	0	113.7
120	R	24.6	Very low	25.2	Very low	258 Å²	258	171 Å²	171	97%	0.974	81%	0.814	S	S	*	*			trans	157.8	139.6	133	-86.1	157	-178.6	-168.9	0.9	110.6
121	G	24.4	Very low	25.3	Very low	61 Å²	61	168.7 Å²	168.7	63%	0.629	81%	0.813	S	S	*	*			cis	156.3	146.8	-17.1	0	0	0	0	0	115.3
122	L	25.2	Very low	25.6	Very low	170 Å²	170	169 Å²	169	89%	0.89	82%	0.817	S	S	*	*			trans	69.4	160	160.4	-74.8	81.6	0	0	0	118.6
123	K	27	Very low	25.7	Very low	165 Å²	165	166.8 Å²	166.8	72%	0.717	82%	0.818	S	S	*	*			cis	-170.9	175.6	-26.4	-116.1	-152.1	151.1	-128.5	0	106.2
124	S	27.5	Very low	25.7	Very low	61 Å²	61	164.2 Å²	164.2	43%	0.427	82%	0.816	S	S	.	*				-177.4	139.6	-51.5	61.9	0	0	0	0	109.6
125	K	23.4	Very low	25.9	Very low	205 Å²	205	162.9 Å²	162.9	89%	0.891	81%	0.81	S	S	*	*			trans	-143.9	126.3	156.6	-82.7	-168	172	-168.4	0	107.9
126	L	27.2	Very low	26.3	Very low	99 Å²	99	159.4 Å²	159.4	52%	0.518	81%	0.806	S	S	.	*			cis	78.5	135.4	29.4	-48.2	-176.1	0	0	0	113
127	E	29.1	Very low	26.9	Very low	139 Å²	139	153.2 Å²	153.2	65%	0.65	78%	0.783	S	S	*	*			cis	-157.9	-157.3	1.2	-127.9	148.3	-168	0	0	113.2
128	E	27.8	Very low	27.5	Very low	164 Å²	164	154.3 Å²	154.3	77%	0.766	77%	0.773	S	S	*	*			trans	85	131.8	167.6	-52.9	111.1	-106.1	0	0	116.3
129	E	24.2	Very low	28.2	Very low	175 Å²	175	152.7 Å²	152.7	82%	0.818	76%	0.756	S	S	*	*			cis	-155.8	155.2	-18.7	-75.5	171.6	139.2	0	0	105.2
130	E	26.2	Very low	28.9	Very low	183 Å²	183	147.4 Å²	147.4	86%	0.855	74%	0.738	S	S	*	*			cis	84.4	127.8	22.9	-59.8	175.4	143.6	0	0	113.5
131	E	26.1	Very low	29.5	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.874	72%	0.718	S	S	*	*			cis	-138.7	139.1	11.3	-55.6	170.9	123	0	0	110.7
132	E	30.8	Very low	30	Very low	192 Å²	192	142.8 Å²	142.8	90%	0.897	72%	0.715	S	S	*	*				76.3	130.1	94.9	-61	-158.5	163.9	0	0	122.1
133	E	24.7	Very low	30.7	Very low	198 Å²	198	140.9 Å²	140.9	93%	0.925	70%	0.7	S	S	*	*			trans	-167.8	170.9	138.4	-123.2	-180	-147.8	0	0	112.6
134	E	26.7	Very low	31.4	Very low	198 Å²	198	139.2 Å²	139.2	93%	0.925	70%	0.698	S	S	*	*			trans	-80.2	170.4	-142.3	-60.9	-173.4	138.8	0	0	122.2
135	D	26.8	Very low	32	Very low	147 Å²	147	141.4 Å²	141.4	79%	0.786	70%	0.701	S	S	*	*			trans	-60.3	148.7	-165.8	-92.6	-41.3	0	0	0	120.5
136	M	31.8	Very low	32.9	Very low	170 Å²	170	137 Å²	137	84%	0.837	69%	0.685	S	S	*	*			trans	-127.2	117.1	144.8	-94.7	-74.7	-67.4	0	0	108.2
137	T	37.3	Very low	33.5	Very low	76 Å²	76	138 Å²	138	47%	0.466	69%	0.687	S	S	.	*			trans	-73.7	140.9	-162.9	85.4	0	0	0	0	114.4	G139 D140	T137-G139 PolarHBondContact O-N 3.23Å; T137-G139 VanDerWaalsContact O-N 3.07Å; T137-D140 PolarHBondContact O-N 3.32Å
138	V	36.1	Very low	34.1	Very low	106 Å²	106	136.8 Å²	136.8	64%	0.642	68%	0.684	S	S	*	*	H	α-helix	trans	-57.8	-25.3	-177.9	-179.5	0	0	0	0	113.2	D140 F142	V138-D140 PolarHBondContact O-N 2.98Å; V138-F142 HydrophobicContact CG1-CD2 3.81Å; V138-F142 HydrophobicContact CG1-CE2 3.79Å
139	G	38.4	Very low	34.8	Very low	49 Å²	49	132.9 Å²	132.9	51%	0.505	67%	0.669	S	S	.	*	H	α-helix	trans	-64.1	-32.8	-176.3	0	0	0	0	0	114.9	T137 K143	T137-G139 PolarHBondContact O-N 3.23Å; T137-G139 VanDerWaalsContact O-N 3.07Å; G139-K143 PolarHBondContact O-N 3.36Å
140	D	40.7	Very low	35.7	Very low	93 Å²	93	132.1 Å²	132.1	50%	0.497	66%	0.659	S	S	.	*	H	α-helix	trans	-80.5	-29.9	-176.1	-67.9	-53.4	0	0	0	112.7	T137 V138 K143 L144	T137-D140 PolarHBondContact O-N 3.32Å; V138-D140 PolarHBondContact O-N 2.98Å; D140-K143 WeakPolarHBondContact O-CB 3.4Å; D140-K143 PolarHBondContact O-N 2.88Å; D140-L144 PolarHBondContact O-N 3.22Å
141	V	38.8	Very low	36.3	Very low	91 Å²	91	129.2 Å²	129.2	55%	0.552	65%	0.645	S	S	*	*	H	α-helix	trans	-64.4	-49.2	174.4	-178.2	0	0	0	0	110.6	K143 L144 E145	V141-K143 PolarHBondContact O-N 3.44Å; V141-K143 VanDerWaalsContact O-N 3.14Å; V141-L144 PolarHBondContact O-N 3.4Å; V141-E145 PolarHBondContact O-N 3.41Å
142	F	34.2	Very low	37.2	Very low	130 Å²	130	124.3 Å²	124.3	57%	0.57	63%	0.625	S	S	*	*	H	α-helix	trans	-58.8	-26.8	176.9	-92.2	-89.9	0	0	0	113.2	V138 M146	V138-F142 HydrophobicContact CG1-CD2 3.81Å; V138-F142 HydrophobicContact CG1-CE2 3.79Å; F142-M146 WeakPolarHBondContact O-CB 3.3Å; F142-M146 PolarHBondContact O-N 3.18Å
143	K	40.1	Very low	37.8	Very low	131 Å²	131	124.8 Å²	124.8	57%	0.57	62%	0.618	S	S	*	*	H	α-helix	trans	-74.9	-45.7	-179.1	-155.5	175.7	-176	-178.1	0	112.1	G139 D140 V141 E145 M146 E147	G139-K143 PolarHBondContact O-N 3.36Å; D140-K143 WeakPolarHBondContact O-CB 3.4Å; D140-K143 PolarHBondContact O-N 2.88Å; V141-K143 PolarHBondContact O-N 3.44Å; V141-K143 VanDerWaalsContact O-N 3.14Å; K143-E145 VanDerWaalsContact C-N 3.32Å; K143-M146 PolarHBondContact O-N 3.03Å; K143-E147 PolarHBondContact O-N 3.08Å
144	L	42.3	Very low	38.6	Very low	130 Å²	130	124.2 Å²	124.2	68%	0.681	61%	0.608	S	S	*	*	H	α-helix	trans	-61.4	-41.7	170.6	-94.4	80.6	0	0	0	111.4	D140 V141 M146 E147 L148	D140-L144 PolarHBondContact O-N 3.22Å; V141-L144 PolarHBondContact O-N 3.4Å; L144-M146 PolarHBondContact O-N 3.1Å; L144-E147 PolarHBondContact O-N 3Å; L144-L148 PolarHBondContact O-N 2.95Å
145	E	38.8	Very low	39.4	Very low	107 Å²	107	121.4 Å²	121.4	50%	0.5	60%	0.598	S	S	.	*	H	α-helix	trans	-66.2	-35.8	-178.4	-170.3	168.2	-165.5	0	0	112.6	V141 K143 N149	V141-E145 PolarHBondContact O-N 3.41Å; K143-E145 VanDerWaalsContact C-N 3.32Å; E145-N149 WeakPolarHBondContact O-CB 3.46Å; E145-N149 PolarHBondContact O-N 3.39Å; E145-N149 PolarHBondContact O-ND2 2.89Å
146	M	43.2	Very low	40	Very low	112 Å²	112	121.2 Å²	121.2	55%	0.552	59%	0.594	S	S	*	*	H	α-helix	trans	-66.7	-36.3	171.1	-86.8	-159.6	72.2	0	0	113.6	F142 K143 L144 R150	F142-M146 WeakPolarHBondContact O-CB 3.3Å; F142-M146 PolarHBondContact O-N 3.18Å; K143-M146 PolarHBondContact O-N 3.03Å; L144-M146 PolarHBondContact O-N 3.1Å; M146-R150 WeakPolarHBondContact O-CG 3.48Å; M146-R150 PolarHBondContact O-N 2.9Å; M146-R150 VanDerWaalsContact O-N 3.17Å
147	E	39.8	Very low	40.4	Very low	119 Å²	119	121.4 Å²	121.4	56%	0.556	59%	0.591	S	S	*	*	H	α-helix	trans	-73.2	-45.1	-179.2	-72.8	-179.7	173.7	0	0	111.2	K143 L144 N149 R150 E151	K143-E147 PolarHBondContact O-N 3.08Å; L144-E147 PolarHBondContact O-N 3Å; E147-N149 VanDerWaalsContact C-N 3.34Å; E147-N149 PolarHBondContact O-N 2.8Å; E147-R150 WeakPolarHBondContact O-CB 3.3Å; E147-R150 PolarHBondContact O-N 3.16Å; E147-R150 VanDerWaalsContact O-N 3.07Å; E147-E151 PolarHBondContact O-N 3.19Å
148	L	42.2	Very low	40.1	Very low	114 Å²	114	120.4 Å²	120.4	60%	0.597	60%	0.595	S	S	*	*	H	α-helix	trans	-60	-41.9	175.7	-164.2	71.4	0	0	0	112.1	L144 R150 E151 N152	L144-L148 PolarHBondContact O-N 2.95Å; L148-R150 VanDerWaalsContact C-N 3.32Å; L148-R150 PolarHBondContact O-N 3.33Å; L148-E151 PolarHBondContact O-N 3.04Å; L148-N152 PolarHBondContact O-N 3.48Å; L148-N152 VanDerWaalsContact O-N 3.16Å; L148-N152 PolarHBondContact O-ND2 2.96Å
149	N	41.6	Very low	40.1	Very low	82 Å²	82	127.2 Å²	127.2	44%	0.439	61%	0.609	S	S	.	*	H	α-helix	trans	-68.2	-27.3	175.9	-82.4	-60.7	0	0	0	113.6	E145 E147 R153	E145-N149 WeakPolarHBondContact O-CB 3.46Å; E145-N149 PolarHBondContact O-N 3.39Å; E145-N149 PolarHBondContact O-ND2 2.89Å; E147-N149 VanDerWaalsContact C-N 3.34Å; E147-N149 PolarHBondContact O-N 2.8Å; N149-R153 WeakPolarHBondContact O-CG 3.26Å; N149-R153 PolarHBondContact O-N 3.39Å; N149-R153 VanDerWaalsContact O-N 3.11Å
150	R	44.1	Very low	40.8	Very low	160 Å²	160	136 Å²	136	60%	0.604	63%	0.627	S	S	*	*	H	α-helix	trans	-71.8	-33.8	174	-86.6	175.8	162.7	170.4	-3.4	112.9	M146 E147 L148 R154	M146-R150 WeakPolarHBondContact O-CG 3.48Å; M146-R150 PolarHBondContact O-N 2.9Å; M146-R150 VanDerWaalsContact O-N 3.17Å; E147-R150 WeakPolarHBondContact O-CB 3.3Å; E147-R150 PolarHBondContact O-N 3.16Å; E147-R150 VanDerWaalsContact O-N 3.07Å; L148-R150 VanDerWaalsContact C-N 3.32Å; L148-R150 PolarHBondContact O-N 3.33Å; R150-R154 WeakPolarHBondContact O-CG 3.48Å; R150-R154 PolarHBondContact O-N 3.34Å
151	E	38.9	Very low	40.6	Very low	121 Å²	121	140.5 Å²	140.5	57%	0.565	65%	0.645	S	S	*	*	H	α-helix	trans	-72.3	-42.9	174.4	-60.3	-152.4	125.8	0	0	111.7	E147 L148 R153 R154 L155	E147-E151 PolarHBondContact O-N 3.19Å; L148-E151 PolarHBondContact O-N 3.04Å; E151-R153 VanDerWaalsContact C-N 3.32Å; E151-R153 PolarHBondContact O-N 2.87Å; E151-R154 WeakPolarHBondContact O-CB 3.38Å; E151-R154 PolarHBondContact O-N 2.94Å; E151-L155 PolarHBondContact O-N 3.07Å
152	N	43.5	Very low	40.9	Very low	85 Å²	85	139.3 Å²	139.3	46%	0.455	65%	0.651	S	S	.	*	H	α-helix	trans	-56.4	-43.4	173.3	-73.5	-25	0	0	0	112.4	L148 R154 L155 M156	L148-N152 PolarHBondContact O-N 3.48Å; L148-N152 VanDerWaalsContact O-N 3.16Å; L148-N152 PolarHBondContact O-ND2 2.96Å; N152-R154 VanDerWaalsContact C-N 3.27Å; N152-R154 PolarHBondContact O-N 3.07Å; N152-L155 PolarHBondContact O-N 3.37Å; N152-M156 WeakPolarHBondContact O-CG 3.01Å; N152-M156 PolarHBondContact O-N 3.02Å
153	R	44	Very low	41.6	Very low	202 Å²	202	135 Å²	135	76%	0.762	64%	0.637	S	S	*	*	H	α-helix	trans	-65	-23.7	175.2	-77.3	-174.1	177.9	-149.6	-0.3	114.2	N149 E151	N149-R153 WeakPolarHBondContact O-CG 3.26Å; N149-R153 PolarHBondContact O-N 3.39Å; N149-R153 VanDerWaalsContact O-N 3.11Å; E151-R153 VanDerWaalsContact C-N 3.32Å; E151-R153 PolarHBondContact O-N 2.87Å
154	R	41.3	Very low	42.5	Very low	186 Å²	186	137 Å²	137	70%	0.702	65%	0.646	S	S	*	*	H	α-helix	trans	-76.3	-39	175.6	-75.9	171.5	170.4	164.5	-2.7	112.1	R150 E151 N152 M156 K157	R150-R154 WeakPolarHBondContact O-CG 3.48Å; R150-R154 PolarHBondContact O-N 3.34Å; E151-R154 WeakPolarHBondContact O-CB 3.38Å; E151-R154 PolarHBondContact O-N 2.94Å; N152-R154 VanDerWaalsContact C-N 3.27Å; N152-R154 PolarHBondContact O-N 3.07Å; R154-M156 VanDerWaalsContact C-N 3.26Å; R154-M156 PolarHBondContact O-N 3.09Å; R154-K157 PolarHBondContact O-N 3.3Å
155	L	43.1	Very low	43.7	Very low	138 Å²	138	131.1 Å²	131.1	72%	0.723	62%	0.615	S	S	*	*	H	α-helix	trans	-62.5	-33.8	176.4	-67.1	169.3	0	0	0	112.2	E151 N152 K157 G158	E151-L155 PolarHBondContact O-N 3.07Å; N152-L155 PolarHBondContact O-N 3.37Å; L155-K157 PolarHBondContact O-N 2.9Å; L155-G158 PolarHBondContact O-N 3.4Å
156	M	40	Very low	45.5	Very low	144 Å²	144	129.4 Å²	129.4	71%	0.709	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-8.9	179.3	-66.9	-69	-95.7	0	0	115.2	N152 R154 G158	N152-M156 WeakPolarHBondContact O-CG 3.01Å; N152-M156 PolarHBondContact O-N 3.02Å; R154-M156 VanDerWaalsContact C-N 3.26Å; R154-M156 PolarHBondContact O-N 3.09Å; M156-G158 VanDerWaalsContact C-N 3.33Å
157	K	39.5	Very low	46.8	Very low	174 Å²	174	132.5 Å²	132.5	76%	0.757	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	12.4	175.6	-65.9	-160.8	173.8	-166.1	0	114.1	R154 L155	R154-K157 PolarHBondContact O-N 3.3Å; L155-K157 PolarHBondContact O-N 2.9Å
158	G	31.8	Very low	48.3	Very low	54 Å²	54	131.1 Å²	131.1	56%	0.557	64%	0.635	S	S	*	*	S	Bend	trans	-71.8	146.8	169.6	0	0	0	0	0	113.5	L155 M156 R160	L155-G158 PolarHBondContact O-N 3.4Å; M156-G158 VanDerWaalsContact C-N 3.33Å; G158-R160 PolarHBondContact O-N 3.27Å
159	R	36.3	Very low	50.1	Low	249 Å²	249	126.3 Å²	126.3	94%	0.94	61%	0.61	S	S	*	*			trans	-55.8	129	-178.2	-74.4	176.3	168.9	166.3	-5.4	112.6	H161	R159-H161 PolarHBondContact O-N 2.71Å
160	R	52.2	Low	51.8	Low	233 Å²	233	128.4 Å²	128.4	88%	0.879	61%	0.611	S	S	*	*			trans	-67	109.4	171.7	-69.4	-178	-179.4	158.6	2.4	111.5	G158	G158-R160 PolarHBondContact O-N 3.27Å
161	H	36.7	Very low	53.6	Low	188 Å²	188	123 Å²	123	87%	0.87	61%	0.606	S	S	*	*			trans	-136.7	153.2	155.8	-94.9	18.4	0	0	0	107.7	R159	R159-H161 PolarHBondContact O-N 2.71Å
162	G	45.4	Very low	55.8	Low	66 Å²	66	120.1 Å²	120.1	68%	0.68	59%	0.594	S	S	*	*			trans	-53.9	154.9	-160.1	0	0	0	0	0	116.3	K164	G162-K164 PolarHBondContact O-N 3.16Å; G162-K164 VanDerWaalsContact O-N 3.11Å
163	S	50.1	Low	57.8	Low	39 Å²	39	116.6 Å²	116.6	27%	0.273	58%	0.575	S	S	.	*			trans	-53.8	118.9	-179.1	50.1	0	0	0	0	110.6	Y203 E204	S163-Y203 WeakPolarHBondContact OG-CD1 3.36Å; S163-E204 PolarHBondContact OG-OE2 2.8Å
164	K	57.3	Low	59.7	Low	175 Å²	175	108.5 Å²	108.5	76%	0.761	55%	0.554	S	S	*	*			trans	-107.9	92.9	161.2	-79.3	179.4	-179.8	175.3	0	105.6	G162	G162-K164 PolarHBondContact O-N 3.16Å; G162-K164 VanDerWaalsContact O-N 3.11Å
165	L	69	Low	61.8	Low	6 Å²	6	103.6 Å²	103.6	3%	0.031	54%	0.539	C	S	.	.			trans	-37.8	125.8	172.2	-87.3	167.6	0	0	0	110.3	L169 R170 M173 I195 A202 E204	L165-L169 HydrophobicContact CD2-CB 4.03Å; L165-R170 HydrophobicContact CB-CB 4.19Å; L165-R170 PolarHBondContact O-NE 3.08Å; L165-R170 PolarHBondContact O-NH2 3.49Å; L165-M173 HydrophobicContact CD1-CB 3.81Å; L165-M173 HydrophobicContact CD1-CG 3.69Å; L165-M173 HydrophobicContact CD1-SD 4.29Å; L165-I195 HydrophobicContact CD2-CG2 3.79Å; L165-A202 HydrophobicContact CD2-CB 3.6Å; L165-A202 HydrophobicContact CG-CB 3.99Å; L165-E204 HydrophobicContact CD1-CB 3.92Å; L165-E204 HydrophobicContact CD1-CG 4.13Å; L165-E204 WeakPolarHBondContact CD1-OE1 3.45Å; L165-E204 VanDerWaalsContact CG-OE1 3.29Å; L165-E204 WeakPolarHBondContact CG-OE1 3.36Å
166	P	75.3	Confident	63.9	Low	70 Å²	70	97 Å²	97	46%	0.455	50%	0.504	S	S	.	.			trans	-49.4	144.4	176.4	-29.6	35.5	0	0	0	110.9	A168 L169 R170	P166-A168 PolarHBondContact O-N 2.91Å; P166-L169 HydrophobicContact CG-CD1 4.25Å; P166-L169 CarbonylContact O-C 3.58Å; P166-L169 WeakPolarHBondContact O-CA 3.29Å; P166-L169 PolarHBondContact O-N 3.21Å; P166-R170 PolarHBondContact O-N 2.94Å
167	Q	71.8	Confident	66.2	Low	177 Å²	177	93.3 Å²	93.3	83%	0.827	49%	0.487	S	S	*	.	H	α-helix	trans	-62	-25.9	-162.7	-167.1	159.3	-11.2	0	0	114.5	G171	Q167-G171 PolarHBondContact O-N 3.49Å
168	A	71.1	Confident	68.5	Low	90 Å²	90	89.4 Å²	89.4	74%	0.744	47%	0.474	S	S	*	.	H	α-helix	trans	-69	-50.6	168.9	0	0	0	0	0	112.8	P166 R170 G171 L172	P166-A168 PolarHBondContact O-N 2.91Å; A168-R170 VanDerWaalsContact C-N 3.27Å; A168-R170 PolarHBondContact O-N 2.94Å; A168-G171 WeakPolarHBondContact O-CA 3.43Å; A168-G171 PolarHBondContact O-N 2.87Å; A168-L172 PolarHBondContact O-N 3.38Å
169	L	78.9	Confident	71.1	Confident	13 Å²	13	89.4 Å²	89.4	7%	0.068	46%	0.457	C	S	.	.	H	α-helix	trans	-63.9	-29.8	177	-73.6	176.1	0	0	0	112.9	L165 P166 G171 L172 M173 I195 Q198	L165-L169 HydrophobicContact CD2-CB 4.03Å; P166-L169 HydrophobicContact CG-CD1 4.25Å; P166-L169 CarbonylContact O-C 3.58Å; P166-L169 WeakPolarHBondContact O-CA 3.29Å; P166-L169 PolarHBondContact O-N 3.21Å; L169-G171 VanDerWaalsContact C-N 3.3Å; L169-G171 PolarHBondContact O-N 3.34Å; L169-L172 PolarHBondContact O-N 3.37Å; L169-M173 WeakPolarHBondContact O-CB 3.26Å; L169-M173 PolarHBondContact O-N 3.2Å; L169-I195 HydrophobicContact CD2-CB 4.49Å; L169-I195 HydrophobicContact CD2-CG1 4.2Å; L169-I195 HydrophobicContact CD2-CG2 4.4Å; L169-Q198 HydrophobicContact CD1-CB 3.96Å; L169-Q198 HydrophobicContact CD2-CB 4.12Å
170	R	78.4	Confident	73.6	Confident	127 Å²	127	79.5 Å²	79.5	48%	0.479	42%	0.42	S	S	.	.	H	α-helix	trans	-64.3	-34.3	171.7	-169.7	-176.2	-55.3	-122.1	-10.9	112.4	L165 P166 A168 G174	L165-R170 HydrophobicContact CB-CB 4.19Å; L165-R170 PolarHBondContact O-NE 3.08Å; L165-R170 PolarHBondContact O-NH2 3.49Å; P166-R170 PolarHBondContact O-N 2.94Å; A168-R170 VanDerWaalsContact C-N 3.27Å; A168-R170 PolarHBondContact O-N 2.94Å; R170-G174 PolarHBondContact O-N 3.08Å
171	G	82.1	Confident	75.3	Confident	47 Å²	47	72.6 Å²	72.6	49%	0.485	41%	0.413	S	S	.	.	H	α-helix	trans	-64.6	-47.2	170.9	0	0	0	0	0	111.4	Q167 A168 L169 M173 G174 E175	Q167-G171 PolarHBondContact O-N 3.49Å; A168-G171 WeakPolarHBondContact O-CA 3.43Å; A168-G171 PolarHBondContact O-N 2.87Å; L169-G171 VanDerWaalsContact C-N 3.3Å; L169-G171 PolarHBondContact O-N 3.34Å; G171-M173 PolarHBondContact O-N 3.24Å; G171-G174 PolarHBondContact O-N 3.17Å; G171-E175 PolarHBondContact O-N 3.22Å
172	L	84.3	Confident	77.8	Confident	60 Å²	60	71.4 Å²	71.4	31%	0.314	40%	0.4	S	S	.	.	H	α-helix	trans	-62.3	-40.7	177.5	-144.7	80.5	0	0	0	112.4	A168 L169 G174 E175 A176 I195	A168-L172 PolarHBondContact O-N 3.38Å; L169-L172 PolarHBondContact O-N 3.37Å; L172-G174 VanDerWaalsContact C-N 3.33Å; L172-E175 PolarHBondContact O-N 3.41Å; L172-A176 PolarHBondContact O-N 3.31Å; L172-I195 HydrophobicContact CB-CD1 4.25Å; L172-I195 HydrophobicContact CB-CG1 4.28Å; L172-I195 HydrophobicContact CD2-CD1 4.44Å; L172-I195 HydrophobicContact CD2-CG1 3.86Å
173	M	85.3	Confident	79.6	Confident	11 Å²	11	70.8 Å²	70.8	5%	0.054	39%	0.394	C	S	.	.	H	α-helix	trans	-63.7	-38.7	174.6	-168.7	69.9	-150.7	0	0	111.8	L165 L169 G171 A176 N177 I195 E204 P205 T208	L165-M173 HydrophobicContact CD1-CB 3.81Å; L165-M173 HydrophobicContact CD1-CG 3.69Å; L165-M173 HydrophobicContact CD1-SD 4.29Å; L169-M173 WeakPolarHBondContact O-CB 3.26Å; L169-M173 PolarHBondContact O-N 3.2Å; G171-M173 PolarHBondContact O-N 3.24Å; M173-A176 PolarHBondContact O-N 3.28Å; M173-N177 WeakPolarHBondContact CE-OD1 3.32Å; M173-N177 PolarHBondContact O-N 3.28Å; M173-I195 HydrophobicContact CB-CD1 3.92Å; M173-I195 HydrophobicContact CG-CD1 4.47Å; M173-I195 HydrophobicContact SD-CD1 3.7Å; M173-E204 VanDerWaalsContact CE-C 3.49Å; M173-E204 HydrophobicContact CE-CB 4.15Å; M173-E204 VanDerWaalsContact CE-O 3.28Å; M173-E204 WeakPolarHBondContact CE-O 3.21Å; M173-E204 HydrophobicContact CG-CB 4.45Å; M173-E204 HydrophobicContact SD-CB 4.26Å; M173-P205 HydrophobicContact SD-CB 3.98Å; M173-T208 HydrophobicContact CE-CG2 4.43Å; M173-T208 WeakPolarHBondContact CE-OG1 3.49Å
174	G	84.1	Confident	81.5	Confident	31 Å²	31	72 Å²	72	32%	0.32	40%	0.396	S	S	.	.	H	α-helix	trans	-62.6	-42.7	172.5	0	0	0	0	0	112.3	R170 G171 L172 I178	R170-G174 PolarHBondContact O-N 3.08Å; G171-G174 PolarHBondContact O-N 3.17Å; L172-G174 VanDerWaalsContact C-N 3.33Å; G174-I178 WeakPolarHBondContact O-CB 3.48Å; G174-I178 WeakPolarHBondContact O-CD1 3.43Å; G174-I178 VanDerWaalsContact O-CG1 3.23Å; G174-I178 WeakPolarHBondContact O-CG1 3.31Å; G174-I178 PolarHBondContact O-N 3.29Å; G174-I178 VanDerWaalsContact O-N 3.07Å
175	E	85.9	Confident	82.9	Confident	83 Å²	83	65.8 Å²	65.8	39%	0.388	37%	0.368	S	S	.	.	H	α-helix	trans	-65	-47.1	173.8	-173.1	170.8	171.7	0	0	111.5	G171 L172 N177 I178 R179 M191	G171-E175 PolarHBondContact O-N 3.22Å; L172-E175 PolarHBondContact O-N 3.41Å; E175-N177 VanDerWaalsContact C-N 3.32Å; E175-N177 PolarHBondContact O-N 3.49Å; E175-I178 CarbonylContact O-C 3.6Å; E175-I178 PolarHBondContact O-N 3.16Å; E175-R179 HydrophobicContact CG-CG 3.88Å; E175-R179 WeakPolarHBondContact O-CB 3.43Å; E175-R179 WeakPolarHBondContact O-CG 3.24Å; E175-R179 PolarHBondContact O-N 3Å; E175-R179 IonicContact OE1-CZ 2.98Å; E175-R179 IonicContact OE1-NE 3.86Å; E175-R179 PolarHBondContact OE1-NE 3.43Å; E175-R179 IonicContact OE1-NH2 3.6Å; E175-R179 PolarHBondContact OE1-NH2 3.11Å; E175-M191 HydrophobicContact CB-SD 4.38Å; E175-M191 HydrophobicContact CG-SD 4.03Å
176	A	86.8	Confident	83.7	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-54.6	-45.6	178.2	0	0	0	0	0	112.4	L172 M173 R179 Y180 M191	L172-A176 PolarHBondContact O-N 3.31Å; M173-A176 PolarHBondContact O-N 3.28Å; A176-R179 PolarHBondContact O-N 2.96Å; A176-Y180 WeakPolarHBondContact O-CB 3.44Å; A176-Y180 PolarHBondContact O-N 3.2Å; A176-M191 HydrophobicContact CB-CB 3.85Å
177	N	87.5	Confident	84.3	Confident	66 Å²	66	73.1 Å²	73.1	35%	0.353	40%	0.399	S	S	.	.	H	α-helix	trans	-66.5	-38.2	176.2	-74.8	-6.6	0	0	0	112.8	M173 E175 R179 A181 T208	M173-N177 WeakPolarHBondContact CE-OD1 3.32Å; M173-N177 PolarHBondContact O-N 3.28Å; E175-N177 VanDerWaalsContact C-N 3.32Å; E175-N177 PolarHBondContact O-N 3.49Å; N177-R179 VanDerWaalsContact C-N 3.32Å; N177-A181 WeakPolarHBondContact O-CB 3.31Å; N177-A181 PolarHBondContact O-N 3.29Å; N177-T208 VanDerWaalsContact OD1-CG2 3.27Å; N177-T208 WeakPolarHBondContact OD1-CG2 3.22Å; N177-T208 PolarHBondContact OD1-OG1 3.01Å
178	I	87.6	Confident	85	Confident	92 Å²	92	64.7 Å²	64.7	47%	0.472	36%	0.36	S	S	.	.	H	α-helix	trans	-66.2	-35.4	174.9	-72.4	166.1	0	0	0	111.4	G174 E175 R182	G174-I178 WeakPolarHBondContact O-CB 3.48Å; G174-I178 WeakPolarHBondContact O-CD1 3.43Å; G174-I178 VanDerWaalsContact O-CG1 3.23Å; G174-I178 WeakPolarHBondContact O-CG1 3.31Å; G174-I178 PolarHBondContact O-N 3.29Å; G174-I178 VanDerWaalsContact O-N 3.07Å; E175-I178 CarbonylContact O-C 3.6Å; E175-I178 PolarHBondContact O-N 3.16Å; I178-R182 VanDerWaalsContact O-CG 3.31Å; I178-R182 WeakPolarHBondContact O-CG 3.22Å; I178-R182 PolarHBondContact O-N 2.78Å
179	R	86.8	Confident	85.8	Confident	54 Å²	54	61.9 Å²	61.9	20%	0.204	33%	0.331	C	S	.	.	H	α-helix	trans	-72.8	-44.8	179.3	-66.9	-83.8	-158.5	129	23.7	111.2	E175 A176 N177 A181 R182 G183 E184 D187 A188 M191	E175-R179 HydrophobicContact CG-CG 3.88Å; E175-R179 WeakPolarHBondContact O-CB 3.43Å; E175-R179 WeakPolarHBondContact O-CG 3.24Å; E175-R179 PolarHBondContact O-N 3Å; E175-R179 IonicContact OE1-CZ 2.98Å; E175-R179 IonicContact OE1-NE 3.86Å; E175-R179 PolarHBondContact OE1-NE 3.43Å; E175-R179 IonicContact OE1-NH2 3.6Å; E175-R179 PolarHBondContact OE1-NH2 3.11Å; A176-R179 PolarHBondContact O-N 2.96Å; N177-R179 VanDerWaalsContact C-N 3.32Å; R179-A181 VanDerWaalsContact C-N 3.33Å; R179-A181 PolarHBondContact O-N 3.1Å; R179-R182 WeakPolarHBondContact O-CB 3.39Å; R179-R182 PolarHBondContact O-N 2.92Å; R179-G183 PolarHBondContact O-N 3.08Å; R179-E184 HydrophobicContact CB-CB 4.23Å; R179-E184 WeakPolarHBondContact CD-OE2 3.3Å; R179-E184 IonicContact CZ-OE2 3.52Å; R179-E184 IonicContact NE-OE2 3.04Å; R179-E184 IonicContact NH1-OE2 2.71Å; R179-E184 PolarHBondContact NH1-OE2 2.88Å; R179-E184 WeakPolarHBondContact O-CB 3.45Å; R179-E184 PolarHBondContact O-N 3.41Å; R179-D187 IonicContact CZ-OD2 2.59Å; R179-D187 IonicContact NH1-OD2 3.84Å; R179-D187 PolarHBondContact NH1-OD2 2.87Å; R179-D187 IonicContact NH2-OD2 3.86Å; R179-A188 HydrophobicContact CB-CB 4.36Å; R179-M191 HydrophobicContact CB-CE 4.18Å; R179-M191 HydrophobicContact CG-CE 3.78Å
180	Y	89.6	Confident	86.2	Confident	42 Å²	42	67 Å²	67	17%	0.165	36%	0.358	C	S	.	.	H	α-helix	trans	-54.2	-48.6	168.8	173.3	-141.5	0	0	0	111.4	A176 R182 G183 K185 T208 M211 I212 D215	A176-Y180 WeakPolarHBondContact O-CB 3.44Å; A176-Y180 PolarHBondContact O-N 3.2Å; Y180-R182 PolarHBondContact O-N 3.39Å; Y180-R182 VanDerWaalsContact O-N 3.07Å; Y180-G183 PolarHBondContact O-N 3.1Å; Y180-K185 HydrophobicContact CD2-CG 4.38Å; Y180-T208 HydrophobicContact CD1-CG2 4.32Å; Y180-M211 HydrophobicContact CE1-CB 4.09Å; Y180-M211 HydrophobicContact CE1-CE 4.39Å; Y180-I212 HydrophobicContact CD1-CG1 4.2Å; Y180-I212 HydrophobicContact CD2-CD1 4.33Å; Y180-I212 HydrophobicContact CD2-CG1 3.53Å; Y180-I212 HydrophobicContact CE1-CG1 4.36Å; Y180-I212 HydrophobicContact CE2-CG1 3.72Å; Y180-I212 HydrophobicContact CG-CD1 4.23Å; Y180-I212 HydrophobicContact CG-CG1 3.8Å; Y180-D215 HydrophobicContact CE2-CB 4.44Å
181	A	87.9	Confident	86.5	Confident	88 Å²	88	62.3 Å²	62.3	73%	0.727	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-8.9	177.2	0	0	0	0	0	115.2	N177 R179	N177-A181 WeakPolarHBondContact O-CB 3.31Å; N177-A181 PolarHBondContact O-N 3.29Å; R179-A181 VanDerWaalsContact C-N 3.33Å; R179-A181 PolarHBondContact O-N 3.1Å
182	R	87.9	Confident	86.6	Confident	162 Å²	162	60 Å²	60	61%	0.611	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-4.5	170.2	-69.7	170.6	-172.2	179.7	3.4	113.6	I178 R179 Y180 E184	I178-R182 VanDerWaalsContact O-CG 3.31Å; I178-R182 WeakPolarHBondContact O-CG 3.22Å; I178-R182 PolarHBondContact O-N 2.78Å; R179-R182 WeakPolarHBondContact O-CB 3.39Å; R179-R182 PolarHBondContact O-N 2.92Å; Y180-R182 PolarHBondContact O-N 3.39Å; Y180-R182 VanDerWaalsContact O-N 3.07Å; R182-E184 VanDerWaalsContact C-N 3.34Å; R182-E184 HydrophobicContact CB-CG 4.11Å; R182-E184 WeakPolarHBondContact CD-OE1 3.44Å; R182-E184 IonicContact NH1-OE1 3.35Å
183	G	84.2	Confident	86.6	Confident	53 Å²	53	60.7 Å²	60.7	55%	0.546	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	5.7	-170.5	0	0	0	0	0	114.3	R179 Y180 K185	R179-G183 PolarHBondContact O-N 3.08Å; Y180-G183 PolarHBondContact O-N 3.1Å; G183-K185 PolarHBondContact O-N 2.92Å
184	E	90.1	Very high	86.5	Confident	65 Å²	65	63 Å²	63	30%	0.304	33%	0.332	S	S	.	.			trans	-79.3	57.8	177.6	-60.2	171.3	-132.9	0	0	110.2	R179 R182 E186 A188	R179-E184 HydrophobicContact CB-CB 4.23Å; R179-E184 WeakPolarHBondContact CD-OE2 3.3Å; R179-E184 IonicContact CZ-OE2 3.52Å; R179-E184 IonicContact NE-OE2 3.04Å; R179-E184 IonicContact NH1-OE2 2.71Å; R179-E184 PolarHBondContact NH1-OE2 2.88Å; R179-E184 WeakPolarHBondContact O-CB 3.45Å; R179-E184 PolarHBondContact O-N 3.41Å; R182-E184 VanDerWaalsContact C-N 3.34Å; R182-E184 HydrophobicContact CB-CG 4.11Å; R182-E184 WeakPolarHBondContact CD-OE1 3.44Å; R182-E184 IonicContact NH1-OE1 3.35Å; E184-E186 PolarHBondContact O-N 3.01Å; E184-A188 PolarHBondContact O-N 3.38Å; E184-A188 VanDerWaalsContact O-N 3.13Å
185	K	86.6	Confident	86.4	Confident	44 Å²	44	61.5 Å²	61.5	19%	0.191	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-40	-168.8	-67.1	-173.6	176.8	-175.1	0	113.9	Y180 G183 A188 I189 I212 D215 N216	Y180-K185 HydrophobicContact CD2-CG 4.38Å; G183-K185 PolarHBondContact O-N 2.92Å; K185-A188 PolarHBondContact O-N 3.41Å; K185-I189 WeakPolarHBondContact O-CG1 3.38Å; K185-I189 PolarHBondContact O-N 3.4Å; K185-I212 HydrophobicContact CB-CG2 4.15Å; K185-I212 HydrophobicContact CD-CG2 4.38Å; K185-I212 HydrophobicContact CG-CG2 4.39Å; K185-D215 WeakPolarHBondContact CE-OD2 3.16Å; K185-D215 VanDerWaalsContact NZ-C 3.32Å; K185-D215 PolarHBondContact NZ-O 3.48Å; K185-D215 IonicContact NZ-OD2 3.43Å; K185-D215 PolarHBondContact NZ-OD2 3.48Å; K185-N216 WeakPolarHBondContact CD-OD1 3.47Å; K185-N216 PolarHBondContact NZ-OD1 3.12Å
186	E	86.8	Confident	86.3	Confident	163 Å²	163	58 Å²	58	76%	0.762	30%	0.3	S	S	*	.	H	α-helix	trans	-64.9	-47.5	-178.3	-63.2	-179.9	177.5	0	0	111.6	E184 A188 I189 L190	E184-E186 PolarHBondContact O-N 3.01Å; E186-A188 VanDerWaalsContact C-N 3.31Å; E186-A188 PolarHBondContact O-N 2.88Å; E186-I189 PolarHBondContact O-N 2.97Å; E186-L190 WeakPolarHBondContact O-CG 3.48Å; E186-L190 PolarHBondContact O-N 2.98Å; E186-L190 VanDerWaalsContact O-N 3.12Å
187	D	86.1	Confident	86	Confident	68 Å²	68	66.3 Å²	66.3	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-57.2	-43.8	172.3	-94.1	23.3	0	0	0	111.2	R179 L190 M191	R179-D187 IonicContact CZ-OD2 2.59Å; R179-D187 IonicContact NH1-OD2 3.84Å; R179-D187 PolarHBondContact NH1-OD2 2.87Å; R179-D187 IonicContact NH2-OD2 3.86Å; D187-L190 PolarHBondContact O-N 3.38Å; D187-M191 VanDerWaalsContact C-CE 3.49Å; D187-M191 HydrophobicContact CB-CE 3.8Å; D187-M191 WeakPolarHBondContact O-CE 3.46Å; D187-M191 PolarHBondContact O-N 3.06Å
188	A	87.8	Confident	85.6	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-39	179	0	0	0	0	0	112.8	R179 E184 K185 E186 M191 C192 I212	R179-A188 HydrophobicContact CB-CB 4.36Å; E184-A188 PolarHBondContact O-N 3.38Å; E184-A188 VanDerWaalsContact O-N 3.13Å; K185-A188 PolarHBondContact O-N 3.41Å; E186-A188 VanDerWaalsContact C-N 3.31Å; E186-A188 PolarHBondContact O-N 2.88Å; A188-M191 PolarHBondContact O-N 3.3Å; A188-C192 WeakPolarHBondContact O-CB 3.37Å; A188-C192 PolarHBondContact O-N 3.17Å; A188-C192 PolarHBondContact O-SG 3.08Å; A188-I212 HydrophobicContact CB-CD1 3.8Å
189	I	88.1	Confident	85.2	Confident	30 Å²	30	65.2 Å²	65.2	15%	0.154	33%	0.326	C	S	.	.	H	α-helix	trans	-61.9	-48	173.9	-68.6	163.2	0	0	0	110.5	K185 E186 M191 C192 M193 L209 I212 Y213	K185-I189 WeakPolarHBondContact O-CG1 3.38Å; K185-I189 PolarHBondContact O-N 3.4Å; E186-I189 PolarHBondContact O-N 2.97Å; I189-M191 VanDerWaalsContact C-N 3.33Å; I189-M191 PolarHBondContact O-N 3.1Å; I189-C192 PolarHBondContact O-N 2.94Å; I189-M193 HydrophobicContact CG2-CG 4.33Å; I189-M193 VanDerWaalsContact O-CG 3.31Å; I189-M193 WeakPolarHBondContact O-CG 3.3Å; I189-M193 PolarHBondContact O-N 3.47Å; I189-L209 HydrophobicContact CB-CD2 4.13Å; I189-L209 HydrophobicContact CG1-CD2 3.94Å; I189-L209 HydrophobicContact CG2-CD2 3.99Å; I189-I212 HydrophobicContact CD1-CG2 3.79Å; I189-I212 HydrophobicContact CG1-CD1 4.35Å; I189-I212 HydrophobicContact CG1-CG2 3.77Å; I189-Y213 HydrophobicContact CD1-CE1 4.45Å
190	L	86.9	Confident	84.7	Confident	121 Å²	121	65 Å²	65	63%	0.634	33%	0.331	S	S	*	.	H	α-helix	trans	-60.5	-42.1	179.6	-69.2	173.4	0	0	0	111.9	E186 D187 M193 E194	E186-L190 WeakPolarHBondContact O-CG 3.48Å; E186-L190 PolarHBondContact O-N 2.98Å; E186-L190 VanDerWaalsContact O-N 3.12Å; D187-L190 PolarHBondContact O-N 3.38Å; L190-M193 PolarHBondContact O-N 3.07Å; L190-E194 PolarHBondContact O-N 3.48Å; L190-E194 VanDerWaalsContact O-N 3.13Å
191	M	83.9	Confident	84	Confident	28 Å²	28	68.1 Å²	68.1	14%	0.138	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-45.3	174.7	-79.4	176.3	-90.6	0	0	112.3	E175 A176 R179 D187 A188 I189 M193 E194 I195	E175-M191 HydrophobicContact CB-SD 4.38Å; E175-M191 HydrophobicContact CG-SD 4.03Å; A176-M191 HydrophobicContact CB-CB 3.85Å; R179-M191 HydrophobicContact CB-CE 4.18Å; R179-M191 HydrophobicContact CG-CE 3.78Å; D187-M191 VanDerWaalsContact C-CE 3.49Å; D187-M191 HydrophobicContact CB-CE 3.8Å; D187-M191 WeakPolarHBondContact O-CE 3.46Å; D187-M191 PolarHBondContact O-N 3.06Å; A188-M191 PolarHBondContact O-N 3.3Å; I189-M191 VanDerWaalsContact C-N 3.33Å; I189-M191 PolarHBondContact O-N 3.1Å; M191-M193 VanDerWaalsContact C-N 3.33Å; M191-M193 PolarHBondContact O-N 3.28Å; M191-E194 PolarHBondContact O-N 3.14Å; M191-I195 VanDerWaalsContact O-CG1 3.29Å; M191-I195 WeakPolarHBondContact O-CG1 3.49Å; M191-I195 PolarHBondContact O-N 3.39Å
192	C	85.3	Confident	83.7	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-39.9	177.8	-66.1	0	0	0	0	112.1	A188 I189 E194 I195 I196 P205 L209	A188-C192 WeakPolarHBondContact O-CB 3.37Å; A188-C192 PolarHBondContact O-N 3.17Å; A188-C192 PolarHBondContact O-SG 3.08Å; I189-C192 PolarHBondContact O-N 2.94Å; C192-E194 PolarHBondContact O-N 3.14Å; C192-I195 PolarHBondContact O-N 3.49Å; C192-I196 WeakPolarHBondContact O-CD1 3.38Å; C192-I196 WeakPolarHBondContact O-CG1 3.5Å; C192-I196 PolarHBondContact O-N 3.23Å; C192-P205 HydrophobicContact CB-CB 4.16Å; C192-L209 HydrophobicContact CB-CD1 4.02Å; C192-L209 HydrophobicContact CB-CD2 3.82Å; C192-L209 HydrophobicContact CB-CG 3.63Å
193	M	84.7	Confident	83.4	Confident	74 Å²	74	60 Å²	60	37%	0.365	30%	0.301	S	S	.	.	H	α-helix	trans	-63.7	-37.8	176.3	-71.7	-66.3	177.8	0	0	112.7	I189 L190 M191 I196 R197 L209 F225	I189-M193 HydrophobicContact CG2-CG 4.33Å; I189-M193 VanDerWaalsContact O-CG 3.31Å; I189-M193 WeakPolarHBondContact O-CG 3.3Å; I189-M193 PolarHBondContact O-N 3.47Å; L190-M193 PolarHBondContact O-N 3.07Å; M191-M193 VanDerWaalsContact C-N 3.33Å; M191-M193 PolarHBondContact O-N 3.28Å; M193-I196 PolarHBondContact O-N 2.91Å; M193-R197 WeakPolarHBondContact O-CB 3.32Å; M193-R197 PolarHBondContact O-N 3.29Å; M193-L209 HydrophobicContact CE-CD1 3.75Å; M193-L209 HydrophobicContact CE-CD2 4.46Å; M193-L209 HydrophobicContact SD-CD1 4.19Å; M193-F225 HydrophobicContact CE-CE1 4.33Å; M193-F225 HydrophobicContact CE-CZ 3.86Å
194	E	82.4	Confident	83.4	Confident	59 Å²	59	59.2 Å²	59.2	28%	0.276	28%	0.283	S	S	.	.	H	α-helix	trans	-71.2	-35	174.7	-177.6	57	-159.4	0	0	112.3	L190 M191 C192 R197 Q198	L190-E194 PolarHBondContact O-N 3.48Å; L190-E194 VanDerWaalsContact O-N 3.13Å; M191-E194 PolarHBondContact O-N 3.14Å; C192-E194 PolarHBondContact O-N 3.14Å; E194-R197 PolarHBondContact O-N 3.12Å; E194-R197 IonicContact OE1-CZ 3.56Å; E194-R197 IonicContact OE1-NE 2.66Å; E194-R197 PolarHBondContact OE1-NE 3.45Å; E194-R197 IonicContact OE1-NH2 2.75Å; E194-R197 PolarHBondContact OE1-NH2 3.49Å; E194-R197 IonicContact OE2-CZ 2.7Å; E194-R197 IonicContact OE2-NE 3.68Å; E194-R197 PolarHBondContact OE2-NE 3.14Å; E194-R197 IonicContact OE2-NH2 2.78Å; E194-R197 PolarHBondContact OE2-NH2 3.24Å; E194-Q198 WeakPolarHBondContact O-CG 3.41Å; E194-Q198 PolarHBondContact O-N 2.93Å; E194-Q198 VanDerWaalsContact O-N 3.09Å; E194-Q198 PolarHBondContact OE1-NE2 3.32Å
195	I	82.6	Confident	83.2	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.9	-45.7	171.5	-61.9	164.7	0	0	0	110.1	L165 L169 L172 M173 M191 C192 R197 Q198 S199 P205	L165-I195 HydrophobicContact CD2-CG2 3.79Å; L169-I195 HydrophobicContact CD2-CB 4.49Å; L169-I195 HydrophobicContact CD2-CG1 4.2Å; L169-I195 HydrophobicContact CD2-CG2 4.4Å; L172-I195 HydrophobicContact CB-CD1 4.25Å; L172-I195 HydrophobicContact CB-CG1 4.28Å; L172-I195 HydrophobicContact CD2-CD1 4.44Å; L172-I195 HydrophobicContact CD2-CG1 3.86Å; M173-I195 HydrophobicContact CB-CD1 3.92Å; M173-I195 HydrophobicContact CG-CD1 4.47Å; M173-I195 HydrophobicContact SD-CD1 3.7Å; M191-I195 VanDerWaalsContact O-CG1 3.29Å; M191-I195 WeakPolarHBondContact O-CG1 3.49Å; M191-I195 PolarHBondContact O-N 3.39Å; C192-I195 PolarHBondContact O-N 3.49Å; I195-R197 VanDerWaalsContact C-N 3.32Å; I195-R197 PolarHBondContact O-N 2.81Å; I195-Q198 CarbonylContact O-C 3.58Å; I195-Q198 PolarHBondContact O-N 3.31Å; I195-S199 PolarHBondContact O-N 3.22Å; I195-P205 HydrophobicContact CB-CB 4.23Å; I195-P205 HydrophobicContact CB-CG 4.46Å; I195-P205 HydrophobicContact CG2-CB 4.09Å; I195-P205 HydrophobicContact CG2-CG 3.88Å
196	I	83.8	Confident	83.2	Confident	9 Å²	9	54.2 Å²	54.2	5%	0.046	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-39.9	176.1	-72.5	160.5	0	0	0	111.2	F4 C192 M193 Q198 S199 P200 P205 F206 L209	F4-I196 HydrophobicContact CE1-CG2 4.18Å; F4-I196 HydrophobicContact CZ-CG2 3.83Å; C192-I196 WeakPolarHBondContact O-CD1 3.38Å; C192-I196 WeakPolarHBondContact O-CG1 3.5Å; C192-I196 PolarHBondContact O-N 3.23Å; M193-I196 PolarHBondContact O-N 2.91Å; I196-Q198 VanDerWaalsContact C-N 3.26Å; I196-Q198 PolarHBondContact O-N 3.01Å; I196-S199 CarbonylContact O-C 3.53Å; I196-S199 PolarHBondContact O-N 3.05Å; I196-P200 WeakPolarHBondContact O-CA 3.38Å; I196-P205 HydrophobicContact CD1-CB 4.09Å; I196-P205 HydrophobicContact CD1-CG 4.34Å; I196-P205 HydrophobicContact CG1-CB 3.86Å; I196-P205 HydrophobicContact CG1-CG 3.69Å; I196-F206 HydrophobicContact CB-CZ 4.3Å; I196-F206 HydrophobicContact CD1-CD1 3.61Å; I196-F206 HydrophobicContact CD1-CD2 4.49Å; I196-F206 HydrophobicContact CD1-CE1 3.49Å; I196-F206 VanDerWaalsContact CD1-CE1 3.49Å; I196-F206 HydrophobicContact CD1-CE2 4.38Å; I196-F206 HydrophobicContact CD1-CG 4.14Å; I196-F206 HydrophobicContact CD1-CZ 3.91Å; I196-F206 HydrophobicContact CG1-CD1 4.25Å; I196-F206 HydrophobicContact CG1-CD2 4.35Å; I196-F206 HydrophobicContact CG1-CE1 3.85Å; I196-F206 HydrophobicContact CG1-CE2 3.96Å; I196-F206 HydrophobicContact CG1-CZ 3.7Å; I196-F206 HydrophobicContact CG2-CE1 3.98Å; I196-F206 HydrophobicContact CG2-CZ 3.64Å; I196-L209 HydrophobicContact CD1-CD1 3.5Å; I196-L209 VanDerWaalsContact CD1-CD1 3.5Å
197	R	80.4	Confident	83.2	Confident	174 Å²	174	47.5 Å²	47.5	66%	0.657	23%	0.232	S	C	*	.	H	α-helix	trans	-63.1	-31.4	176.3	-162.5	-176.1	72.1	85.2	3.4	112.8	M193 E194 I195	M193-R197 WeakPolarHBondContact O-CB 3.32Å; M193-R197 PolarHBondContact O-N 3.29Å; E194-R197 PolarHBondContact O-N 3.12Å; E194-R197 IonicContact OE1-CZ 3.56Å; E194-R197 IonicContact OE1-NE 2.66Å; E194-R197 PolarHBondContact OE1-NE 3.45Å; E194-R197 IonicContact OE1-NH2 2.75Å; E194-R197 PolarHBondContact OE1-NH2 3.49Å; E194-R197 IonicContact OE2-CZ 2.7Å; E194-R197 IonicContact OE2-NE 3.68Å; E194-R197 PolarHBondContact OE2-NE 3.14Å; E194-R197 IonicContact OE2-NH2 2.78Å; E194-R197 PolarHBondContact OE2-NH2 3.24Å; I195-R197 VanDerWaalsContact C-N 3.32Å; I195-R197 PolarHBondContact O-N 2.81Å
198	Q	78.9	Confident	83.3	Confident	109 Å²	109	44.8 Å²	44.8	51%	0.509	22%	0.218	S	C	.	.	H	α-helix	trans	-93.6	-24	178.6	-64.7	-174.2	30.7	0	0	113.8	L169 E194 I195 I196	L169-Q198 HydrophobicContact CD1-CB 3.96Å; L169-Q198 HydrophobicContact CD2-CB 4.12Å; E194-Q198 WeakPolarHBondContact O-CG 3.41Å; E194-Q198 PolarHBondContact O-N 2.93Å; E194-Q198 VanDerWaalsContact O-N 3.09Å; E194-Q198 PolarHBondContact OE1-NE2 3.32Å; I195-Q198 CarbonylContact O-C 3.58Å; I195-Q198 PolarHBondContact O-N 3.31Å; I196-Q198 VanDerWaalsContact C-N 3.26Å; I196-Q198 PolarHBondContact O-N 3.01Å
199	S	78	Confident	83.3	Confident	27 Å²	27	44.8 Å²	44.8	19%	0.189	22%	0.218	C	C	.	.			trans	-148	78.1	-178.2	-156.1	0	0	0	0	111.8	I195 I196 L201 A202	I195-S199 PolarHBondContact O-N 3.22Å; I196-S199 CarbonylContact O-C 3.53Å; I196-S199 PolarHBondContact O-N 3.05Å; S199-L201 PolarHBondContact O-N 3.45Å; S199-A202 PolarHBondContact O-N 3.07Å
200	P	76.1	Confident	83.3	Confident	48 Å²	48	43.8 Å²	43.8	31%	0.312	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	8.4	-175.5	30.8	-37.6	0	0	0	114.6	F4 I196	F4-P200 HydrophobicContact CD1-CB 4.16Å; F4-P200 HydrophobicContact CE1-CB 3.66Å; I196-P200 WeakPolarHBondContact O-CA 3.38Å
201	L	76.3	Confident	83.3	Confident	109 Å²	109	41.3 Å²	41.3	57%	0.571	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.1	1.1	179.6	-62.6	176.9	0	0	0	113.2	S199 L232	S199-L201 PolarHBondContact O-N 3.45Å; L201-L232 HydrophobicContact CD2-CD2 4.35Å
202	A	80.2	Confident	83.6	Confident	1 Å²	1	40 Å²	40	1%	0.008	19%	0.193	C	C	.	.			trans	-86	126.5	173.2	0	0	0	0	0	109.6	L165 S199 E204 P205 F206	L165-A202 HydrophobicContact CD2-CB 3.6Å; L165-A202 HydrophobicContact CG-CB 3.99Å; S199-A202 PolarHBondContact O-N 3.07Å; A202-E204 WeakPolarHBondContact CB-OE2 3.47Å; A202-P205 HydrophobicContact CB-CG 4.38Å; A202-P205 WeakPolarHBondContact O-CD 3.49Å; A202-F206 WeakPolarHBondContact O-CD2 3.21Å; A202-F206 WeakPolarHBondContact O-CE2 3.46Å
203	Y	82.4	Confident	83.8	Confident	77 Å²	77	41.7 Å²	41.7	30%	0.302	20%	0.2	S	C	.	.	S	Bend	trans	-77.2	-28.2	178.9	76.7	-84	0	0	0	112.1	S163 F206 S207 A229 N233	S163-Y203 WeakPolarHBondContact OG-CD1 3.36Å; Y203-F206 PolarHBondContact O-N 3.38Å; Y203-S207 PolarHBondContact O-N 2.67Å; Y203-A229 WeakPolarHBondContact CB-O 3.3Å; Y203-N233 HydrophobicContact CD1-CB 3.74Å; Y203-N233 HydrophobicContact CD2-CB 3.85Å; Y203-N233 HydrophobicContact CE1-CB 4.11Å; Y203-N233 HydrophobicContact CE2-CB 4.19Å; Y203-N233 HydrophobicContact CG-CB 3.61Å
204	E	84.2	Confident	83.9	Confident	37 Å²	37	41.5 Å²	41.5	17%	0.173	20%	0.199	C	C	.	.	H	α-helix	trans	-51.9	-49.9	-173.6	-54.5	100.7	112.7	0	0	114.1	S163 L165 M173 A202 F206 S207 T208	S163-E204 PolarHBondContact OG-OE2 2.8Å; L165-E204 HydrophobicContact CD1-CB 3.92Å; L165-E204 HydrophobicContact CD1-CG 4.13Å; L165-E204 WeakPolarHBondContact CD1-OE1 3.45Å; L165-E204 VanDerWaalsContact CG-OE1 3.29Å; L165-E204 WeakPolarHBondContact CG-OE1 3.36Å; M173-E204 VanDerWaalsContact CE-C 3.49Å; M173-E204 HydrophobicContact CE-CB 4.15Å; M173-E204 VanDerWaalsContact CE-O 3.28Å; M173-E204 WeakPolarHBondContact CE-O 3.21Å; M173-E204 HydrophobicContact CG-CB 4.45Å; M173-E204 HydrophobicContact SD-CB 4.26Å; A202-E204 WeakPolarHBondContact CB-OE2 3.47Å; E204-F206 VanDerWaalsContact C-N 3.34Å; E204-F206 PolarHBondContact O-N 3.17Å; E204-S207 PolarHBondContact O-N 3.2Å; E204-T208 PolarHBondContact O-N 3.16Å; E204-T208 VanDerWaalsContact O-N 3.12Å
205	P	85.9	Confident	84.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.3	-28	177.5	29.3	-38.5	0	0	0	114	M173 C192 I195 I196 A202 L209	M173-P205 HydrophobicContact SD-CB 3.98Å; C192-P205 HydrophobicContact CB-CB 4.16Å; I195-P205 HydrophobicContact CB-CB 4.23Å; I195-P205 HydrophobicContact CB-CG 4.46Å; I195-P205 HydrophobicContact CG2-CB 4.09Å; I195-P205 HydrophobicContact CG2-CG 3.88Å; I196-P205 HydrophobicContact CD1-CB 4.09Å; I196-P205 HydrophobicContact CD1-CG 4.34Å; I196-P205 HydrophobicContact CG1-CB 3.86Å; I196-P205 HydrophobicContact CG1-CG 3.69Å; A202-P205 HydrophobicContact CB-CG 4.38Å; A202-P205 WeakPolarHBondContact O-CD 3.49Å; P205-L209 WeakPolarHBondContact O-CB 3.48Å; P205-L209 VanDerWaalsContact O-CG 3.3Å; P205-L209 WeakPolarHBondContact O-CG 3.27Å; P205-L209 PolarHBondContact O-N 2.93Å
206	F	86.5	Confident	84.3	Confident	5 Å²	5	47.1 Å²	47.1	2%	0.022	23%	0.23	C	C	.	.	H	α-helix	trans	-73.6	-37.6	176.1	-64.9	-74.9	0	0	0	111.6	I196 A202 Y203 E204 L209 A210 F225 I228 A229 L232	I196-F206 HydrophobicContact CB-CZ 4.3Å; I196-F206 HydrophobicContact CD1-CD1 3.61Å; I196-F206 HydrophobicContact CD1-CD2 4.49Å; I196-F206 HydrophobicContact CD1-CE1 3.49Å; I196-F206 VanDerWaalsContact CD1-CE1 3.49Å; I196-F206 HydrophobicContact CD1-CE2 4.38Å; I196-F206 HydrophobicContact CD1-CG 4.14Å; I196-F206 HydrophobicContact CD1-CZ 3.91Å; I196-F206 HydrophobicContact CG1-CD1 4.25Å; I196-F206 HydrophobicContact CG1-CD2 4.35Å; I196-F206 HydrophobicContact CG1-CE1 3.85Å; I196-F206 HydrophobicContact CG1-CE2 3.96Å; I196-F206 HydrophobicContact CG1-CZ 3.7Å; I196-F206 HydrophobicContact CG2-CE1 3.98Å; I196-F206 HydrophobicContact CG2-CZ 3.64Å; A202-F206 WeakPolarHBondContact O-CD2 3.21Å; A202-F206 WeakPolarHBondContact O-CE2 3.46Å; Y203-F206 PolarHBondContact O-N 3.38Å; E204-F206 VanDerWaalsContact C-N 3.34Å; E204-F206 PolarHBondContact O-N 3.17Å; F206-L209 PolarHBondContact O-N 3.47Å; F206-A210 WeakPolarHBondContact O-CB 3.43Å; F206-A210 PolarHBondContact O-N 2.95Å; F206-F225 HydrophobicContact CD1-CD1 4.01Å; F206-I228 HydrophobicContact CB-CG2 4.44Å; F206-I228 HydrophobicContact CD1-CB 4.44Å; F206-I228 HydrophobicContact CD1-CG2 3.78Å; F206-I228 HydrophobicContact CD2-CG2 3.96Å; F206-I228 HydrophobicContact CE1-CG2 3.86Å; F206-I228 HydrophobicContact CE2-CG2 4.05Å; F206-I228 HydrophobicContact CG-CG2 3.82Å; F206-I228 HydrophobicContact CZ-CG2 3.99Å; F206-A229 HydrophobicContact CB-CB 3.86Å; F206-L232 HydrophobicContact CD2-CD1 3.51Å; F206-L232 HydrophobicContact CE2-CD1 3.5Å
207	S	87.1	Confident	84.3	Confident	22 Å²	22	49.3 Å²	49.3	15%	0.154	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-48	172.7	171.5	0	0	0	0	111.4	Y203 E204 L209 A210 M211	Y203-S207 PolarHBondContact O-N 2.67Å; E204-S207 PolarHBondContact O-N 3.2Å; S207-L209 PolarHBondContact O-N 3.08Å; S207-A210 WeakPolarHBondContact O-CB 3.37Å; S207-A210 PolarHBondContact O-N 3.41Å; S207-M211 WeakPolarHBondContact O-CG 3.35Å; S207-M211 PolarHBondContact O-N 3.5Å
208	T	87.4	Confident	84.6	Confident	10 Å²	10	43.9 Å²	43.9	6%	0.061	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-39	175.3	-65.2	0	0	0	0	112.3	M173 N177 Y180 E204 M211 I212	M173-T208 HydrophobicContact CE-CG2 4.43Å; M173-T208 WeakPolarHBondContact CE-OG1 3.49Å; N177-T208 VanDerWaalsContact OD1-CG2 3.27Å; N177-T208 WeakPolarHBondContact OD1-CG2 3.22Å; N177-T208 PolarHBondContact OD1-OG1 3.01Å; Y180-T208 HydrophobicContact CD1-CG2 4.32Å; E204-T208 PolarHBondContact O-N 3.16Å; E204-T208 VanDerWaalsContact O-N 3.12Å; T208-M211 PolarHBondContact O-N 2.98Å; T208-I212 HydrophobicContact CG2-CD1 3.81Å; T208-I212 HydrophobicContact CG2-CG1 4.44Å; T208-I212 WeakPolarHBondContact O-CD1 3.31Å; T208-I212 VanDerWaalsContact O-CG1 3.25Å; T208-I212 WeakPolarHBondContact O-CG1 3.37Å; T208-I212 PolarHBondContact O-N 2.92Å
209	L	87.6	Confident	84.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-43.3	173.1	-78.2	174.7	0	0	0	112.3	I189 C192 M193 I196 P205 F206 S207 M211 I212 Y213 F225	I189-L209 HydrophobicContact CB-CD2 4.13Å; I189-L209 HydrophobicContact CG1-CD2 3.94Å; I189-L209 HydrophobicContact CG2-CD2 3.99Å; C192-L209 HydrophobicContact CB-CD1 4.02Å; C192-L209 HydrophobicContact CB-CD2 3.82Å; C192-L209 HydrophobicContact CB-CG 3.63Å; M193-L209 HydrophobicContact CE-CD1 3.75Å; M193-L209 HydrophobicContact CE-CD2 4.46Å; M193-L209 HydrophobicContact SD-CD1 4.19Å; I196-L209 HydrophobicContact CD1-CD1 3.5Å; I196-L209 VanDerWaalsContact CD1-CD1 3.5Å; P205-L209 WeakPolarHBondContact O-CB 3.48Å; P205-L209 VanDerWaalsContact O-CG 3.3Å; P205-L209 WeakPolarHBondContact O-CG 3.27Å; P205-L209 PolarHBondContact O-N 2.93Å; F206-L209 PolarHBondContact O-N 3.47Å; S207-L209 PolarHBondContact O-N 3.08Å; L209-M211 VanDerWaalsContact C-N 3.33Å; L209-M211 PolarHBondContact O-N 3.37Å; L209-I212 PolarHBondContact O-N 3.4Å; L209-I212 VanDerWaalsContact O-N 3.17Å; L209-Y213 HydrophobicContact CD2-CE2 4.23Å; L209-Y213 WeakPolarHBondContact O-CD2 3.31Å; L209-Y213 PolarHBondContact O-N 2.91Å; L209-F225 HydrophobicContact CB-CB 4.36Å; L209-F225 HydrophobicContact CB-CD2 4.24Å; L209-F225 HydrophobicContact CB-CG 4.23Å; L209-F225 HydrophobicContact CD1-CD1 4.5Å
210	A	88.2	Confident	85.1	Confident	10 Å²	10	45 Å²	45	8%	0.083	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-50.1	177.5	0	0	0	0	0	110.8	F206 S207 I212 Y213 E214 A222 F225	F206-A210 WeakPolarHBondContact O-CB 3.43Å; F206-A210 PolarHBondContact O-N 2.95Å; S207-A210 WeakPolarHBondContact O-CB 3.37Å; S207-A210 PolarHBondContact O-N 3.41Å; A210-I212 PolarHBondContact O-N 3.38Å; A210-Y213 PolarHBondContact O-N 3.27Å; A210-E214 WeakPolarHBondContact O-CB 3.42Å; A210-E214 PolarHBondContact O-N 3.35Å; A210-A222 WeakPolarHBondContact CB-O 3.5Å; A210-A222 WeakPolarHBondContact O-CB 3.48Å; A210-F225 HydrophobicContact CB-CB 4.16Å
211	M	88.4	Confident	85.3	Confident	68 Å²	68	46.7 Å²	46.7	34%	0.335	25%	0.251	S	S	.	.	H	α-helix	trans	-57.9	-45.6	174.2	-66.1	-177.3	75.5	0	0	112.3	Y180 S207 T208 L209 Y213 E214 D215	Y180-M211 HydrophobicContact CE1-CB 4.09Å; Y180-M211 HydrophobicContact CE1-CE 4.39Å; S207-M211 WeakPolarHBondContact O-CG 3.35Å; S207-M211 PolarHBondContact O-N 3.5Å; T208-M211 PolarHBondContact O-N 2.98Å; L209-M211 VanDerWaalsContact C-N 3.33Å; L209-M211 PolarHBondContact O-N 3.37Å; M211-Y213 VanDerWaalsContact C-N 3.31Å; M211-Y213 PolarHBondContact O-N 2.95Å; M211-E214 WeakPolarHBondContact O-CB 3.43Å; M211-E214 PolarHBondContact O-N 3.2Å; M211-D215 WeakPolarHBondContact O-CB 3.43Å; M211-D215 PolarHBondContact O-N 3.1Å
212	I	90.2	Very high	85.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-38.1	179.8	-69.4	162	0	0	0	112.1	Y180 K185 A188 I189 T208 L209 A210 N216	Y180-I212 HydrophobicContact CD1-CG1 4.2Å; Y180-I212 HydrophobicContact CD2-CD1 4.33Å; Y180-I212 HydrophobicContact CD2-CG1 3.53Å; Y180-I212 HydrophobicContact CE1-CG1 4.36Å; Y180-I212 HydrophobicContact CE2-CG1 3.72Å; Y180-I212 HydrophobicContact CG-CD1 4.23Å; Y180-I212 HydrophobicContact CG-CG1 3.8Å; K185-I212 HydrophobicContact CB-CG2 4.15Å; K185-I212 HydrophobicContact CD-CG2 4.38Å; K185-I212 HydrophobicContact CG-CG2 4.39Å; A188-I212 HydrophobicContact CB-CD1 3.8Å; I189-I212 HydrophobicContact CD1-CG2 3.79Å; I189-I212 HydrophobicContact CG1-CD1 4.35Å; I189-I212 HydrophobicContact CG1-CG2 3.77Å; T208-I212 HydrophobicContact CG2-CD1 3.81Å; T208-I212 HydrophobicContact CG2-CG1 4.44Å; T208-I212 WeakPolarHBondContact O-CD1 3.31Å; T208-I212 VanDerWaalsContact O-CG1 3.25Å; T208-I212 WeakPolarHBondContact O-CG1 3.37Å; T208-I212 PolarHBondContact O-N 2.92Å; L209-I212 PolarHBondContact O-N 3.4Å; L209-I212 VanDerWaalsContact O-N 3.17Å; A210-I212 PolarHBondContact O-N 3.38Å; I212-N216 PolarHBondContact O-N 3.1Å; I212-N216 PolarHBondContact O-ND2 2.92Å; I212-N216 VanDerWaalsContact O-ND2 3.12Å; I212-N216 PolarHBondContact O-OD1 3.46Å
213	Y	88.4	Confident	86.1	Confident	36 Å²	36	41.7 Å²	41.7	14%	0.141	23%	0.225	C	C	.	.	H	α-helix	trans	-75.8	-36.8	178.4	-76	-65.7	0	0	0	112.9	I189 L209 A210 M211 N216 G217 D218 K221 F225	I189-Y213 HydrophobicContact CD1-CE1 4.45Å; L209-Y213 HydrophobicContact CD2-CE2 4.23Å; L209-Y213 WeakPolarHBondContact O-CD2 3.31Å; L209-Y213 PolarHBondContact O-N 2.91Å; A210-Y213 PolarHBondContact O-N 3.27Å; M211-Y213 VanDerWaalsContact C-N 3.31Å; M211-Y213 PolarHBondContact O-N 2.95Å; Y213-N216 CarbonylContact O-C 3.58Å; Y213-N216 WeakPolarHBondContact O-CA 3.31Å; Y213-N216 WeakPolarHBondContact O-CB 3.31Å; Y213-N216 PolarHBondContact O-N 3.36Å; Y213-N216 VanDerWaalsContact O-N 3.09Å; Y213-G217 PolarHBondContact O-N 3.19Å; Y213-G217 VanDerWaalsContact O-N 3.13Å; Y213-D218 HydrophobicContact CD1-CB 3.75Å; Y213-D218 WeakPolarHBondContact CD1-OD2 3.22Å; Y213-D218 HydrophobicContact CG-CB 4.31Å; Y213-D218 PolarHBondContact O-N 3.05Å; Y213-K221 HydrophobicContact CD1-CB 4.05Å; Y213-K221 HydrophobicContact CD1-CD 3.81Å; Y213-K221 HydrophobicContact CD2-CB 4.08Å; Y213-K221 HydrophobicContact CE1-CD 3.77Å; Y213-K221 HydrophobicContact CG-CB 3.79Å; Y213-K221 HydrophobicContact CG-CD 4.4Å; Y213-F225 AromaticContact CD2-CD2 3.66Å; Y213-F225 HydrophobicContact CD2-CD2 3.66Å; Y213-F225 AromaticContact CD2-CE2 3.74Å; Y213-F225 HydrophobicContact CD2-CE2 3.74Å; Y213-F225 AromaticContact CE2-CD2 3.8Å; Y213-F225 HydrophobicContact CE2-CD2 3.8Å; Y213-F225 AromaticContact CE2-CE2 3.41Å; Y213-F225 HydrophobicContact CE2-CE2 3.41Å; Y213-F225 VanDerWaalsContact CE2-CE2 3.41Å; Y213-F225 HydrophobicContact CE2-CZ 4.45Å
214	E	88	Confident	86.1	Confident	71 Å²	71	40.6 Å²	40.6	33%	0.332	22%	0.223	S	C	.	.	H	α-helix	trans	-57.4	-49.6	170.6	-177.3	-175.1	-173.3	0	0	110.4	A210 M211 N216 G217 A222 R242 M246	A210-E214 WeakPolarHBondContact O-CB 3.42Å; A210-E214 PolarHBondContact O-N 3.35Å; M211-E214 WeakPolarHBondContact O-CB 3.43Å; M211-E214 PolarHBondContact O-N 3.2Å; E214-N216 PolarHBondContact O-N 3.16Å; E214-N216 VanDerWaalsContact O-N 3.08Å; E214-G217 PolarHBondContact O-N 3.18Å; E214-A222 HydrophobicContact CB-CB 3.9Å; E214-R242 IonicContact OE1-CZ 2.89Å; E214-R242 IonicContact OE1-NE 3.24Å; E214-R242 IonicContact OE1-NH2 2.68Å; E214-R242 PolarHBondContact OE1-NH2 3.45Å; E214-R242 IonicContact OE2-CZ 3.68Å; E214-R242 IonicContact OE2-NH2 2.72Å; E214-R242 PolarHBondContact OE2-NH2 3.48Å; E214-M246 HydrophobicContact CG-CE 4.46Å
215	D	87	Confident	86.1	Confident	96 Å²	96	40 Å²	40	51%	0.513	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-8.3	176.6	-149.2	64.6	0	0	0	113.1	Y180 K185 M211	Y180-D215 HydrophobicContact CE2-CB 4.44Å; K185-D215 WeakPolarHBondContact CE-OD2 3.16Å; K185-D215 VanDerWaalsContact NZ-C 3.32Å; K185-D215 PolarHBondContact NZ-O 3.48Å; K185-D215 IonicContact NZ-OD2 3.43Å; K185-D215 PolarHBondContact NZ-OD2 3.48Å; M211-D215 WeakPolarHBondContact O-CB 3.43Å; M211-D215 PolarHBondContact O-N 3.1Å
216	N	86.3	Confident	86.1	Confident	80 Å²	80	40.2 Å²	40.2	43%	0.428	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-6.2	172.7	-70.7	-18.3	0	0	0	113.5	K185 I212 Y213 E214 D218	K185-N216 WeakPolarHBondContact CD-OD1 3.47Å; K185-N216 PolarHBondContact NZ-OD1 3.12Å; I212-N216 PolarHBondContact O-N 3.1Å; I212-N216 PolarHBondContact O-ND2 2.92Å; I212-N216 VanDerWaalsContact O-ND2 3.12Å; I212-N216 PolarHBondContact O-OD1 3.46Å; Y213-N216 CarbonylContact O-C 3.58Å; Y213-N216 WeakPolarHBondContact O-CA 3.31Å; Y213-N216 WeakPolarHBondContact O-CB 3.31Å; Y213-N216 PolarHBondContact O-N 3.36Å; Y213-N216 VanDerWaalsContact O-N 3.09Å; E214-N216 PolarHBondContact O-N 3.16Å; E214-N216 VanDerWaalsContact O-N 3.08Å; N216-D218 VanDerWaalsContact C-N 3.32Å
217	G	82.9	Confident	85.9	Confident	56 Å²	56	40 Å²	40	58%	0.577	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.8	6.2	-173	0	0	0	0	0	115.2	Y213 E214 V219	Y213-G217 PolarHBondContact O-N 3.19Å; Y213-G217 VanDerWaalsContact O-N 3.13Å; E214-G217 PolarHBondContact O-N 3.18Å; G217-V219 PolarHBondContact O-N 3.37Å
218	D	86.9	Confident	85.7	Confident	60 Å²	60	39.3 Å²	39.3	32%	0.321	22%	0.216	S	C	.	.			trans	-82.8	58.3	178.6	-102.9	-18.4	0	0	0	110.3	Y213 N216 D220 K221 A222	Y213-D218 HydrophobicContact CD1-CB 3.75Å; Y213-D218 WeakPolarHBondContact CD1-OD2 3.22Å; Y213-D218 HydrophobicContact CG-CB 4.31Å; Y213-D218 PolarHBondContact O-N 3.05Å; N216-D218 VanDerWaalsContact C-N 3.32Å; D218-D220 VanDerWaalsContact C-N 3.28Å; D218-D220 PolarHBondContact O-N 3.14Å; D218-D220 VanDerWaalsContact O-N 3.15Å; D218-K221 HydrophobicContact CB-CB 4.45Å; D218-K221 HydrophobicContact CB-CD 4.19Å; D218-K221 PolarHBondContact O-N 2.97Å; D218-K221 IonicContact OD1-NZ 3.37Å; D218-K221 PolarHBondContact OD1-NZ 3.18Å; D218-K221 VanDerWaalsContact OD1-NZ 3.16Å; D218-K221 IonicContact OD2-NZ 2.73Å; D218-K221 PolarHBondContact OD2-NZ 3.47Å; D218-A222 PolarHBondContact O-N 3.09Å
219	V	84.5	Confident	85.4	Confident	55 Å²	55	39.2 Å²	39.2	33%	0.333	22%	0.216	S	C	.	.	H	α-helix	trans	-54.8	-39	-168.7	-170.4	0	0	0	0	112.9	G217 K221 A222 L223 M246 Q250	G217-V219 PolarHBondContact O-N 3.37Å; V219-K221 VanDerWaalsContact C-N 3.33Å; V219-K221 PolarHBondContact O-N 3.19Å; V219-A222 WeakPolarHBondContact O-CB 3.19Å; V219-A222 PolarHBondContact O-N 3.08Å; V219-L223 WeakPolarHBondContact O-CB 3.48Å; V219-L223 PolarHBondContact O-N 2.94Å; V219-M246 HydrophobicContact CG1-CE 4.31Å; V219-Q250 HydrophobicContact CG1-CG 4.39Å
220	D	81.6	Confident	85.3	Confident	104 Å²	104	39.4 Å²	39.4	56%	0.556	22%	0.218	S	C	*	.	H	α-helix	trans	-58.7	-42	177.9	-61.8	-34.2	0	0	0	112.9	D218 Q224 Q250	D218-D220 VanDerWaalsContact C-N 3.28Å; D218-D220 PolarHBondContact O-N 3.14Å; D218-D220 VanDerWaalsContact O-N 3.15Å; D220-Q224 VanDerWaalsContact O-CG 3.27Å; D220-Q224 WeakPolarHBondContact O-CG 3.49Å; D220-Q224 PolarHBondContact O-N 3.34Å; D220-Q250 PolarHBondContact OD1-NE2 3.19Å
221	K	82.3	Confident	84.7	Confident	83 Å²	83	39.7 Å²	39.7	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-75.5	-38.3	179.3	-61.5	173	-162.9	147.6	0	110.5	Y213 D218 V219 L223 Q224 F225	Y213-K221 HydrophobicContact CD1-CB 4.05Å; Y213-K221 HydrophobicContact CD1-CD 3.81Å; Y213-K221 HydrophobicContact CD2-CB 4.08Å; Y213-K221 HydrophobicContact CE1-CD 3.77Å; Y213-K221 HydrophobicContact CG-CB 3.79Å; Y213-K221 HydrophobicContact CG-CD 4.4Å; D218-K221 HydrophobicContact CB-CB 4.45Å; D218-K221 HydrophobicContact CB-CD 4.19Å; D218-K221 PolarHBondContact O-N 2.97Å; D218-K221 IonicContact OD1-NZ 3.37Å; D218-K221 PolarHBondContact OD1-NZ 3.18Å; D218-K221 VanDerWaalsContact OD1-NZ 3.16Å; D218-K221 IonicContact OD2-NZ 2.73Å; D218-K221 PolarHBondContact OD2-NZ 3.47Å; V219-K221 VanDerWaalsContact C-N 3.33Å; V219-K221 PolarHBondContact O-N 3.19Å; K221-L223 VanDerWaalsContact C-N 3.29Å; K221-L223 PolarHBondContact O-N 3.39Å; K221-Q224 PolarHBondContact O-N 3.28Å; K221-F225 HydrophobicContact CB-CD2 4.44Å; K221-F225 HydrophobicContact CB-CE2 4.33Å; K221-F225 WeakPolarHBondContact O-CD2 3.45Å; K221-F225 PolarHBondContact O-N 3.09Å
222	A	86.6	Confident	84.2	Confident	1 Å²	1	39 Å²	39	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-56.4	-47.2	173.8	0	0	0	0	0	110.9	A210 E214 D218 V219 G226 M246	A210-A222 WeakPolarHBondContact CB-O 3.5Å; A210-A222 WeakPolarHBondContact O-CB 3.48Å; E214-A222 HydrophobicContact CB-CB 3.9Å; D218-A222 PolarHBondContact O-N 3.09Å; V219-A222 WeakPolarHBondContact O-CB 3.19Å; V219-A222 PolarHBondContact O-N 3.08Å; A222-G226 PolarHBondContact O-N 2.9Å; A222-M246 HydrophobicContact CB-CE 3.98Å
223	L	85.4	Confident	83.6	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-44.1	179.4	-166	56	0	0	0	112.1	V219 K221 G226 L227 L243 M246	V219-L223 WeakPolarHBondContact O-CB 3.48Å; V219-L223 PolarHBondContact O-N 2.94Å; K221-L223 VanDerWaalsContact C-N 3.29Å; K221-L223 PolarHBondContact O-N 3.39Å; L223-G226 PolarHBondContact O-N 3.48Å; L223-L227 HydrophobicContact CD1-CD1 4.34Å; L223-L227 HydrophobicContact CD1-CG 4.41Å; L223-L227 HydrophobicContact CG-CD1 4.11Å; L223-L227 WeakPolarHBondContact O-CB 3.32Å; L223-L227 WeakPolarHBondContact O-CD1 3.32Å; L223-L227 WeakPolarHBondContact O-CG 3.39Å; L223-L227 PolarHBondContact O-N 3.06Å; L223-L243 HydrophobicContact CD1-CB 4.39Å; L223-L243 HydrophobicContact CD1-CD2 3.89Å; L223-M246 HydrophobicContact CD1-CB 4.03Å
224	Q	82.4	Confident	82.9	Confident	54 Å²	54	40.6 Å²	40.6	25%	0.252	23%	0.228	S	C	.	.	H	α-helix	trans	-58.9	-50	175.1	-74.8	170.9	15.3	0	0	112.8	Y11 D220 K221 I228	Y11-Q224 HydrophobicContact CE1-CB 4.41Å; Y11-Q224 HydrophobicContact CE1-CG 4.36Å; D220-Q224 VanDerWaalsContact O-CG 3.27Å; D220-Q224 WeakPolarHBondContact O-CG 3.49Å; D220-Q224 PolarHBondContact O-N 3.34Å; K221-Q224 PolarHBondContact O-N 3.28Å; Q224-I228 WeakPolarHBondContact O-CD1 3.1Å; Q224-I228 WeakPolarHBondContact O-CG1 3.23Å; Q224-I228 PolarHBondContact O-N 3.27Å
225	F	84.5	Confident	82.3	Confident	23 Å²	23	41.6 Å²	41.6	10%	0.101	24%	0.243	C	C	.	.	H	α-helix	trans	-70.6	-34.2	179	-67.2	-56.3	0	0	0	112.3	L12 M193 F206 L209 A210 Y213 K221 I228 A229	L12-F225 HydrophobicContact CD2-CE1 4.02Å; M193-F225 HydrophobicContact CE-CE1 4.33Å; M193-F225 HydrophobicContact CE-CZ 3.86Å; F206-F225 HydrophobicContact CD1-CD1 4.01Å; L209-F225 HydrophobicContact CB-CB 4.36Å; L209-F225 HydrophobicContact CB-CD2 4.24Å; L209-F225 HydrophobicContact CB-CG 4.23Å; L209-F225 HydrophobicContact CD1-CD1 4.5Å; A210-F225 HydrophobicContact CB-CB 4.16Å; Y213-F225 AromaticContact CD2-CD2 3.66Å; Y213-F225 HydrophobicContact CD2-CD2 3.66Å; Y213-F225 AromaticContact CD2-CE2 3.74Å; Y213-F225 HydrophobicContact CD2-CE2 3.74Å; Y213-F225 AromaticContact CE2-CD2 3.8Å; Y213-F225 HydrophobicContact CE2-CD2 3.8Å; Y213-F225 AromaticContact CE2-CE2 3.41Å; Y213-F225 HydrophobicContact CE2-CE2 3.41Å; Y213-F225 VanDerWaalsContact CE2-CE2 3.41Å; Y213-F225 HydrophobicContact CE2-CZ 4.45Å; K221-F225 HydrophobicContact CB-CD2 4.44Å; K221-F225 HydrophobicContact CB-CE2 4.33Å; K221-F225 WeakPolarHBondContact O-CD2 3.45Å; K221-F225 PolarHBondContact O-N 3.09Å; F225-I228 PolarHBondContact O-N 3.38Å; F225-A229 PolarHBondContact O-N 3.29Å
226	G	85	Confident	82	Confident	6 Å²	6	39.8 Å²	39.8	6%	0.062	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-46.6	176	0	0	0	0	0	112.7	A222 L223 I228 A229 A230 L243	A222-G226 PolarHBondContact O-N 2.9Å; L223-G226 PolarHBondContact O-N 3.48Å; G226-I228 VanDerWaalsContact C-N 3.27Å; G226-I228 PolarHBondContact O-N 3.1Å; G226-A229 WeakPolarHBondContact O-CA 3.4Å; G226-A229 WeakPolarHBondContact O-CB 3.28Å; G226-A229 PolarHBondContact O-N 3.33Å; G226-A230 PolarHBondContact O-N 2.84Å; G226-L243 VanDerWaalsContact C-CD1 3.42Å; G226-L243 WeakPolarHBondContact O-CD1 3.27Å
227	L	84.1	Confident	81.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-34.8	176.1	-70.3	167.7	0	0	0	112.3	Y11 F18 L223 H231 W240 L243 Q255 C259	Y11-L227 WeakPolarHBondContact OH-CD1 3.4Å; F18-L227 HydrophobicContact CD1-CD1 4.31Å; F18-L227 HydrophobicContact CD2-CB 4.19Å; F18-L227 HydrophobicContact CD2-CD1 3.87Å; F18-L227 HydrophobicContact CD2-CG 4.49Å; F18-L227 HydrophobicContact CE1-CD1 4.47Å; F18-L227 HydrophobicContact CE1-CD2 4.04Å; F18-L227 HydrophobicContact CE2-CB 3.71Å; F18-L227 HydrophobicContact CE2-CD1 4.07Å; F18-L227 HydrophobicContact CE2-CD2 4.19Å; F18-L227 HydrophobicContact CE2-CG 4.21Å; F18-L227 HydrophobicContact CG-CD1 3.99Å; F18-L227 HydrophobicContact CZ-CB 4.15Å; F18-L227 HydrophobicContact CZ-CD1 4.35Å; F18-L227 HydrophobicContact CZ-CD2 3.8Å; F18-L227 HydrophobicContact CZ-CG 4.32Å; L223-L227 HydrophobicContact CD1-CD1 4.34Å; L223-L227 HydrophobicContact CD1-CG 4.41Å; L223-L227 HydrophobicContact CG-CD1 4.11Å; L223-L227 WeakPolarHBondContact O-CB 3.32Å; L223-L227 WeakPolarHBondContact O-CD1 3.32Å; L223-L227 WeakPolarHBondContact O-CG 3.39Å; L223-L227 PolarHBondContact O-N 3.06Å; L227-H231 WeakPolarHBondContact O-CB 3.21Å; L227-H231 PolarHBondContact O-CD2 2.77Å; L227-H231 PolarHBondContact O-N 3.29Å; L227-W240 HydrophobicContact CD2-CZ3 4.02Å; L227-L243 HydrophobicContact CD2-CB 4.17Å; L227-L243 HydrophobicContact CD2-CD1 4.27Å; L227-Q255 HydrophobicContact CD1-CG 4.38Å; L227-C259 VanDerWaalsContact CD2-SG 3.54Å
228	I	81.4	Confident	81.8	Confident	8 Å²	8	41.9 Å²	41.9	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-44.1	171.6	-67.2	164.9	0	0	0	110.6	L8 Y11 L12 F206 Q224 F225 G226 H231 L232	L8-I228 HydrophobicContact CD1-CD1 3.81Å; L8-I228 HydrophobicContact CD1-CG1 4Å; Y11-I228 HydrophobicContact CE1-CD1 4.43Å; Y11-I228 HydrophobicContact CE1-CG1 4.45Å; L12-I228 HydrophobicContact CD1-CD1 4.41Å; L12-I228 HydrophobicContact CD2-CD1 3.66Å; L12-I228 HydrophobicContact CG-CD1 4.14Å; F206-I228 HydrophobicContact CB-CG2 4.44Å; F206-I228 HydrophobicContact CD1-CB 4.44Å; F206-I228 HydrophobicContact CD1-CG2 3.78Å; F206-I228 HydrophobicContact CD2-CG2 3.96Å; F206-I228 HydrophobicContact CE1-CG2 3.86Å; F206-I228 HydrophobicContact CE2-CG2 4.05Å; F206-I228 HydrophobicContact CG-CG2 3.82Å; F206-I228 HydrophobicContact CZ-CG2 3.99Å; Q224-I228 WeakPolarHBondContact O-CD1 3.1Å; Q224-I228 WeakPolarHBondContact O-CG1 3.23Å; Q224-I228 PolarHBondContact O-N 3.27Å; F225-I228 PolarHBondContact O-N 3.38Å; G226-I228 VanDerWaalsContact C-N 3.27Å; G226-I228 PolarHBondContact O-N 3.1Å; I228-H231 PolarHBondContact O-N 3.41Å; I228-L232 HydrophobicContact CG2-CD1 3.99Å; I228-L232 WeakPolarHBondContact O-CG 3.24Å; I228-L232 PolarHBondContact O-N 2.73Å; I228-L232 VanDerWaalsContact O-N 3.09Å
229	A	82.4	Confident	81.6	Confident	8 Å²	8	41.5 Å²	41.5	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-49.4	177.3	0	0	0	0	0	112.1	Y203 F206 F225 G226 H231 L232 N233	Y203-A229 WeakPolarHBondContact CB-O 3.3Å; F206-A229 HydrophobicContact CB-CB 3.86Å; F225-A229 PolarHBondContact O-N 3.29Å; G226-A229 WeakPolarHBondContact O-CA 3.4Å; G226-A229 WeakPolarHBondContact O-CB 3.28Å; G226-A229 PolarHBondContact O-N 3.33Å; A229-H231 VanDerWaalsContact C-N 3.29Å; A229-H231 PolarHBondContact O-N 3.31Å; A229-L232 CarbonylContact O-C 3.6Å; A229-L232 PolarHBondContact O-N 2.94Å; A229-N233 PolarHBondContact O-N 3.42Å
230	A	83.8	Confident	81.7	Confident	4 Å²	4	39 Å²	39	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-32.4	178	0	0	0	0	0	112.5	G226 L232 N233 P234 W240 L243	G226-A230 PolarHBondContact O-N 2.84Å; A230-L232 VanDerWaalsContact C-N 3.33Å; A230-L232 PolarHBondContact O-N 3.02Å; A230-N233 CarbonylContact O-C 3.49Å; A230-P234 WeakPolarHBondContact O-CA 3.19Å; A230-W240 HydrophobicContact CB-CD2 3.89Å; A230-W240 HydrophobicContact CB-CE3 4.09Å; A230-W240 HydrophobicContact CB-CH2 3.79Å; A230-W240 HydrophobicContact CB-CZ2 3.62Å; A230-W240 HydrophobicContact CB-CZ3 4.04Å; A230-W240 WeakPolarHBondContact O-CZ2 3.37Å; A230-L243 HydrophobicContact CB-CD1 3.63Å
231	H	76.7	Confident	82.1	Confident	15 Å²	15	34.8 Å²	34.8	7%	0.069	19%	0.186	C	C	.	.	H	α-helix	trans	-71.8	-21	171	-88.5	-32	0	0	0	115.4	F18 F21 D22 R25 L227 I228 A229 W240	F18-H231 AromaticContact CE2-CD2 3.69Å; F18-H231 AromaticContact CE2-NE2 3.37Å; F18-H231 WeakPolarHBondContact CE2-NE2 3.09Å; F18-H231 AromaticContact CZ-CD2 3.89Å; F18-H231 AromaticContact CZ-CE1 3.93Å; F18-H231 AromaticContact CZ-NE2 3.22Å; F18-H231 WeakPolarHBondContact CZ-NE2 3.42Å; F21-H231 AromaticContact CE1-CD2 3.75Å; F21-H231 AromaticContact CE1-NE2 3.94Å; D22-H231 IonicContact OD1-CE1 2.83Å; D22-H231 PolarHBondContact OD1-CE1 2.72Å; D22-H231 IonicContact OD1-NE2 3.62Å; D22-H231 PolarHBondContact OD1-NE2 3.41Å; R25-H231 PolarHBondContact NH1-CD2 3.25Å; R25-H231 PolarHBondContact NH1-CE1 3.28Å; R25-H231 VanDerWaalsContact NH1-CG 3.28Å; R25-H231 PolarHBondContact NH1-ND1 2.86Å; R25-H231 PolarHBondContact NH1-NE2 2.98Å; R25-H231 PolarHBondContact NH2-O 3.05Å; L227-H231 WeakPolarHBondContact O-CB 3.21Å; L227-H231 PolarHBondContact O-CD2 2.77Å; L227-H231 PolarHBondContact O-N 3.29Å; I228-H231 PolarHBondContact O-N 3.41Å; A229-H231 VanDerWaalsContact C-N 3.29Å; A229-H231 PolarHBondContact O-N 3.31Å; H231-W240 AromaticContact CE1-CH2 3.57Å; H231-W240 AromaticContact CG-CH2 3.83Å; H231-W240 AromaticContact ND1-CH2 3.33Å; H231-W240 VanDerWaalsContact ND1-CH2 3.33Å; H231-W240 WeakPolarHBondContact ND1-CH2 3.18Å; H231-W240 AromaticContact ND1-CZ2 3.56Å
232	L	78.7	Confident	82.3	Confident	53 Å²	53	34.7 Å²	34.7	28%	0.277	18%	0.183	S	C	.	.	H	α-helix	trans	-91.5	-25.7	175.4	-71.1	171.7	0	0	0	112.2	L201 F206 I228 A229 A230	L201-L232 HydrophobicContact CD2-CD2 4.35Å; F206-L232 HydrophobicContact CD2-CD1 3.51Å; F206-L232 HydrophobicContact CE2-CD1 3.5Å; I228-L232 HydrophobicContact CG2-CD1 3.99Å; I228-L232 WeakPolarHBondContact O-CG 3.24Å; I228-L232 PolarHBondContact O-N 2.73Å; I228-L232 VanDerWaalsContact O-N 3.09Å; A229-L232 CarbonylContact O-C 3.6Å; A229-L232 PolarHBondContact O-N 2.94Å; A230-L232 VanDerWaalsContact C-N 3.33Å; A230-L232 PolarHBondContact O-N 3.02Å
233	N	77.5	Confident	82.4	Confident	29 Å²	29	34.9 Å²	34.9	16%	0.155	18%	0.184	C	C	.	.			trans	-119.7	73.3	167.1	-180	24.9	0	0	0	112.1	Y203 A229 A230 S235 D236	Y203-N233 HydrophobicContact CD1-CB 3.74Å; Y203-N233 HydrophobicContact CD2-CB 3.85Å; Y203-N233 HydrophobicContact CE1-CB 4.11Å; Y203-N233 HydrophobicContact CE2-CB 4.19Å; Y203-N233 HydrophobicContact CG-CB 3.61Å; A229-N233 PolarHBondContact O-N 3.42Å; A230-N233 CarbonylContact O-C 3.49Å; N233-S235 PolarHBondContact O-N 2.98Å; N233-S235 VanDerWaalsContact O-N 3.08Å; N233-S235 PolarHBondContact OD1-OG 3.17Å; N233-D236 PolarHBondContact O-N 3Å
234	P	73.1	Confident	82.5	Confident	41 Å²	41	34.7 Å²	34.7	27%	0.266	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13	-176.6	-21.5	34.5	0	0	0	115	A230 D236 Y266	A230-P234 WeakPolarHBondContact O-CA 3.19Å; P234-D236 VanDerWaalsContact C-N 3.25Å; P234-D236 PolarHBondContact O-N 3.48Å; P234-Y266 HydrophobicContact CB-CE1 4.44Å; P234-Y266 HydrophobicContact CB-CE2 3.84Å; P234-Y266 VanDerWaalsContact CB-OH 3.29Å; P234-Y266 WeakPolarHBondContact CB-OH 3.4Å; P234-Y266 WeakPolarHBondContact O-CD2 3.31Å; P234-Y266 WeakPolarHBondContact O-CE2 3.37Å
235	S	75.9	Confident	82.9	Confident	93 Å²	93	35.3 Å²	35.3	65%	0.65	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.5	179.1	16.9	0	0	0	0	114.3	N233	N233-S235 PolarHBondContact O-N 2.98Å; N233-S235 VanDerWaalsContact O-N 3.08Å; N233-S235 PolarHBondContact OD1-OG 3.17Å
236	D	79.5	Confident	83	Confident	57 Å²	57	35 Å²	35	31%	0.305	19%	0.187	S	C	.	.			trans	-90.6	108.3	-179.3	-160.6	-42.6	0	0	0	110.8	N233 P234 E238 E239	N233-D236 PolarHBondContact O-N 3Å; P234-D236 VanDerWaalsContact C-N 3.25Å; P234-D236 PolarHBondContact O-N 3.48Å; D236-E238 PolarHBondContact OD1-N 3.16Å; D236-E239 PolarHBondContact OD1-N 3.05Å
237	C	81	Confident	83.2	Confident	26 Å²	26	34.7 Å²	34.7	18%	0.176	18%	0.184	C	C	.	.	H	α-helix	trans	-79.4	-26.7	179	-62.5	0	0	0	0	112.4	W240 I241 Y266	C237-W240 PolarHBondContact O-N 3.48Å; C237-I241 WeakPolarHBondContact O-CD1 3.44Å; C237-I241 VanDerWaalsContact O-CG1 3.3Å; C237-I241 WeakPolarHBondContact O-CG1 3.45Å; C237-I241 PolarHBondContact O-N 3.27Å; C237-Y266 VanDerWaalsContact SG-CB 3.58Å
238	E	83.5	Confident	83.4	Confident	155 Å²	155	37 Å²	37	72%	0.724	20%	0.196	S	C	*	.	H	α-helix	trans	-73.6	-41.3	-173.5	-62.7	-170.6	164.7	0	0	110.7	D236 W240 I241 R242	D236-E238 PolarHBondContact OD1-N 3.16Å; E238-W240 VanDerWaalsContact C-N 3.33Å; E238-W240 PolarHBondContact O-N 3.38Å; E238-I241 PolarHBondContact O-N 3.42Å; E238-R242 PolarHBondContact O-N 2.99Å
239	E	83.4	Confident	83.7	Confident	52 Å²	52	44.2 Å²	44.2	24%	0.243	23%	0.23	C	C	.	.	H	α-helix	trans	-65.6	-33.3	172.7	-66.8	-78.9	-145	0	0	112.2	D236 I241 R242 L243	D236-E239 PolarHBondContact OD1-N 3.05Å; E239-I241 VanDerWaalsContact C-N 3.32Å; E239-I241 PolarHBondContact O-N 3.28Å; E239-R242 PolarHBondContact O-N 3.26Å; E239-R242 IonicContact OE1-NH1 3.19Å; E239-R242 WeakPolarHBondContact OE2-CD 3.36Å; E239-R242 IonicContact OE2-NH1 2.79Å; E239-R242 PolarHBondContact OE2-NH1 2.95Å; E239-R242 VanDerWaalsContact OE2-NH1 3.12Å; E239-L243 WeakPolarHBondContact O-CB 3.28Å; E239-L243 WeakPolarHBondContact O-CD1 3.36Å; E239-L243 WeakPolarHBondContact O-CG 3.05Å; E239-L243 PolarHBondContact O-N 3.43Å
240	W	87.5	Confident	83.8	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-35.5	172.8	-81.5	118.3	0	0	0	112.9	F18 L227 A230 H231 C237 E238 A244 C259 K262 A263	F18-W240 HydrophobicContact CZ-CZ3 4.49Å; L227-W240 HydrophobicContact CD2-CZ3 4.02Å; A230-W240 HydrophobicContact CB-CD2 3.89Å; A230-W240 HydrophobicContact CB-CE3 4.09Å; A230-W240 HydrophobicContact CB-CH2 3.79Å; A230-W240 HydrophobicContact CB-CZ2 3.62Å; A230-W240 HydrophobicContact CB-CZ3 4.04Å; A230-W240 WeakPolarHBondContact O-CZ2 3.37Å; H231-W240 AromaticContact CE1-CH2 3.57Å; H231-W240 AromaticContact CG-CH2 3.83Å; H231-W240 AromaticContact ND1-CH2 3.33Å; H231-W240 VanDerWaalsContact ND1-CH2 3.33Å; H231-W240 WeakPolarHBondContact ND1-CH2 3.18Å; H231-W240 AromaticContact ND1-CZ2 3.56Å; C237-W240 PolarHBondContact O-N 3.48Å; E238-W240 VanDerWaalsContact C-N 3.33Å; E238-W240 PolarHBondContact O-N 3.38Å; W240-A244 WeakPolarHBondContact O-CB 3.29Å; W240-A244 PolarHBondContact O-N 2.64Å; W240-A244 VanDerWaalsContact O-N 3.11Å; W240-C259 HydrophobicContact CE3-CB 4.04Å; W240-C259 WeakPolarHBondContact O-CB 3.26Å; W240-K262 HydrophobicContact CD2-CB 3.93Å; W240-K262 HydrophobicContact CE3-CB 4.2Å; W240-K262 HydrophobicContact CG-CB 4.42Å; W240-K262 HydrophobicContact CH2-CG 4.47Å; W240-K262 HydrophobicContact CZ2-CB 4.26Å; W240-A263 HydrophobicContact CB-CB 3.95Å
241	I	88.3	Confident	83.9	Confident	15 Å²	15	52.8 Å²	52.8	8%	0.077	27%	0.273	C	S	.	.	H	α-helix	trans	-74.2	-46.5	178.1	-62.2	149.7	0	0	0	109.8	C237 E238 E239 L243 A244 D245 Y260 A263 Y273	C237-I241 WeakPolarHBondContact O-CD1 3.44Å; C237-I241 VanDerWaalsContact O-CG1 3.3Å; C237-I241 WeakPolarHBondContact O-CG1 3.45Å; C237-I241 PolarHBondContact O-N 3.27Å; E238-I241 PolarHBondContact O-N 3.42Å; E239-I241 VanDerWaalsContact C-N 3.32Å; E239-I241 PolarHBondContact O-N 3.28Å; I241-L243 VanDerWaalsContact C-N 3.28Å; I241-L243 PolarHBondContact O-N 3.05Å; I241-A244 CarbonylContact O-C 3.58Å; I241-A244 WeakPolarHBondContact O-CA 3.49Å; I241-A244 VanDerWaalsContact O-CB 3.27Å; I241-A244 WeakPolarHBondContact O-CB 3.27Å; I241-A244 PolarHBondContact O-N 3.02Å; I241-D245 PolarHBondContact O-N 2.88Å; I241-Y260 HydrophobicContact CG2-CE1 4.36Å; I241-A263 HydrophobicContact CG1-CB 4.47Å; I241-Y273 HydrophobicContact CD1-CD1 3.95Å; I241-Y273 HydrophobicContact CD1-CD2 4.47Å; I241-Y273 HydrophobicContact CD1-CE1 3.23Å; I241-Y273 HydrophobicContact CD1-CE2 3.85Å; I241-Y273 WeakPolarHBondContact CD1-OH 3.47Å; I241-Y273 HydrophobicContact CG1-CD1 4.09Å; I241-Y273 HydrophobicContact CG1-CE1 3.84Å
242	R	87.5	Confident	84.4	Confident	81 Å²	81	55.6 Å²	55.6	31%	0.306	29%	0.288	S	S	.	.	H	α-helix	trans	-54.3	-44.1	175.6	-172.4	-170.4	-177.5	-165.7	0.1	112.1	E214 E238 E239 A244 D245 M246	E214-R242 IonicContact OE1-CZ 2.89Å; E214-R242 IonicContact OE1-NE 3.24Å; E214-R242 IonicContact OE1-NH2 2.68Å; E214-R242 PolarHBondContact OE1-NH2 3.45Å; E214-R242 IonicContact OE2-CZ 3.68Å; E214-R242 IonicContact OE2-NH2 2.72Å; E214-R242 PolarHBondContact OE2-NH2 3.48Å; E238-R242 PolarHBondContact O-N 2.99Å; E239-R242 PolarHBondContact O-N 3.26Å; E239-R242 IonicContact OE1-NH1 3.19Å; E239-R242 WeakPolarHBondContact OE2-CD 3.36Å; E239-R242 IonicContact OE2-NH1 2.79Å; E239-R242 PolarHBondContact OE2-NH1 2.95Å; E239-R242 VanDerWaalsContact OE2-NH1 3.12Å; R242-A244 VanDerWaalsContact C-N 3.33Å; R242-D245 PolarHBondContact O-N 2.85Å; R242-M246 HydrophobicContact CG-SD 4.36Å; R242-M246 WeakPolarHBondContact O-CB 3.45Å; R242-M246 VanDerWaalsContact O-CG 3.29Å; R242-M246 WeakPolarHBondContact O-CG 3.48Å; R242-M246 PolarHBondContact O-N 2.9Å
243	L	88.9	Confident	84.8	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-72	-25.9	176.7	-65.4	165.2	0	0	0	112.9	L223 G226 L227 A230 E239 I241 M246 S247	L223-L243 HydrophobicContact CD1-CB 4.39Å; L223-L243 HydrophobicContact CD1-CD2 3.89Å; G226-L243 VanDerWaalsContact C-CD1 3.42Å; G226-L243 WeakPolarHBondContact O-CD1 3.27Å; L227-L243 HydrophobicContact CD2-CB 4.17Å; L227-L243 HydrophobicContact CD2-CD1 4.27Å; A230-L243 HydrophobicContact CB-CD1 3.63Å; E239-L243 WeakPolarHBondContact O-CB 3.28Å; E239-L243 WeakPolarHBondContact O-CD1 3.36Å; E239-L243 WeakPolarHBondContact O-CG 3.05Å; E239-L243 PolarHBondContact O-N 3.43Å; I241-L243 VanDerWaalsContact C-N 3.28Å; I241-L243 PolarHBondContact O-N 3.05Å; L243-M246 HydrophobicContact CD2-SD 4.29Å; L243-S247 WeakPolarHBondContact O-CB 3.38Å; L243-S247 PolarHBondContact O-N 3.38Å; L243-S247 PolarHBondContact O-OG 3.25Å
244	A	88.1	Confident	85.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-68.9	-45	169.8	0	0	0	0	0	110.9	W240 I241 R242 S247 L248 A256 C259 Y260	W240-A244 WeakPolarHBondContact O-CB 3.29Å; W240-A244 PolarHBondContact O-N 2.64Å; W240-A244 VanDerWaalsContact O-N 3.11Å; I241-A244 CarbonylContact O-C 3.58Å; I241-A244 WeakPolarHBondContact O-CA 3.49Å; I241-A244 VanDerWaalsContact O-CB 3.27Å; I241-A244 WeakPolarHBondContact O-CB 3.27Å; I241-A244 PolarHBondContact O-N 3.02Å; R242-A244 VanDerWaalsContact C-N 3.33Å; A244-S247 CarbonylContact O-C 3.17Å; A244-S247 WeakPolarHBondContact O-CA 3.4Å; A244-S247 VanDerWaalsContact O-CB 3.29Å; A244-S247 WeakPolarHBondContact O-CB 3.32Å; A244-S247 PolarHBondContact O-N 3.11Å; A244-L248 WeakPolarHBondContact O-CG 3.01Å; A244-L248 PolarHBondContact O-N 3.49Å; A244-A256 HydrophobicContact CB-CB 4.29Å; A244-A256 WeakPolarHBondContact O-CB 3.35Å; A244-C259 HydrophobicContact CB-CB 3.64Å; A244-Y260 HydrophobicContact CB-CD2 3.56Å; A244-Y260 HydrophobicContact CB-CE2 3.37Å; A244-Y260 HydrophobicContact CB-CG 4.22Å
245	D	89.5	Confident	85.7	Confident	67 Å²	67	59.6 Å²	59.6	36%	0.358	30%	0.296	S	S	.	.	H	α-helix	trans	-68.3	-43.2	-179.6	-62.5	-19.7	0	0	0	111.1	I241 R242 S247 L248 E249 Y260	I241-D245 PolarHBondContact O-N 2.88Å; R242-D245 PolarHBondContact O-N 2.85Å; D245-S247 PolarHBondContact O-N 3.45Å; D245-L248 WeakPolarHBondContact O-CA 3.18Å; D245-L248 WeakPolarHBondContact O-CB 3.16Å; D245-L248 PolarHBondContact O-N 2.96Å; D245-E249 PolarHBondContact O-N 3.49Å; D245-Y260 PolarHBondContact OD1-OH 3.49Å
246	M	87.8	Confident	86.3	Confident	17 Å²	17	55.2 Å²	55.2	8%	0.084	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-31.2	168.3	-69.3	174.4	75.9	0	0	112.7	E214 V219 A222 L223 R242 L243 Q250	E214-M246 HydrophobicContact CG-CE 4.46Å; V219-M246 HydrophobicContact CG1-CE 4.31Å; A222-M246 HydrophobicContact CB-CE 3.98Å; L223-M246 HydrophobicContact CD1-CB 4.03Å; R242-M246 HydrophobicContact CG-SD 4.36Å; R242-M246 WeakPolarHBondContact O-CB 3.45Å; R242-M246 VanDerWaalsContact O-CG 3.29Å; R242-M246 WeakPolarHBondContact O-CG 3.48Å; R242-M246 PolarHBondContact O-N 2.9Å; L243-M246 HydrophobicContact CD2-SD 4.29Å; M246-Q250 PolarHBondContact O-N 3.41Å
247	S	88.2	Confident	86.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-72.9	-29.8	172.7	-59.9	0	0	0	0	112.2	L243 A244 D245 Q250 N252 Q255	L243-S247 WeakPolarHBondContact O-CB 3.38Å; L243-S247 PolarHBondContact O-N 3.38Å; L243-S247 PolarHBondContact O-OG 3.25Å; A244-S247 CarbonylContact O-C 3.17Å; A244-S247 WeakPolarHBondContact O-CA 3.4Å; A244-S247 VanDerWaalsContact O-CB 3.29Å; A244-S247 WeakPolarHBondContact O-CB 3.32Å; A244-S247 PolarHBondContact O-N 3.11Å; D245-S247 PolarHBondContact O-N 3.45Å; S247-Q250 PolarHBondContact O-N 3.13Å; S247-N252 WeakPolarHBondContact O-CA 3.34Å; S247-N252 WeakPolarHBondContact O-CB 3.36Å; S247-N252 PolarHBondContact O-N 3.07Å; S247-Q255 PolarHBondContact OG-NE2 2.94Å
248	L	88.8	Confident	87	Confident	48 Å²	48	53.6 Å²	53.6	25%	0.251	26%	0.255	S	S	.	.	H	α-helix	trans	-74.3	-35.7	173.9	-66.4	176.4	0	0	0	112.2	A244 D245 Q250 D251 V253 A256 L280	A244-L248 WeakPolarHBondContact O-CG 3.01Å; A244-L248 PolarHBondContact O-N 3.49Å; D245-L248 WeakPolarHBondContact O-CA 3.18Å; D245-L248 WeakPolarHBondContact O-CB 3.16Å; D245-L248 PolarHBondContact O-N 2.96Å; L248-Q250 PolarHBondContact O-N 3.5Å; L248-D251 PolarHBondContact O-N 3.1Å; L248-V253 HydrophobicContact CD2-CG2 4.37Å; L248-A256 HydrophobicContact CD2-CB 3.61Å; L248-A256 HydrophobicContact CG-CB 3.76Å; L248-L280 HydrophobicContact CD1-CD1 4.25Å; L248-L280 HydrophobicContact CD1-CD2 4.29Å; L248-L280 HydrophobicContact CD2-CD1 3.91Å; L248-L280 HydrophobicContact CD2-CD2 3.54Å; L248-L280 HydrophobicContact CD2-CG 4.38Å
249	E	87.5	Confident	87.2	Confident	160 Å²	160	46.2 Å²	46.2	75%	0.748	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.2	171.3	-69	-177.5	159.1	0	0	113	D245	D245-E249 PolarHBondContact O-N 3.49Å
250	Q	85.2	Confident	87.5	Confident	48 Å²	48	44.2 Å²	44.2	22%	0.224	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	9.7	172.4	-64.3	-163	-23.9	0	0	114.5	V219 D220 M246 S247 L248 N252	V219-Q250 HydrophobicContact CG1-CG 4.39Å; D220-Q250 PolarHBondContact OD1-NE2 3.19Å; M246-Q250 PolarHBondContact O-N 3.41Å; S247-Q250 PolarHBondContact O-N 3.13Å; L248-Q250 PolarHBondContact O-N 3.5Å; Q250-N252 HydrophobicContact CB-CB 4.39Å; Q250-N252 WeakPolarHBondContact CB-ND2 3.38Å; Q250-N252 PolarHBondContact O-N 3.14Å; Q250-N252 PolarHBondContact OE1-ND2 3.43Å; Q250-N252 VanDerWaalsContact OE1-ND2 3.1Å
251	D	85.1	Confident	87.5	Confident	144 Å²	144	46.3 Å²	46.3	77%	0.77	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	13.3	-170.3	-77.4	-44.3	0	0	0	114.9	L248 V253	L248-D251 PolarHBondContact O-N 3.1Å; D251-V253 PolarHBondContact O-N 2.62Å
252	N	86.6	Confident	87.4	Confident	74 Å²	74	46.7 Å²	46.7	40%	0.396	23%	0.225	S	C	.	.			trans	-80.7	56.5	-179.1	-79.3	-46.2	0	0	0	112	S247 Q250 R254 Q255 A256	S247-N252 WeakPolarHBondContact O-CA 3.34Å; S247-N252 WeakPolarHBondContact O-CB 3.36Å; S247-N252 PolarHBondContact O-N 3.07Å; Q250-N252 HydrophobicContact CB-CB 4.39Å; Q250-N252 WeakPolarHBondContact CB-ND2 3.38Å; Q250-N252 PolarHBondContact O-N 3.14Å; Q250-N252 PolarHBondContact OE1-ND2 3.43Å; Q250-N252 VanDerWaalsContact OE1-ND2 3.1Å; N252-R254 VanDerWaalsContact C-N 3.29Å; N252-R254 PolarHBondContact O-N 3.04Å; N252-R254 VanDerWaalsContact O-N 3.13Å; N252-Q255 HydrophobicContact CB-CB 4.25Å; N252-Q255 WeakPolarHBondContact O-CB 3.49Å; N252-Q255 PolarHBondContact O-N 3.37Å; N252-A256 PolarHBondContact O-N 3.41Å; N252-A256 VanDerWaalsContact O-N 3.16Å
253	V	87.6	Confident	87.3	Confident	29 Å²	29	42.9 Å²	42.9	18%	0.176	21%	0.21	C	C	.	.	H	α-helix	trans	-50	-40.7	-172.8	175.6	0	0	0	0	113.9	L248 D251 A256 I257 L280 L284	L248-V253 HydrophobicContact CD2-CG2 4.37Å; D251-V253 PolarHBondContact O-N 2.62Å; V253-A256 WeakPolarHBondContact O-CB 3.31Å; V253-A256 PolarHBondContact O-N 2.81Å; V253-I257 HydrophobicContact CG1-CD1 4.05Å; V253-I257 WeakPolarHBondContact O-CG1 3.48Å; V253-I257 PolarHBondContact O-N 3.49Å; V253-L280 HydrophobicContact CG1-CB 4.14Å; V253-L280 HydrophobicContact CG1-CD2 4.22Å; V253-L284 HydrophobicContact CB-CD2 4.43Å; V253-L284 HydrophobicContact CG1-CD1 4.11Å; V253-L284 HydrophobicContact CG1-CD2 4.06Å; V253-L284 HydrophobicContact CG1-CG 3.87Å
254	R	85.8	Confident	87.2	Confident	151 Å²	151	43.8 Å²	43.8	57%	0.57	22%	0.215	S	C	*	.	H	α-helix	trans	-65.8	-40.2	178.6	-67.6	-178.4	-178.6	176	0.6	112.8	E19 N252 A256 I257 I258 L284	E19-R254 WeakPolarHBondContact OE1-CB 3.22Å; E19-R254 WeakPolarHBondContact OE1-CD 3.38Å; E19-R254 IonicContact OE2-NH1 2.85Å; N252-R254 VanDerWaalsContact C-N 3.29Å; N252-R254 PolarHBondContact O-N 3.04Å; N252-R254 VanDerWaalsContact O-N 3.13Å; R254-A256 VanDerWaalsContact C-N 3.33Å; R254-I257 PolarHBondContact O-N 3.27Å; R254-I258 PolarHBondContact O-N 3.02Å; R254-L284 HydrophobicContact CG-CD1 3.69Å
255	Q	84.1	Confident	87	Confident	27 Å²	27	50.1 Å²	50.1	13%	0.126	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-40	177.4	-170.3	173.5	-85.8	0	0	110.7	F18 L227 S247 N252 I257 I258 C259	F18-Q255 HydrophobicContact CD1-CG 3.87Å; F18-Q255 HydrophobicContact CG-CG 4.48Å; L227-Q255 HydrophobicContact CD1-CG 4.38Å; S247-Q255 PolarHBondContact OG-NE2 2.94Å; N252-Q255 HydrophobicContact CB-CB 4.25Å; N252-Q255 WeakPolarHBondContact O-CB 3.49Å; N252-Q255 PolarHBondContact O-N 3.37Å; Q255-I257 PolarHBondContact O-N 3.33Å; Q255-I258 PolarHBondContact O-N 3.23Å; Q255-C259 PolarHBondContact O-N 3.22Å; Q255-C259 PolarHBondContact O-SG 3.05Å
256	A	88.8	Confident	86.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-44.6	171.4	0	0	0	0	0	111.9	A244 L248 N252 V253 R254 I258 C259 Y260 L280	A244-A256 HydrophobicContact CB-CB 4.29Å; A244-A256 WeakPolarHBondContact O-CB 3.35Å; L248-A256 HydrophobicContact CD2-CB 3.61Å; L248-A256 HydrophobicContact CG-CB 3.76Å; N252-A256 PolarHBondContact O-N 3.41Å; N252-A256 VanDerWaalsContact O-N 3.16Å; V253-A256 WeakPolarHBondContact O-CB 3.31Å; V253-A256 PolarHBondContact O-N 2.81Å; R254-A256 VanDerWaalsContact C-N 3.33Å; A256-I258 VanDerWaalsContact C-N 3.32Å; A256-I258 PolarHBondContact O-N 3.47Å; A256-C259 PolarHBondContact O-N 3.45Å; A256-C259 VanDerWaalsContact O-N 3.15Å; A256-Y260 VanDerWaalsContact O-CD2 3.29Å; A256-Y260 WeakPolarHBondContact O-CD2 3.25Å; A256-Y260 PolarHBondContact O-N 3.02Å; A256-L280 HydrophobicContact CB-CD1 3.98Å
257	I	88.2	Confident	86.3	Confident	13 Å²	13	53.9 Å²	53.9	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-38.8	175.9	-69.7	161.9	0	0	0	111.9	V253 R254 Q255 T261 R277 L280 Q281 L284	V253-I257 HydrophobicContact CG1-CD1 4.05Å; V253-I257 WeakPolarHBondContact O-CG1 3.48Å; V253-I257 PolarHBondContact O-N 3.49Å; R254-I257 PolarHBondContact O-N 3.27Å; Q255-I257 PolarHBondContact O-N 3.33Å; I257-T261 WeakPolarHBondContact O-CB 3.48Å; I257-T261 PolarHBondContact O-N 3.17Å; I257-T261 PolarHBondContact O-OG1 3.38Å; I257-R277 HydrophobicContact CG2-CG 4.17Å; I257-L280 HydrophobicContact CD1-CB 3.82Å; I257-L280 HydrophobicContact CG1-CB 3.58Å; I257-L280 HydrophobicContact CG1-CD1 4.15Å; I257-Q281 HydrophobicContact CD1-CG 3.87Å; I257-Q281 HydrophobicContact CG1-CG 4.31Å; I257-Q281 HydrophobicContact CG2-CG 4.14Å; I257-L284 HydrophobicContact CD1-CD1 3.42Å; I257-L284 VanDerWaalsContact CD1-CD1 3.42Å; I257-L284 HydrophobicContact CD1-CG 4.25Å
258	I	86.9	Confident	86	Confident	37 Å²	37	57.6 Å²	57.6	19%	0.19	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-46.3	174	-64.9	170.9	0	0	0	110.3	F18 E19 R254 Q255 A256 T261 K262	F18-I258 HydrophobicContact CE1-CG2 3.85Å; E19-I258 HydrophobicContact CB-CD1 4.21Å; E19-I258 HydrophobicContact CG-CD1 3.92Å; R254-I258 PolarHBondContact O-N 3.02Å; Q255-I258 PolarHBondContact O-N 3.23Å; A256-I258 VanDerWaalsContact C-N 3.32Å; A256-I258 PolarHBondContact O-N 3.47Å; I258-T261 CarbonylContact O-C 3.57Å; I258-T261 WeakPolarHBondContact O-CB 3.14Å; I258-T261 PolarHBondContact O-N 3.08Å; I258-T261 VanDerWaalsContact O-N 3.15Å; I258-K262 HydrophobicContact CG2-CG 4.36Å; I258-K262 VanDerWaalsContact O-CG 3.3Å; I258-K262 WeakPolarHBondContact O-CG 3.32Å; I258-K262 PolarHBondContact O-N 2.88Å
259	C	87.1	Confident	85.6	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-50.2	179.1	-63.2	0	0	0	0	111.9	L227 W240 A244 Q255 A256 T261 K262 A263	L227-C259 VanDerWaalsContact CD2-SG 3.54Å; W240-C259 HydrophobicContact CE3-CB 4.04Å; W240-C259 WeakPolarHBondContact O-CB 3.26Å; A244-C259 HydrophobicContact CB-CB 3.64Å; Q255-C259 PolarHBondContact O-N 3.22Å; Q255-C259 PolarHBondContact O-SG 3.05Å; A256-C259 PolarHBondContact O-N 3.45Å; A256-C259 VanDerWaalsContact O-N 3.15Å; C259-T261 VanDerWaalsContact C-N 3.29Å; C259-T261 PolarHBondContact O-N 3.42Å; C259-K262 PolarHBondContact O-N 3.44Å; C259-K262 VanDerWaalsContact O-N 3.08Å; C259-A263 PolarHBondContact O-N 3.39Å
260	Y	89.5	Confident	85.4	Confident	10 Å²	10	54.3 Å²	54.3	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-58.1	-38.6	172.1	-82	-68.3	0	0	0	112.3	I241 A244 D245 A256 K262 A263 I264 Y273 E276 R277 L280	I241-Y260 HydrophobicContact CG2-CE1 4.36Å; A244-Y260 HydrophobicContact CB-CD2 3.56Å; A244-Y260 HydrophobicContact CB-CE2 3.37Å; A244-Y260 HydrophobicContact CB-CG 4.22Å; D245-Y260 PolarHBondContact OD1-OH 3.49Å; A256-Y260 VanDerWaalsContact O-CD2 3.29Å; A256-Y260 WeakPolarHBondContact O-CD2 3.25Å; A256-Y260 PolarHBondContact O-N 3.02Å; Y260-K262 VanDerWaalsContact C-N 3.34Å; Y260-K262 PolarHBondContact O-N 3.41Å; Y260-A263 PolarHBondContact O-N 3.33Å; Y260-I264 VanDerWaalsContact O-CD1 3.26Å; Y260-I264 WeakPolarHBondContact O-CD1 3.4Å; Y260-I264 WeakPolarHBondContact O-CG1 3.38Å; Y260-I264 PolarHBondContact O-N 3.13Å; Y260-Y273 HydrophobicContact CE1-CD1 4.26Å; Y260-E276 HydrophobicContact CD1-CB 4.44Å; Y260-E276 HydrophobicContact CE1-CB 3.94Å; Y260-E276 HydrophobicContact CE1-CG 4.49Å; Y260-E276 HydrophobicContact CE2-CB 4.25Å; Y260-R277 HydrophobicContact CG-CB 4.5Å; Y260-L280 HydrophobicContact CD2-CD1 3.94Å; Y260-L280 HydrophobicContact CE2-CD1 4.05Å
261	T	88.4	Confident	85.2	Confident	46 Å²	46	53.9 Å²	53.9	28%	0.282	27%	0.271	S	S	.	.	H	α-helix	trans	-67.1	-31.2	176.1	-59.9	0	0	0	0	112.8	I257 I258 C259 K265 R277	I257-T261 WeakPolarHBondContact O-CB 3.48Å; I257-T261 PolarHBondContact O-N 3.17Å; I257-T261 PolarHBondContact O-OG1 3.38Å; I258-T261 CarbonylContact O-C 3.57Å; I258-T261 WeakPolarHBondContact O-CB 3.14Å; I258-T261 PolarHBondContact O-N 3.08Å; I258-T261 VanDerWaalsContact O-N 3.15Å; C259-T261 VanDerWaalsContact C-N 3.29Å; C259-T261 PolarHBondContact O-N 3.42Å; T261-K265 WeakPolarHBondContact O-CG 3.49Å; T261-R277 VanDerWaalsContact OG1-CD 3.28Å; T261-R277 WeakPolarHBondContact OG1-CD 3.39Å
262	K	85.1	Confident	85.1	Confident	23 Å²	23	54 Å²	54	10%	0.1	26%	0.261	C	S	.	.	H	α-helix	trans	-75	-42.1	173.4	-59.8	-85.4	174.8	170	0	109.8	D22 D26 W240 I258 C259 Y260 I264 K265 Y266	D22-K262 IonicContact OD1-NZ 3.75Å; D22-K262 PolarHBondContact OD1-NZ 3.45Å; D22-K262 WeakPolarHBondContact OD2-CE 3.46Å; D22-K262 IonicContact OD2-NZ 2.95Å; D22-K262 PolarHBondContact OD2-NZ 3.34Å; D26-K262 IonicContact OD2-NZ 3.72Å; W240-K262 HydrophobicContact CD2-CB 3.93Å; W240-K262 HydrophobicContact CE3-CB 4.2Å; W240-K262 HydrophobicContact CG-CB 4.42Å; W240-K262 HydrophobicContact CH2-CG 4.47Å; W240-K262 HydrophobicContact CZ2-CB 4.26Å; I258-K262 HydrophobicContact CG2-CG 4.36Å; I258-K262 VanDerWaalsContact O-CG 3.3Å; I258-K262 WeakPolarHBondContact O-CG 3.32Å; I258-K262 PolarHBondContact O-N 2.88Å; C259-K262 PolarHBondContact O-N 3.44Å; C259-K262 VanDerWaalsContact O-N 3.08Å; Y260-K262 VanDerWaalsContact C-N 3.34Å; Y260-K262 PolarHBondContact O-N 3.41Å; K262-I264 PolarHBondContact O-N 3.35Å; K262-K265 WeakPolarHBondContact O-CB 3.34Å; K262-K265 PolarHBondContact O-N 2.85Å; K262-Y266 WeakPolarHBondContact O-CD2 3.44Å
263	A	86.8	Confident	85.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.9	-48.4	174	0	0	0	0	0	113	W240 I241 C259 Y260 K265 Y266 D267	W240-A263 HydrophobicContact CB-CB 3.95Å; I241-A263 HydrophobicContact CG1-CB 4.47Å; C259-A263 PolarHBondContact O-N 3.39Å; Y260-A263 PolarHBondContact O-N 3.33Å; A263-K265 PolarHBondContact O-N 2.91Å; A263-K265 VanDerWaalsContact O-N 3.16Å; A263-Y266 PolarHBondContact O-N 2.84Å; A263-D267 PolarHBondContact O-N 3.45Å
264	I	86.6	Confident	85.1	Confident	25 Å²	25	50.3 Å²	50.3	13%	0.128	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-20.8	179.7	-66.2	158.2	0	0	0	112.8	Y260 K262 Y266 D267 P268 Y273 L274 R277	Y260-I264 VanDerWaalsContact O-CD1 3.26Å; Y260-I264 WeakPolarHBondContact O-CD1 3.4Å; Y260-I264 WeakPolarHBondContact O-CG1 3.38Å; Y260-I264 PolarHBondContact O-N 3.13Å; K262-I264 PolarHBondContact O-N 3.35Å; I264-Y266 PolarHBondContact O-N 3.15Å; I264-D267 CarbonylContact O-C 3.53Å; I264-P268 VanDerWaalsContact O-CA 3.25Å; I264-P268 WeakPolarHBondContact O-CA 3.48Å; I264-P268 WeakPolarHBondContact O-CB 3.37Å; I264-Y273 WeakPolarHBondContact CD1-O 3.27Å; I264-L274 HydrophobicContact CD1-CD2 4.21Å; I264-L274 HydrophobicContact CG2-CD2 3.93Å; I264-R277 HydrophobicContact CD1-CB 4.04Å; I264-R277 HydrophobicContact CD1-CG 4.41Å
265	K	84.5	Confident	85.1	Confident	133 Å²	133	47.3 Å²	47.3	58%	0.578	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-15.8	172.9	-73.8	171.1	179.6	-178.7	0	113.2	T261 K262 A263	T261-K265 WeakPolarHBondContact O-CG 3.49Å; K262-K265 WeakPolarHBondContact O-CB 3.34Å; K262-K265 PolarHBondContact O-N 2.85Å; A263-K265 PolarHBondContact O-N 2.91Å; A263-K265 VanDerWaalsContact O-N 3.16Å
266	Y	81.2	Confident	85.2	Confident	123 Å²	123	49.1 Å²	49.1	48%	0.482	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-36	-179.5	-62.1	-68.9	0	0	0	112.5	P234 C237 K262 A263 I264 P268	P234-Y266 HydrophobicContact CB-CE1 4.44Å; P234-Y266 HydrophobicContact CB-CE2 3.84Å; P234-Y266 VanDerWaalsContact CB-OH 3.29Å; P234-Y266 WeakPolarHBondContact CB-OH 3.4Å; P234-Y266 WeakPolarHBondContact O-CD2 3.31Å; P234-Y266 WeakPolarHBondContact O-CE2 3.37Å; C237-Y266 VanDerWaalsContact SG-CB 3.58Å; K262-Y266 WeakPolarHBondContact O-CD2 3.44Å; A263-Y266 PolarHBondContact O-N 2.84Å; I264-Y266 PolarHBondContact O-N 3.15Å; Y266-P268 WeakPolarHBondContact O-CD 3.47Å
267	D	81.4	Confident	85.3	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.214	24%	0.24	C	C	.	.			trans	-117.8	84.2	164.4	-176.7	-0	0	0	0	110.6	A263 I264 T269 N270 Y273	A263-D267 PolarHBondContact O-N 3.45Å; I264-D267 CarbonylContact O-C 3.53Å; D267-T269 PolarHBondContact O-N 3.34Å; D267-T269 PolarHBondContact OD1-N 3.38Å; D267-T269 PolarHBondContact OD1-OG1 2.84Å; D267-N270 PolarHBondContact OD1-N 3.24Å; D267-N270 WeakPolarHBondContact OD2-CB 3.49Å; D267-N270 PolarHBondContact OD2-ND2 3.01Å; D267-Y273 HydrophobicContact CB-CE2 4.43Å
268	P	81	Confident	85.3	Confident	79 Å²	79	49.8 Å²	49.8	51%	0.513	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.2	178.9	32.8	-36.6	0	0	0	113.3	I264 Y266	I264-P268 VanDerWaalsContact O-CA 3.25Å; I264-P268 WeakPolarHBondContact O-CA 3.48Å; I264-P268 WeakPolarHBondContact O-CB 3.37Å; Y266-P268 WeakPolarHBondContact O-CD 3.47Å
269	T	80.1	Confident	85.3	Confident	98 Å²	98	49.2 Å²	49.2	60%	0.601	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-15.7	-178.1	27.5	0	0	0	0	113.4	D267 V271	D267-T269 PolarHBondContact O-N 3.34Å; D267-T269 PolarHBondContact OD1-N 3.38Å; D267-T269 PolarHBondContact OD1-OG1 2.84Å; T269-V271 PolarHBondContact O-N 3.3Å
270	N	83.2	Confident	85.3	Confident	41 Å²	41	49.3 Å²	49.3	22%	0.219	24%	0.237	C	C	.	.			trans	-77.6	105.2	-174.1	-140.3	-64.5	0	0	0	113.1	D267 R272 Y273 L274	D267-N270 PolarHBondContact OD1-N 3.24Å; D267-N270 WeakPolarHBondContact OD2-CB 3.49Å; D267-N270 PolarHBondContact OD2-ND2 3.01Å; N270-R272 PolarHBondContact O-N 3.24Å; N270-R272 WeakPolarHBondContact OD1-CB 3.45Å; N270-R272 PolarHBondContact OD1-N 2.88Å; N270-Y273 HydrophobicContact CB-CD2 3.28Å; N270-Y273 HydrophobicContact CB-CE2 3.47Å; N270-Y273 VanDerWaalsContact CB-CE2 3.47Å; N270-Y273 HydrophobicContact CB-CG 3.94Å; N270-Y273 WeakPolarHBondContact ND2-CE2 3.42Å; N270-Y273 PolarHBondContact O-N 3.45Å; N270-L274 PolarHBondContact O-N 2.99Å
271	V	81.6	Confident	85.3	Confident	39 Å²	39	48.9 Å²	48.9	24%	0.236	24%	0.236	C	C	.	.	H	α-helix	trans	-56.1	-36.2	174.3	172.1	0	0	0	0	111.7	T269 Y273 L274 W275 I297 L300 L301	T269-V271 PolarHBondContact O-N 3.3Å; V271-Y273 PolarHBondContact O-N 2.98Å; V271-L274 PolarHBondContact O-N 2.97Å; V271-W275 VanDerWaalsContact O-CB 3.32Å; V271-W275 WeakPolarHBondContact O-CB 3.44Å; V271-W275 PolarHBondContact O-N 3.43Å; V271-I297 HydrophobicContact CG1-CG1 4.49Å; V271-I297 HydrophobicContact CG1-CG2 3.78Å; V271-L300 HydrophobicContact CG2-CB 4.06Å; V271-L301 HydrophobicContact CG1-CD2 4.15Å
272	R	83.7	Confident	85.1	Confident	147 Å²	147	49.3 Å²	49.3	56%	0.555	24%	0.235	S	C	*	.	H	α-helix	trans	-61.2	-46.3	179.8	-175.4	174.9	62.6	150.2	-1	112.6	N270 W275 E276	N270-R272 PolarHBondContact O-N 3.24Å; N270-R272 WeakPolarHBondContact OD1-CB 3.45Å; N270-R272 PolarHBondContact OD1-N 2.88Å; R272-W275 WeakPolarHBondContact O-CB 3.39Å; R272-W275 PolarHBondContact O-N 3.12Å; R272-E276 PolarHBondContact O-N 3.38Å
273	Y	86.9	Confident	85.1	Confident	18 Å²	18	56.9 Å²	56.9	7%	0.071	26%	0.263	C	S	.	.	H	α-helix	trans	-71.6	-36.8	-178.5	-49.7	-31.4	0	0	0	111.5	I241 Y260 I264 D267 N270 V271 W275 R277	I241-Y273 HydrophobicContact CD1-CD1 3.95Å; I241-Y273 HydrophobicContact CD1-CD2 4.47Å; I241-Y273 HydrophobicContact CD1-CE1 3.23Å; I241-Y273 HydrophobicContact CD1-CE2 3.85Å; I241-Y273 WeakPolarHBondContact CD1-OH 3.47Å; I241-Y273 HydrophobicContact CG1-CD1 4.09Å; I241-Y273 HydrophobicContact CG1-CE1 3.84Å; Y260-Y273 HydrophobicContact CE1-CD1 4.26Å; I264-Y273 WeakPolarHBondContact CD1-O 3.27Å; D267-Y273 HydrophobicContact CB-CE2 4.43Å; N270-Y273 HydrophobicContact CB-CD2 3.28Å; N270-Y273 HydrophobicContact CB-CE2 3.47Å; N270-Y273 VanDerWaalsContact CB-CE2 3.47Å; N270-Y273 HydrophobicContact CB-CG 3.94Å; N270-Y273 WeakPolarHBondContact ND2-CE2 3.42Å; N270-Y273 PolarHBondContact O-N 3.45Å; V271-Y273 PolarHBondContact O-N 2.98Å; Y273-W275 VanDerWaalsContact C-N 3.32Å; Y273-R277 VanDerWaalsContact O-CB 3.29Å; Y273-R277 WeakPolarHBondContact O-CB 3.48Å; Y273-R277 PolarHBondContact O-N 3.42Å; Y273-R277 VanDerWaalsContact O-N 3.11Å
274	L	85.7	Confident	85.1	Confident	7 Å²	7	60.2 Å²	60.2	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-41.3	171	-72.4	165.4	0	0	0	111.4	I264 N270 V271 S278 K296 I297 L300	I264-L274 HydrophobicContact CD1-CD2 4.21Å; I264-L274 HydrophobicContact CG2-CD2 3.93Å; N270-L274 PolarHBondContact O-N 2.99Å; V271-L274 PolarHBondContact O-N 2.97Å; L274-S278 VanDerWaalsContact O-CB 3.28Å; L274-S278 WeakPolarHBondContact O-CB 3.29Å; L274-S278 PolarHBondContact O-N 3.4Å; L274-S278 VanDerWaalsContact O-N 3.15Å; L274-S278 PolarHBondContact O-OG 2.72Å; L274-K296 HydrophobicContact CD1-CB 4.45Å; L274-I297 HydrophobicContact CB-CD1 3.94Å; L274-I297 HydrophobicContact CB-CG1 3.65Å; L274-I297 HydrophobicContact CD1-CG1 4.41Å; L274-L300 HydrophobicContact CD1-CD1 3.58Å
275	W	85.6	Confident	84.9	Confident	88 Å²	88	60.9 Å²	60.9	33%	0.333	29%	0.294	S	S	.	.	H	α-helix	trans	-63.9	-57.7	178.2	-173.8	-86.8	0	0	0	111.6	V271 R272 Y273 R277 S278 S279 I297 L312	V271-W275 VanDerWaalsContact O-CB 3.32Å; V271-W275 WeakPolarHBondContact O-CB 3.44Å; V271-W275 PolarHBondContact O-N 3.43Å; R272-W275 WeakPolarHBondContact O-CB 3.39Å; R272-W275 PolarHBondContact O-N 3.12Å; Y273-W275 VanDerWaalsContact C-N 3.32Å; W275-R277 PolarHBondContact O-N 2.92Å; W275-S278 PolarHBondContact O-N 3.18Å; W275-S279 WeakPolarHBondContact O-CB 3.31Å; W275-S279 PolarHBondContact O-N 3.5Å; W275-I297 HydrophobicContact CB-CD1 4.03Å; W275-I297 HydrophobicContact CE3-CD1 3.99Å; W275-L312 HydrophobicContact CH2-CD1 4.26Å; W275-L312 HydrophobicContact CZ3-CB 4.3Å; W275-L312 HydrophobicContact CZ3-CD1 3.85Å; W275-L312 HydrophobicContact CZ3-CD2 4.11Å; W275-L312 HydrophobicContact CZ3-CG 4.31Å
276	E	86.5	Confident	84.9	Confident	65 Å²	65	58 Å²	58	30%	0.304	28%	0.282	S	S	.	.	H	α-helix	trans	-59.7	-45.6	-177.6	-66.2	-50.9	147.2	0	0	112	Y260 R272 S278 S279 L280	Y260-E276 HydrophobicContact CD1-CB 4.44Å; Y260-E276 HydrophobicContact CE1-CB 3.94Å; Y260-E276 HydrophobicContact CE1-CG 4.49Å; Y260-E276 HydrophobicContact CE2-CB 4.25Å; R272-E276 PolarHBondContact O-N 3.38Å; E276-S278 VanDerWaalsContact C-N 3.27Å; E276-S278 PolarHBondContact O-N 2.91Å; E276-S279 WeakPolarHBondContact O-CB 3.15Å; E276-S279 PolarHBondContact O-N 3.46Å; E276-L280 VanDerWaalsContact O-CG 3.27Å; E276-L280 WeakPolarHBondContact O-CG 3.39Å; E276-L280 PolarHBondContact O-N 3.41Å
277	R	90.4	Very high	84.9	Confident	26 Å²	26	56 Å²	56	10%	0.098	28%	0.277	C	S	.	.	H	α-helix	trans	-57.4	-41	175.5	-168.4	-167.1	58.5	81.7	26.6	112.2	I257 Y260 T261 I264 Y273 W275 Q281	I257-R277 HydrophobicContact CG2-CG 4.17Å; Y260-R277 HydrophobicContact CG-CB 4.5Å; T261-R277 VanDerWaalsContact OG1-CD 3.28Å; T261-R277 WeakPolarHBondContact OG1-CD 3.39Å; I264-R277 HydrophobicContact CD1-CB 4.04Å; I264-R277 HydrophobicContact CD1-CG 4.41Å; Y273-R277 VanDerWaalsContact O-CB 3.29Å; Y273-R277 WeakPolarHBondContact O-CB 3.48Å; Y273-R277 PolarHBondContact O-N 3.42Å; Y273-R277 VanDerWaalsContact O-N 3.11Å; W275-R277 PolarHBondContact O-N 2.92Å; R277-Q281 WeakPolarHBondContact O-CB 3.39Å; R277-Q281 WeakPolarHBondContact O-CG 3.4Å; R277-Q281 PolarHBondContact O-N 3.38Å
278	S	88.4	Confident	85	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-75.2	-36.9	-177.1	-51.5	0	0	0	0	111.5	L274 W275 E276 Q281 M282 C290 G293	L274-S278 VanDerWaalsContact O-CB 3.28Å; L274-S278 WeakPolarHBondContact O-CB 3.29Å; L274-S278 PolarHBondContact O-N 3.4Å; L274-S278 VanDerWaalsContact O-N 3.15Å; L274-S278 PolarHBondContact O-OG 2.72Å; W275-S278 PolarHBondContact O-N 3.18Å; E276-S278 VanDerWaalsContact C-N 3.27Å; E276-S278 PolarHBondContact O-N 2.91Å; S278-Q281 PolarHBondContact O-N 3.39Å; S278-M282 PolarHBondContact O-N 2.97Å; S278-C290 PolarHBondContact O-SG 3.31Å; S278-G293 WeakPolarHBondContact OG-CA 3.45Å
279	S	86.6	Confident	85.1	Confident	26 Å²	26	63.3 Å²	63.3	18%	0.182	30%	0.3	C	S	.	.	H	α-helix	trans	-57	-48.9	169.1	171.7	0	0	0	0	111.5	W275 E276 Q281 M282 R283	W275-S279 WeakPolarHBondContact O-CB 3.31Å; W275-S279 PolarHBondContact O-N 3.5Å; E276-S279 WeakPolarHBondContact O-CB 3.15Å; E276-S279 PolarHBondContact O-N 3.46Å; S279-Q281 PolarHBondContact O-N 2.91Å; S279-M282 WeakPolarHBondContact O-CB 3.1Å; S279-M282 PolarHBondContact O-N 3.31Å; S279-R283 WeakPolarHBondContact O-CG 3.47Å; S279-R283 PolarHBondContact O-N 2.98Å; S279-R283 VanDerWaalsContact O-N 3.08Å
280	L	89.1	Confident	85.3	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-37.6	176.1	-63.9	175.4	0	0	0	112.5	L248 V253 A256 I257 Y260 E276 R283 L284	L248-L280 HydrophobicContact CD1-CD1 4.25Å; L248-L280 HydrophobicContact CD1-CD2 4.29Å; L248-L280 HydrophobicContact CD2-CD1 3.91Å; L248-L280 HydrophobicContact CD2-CD2 3.54Å; L248-L280 HydrophobicContact CD2-CG 4.38Å; V253-L280 HydrophobicContact CG1-CB 4.14Å; V253-L280 HydrophobicContact CG1-CD2 4.22Å; A256-L280 HydrophobicContact CB-CD1 3.98Å; I257-L280 HydrophobicContact CD1-CB 3.82Å; I257-L280 HydrophobicContact CG1-CB 3.58Å; I257-L280 HydrophobicContact CG1-CD1 4.15Å; Y260-L280 HydrophobicContact CD2-CD1 3.94Å; Y260-L280 HydrophobicContact CE2-CD1 4.05Å; E276-L280 VanDerWaalsContact O-CG 3.27Å; E276-L280 WeakPolarHBondContact O-CG 3.39Å; E276-L280 PolarHBondContact O-N 3.41Å; L280-R283 PolarHBondContact O-N 3.49Å; L280-L284 PolarHBondContact O-N 3.17Å
281	Q	88.7	Confident	85.3	Confident	1 Å²	1	57 Å²	57	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-34.9	173.9	-78.2	-170.1	-45.1	0	0	113	I257 R277 S278 S279 L284 G285 E286 Q289 C290	I257-Q281 HydrophobicContact CD1-CG 3.87Å; I257-Q281 HydrophobicContact CG1-CG 4.31Å; I257-Q281 HydrophobicContact CG2-CG 4.14Å; R277-Q281 WeakPolarHBondContact O-CB 3.39Å; R277-Q281 WeakPolarHBondContact O-CG 3.4Å; R277-Q281 PolarHBondContact O-N 3.38Å; S278-Q281 PolarHBondContact O-N 3.39Å; S279-Q281 PolarHBondContact O-N 2.91Å; Q281-L284 PolarHBondContact O-N 3.07Å; Q281-G285 PolarHBondContact O-N 2.93Å; Q281-E286 HydrophobicContact CB-CB 4.16Å; Q281-E286 HydrophobicContact CG-CB 4.42Å; Q281-E286 PolarHBondContact NE2-OE2 3.44Å; Q281-E286 PolarHBondContact O-N 3.11Å; Q281-Q289 VanDerWaalsContact NE2-CB 3.34Å; Q281-Q289 VanDerWaalsContact OE1-C 3.31Å; Q281-Q289 VanDerWaalsContact OE1-CB 3.28Å; Q281-Q289 PolarHBondContact OE1-O 3.08Å; Q281-C290 HydrophobicContact CB-CB 4.08Å
282	M	84.4	Confident	85.5	Confident	54 Å²	54	59.3 Å²	59.3	27%	0.266	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-41.9	172	-165.6	66.4	91.6	0	0	111.1	S278 S279 L284 G285 H287 Y294	S278-M282 PolarHBondContact O-N 2.97Å; S279-M282 WeakPolarHBondContact O-CB 3.1Å; S279-M282 PolarHBondContact O-N 3.31Å; M282-L284 PolarHBondContact O-N 2.8Å; M282-G285 PolarHBondContact O-N 3.17Å; M282-H287 PolarHBondContact SD-ND1 3.23Å; M282-Y294 HydrophobicContact CE-CE2 4.06Å
283	R	85.4	Confident	85.5	Confident	183 Å²	183	52.3 Å²	52.3	69%	0.691	25%	0.247	S	C	*	.	H	α-helix	trans	-61.8	-26.8	175.7	-65.7	-179.7	-168.9	-172.5	4.2	113.8	S279 L280	S279-R283 WeakPolarHBondContact O-CG 3.47Å; S279-R283 PolarHBondContact O-N 2.98Å; S279-R283 VanDerWaalsContact O-N 3.08Å; L280-R283 PolarHBondContact O-N 3.49Å
284	L	86.2	Confident	85.4	Confident	70 Å²	70	52.4 Å²	52.4	37%	0.366	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-4.7	174	-69.4	-176.6	0	0	0	114.3	V253 R254 I257 L280 Q281 M282 E286	V253-L284 HydrophobicContact CB-CD2 4.43Å; V253-L284 HydrophobicContact CG1-CD1 4.11Å; V253-L284 HydrophobicContact CG1-CD2 4.06Å; V253-L284 HydrophobicContact CG1-CG 3.87Å; R254-L284 HydrophobicContact CG-CD1 3.69Å; I257-L284 HydrophobicContact CD1-CD1 3.42Å; I257-L284 VanDerWaalsContact CD1-CD1 3.42Å; I257-L284 HydrophobicContact CD1-CG 4.25Å; L280-L284 PolarHBondContact O-N 3.17Å; Q281-L284 PolarHBondContact O-N 3.07Å; M282-L284 PolarHBondContact O-N 2.8Å; L284-E286 VanDerWaalsContact C-N 3.32Å; L284-E286 HydrophobicContact CB-CG 4.14Å
285	G	82.8	Confident	85.3	Confident	39 Å²	39	57.4 Å²	57.4	40%	0.402	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	16.1	-173	0	0	0	0	0	114.4	Q281 M282 H287	Q281-G285 PolarHBondContact O-N 2.93Å; M282-G285 PolarHBondContact O-N 3.17Å; G285-H287 PolarHBondContact O-CD2 3.01Å; G285-H287 PolarHBondContact O-N 2.92Å
286	E	85.1	Confident	85.2	Confident	71 Å²	71	58.7 Å²	58.7	33%	0.332	27%	0.274	S	S	.	.			trans	-80.7	48.4	177.8	-63.3	-164.2	154.6	0	0	112.2	Q281 L284 K288 Q289 C290	Q281-E286 HydrophobicContact CB-CB 4.16Å; Q281-E286 HydrophobicContact CG-CB 4.42Å; Q281-E286 PolarHBondContact NE2-OE2 3.44Å; Q281-E286 PolarHBondContact O-N 3.11Å; L284-E286 VanDerWaalsContact C-N 3.32Å; L284-E286 HydrophobicContact CB-CG 4.14Å; E286-K288 VanDerWaalsContact C-N 3.25Å; E286-K288 PolarHBondContact O-N 2.85Å; E286-Q289 VanDerWaalsContact CD-NE2 3.33Å; E286-Q289 PolarHBondContact O-N 3.47Å; E286-Q289 PolarHBondContact OE2-NE2 3.22Å; E286-C290 PolarHBondContact O-N 2.85Å; E286-C290 VanDerWaalsContact O-N 3.16Å
287	H	80.3	Confident	85.1	Confident	81 Å²	81	55.6 Å²	55.6	38%	0.375	26%	0.26	S	S	.	.	H	α-helix	trans	-46.4	-42	-168.4	-61.6	-80	0	0	0	114.1	M282 G285 Q289 C290 M291	M282-H287 PolarHBondContact SD-ND1 3.23Å; G285-H287 PolarHBondContact O-CD2 3.01Å; G285-H287 PolarHBondContact O-N 2.92Å; H287-Q289 PolarHBondContact O-N 3.33Å; H287-C290 WeakPolarHBondContact O-CB 3.2Å; H287-C290 PolarHBondContact O-N 3.4Å; H287-M291 WeakPolarHBondContact O-CB 3.19Å; H287-M291 VanDerWaalsContact O-CG 3.25Å; H287-M291 WeakPolarHBondContact O-CG 3.39Å; H287-M291 PolarHBondContact O-N 3.12Å
288	K	83.4	Confident	84.6	Confident	179 Å²	179	54.6 Å²	54.6	78%	0.778	26%	0.256	S	S	*	.	H	α-helix	trans	-62.1	-45	-180	-66.3	-173.5	177.3	-176.5	0	113.3	E286 M291 D292	E286-K288 VanDerWaalsContact C-N 3.25Å; E286-K288 PolarHBondContact O-N 2.85Å; K288-M291 PolarHBondContact O-N 2.94Å; K288-D292 PolarHBondContact O-N 3.24Å; K288-D292 VanDerWaalsContact O-N 3.1Å
289	Q	83.6	Confident	84.3	Confident	94 Å²	94	58.5 Å²	58.5	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-73.9	-32.1	-179.4	-61.1	-172.8	61.9	0	0	112.2	Q281 E286 H287 G293	Q281-Q289 VanDerWaalsContact NE2-CB 3.34Å; Q281-Q289 VanDerWaalsContact OE1-C 3.31Å; Q281-Q289 VanDerWaalsContact OE1-CB 3.28Å; Q281-Q289 PolarHBondContact OE1-O 3.08Å; E286-Q289 VanDerWaalsContact CD-NE2 3.33Å; E286-Q289 PolarHBondContact O-N 3.47Å; E286-Q289 PolarHBondContact OE2-NE2 3.22Å; H287-Q289 PolarHBondContact O-N 3.33Å; Q289-G293 PolarHBondContact O-N 2.93Å; Q289-G293 VanDerWaalsContact O-N 3.13Å
290	C	84.6	Confident	84	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-50.1	170.1	179	0	0	0	0	110.7	S278 Q281 E286 H287 D292 G293 Y294	S278-C290 PolarHBondContact O-SG 3.31Å; Q281-C290 HydrophobicContact CB-CB 4.08Å; E286-C290 PolarHBondContact O-N 2.85Å; E286-C290 VanDerWaalsContact O-N 3.16Å; H287-C290 WeakPolarHBondContact O-CB 3.2Å; H287-C290 PolarHBondContact O-N 3.4Å; C290-D292 PolarHBondContact O-N 2.9Å; C290-G293 CarbonylContact O-C 3.54Å; C290-G293 WeakPolarHBondContact O-CA 3.41Å; C290-G293 PolarHBondContact O-N 3.29Å; C290-Y294 PolarHBondContact O-N 3.32Å; C290-Y294 WeakPolarHBondContact SG-CE2 3.46Å; C290-Y294 VanDerWaalsContact SG-CZ 3.54Å
291	M	82.9	Confident	83.4	Confident	8 Å²	8	61.5 Å²	61.5	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-60.1	-42.5	177.4	-73.5	-61.3	-169.9	0	0	113.6	H287 K288 G293 Y294 R295 M316 Y320	H287-M291 WeakPolarHBondContact O-CB 3.19Å; H287-M291 VanDerWaalsContact O-CG 3.25Å; H287-M291 WeakPolarHBondContact O-CG 3.39Å; H287-M291 PolarHBondContact O-N 3.12Å; K288-M291 PolarHBondContact O-N 2.94Å; M291-G293 PolarHBondContact O-N 3.42Å; M291-Y294 PolarHBondContact O-N 3.23Å; M291-R295 WeakPolarHBondContact O-CB 3.41Å; M291-R295 WeakPolarHBondContact O-CG 3.43Å; M291-R295 PolarHBondContact O-N 2.9Å; M291-M316 WeakPolarHBondContact CE-O 3.44Å; M291-M316 HydrophobicContact SD-CB 4.28Å; M291-M316 HydrophobicContact SD-CE 4.16Å; M291-M316 HydrophobicContact SD-CG 4.08Å; M291-Y320 HydrophobicContact CB-CE1 4.34Å; M291-Y320 HydrophobicContact CE-CD1 3.76Å; M291-Y320 HydrophobicContact CE-CD2 3.79Å; M291-Y320 HydrophobicContact CE-CE1 3.84Å; M291-Y320 HydrophobicContact CE-CE2 3.88Å; M291-Y320 HydrophobicContact CE-CG 3.72Å; M291-Y320 HydrophobicContact CG-CE1 3.78Å; M291-Y320 HydrophobicContact SD-CD1 4.39Å; M291-Y320 HydrophobicContact SD-CD2 4.14Å; M291-Y320 HydrophobicContact SD-CE1 3.87Å; M291-Y320 HydrophobicContact SD-CE2 3.59Å; M291-Y320 VanDerWaalsContact SD-CE2 3.59Å; M291-Y320 HydrophobicContact SD-CG 4.49Å
292	D	84.2	Confident	82.6	Confident	86 Å²	86	64.7 Å²	64.7	46%	0.46	32%	0.317	S	S	.	.	H	α-helix	trans	-66	-23.2	174	-74.5	-27.8	0	0	0	112.9	K288 C290 K296	K288-D292 PolarHBondContact O-N 3.24Å; K288-D292 VanDerWaalsContact O-N 3.1Å; C290-D292 PolarHBondContact O-N 2.9Å; D292-K296 VanDerWaalsContact O-CD 3.3Å; D292-K296 WeakPolarHBondContact O-CD 3.45Å; D292-K296 WeakPolarHBondContact O-CE 3.5Å; D292-K296 WeakPolarHBondContact O-CG 3.45Å
293	G	84	Confident	81.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-73	-52.6	168.8	0	0	0	0	0	112.1	S278 Q289 C290 M291 R295 K296 I297	S278-G293 WeakPolarHBondContact OG-CA 3.45Å; Q289-G293 PolarHBondContact O-N 2.93Å; Q289-G293 VanDerWaalsContact O-N 3.13Å; C290-G293 CarbonylContact O-C 3.54Å; C290-G293 WeakPolarHBondContact O-CA 3.41Å; C290-G293 PolarHBondContact O-N 3.29Å; M291-G293 PolarHBondContact O-N 3.42Å; G293-R295 PolarHBondContact O-N 3.48Å; G293-K296 WeakPolarHBondContact O-CB 3.47Å; G293-K296 PolarHBondContact O-N 2.92Å; G293-I297 PolarHBondContact O-N 3.03Å; G293-I297 VanDerWaalsContact O-N 3.09Å
294	Y	84.8	Confident	80.8	Confident	21 Å²	21	70 Å²	70	8%	0.082	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-38.4	179.8	-65	-24.1	0	0	0	113.2	M282 C290 M291 K296 I297 L298 L312 M316	M282-Y294 HydrophobicContact CE-CE2 4.06Å; C290-Y294 PolarHBondContact O-N 3.32Å; C290-Y294 WeakPolarHBondContact SG-CE2 3.46Å; C290-Y294 VanDerWaalsContact SG-CZ 3.54Å; M291-Y294 PolarHBondContact O-N 3.23Å; Y294-K296 VanDerWaalsContact C-N 3.25Å; Y294-K296 PolarHBondContact O-N 3.34Å; Y294-I297 HydrophobicContact CD1-CD1 4.08Å; Y294-I297 WeakPolarHBondContact O-CB 3.27Å; Y294-I297 PolarHBondContact O-N 2.89Å; Y294-L298 PolarHBondContact O-N 3.25Å; Y294-L312 HydrophobicContact CD1-CD1 3.77Å; Y294-L312 HydrophobicContact CD2-CD1 3.91Å; Y294-L312 HydrophobicContact CE1-CD1 4.07Å; Y294-L312 HydrophobicContact CE2-CD1 4.19Å; Y294-L312 HydrophobicContact CG-CD1 3.67Å; Y294-M316 WeakPolarHBondContact CB-SD 3.18Å; Y294-M316 HydrophobicContact CD2-CG 3.77Å; Y294-M316 HydrophobicContact CG-CG 4.26Å; Y294-M316 HydrophobicContact CG-SD 4.45Å
295	R	84.4	Confident	80.1	Confident	111 Å²	111	69.9 Å²	69.9	42%	0.419	35%	0.349	S	S	.	.	H	α-helix	trans	-56.5	-37.8	170.8	-75.5	178.2	176	-178.6	-3.3	112.5	M291 G293 S299 M316 Y320 S328	M291-R295 WeakPolarHBondContact O-CB 3.41Å; M291-R295 WeakPolarHBondContact O-CG 3.43Å; M291-R295 PolarHBondContact O-N 2.9Å; G293-R295 PolarHBondContact O-N 3.48Å; R295-S299 PolarHBondContact O-N 2.89Å; R295-M316 HydrophobicContact CG-CE 3.69Å; R295-Y320 PolarHBondContact NE-OH 3.41Å; R295-Y320 PolarHBondContact NH2-OH 3.48Å; R295-S328 PolarHBondContact NH2-OG 3.09Å
296	K	83.4	Confident	79.6	Confident	115 Å²	115	68.1 Å²	68.1	50%	0.5	33%	0.331	S	S	.	.	H	α-helix	trans	-70.5	-37.2	175.5	-69.2	166.3	-171.1	168	0	111.7	L274 D292 G293 Y294 S299 L300	L274-K296 HydrophobicContact CD1-CB 4.45Å; D292-K296 VanDerWaalsContact O-CD 3.3Å; D292-K296 WeakPolarHBondContact O-CD 3.45Å; D292-K296 WeakPolarHBondContact O-CE 3.5Å; D292-K296 WeakPolarHBondContact O-CG 3.45Å; G293-K296 WeakPolarHBondContact O-CB 3.47Å; G293-K296 PolarHBondContact O-N 2.92Å; Y294-K296 VanDerWaalsContact C-N 3.25Å; Y294-K296 PolarHBondContact O-N 3.34Å; K296-S299 WeakPolarHBondContact CA-OG 3.34Å; K296-S299 PolarHBondContact O-N 2.56Å; K296-S299 PolarHBondContact O-OG 3.21Å; K296-L300 WeakPolarHBondContact O-CG 3.42Å; K296-L300 PolarHBondContact O-N 3.34Å; K296-L300 VanDerWaalsContact O-N 3.16Å
297	I	83.8	Confident	79.3	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-61	-49.7	174.1	-63.7	174.3	0	0	0	110.8	V271 L274 W275 G293 Y294 S299 L300 L301 L312	V271-I297 HydrophobicContact CG1-CG1 4.49Å; V271-I297 HydrophobicContact CG1-CG2 3.78Å; L274-I297 HydrophobicContact CB-CD1 3.94Å; L274-I297 HydrophobicContact CB-CG1 3.65Å; L274-I297 HydrophobicContact CD1-CG1 4.41Å; W275-I297 HydrophobicContact CB-CD1 4.03Å; W275-I297 HydrophobicContact CE3-CD1 3.99Å; G293-I297 PolarHBondContact O-N 3.03Å; G293-I297 VanDerWaalsContact O-N 3.09Å; Y294-I297 HydrophobicContact CD1-CD1 4.08Å; Y294-I297 WeakPolarHBondContact O-CB 3.27Å; Y294-I297 PolarHBondContact O-N 2.89Å; I297-S299 PolarHBondContact O-N 3.11Å; I297-S299 VanDerWaalsContact O-N 3.12Å; I297-L300 PolarHBondContact O-N 2.96Å; I297-L301 HydrophobicContact CG2-CD1 3.81Å; I297-L301 HydrophobicContact CG2-CD2 4.38Å; I297-L301 HydrophobicContact CG2-CG 3.83Å; I297-L301 WeakPolarHBondContact O-CG 3.23Å; I297-L301 PolarHBondContact O-N 2.87Å; I297-L312 HydrophobicContact CB-CD2 3.88Å; I297-L312 HydrophobicContact CG2-CD2 3.55Å
298	L	81	Confident	79.2	Confident	5 Å²	5	72 Å²	72	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-23.2	176	-63.2	179.7	0	0	0	113.5	Y294 L301 F309 L312 M316 V332 R339	Y294-L298 PolarHBondContact O-N 3.25Å; L298-L301 HydrophobicContact CD2-CD1 4.38Å; L298-F309 HydrophobicContact CB-CE2 3.81Å; L298-F309 HydrophobicContact CB-CZ 4.21Å; L298-F309 HydrophobicContact CD1-CZ 4.41Å; L298-F309 HydrophobicContact CD2-CD1 4.26Å; L298-F309 HydrophobicContact CD2-CD2 3.64Å; L298-F309 HydrophobicContact CD2-CE1 4.15Å; L298-F309 HydrophobicContact CD2-CE2 3.52Å; L298-F309 HydrophobicContact CD2-CG 4Å; L298-F309 HydrophobicContact CD2-CZ 3.77Å; L298-F309 HydrophobicContact CG-CE2 4.17Å; L298-F309 HydrophobicContact CG-CZ 4.35Å; L298-L312 HydrophobicContact CD2-CB 4.15Å; L298-L312 HydrophobicContact CD2-CD2 3.73Å; L298-L312 HydrophobicContact CD2-CG 4.02Å; L298-L312 HydrophobicContact CG-CD2 4Å; L298-L312 HydrophobicContact CG-CG 4.43Å; L298-M316 HydrophobicContact CD1-CE 4.19Å; L298-M316 HydrophobicContact CD1-SD 3.49Å; L298-M316 WeakPolarHBondContact CD1-SD 3.44Å; L298-M316 HydrophobicContact CG-SD 4.17Å; L298-V332 HydrophobicContact CD1-CG1 4.2Å; L298-R339 PolarHBondContact O-NH1 3.06Å
299	S	81.6	Confident	79.1	Confident	81 Å²	81	63.7 Å²	63.7	57%	0.566	31%	0.313	S	S	*	.	H	α-helix	trans	-84.4	-14.1	173.4	76.3	0	0	0	0	114.9	R295 K296 I297	R295-S299 PolarHBondContact O-N 2.89Å; K296-S299 WeakPolarHBondContact CA-OG 3.34Å; K296-S299 PolarHBondContact O-N 2.56Å; K296-S299 PolarHBondContact O-OG 3.21Å; I297-S299 PolarHBondContact O-N 3.11Å; I297-S299 VanDerWaalsContact O-N 3.12Å
300	L	81.1	Confident	79.1	Confident	67 Å²	67	59.8 Å²	59.8	35%	0.351	30%	0.295	S	S	.	.	H	α-helix	trans	-114.2	-18.5	-175.9	-69.6	172.2	0	0	0	113.9	V271 L274 K296 I297	V271-L300 HydrophobicContact CG2-CB 4.06Å; L274-L300 HydrophobicContact CD1-CD1 3.58Å; K296-L300 WeakPolarHBondContact O-CG 3.42Å; K296-L300 PolarHBondContact O-N 3.34Å; K296-L300 VanDerWaalsContact O-N 3.16Å; I297-L300 PolarHBondContact O-N 2.96Å
301	L	75.8	Confident	79.1	Confident	24 Å²	24	64.5 Å²	64.5	13%	0.126	32%	0.317	C	S	.	.	S	Bend	trans	-61.4	128.8	177.4	-80.6	171.2	0	0	0	111.6	V271 I297 L298 D305 F309	V271-L301 HydrophobicContact CG1-CD2 4.15Å; I297-L301 HydrophobicContact CG2-CD1 3.81Å; I297-L301 HydrophobicContact CG2-CD2 4.38Å; I297-L301 HydrophobicContact CG2-CG 3.83Å; I297-L301 WeakPolarHBondContact O-CG 3.23Å; I297-L301 PolarHBondContact O-N 2.87Å; L298-L301 HydrophobicContact CD2-CD1 4.38Å; L301-D305 HydrophobicContact CD2-CB 4.12Å; L301-F309 HydrophobicContact CD1-CB 4.33Å; L301-F309 HydrophobicContact CD1-CD2 4.21Å
302	P	72	Confident	79.1	Confident	68 Å²	68	64.2 Å²	64.2	44%	0.442	32%	0.316	S	S	.	.			trans	-58.2	151.7	167.7	-23.1	33.6	0	0	0	112.3	E304 D305	P302-E304 PolarHBondContact O-N 3.22Å; P302-E304 VanDerWaalsContact O-N 3.1Å; P302-D305 WeakPolarHBondContact CD-OD2 3.49Å; P302-D305 PolarHBondContact O-N 2.96Å; P302-D305 VanDerWaalsContact O-N 3.13Å
303	Q	65.2	Low	79.2	Confident	161 Å²	161	60.1 Å²	60.1	75%	0.752	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.2	178.1	-162	168.6	7.6	0	0	113.5
304	E	65.8	Low	79.3	Confident	187 Å²	187	63.1 Å²	63.1	87%	0.874	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-30.9	173.5	-61.6	-178.8	177.4	0	0	112	P302 G306	P302-E304 PolarHBondContact O-N 3.22Å; P302-E304 VanDerWaalsContact O-N 3.1Å; E304-G306 PolarHBondContact O-N 3.12Å
305	D	72.2	Confident	79.3	Confident	69 Å²	69	66.4 Å²	66.4	37%	0.369	33%	0.326	S	S	.	.			trans	-82	35.9	-179.5	-68.4	-46.2	0	0	0	113	L301 P302 E307 H308 F309	L301-D305 HydrophobicContact CD2-CB 4.12Å; P302-D305 WeakPolarHBondContact CD-OD2 3.49Å; P302-D305 PolarHBondContact O-N 2.96Å; P302-D305 VanDerWaalsContact O-N 3.13Å; D305-E307 VanDerWaalsContact C-N 3.28Å; D305-E307 PolarHBondContact O-N 2.96Å; D305-H308 PolarHBondContact O-N 3.18Å; D305-H308 VanDerWaalsContact O-N 3.11Å; D305-F309 PolarHBondContact O-N 3.22Å
306	G	72.8	Confident	79.4	Confident	2 Å²	2	61.1 Å²	61.1	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-60.4	-31	-171.5	0	0	0	0	0	114.7	E304 F309 M310	E304-G306 PolarHBondContact O-N 3.12Å; G306-F309 WeakPolarHBondContact O-CB 3.36Å; G306-F309 PolarHBondContact O-N 2.88Å; G306-M310 VanDerWaalsContact O-CG 3.3Å; G306-M310 WeakPolarHBondContact O-CG 3.29Å; G306-M310 PolarHBondContact O-N 2.74Å
307	E	78.4	Confident	79.5	Confident	133 Å²	133	55.7 Å²	55.7	62%	0.621	28%	0.282	S	S	*	.	H	α-helix	trans	-65.9	-43.7	175.3	-65	-174	-176.1	0	0	111.8	D305 M310 Q311	D305-E307 VanDerWaalsContact C-N 3.28Å; D305-E307 PolarHBondContact O-N 2.96Å; E307-M310 PolarHBondContact O-N 2.84Å; E307-Q311 VanDerWaalsContact O-CG 3.26Å; E307-Q311 WeakPolarHBondContact O-CG 3.49Å; E307-Q311 PolarHBondContact O-N 3.48Å
308	H	77.3	Confident	79.7	Confident	101 Å²	101	60.6 Å²	60.6	47%	0.468	30%	0.304	S	S	.	.	H	α-helix	trans	-70	-32.7	176.6	-67.9	-42.2	0	0	0	112.1	D305 Q311 L312	D305-H308 PolarHBondContact O-N 3.18Å; D305-H308 VanDerWaalsContact O-N 3.11Å; H308-Q311 PolarHBondContact ND1-OE1 2.97Å; H308-Q311 VanDerWaalsContact ND1-OE1 3.08Å; H308-L312 VanDerWaalsContact O-CB 3.31Å; H308-L312 WeakPolarHBondContact O-CB 3.41Å; H308-L312 PolarHBondContact O-N 2.99Å
309	F	82.6	Confident	79.8	Confident	3 Å²	3	60.6 Å²	60.6	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-58.4	-51.6	169.8	-168.6	-76.5	0	0	0	111	L298 L301 D305 G306 Q311 L312 S313 E335 H340	L298-F309 HydrophobicContact CB-CE2 3.81Å; L298-F309 HydrophobicContact CB-CZ 4.21Å; L298-F309 HydrophobicContact CD1-CZ 4.41Å; L298-F309 HydrophobicContact CD2-CD1 4.26Å; L298-F309 HydrophobicContact CD2-CD2 3.64Å; L298-F309 HydrophobicContact CD2-CE1 4.15Å; L298-F309 HydrophobicContact CD2-CE2 3.52Å; L298-F309 HydrophobicContact CD2-CG 4Å; L298-F309 HydrophobicContact CD2-CZ 3.77Å; L298-F309 HydrophobicContact CG-CE2 4.17Å; L298-F309 HydrophobicContact CG-CZ 4.35Å; L301-F309 HydrophobicContact CD1-CB 4.33Å; L301-F309 HydrophobicContact CD1-CD2 4.21Å; D305-F309 PolarHBondContact O-N 3.22Å; G306-F309 WeakPolarHBondContact O-CB 3.36Å; G306-F309 PolarHBondContact O-N 2.88Å; F309-Q311 PolarHBondContact O-N 2.99Å; F309-L312 PolarHBondContact O-N 3.12Å; F309-S313 WeakPolarHBondContact CE1-OG 3.5Å; F309-S313 WeakPolarHBondContact O-CB 3.21Å; F309-S313 PolarHBondContact O-N 2.65Å; F309-S313 PolarHBondContact O-OG 2.89Å; F309-E335 HydrophobicContact CZ-CG 4.11Å; F309-H340 AromaticContact CD1-CD2 3.84Å; F309-H340 AromaticContact CG-CD2 3.95Å; F309-H340 AromaticContact CG-NE2 3.95Å
310	M	82.9	Confident	80.1	Confident	13 Å²	13	57.2 Å²	57.2	6%	0.064	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-37.1	-177.7	-66.2	-64.8	-79.6	0	0	112.7	G306 E307 K314 H340 L343 V344 F348	G306-M310 VanDerWaalsContact O-CG 3.3Å; G306-M310 WeakPolarHBondContact O-CG 3.29Å; G306-M310 PolarHBondContact O-N 2.74Å; E307-M310 PolarHBondContact O-N 2.84Å; M310-K314 PolarHBondContact O-N 3.28Å; M310-H340 HydrophobicContact CG-CB 4.35Å; M310-H340 HydrophobicContact SD-CB 4.17Å; M310-L343 HydrophobicContact CG-CB 4.49Å; M310-V344 HydrophobicContact CE-CB 4.49Å; M310-V344 HydrophobicContact CE-CG2 3.99Å; M310-F348 HydrophobicContact CE-CB 4.35Å; M310-F348 HydrophobicContact CE-CD1 3.55Å; M310-F348 HydrophobicContact CE-CD2 3.79Å; M310-F348 HydrophobicContact CE-CE1 3.64Å; M310-F348 HydrophobicContact CE-CE2 3.88Å; M310-F348 HydrophobicContact CE-CG 3.62Å; M310-F348 HydrophobicContact CE-CZ 3.8Å; M310-F348 WeakPolarHBondContact O-CE2 3.27Å; M310-F348 HydrophobicContact SD-CE1 4.43Å; M310-F348 HydrophobicContact SD-CE2 4.15Å; M310-F348 HydrophobicContact SD-CZ 4.09Å
311	Q	84.1	Confident	80.3	Confident	99 Å²	99	58.4 Å²	58.4	46%	0.463	28%	0.279	S	S	.	.	H	α-helix	trans	-60.8	-51.7	171.9	-72.7	165	4.5	0	0	111.4	E307 H308 F309 S313 K314 D315	E307-Q311 VanDerWaalsContact O-CG 3.26Å; E307-Q311 WeakPolarHBondContact O-CG 3.49Å; E307-Q311 PolarHBondContact O-N 3.48Å; H308-Q311 PolarHBondContact ND1-OE1 2.97Å; H308-Q311 VanDerWaalsContact ND1-OE1 3.08Å; F309-Q311 PolarHBondContact O-N 2.99Å; Q311-S313 PolarHBondContact O-N 3.1Å; Q311-K314 WeakPolarHBondContact O-CB 3.48Å; Q311-K314 PolarHBondContact O-N 3.29Å; Q311-K314 VanDerWaalsContact O-N 3.11Å; Q311-D315 PolarHBondContact O-N 2.98Å
312	L	84.4	Confident	80.8	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-40.6	-179.9	-177.5	57.9	0	0	0	112.1	W275 Y294 I297 L298 H308 F309 K314 D315 M316	W275-L312 HydrophobicContact CH2-CD1 4.26Å; W275-L312 HydrophobicContact CZ3-CB 4.3Å; W275-L312 HydrophobicContact CZ3-CD1 3.85Å; W275-L312 HydrophobicContact CZ3-CD2 4.11Å; W275-L312 HydrophobicContact CZ3-CG 4.31Å; Y294-L312 HydrophobicContact CD1-CD1 3.77Å; Y294-L312 HydrophobicContact CD2-CD1 3.91Å; Y294-L312 HydrophobicContact CE1-CD1 4.07Å; Y294-L312 HydrophobicContact CE2-CD1 4.19Å; Y294-L312 HydrophobicContact CG-CD1 3.67Å; I297-L312 HydrophobicContact CB-CD2 3.88Å; I297-L312 HydrophobicContact CG2-CD2 3.55Å; L298-L312 HydrophobicContact CD2-CB 4.15Å; L298-L312 HydrophobicContact CD2-CD2 3.73Å; L298-L312 HydrophobicContact CD2-CG 4.02Å; L298-L312 HydrophobicContact CG-CD2 4Å; L298-L312 HydrophobicContact CG-CG 4.43Å; H308-L312 VanDerWaalsContact O-CB 3.31Å; H308-L312 WeakPolarHBondContact O-CB 3.41Å; H308-L312 PolarHBondContact O-N 2.99Å; F309-L312 PolarHBondContact O-N 3.12Å; L312-K314 VanDerWaalsContact C-N 3.31Å; L312-K314 PolarHBondContact O-N 3.43Å; L312-D315 PolarHBondContact O-N 3.41Å; L312-M316 HydrophobicContact CD1-CG 4.24Å; L312-M316 HydrophobicContact CD1-SD 4.43Å; L312-M316 HydrophobicContact CG-CG 4.42Å; L312-M316 HydrophobicContact CG-SD 4.11Å; L312-M316 WeakPolarHBondContact O-CB 3.42Å; L312-M316 VanDerWaalsContact O-CG 3.27Å; L312-M316 WeakPolarHBondContact O-CG 3.26Å; L312-M316 PolarHBondContact O-N 3.2Å
313	S	86	Confident	81.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-37.1	173.5	-79	0	0	0	0	112.7	F309 Q311 A317 V332	F309-S313 WeakPolarHBondContact CE1-OG 3.5Å; F309-S313 WeakPolarHBondContact O-CB 3.21Å; F309-S313 PolarHBondContact O-N 2.65Å; F309-S313 PolarHBondContact O-OG 2.89Å; Q311-S313 PolarHBondContact O-N 3.1Å; S313-A317 VanDerWaalsContact O-CB 3.22Å; S313-A317 WeakPolarHBondContact O-CB 3.49Å; S313-A317 PolarHBondContact O-N 3.01Å; S313-V332 WeakPolarHBondContact OG-CG1 3.2Å
314	K	86.3	Confident	82.3	Confident	64 Å²	64	61.9 Å²	61.9	28%	0.278	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-46.4	176.3	-168.4	-174.7	-179.1	-166	0	111.6	M310 Q311 L312 A317 K318 D347 F348	M310-K314 PolarHBondContact O-N 3.28Å; Q311-K314 WeakPolarHBondContact O-CB 3.48Å; Q311-K314 PolarHBondContact O-N 3.29Å; Q311-K314 VanDerWaalsContact O-N 3.11Å; L312-K314 VanDerWaalsContact C-N 3.31Å; L312-K314 PolarHBondContact O-N 3.43Å; K314-A317 PolarHBondContact O-N 3.14Å; K314-K318 WeakPolarHBondContact O-CB 3.22Å; K314-K318 PolarHBondContact O-N 3.35Å; K314-D347 IonicContact NZ-OD2 2.87Å; K314-D347 PolarHBondContact NZ-OD2 3.07Å; K314-F348 HydrophobicContact CB-CD2 4.26Å; K314-F348 HydrophobicContact CB-CE2 4.48Å
315	D	84.4	Confident	83.3	Confident	90 Å²	90	55.8 Å²	55.8	48%	0.481	27%	0.274	S	S	.	.	H	α-helix	trans	-68.2	-38.1	179.8	-73.1	-21.1	0	0	0	112.2	Q311 L312 S319	Q311-D315 PolarHBondContact O-N 2.98Å; L312-D315 PolarHBondContact O-N 3.41Å; D315-S319 PolarHBondContact O-N 3.19Å
316	M	85.8	Confident	83.9	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-49.2	170.5	-74.9	179.1	77.4	0	0	111.7	M291 Y294 R295 L298 L312 K318 S319 Y320 V332	M291-M316 WeakPolarHBondContact CE-O 3.44Å; M291-M316 HydrophobicContact SD-CB 4.28Å; M291-M316 HydrophobicContact SD-CE 4.16Å; M291-M316 HydrophobicContact SD-CG 4.08Å; Y294-M316 WeakPolarHBondContact CB-SD 3.18Å; Y294-M316 HydrophobicContact CD2-CG 3.77Å; Y294-M316 HydrophobicContact CG-CG 4.26Å; Y294-M316 HydrophobicContact CG-SD 4.45Å; R295-M316 HydrophobicContact CG-CE 3.69Å; L298-M316 HydrophobicContact CD1-CE 4.19Å; L298-M316 HydrophobicContact CD1-SD 3.49Å; L298-M316 WeakPolarHBondContact CD1-SD 3.44Å; L298-M316 HydrophobicContact CG-SD 4.17Å; L312-M316 HydrophobicContact CD1-CG 4.24Å; L312-M316 HydrophobicContact CD1-SD 4.43Å; L312-M316 HydrophobicContact CG-CG 4.42Å; L312-M316 HydrophobicContact CG-SD 4.11Å; L312-M316 WeakPolarHBondContact O-CB 3.42Å; L312-M316 VanDerWaalsContact O-CG 3.27Å; L312-M316 WeakPolarHBondContact O-CG 3.26Å; L312-M316 PolarHBondContact O-N 3.2Å; M316-K318 VanDerWaalsContact C-N 3.31Å; M316-K318 PolarHBondContact O-N 3.43Å; M316-S319 PolarHBondContact O-N 3.34Å; M316-Y320 HydrophobicContact CB-CD2 4.46Å; M316-Y320 HydrophobicContact CB-CE2 4.35Å; M316-Y320 HydrophobicContact CE-CE2 4.08Å; M316-Y320 WeakPolarHBondContact O-CD2 3.35Å; M316-Y320 PolarHBondContact O-N 3.42Å; M316-V332 HydrophobicContact CB-CG1 4.09Å; M316-V332 HydrophobicContact CE-CG2 4.05Å; M316-V332 HydrophobicContact SD-CG1 4.37Å
317	A	87	Confident	84.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-42.5	179.6	0	0	0	0	0	111.7	S313 K314 Y320 Y321 I333 L355	S313-A317 VanDerWaalsContact O-CB 3.22Å; S313-A317 WeakPolarHBondContact O-CB 3.49Å; S313-A317 PolarHBondContact O-N 3.01Å; K314-A317 PolarHBondContact O-N 3.14Å; A317-Y320 PolarHBondContact O-N 3.06Å; A317-Y321 WeakPolarHBondContact O-CB 3.22Å; A317-Y321 PolarHBondContact O-N 3.46Å; A317-I333 HydrophobicContact CB-CD1 3.68Å; A317-I333 HydrophobicContact CB-CG1 3.76Å; A317-L355 HydrophobicContact CB-CD1 3.99Å
318	K	86.7	Confident	85.1	Confident	105 Å²	105	52.9 Å²	52.9	46%	0.457	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-48.8	174.3	-179.8	178	169.5	-179.7	0	112.4	K314 M316 Y320 Y321 E322	K314-K318 WeakPolarHBondContact O-CB 3.22Å; K314-K318 PolarHBondContact O-N 3.35Å; M316-K318 VanDerWaalsContact C-N 3.31Å; M316-K318 PolarHBondContact O-N 3.43Å; K318-Y320 VanDerWaalsContact C-N 3.33Å; K318-Y320 PolarHBondContact O-N 2.81Å; K318-Y321 WeakPolarHBondContact O-CB 3.5Å; K318-Y321 PolarHBondContact O-N 2.8Å; K318-Y321 VanDerWaalsContact O-N 3.14Å; K318-E322 WeakPolarHBondContact CE-OE1 3.42Å; K318-E322 IonicContact NZ-OE1 3.8Å; K318-E322 WeakPolarHBondContact O-CG 3.43Å; K318-E322 PolarHBondContact O-N 3Å
319	S	84.3	Confident	85.6	Confident	5 Å²	5	48 Å²	48	4%	0.035	25%	0.246	C	C	.	.	H	α-helix	trans	-72.4	-25.5	-178.6	-175.8	0	0	0	0	112.9	D315 M316 S323	D315-S319 PolarHBondContact O-N 3.19Å; M316-S319 PolarHBondContact O-N 3.34Å; S319-S323 WeakPolarHBondContact O-CB 3.29Å; S319-S323 PolarHBondContact O-N 2.91Å; S319-S323 VanDerWaalsContact O-N 3.14Å; S319-S323 PolarHBondContact O-OG 3Å
320	Y	86.4	Confident	85.9	Confident	10 Å²	10	48.3 Å²	48.3	4%	0.039	25%	0.248	C	C	.	.	H	α-helix	trans	-68.3	-38.8	166	-76.9	-54.4	0	0	0	112.6	M291 R295 M316 A317 K318 S323 N324 D325 S328 V332	M291-Y320 HydrophobicContact CB-CE1 4.34Å; M291-Y320 HydrophobicContact CE-CD1 3.76Å; M291-Y320 HydrophobicContact CE-CD2 3.79Å; M291-Y320 HydrophobicContact CE-CE1 3.84Å; M291-Y320 HydrophobicContact CE-CE2 3.88Å; M291-Y320 HydrophobicContact CE-CG 3.72Å; M291-Y320 HydrophobicContact CG-CE1 3.78Å; M291-Y320 HydrophobicContact SD-CD1 4.39Å; M291-Y320 HydrophobicContact SD-CD2 4.14Å; M291-Y320 HydrophobicContact SD-CE1 3.87Å; M291-Y320 HydrophobicContact SD-CE2 3.59Å; M291-Y320 VanDerWaalsContact SD-CE2 3.59Å; M291-Y320 HydrophobicContact SD-CG 4.49Å; R295-Y320 PolarHBondContact NE-OH 3.41Å; R295-Y320 PolarHBondContact NH2-OH 3.48Å; M316-Y320 HydrophobicContact CB-CD2 4.46Å; M316-Y320 HydrophobicContact CB-CE2 4.35Å; M316-Y320 HydrophobicContact CE-CE2 4.08Å; M316-Y320 WeakPolarHBondContact O-CD2 3.35Å; M316-Y320 PolarHBondContact O-N 3.42Å; A317-Y320 PolarHBondContact O-N 3.06Å; K318-Y320 VanDerWaalsContact C-N 3.33Å; K318-Y320 PolarHBondContact O-N 2.81Å; Y320-S323 WeakPolarHBondContact CA-OG 3.42Å; Y320-S323 CarbonylContact O-C 3.6Å; Y320-S323 PolarHBondContact O-N 2.77Å; Y320-S323 PolarHBondContact O-OG 2.84Å; Y320-N324 PolarHBondContact O-N 3.11Å; Y320-D325 HydrophobicContact CD1-CB 4.07Å; Y320-D325 PolarHBondContact O-N 3.42Å; Y320-S328 VanDerWaalsContact CD1-CB 3.49Å; Y320-S328 VanDerWaalsContact CE1-CB 3.46Å; Y320-V332 HydrophobicContact CE2-CG2 4.06Å
321	Y	85.9	Confident	86.1	Confident	92 Å²	92	51.2 Å²	51.2	36%	0.361	27%	0.269	S	S	.	.	H	α-helix	trans	-63.7	-47.1	174.4	-173.4	-117.3	0	0	0	111.9	A317 K318 S323 N324 L326 L355	A317-Y321 WeakPolarHBondContact O-CB 3.22Å; A317-Y321 PolarHBondContact O-N 3.46Å; K318-Y321 WeakPolarHBondContact O-CB 3.5Å; K318-Y321 PolarHBondContact O-N 2.8Å; K318-Y321 VanDerWaalsContact O-N 3.14Å; Y321-S323 PolarHBondContact O-N 3.2Å; Y321-N324 PolarHBondContact O-N 3.41Å; Y321-L326 HydrophobicContact CD2-CD2 3.64Å; Y321-L326 HydrophobicContact CE2-CD2 4.05Å; Y321-L355 HydrophobicContact CD2-CD2 3.63Å; Y321-L355 HydrophobicContact CE2-CD2 4.33Å; Y321-L355 HydrophobicContact CG-CD2 4.14Å
322	E	86.1	Confident	86.3	Confident	127 Å²	127	46.9 Å²	46.9	59%	0.593	25%	0.249	S	C	*	.	H	α-helix	trans	-60.1	-28.3	174.5	-70.9	171.8	172.5	0	0	113.1	K318	K318-E322 WeakPolarHBondContact CE-OE1 3.42Å; K318-E322 IonicContact NZ-OE1 3.8Å; K318-E322 WeakPolarHBondContact O-CG 3.43Å; K318-E322 PolarHBondContact O-N 3Å
323	S	83.6	Confident	86.5	Confident	67 Å²	67	46.8 Å²	46.8	47%	0.469	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	6	174.3	55.4	0	0	0	0	114.5	S319 Y320 Y321 D325	S319-S323 WeakPolarHBondContact O-CB 3.29Å; S319-S323 PolarHBondContact O-N 2.91Å; S319-S323 VanDerWaalsContact O-N 3.14Å; S319-S323 PolarHBondContact O-OG 3Å; Y320-S323 WeakPolarHBondContact CA-OG 3.42Å; Y320-S323 CarbonylContact O-C 3.6Å; Y320-S323 PolarHBondContact O-N 2.77Å; Y320-S323 PolarHBondContact O-OG 2.84Å; Y321-S323 PolarHBondContact O-N 3.2Å; S323-D325 VanDerWaalsContact C-N 3.29Å; S323-D325 PolarHBondContact O-N 3.04Å
324	N	84.5	Confident	86.6	Confident	131 Å²	131	50.4 Å²	50.4	70%	0.701	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	28.7	178.9	-160.6	25.8	0	0	0	115.1	Y320 Y321	Y320-N324 PolarHBondContact O-N 3.11Å; Y321-N324 PolarHBondContact O-N 3.41Å
325	D	87.1	Confident	86.5	Confident	59 Å²	59	50.7 Å²	50.7	32%	0.316	27%	0.268	S	S	.	.			trans	-99.6	68.5	173.4	-174	0.8	0	0	0	110.8	Y320 S323 P327 S328 A329	Y320-D325 HydrophobicContact CD1-CB 4.07Å; Y320-D325 PolarHBondContact O-N 3.42Å; S323-D325 VanDerWaalsContact C-N 3.29Å; S323-D325 PolarHBondContact O-N 3.04Å; D325-P327 VanDerWaalsContact C-CD 3.46Å; D325-P327 WeakPolarHBondContact OD1-CD 3.21Å; D325-S328 VanDerWaalsContact CG-OG 3.23Å; D325-S328 PolarHBondContact O-N 2.97Å; D325-S328 WeakPolarHBondContact OD1-CB 3.37Å; D325-S328 PolarHBondContact OD1-N 3.03Å; D325-S328 VanDerWaalsContact OD1-N 3.15Å; D325-S328 PolarHBondContact OD1-OG 3.22Å; D325-S328 WeakPolarHBondContact OD2-CB 3.44Å; D325-S328 PolarHBondContact OD2-OG 2.98Å; D325-A329 PolarHBondContact O-N 2.94Å
326	L	86.3	Confident	86.5	Confident	33 Å²	33	46.4 Å²	46.4	17%	0.173	25%	0.245	C	C	.	.	H	α-helix	trans	-55.1	-39.1	179.2	-57.8	177.4	0	0	0	113.9	Y321 A329 L330 L355 C358	Y321-L326 HydrophobicContact CD2-CD2 3.64Å; Y321-L326 HydrophobicContact CE2-CD2 4.05Å; L326-A329 PolarHBondContact O-N 3.03Å; L326-L330 WeakPolarHBondContact O-CG 3.44Å; L326-L330 PolarHBondContact O-N 3.26Å; L326-L355 HydrophobicContact CD2-CD2 4.22Å; L326-C358 HydrophobicContact CD1-CB 4.39Å
327	P	88.4	Confident	86.5	Confident	92 Å²	92	46.9 Å²	46.9	60%	0.597	25%	0.248	S	C	*	.	H	α-helix	trans	-62.4	-42.1	176.1	-24.9	36	0	0	0	113.7	D325 S331	D325-P327 VanDerWaalsContact C-CD 3.46Å; D325-P327 WeakPolarHBondContact OD1-CD 3.21Å; P327-S331 PolarHBondContact O-N 3.06Å; P327-S331 VanDerWaalsContact O-N 3.14Å
328	S	86.3	Confident	86.3	Confident	18 Å²	18	50.4 Å²	50.4	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-67	-39.7	174.7	-71	0	0	0	0	112.1	R295 Y320 D325 S331 V332	R295-S328 PolarHBondContact NH2-OG 3.09Å; Y320-S328 VanDerWaalsContact CD1-CB 3.49Å; Y320-S328 VanDerWaalsContact CE1-CB 3.46Å; D325-S328 VanDerWaalsContact CG-OG 3.23Å; D325-S328 PolarHBondContact O-N 2.97Å; D325-S328 WeakPolarHBondContact OD1-CB 3.37Å; D325-S328 PolarHBondContact OD1-N 3.03Å; D325-S328 VanDerWaalsContact OD1-N 3.15Å; D325-S328 PolarHBondContact OD1-OG 3.22Å; D325-S328 WeakPolarHBondContact OD2-CB 3.44Å; D325-S328 PolarHBondContact OD2-OG 2.98Å; S328-S331 PolarHBondContact O-N 3.3Å; S328-V332 PolarHBondContact O-N 3.13Å
329	A	88.6	Confident	86.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-49.6	176.7	0	0	0	0	0	111.6	D325 L326 S331 V332 I333 L355	D325-A329 PolarHBondContact O-N 2.94Å; L326-A329 PolarHBondContact O-N 3.03Å; A329-S331 PolarHBondContact O-N 3.07Å; A329-V332 PolarHBondContact O-N 3.33Å; A329-I333 WeakPolarHBondContact O-CG1 3.38Å; A329-I333 PolarHBondContact O-N 3.27Å; A329-L355 HydrophobicContact CB-CD1 4.14Å; A329-L355 HydrophobicContact CB-CD2 3.98Å
330	L	88.3	Confident	85.9	Confident	9 Å²	9	50.5 Å²	50.5	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-39.1	-179.8	-76.2	173.4	0	0	0	112.9	L326 V332 I333 E334 L355 Y356 N359	L326-L330 WeakPolarHBondContact O-CG 3.44Å; L326-L330 PolarHBondContact O-N 3.26Å; L330-V332 VanDerWaalsContact C-N 3.34Å; L330-V332 PolarHBondContact O-N 3.19Å; L330-I333 PolarHBondContact O-N 3.25Å; L330-E334 WeakPolarHBondContact O-CB 3.35Å; L330-E334 WeakPolarHBondContact O-CG 3.11Å; L330-E334 PolarHBondContact O-N 3.37Å; L330-L355 HydrophobicContact CD2-CB 3.7Å; L330-L355 HydrophobicContact CG-CB 4.34Å; L330-Y356 HydrophobicContact CD2-CD1 3.58Å; L330-Y356 HydrophobicContact CD2-CE1 3.75Å; L330-Y356 HydrophobicContact CD2-CG 4.08Å; L330-N359 HydrophobicContact CD1-CB 3.74Å; L330-N359 WeakPolarHBondContact CD1-ND2 3.4Å
331	S	88.4	Confident	85.6	Confident	74 Å²	74	52.9 Å²	52.9	52%	0.517	29%	0.291	S	S	.	.	H	α-helix	trans	-58.4	-44.3	177.1	-173.4	0	0	0	0	112.4	P327 S328 A329 E334 E335	P327-S331 PolarHBondContact O-N 3.06Å; P327-S331 VanDerWaalsContact O-N 3.14Å; S328-S331 PolarHBondContact O-N 3.3Å; A329-S331 PolarHBondContact O-N 3.07Å; S331-E334 PolarHBondContact O-N 2.93Å; S331-E335 WeakPolarHBondContact O-CB 3.49Å; S331-E335 PolarHBondContact O-N 3Å
332	V	87.9	Confident	85.2	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-70	-32.7	179.3	174.8	0	0	0	0	112.3	L298 S313 M316 Y320 S328 A329 L330 G336	L298-V332 HydrophobicContact CD1-CG1 4.2Å; S313-V332 WeakPolarHBondContact OG-CG1 3.2Å; M316-V332 HydrophobicContact CB-CG1 4.09Å; M316-V332 HydrophobicContact CE-CG2 4.05Å; M316-V332 HydrophobicContact SD-CG1 4.37Å; Y320-V332 HydrophobicContact CE2-CG2 4.06Å; S328-V332 PolarHBondContact O-N 3.13Å; A329-V332 PolarHBondContact O-N 3.33Å; L330-V332 VanDerWaalsContact C-N 3.34Å; L330-V332 PolarHBondContact O-N 3.19Å; V332-G336 PolarHBondContact O-N 2.88Å; V332-G336 VanDerWaalsContact O-N 3.13Å
333	I	87.6	Confident	84.9	Confident	0 Å²	0	50 Å²	50	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-72.6	-45.3	174.1	-69.3	-62.8	0	0	0	111.5	A317 A329 L330 E335 G336 L337 F348 M351 A352 L355	A317-I333 HydrophobicContact CB-CD1 3.68Å; A317-I333 HydrophobicContact CB-CG1 3.76Å; A329-I333 WeakPolarHBondContact O-CG1 3.38Å; A329-I333 PolarHBondContact O-N 3.27Å; L330-I333 PolarHBondContact O-N 3.25Å; I333-E335 VanDerWaalsContact C-N 3.27Å; I333-E335 PolarHBondContact O-N 2.98Å; I333-G336 PolarHBondContact O-N 3.42Å; I333-L337 HydrophobicContact CG2-CD1 3.96Å; I333-L337 HydrophobicContact CG2-CG 4.34Å; I333-L337 WeakPolarHBondContact O-CG 3.42Å; I333-L337 PolarHBondContact O-N 2.99Å; I333-F348 HydrophobicContact CD1-CE1 3.96Å; I333-F348 HydrophobicContact CD1-CE2 3.95Å; I333-F348 HydrophobicContact CD1-CZ 3.55Å; I333-F348 HydrophobicContact CG2-CE1 4.41Å; I333-M351 HydrophobicContact CD1-CG 4.48Å; I333-A352 HydrophobicContact CG2-CB 3.46Å; I333-A352 VanDerWaalsContact CG2-CB 3.46Å; I333-L355 HydrophobicContact CG1-CD1 3.85Å
334	E	87.9	Confident	84.8	Confident	76 Å²	76	48.3 Å²	48.3	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-59	-39.8	175.1	-78.3	-176.4	165.2	0	0	111.1	L330 S331 A338 Y356 K364	L330-E334 WeakPolarHBondContact O-CB 3.35Å; L330-E334 WeakPolarHBondContact O-CG 3.11Å; L330-E334 PolarHBondContact O-N 3.37Å; S331-E334 PolarHBondContact O-N 2.93Å; E334-A338 VanDerWaalsContact O-CB 3.25Å; E334-A338 WeakPolarHBondContact O-CB 3.21Å; E334-A338 PolarHBondContact O-N 3.48Å; E334-Y356 HydrophobicContact CG-CE1 4.41Å; E334-Y356 WeakPolarHBondContact CG-OH 3.25Å; E334-K364 IonicContact OE1-NZ 3.69Å; E334-K364 PolarHBondContact OE1-NZ 2.78Å
335	E	85.6	Confident	84.8	Confident	69 Å²	69	45 Å²	45	32%	0.322	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-42.3	174.2	-175.2	164.9	-138.9	0	0	112.9	F309 S331 I333 A338 R339	F309-E335 HydrophobicContact CZ-CG 4.11Å; S331-E335 WeakPolarHBondContact O-CB 3.49Å; S331-E335 PolarHBondContact O-N 3Å; I333-E335 VanDerWaalsContact C-N 3.27Å; I333-E335 PolarHBondContact O-N 2.98Å; E335-A338 PolarHBondContact O-N 3.49Å; E335-R339 HydrophobicContact CG-CG 4.14Å; E335-R339 WeakPolarHBondContact O-CB 3.29Å; E335-R339 WeakPolarHBondContact O-CG 3.48Å; E335-R339 PolarHBondContact O-N 3.39Å; E335-R339 IonicContact OE1-CZ 3.16Å; E335-R339 IonicContact OE1-NE 2.78Å; E335-R339 PolarHBondContact OE1-NE 3.29Å; E335-R339 IonicContact OE1-NH2 3.76Å; E335-R339 PolarHBondContact OE1-NH2 3.35Å
336	G	84.5	Confident	84.6	Confident	0 Å²	0	46 Å²	46	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-49.4	175.3	0	0	0	0	0	113.1	V332 I333 A338 R339 H340	V332-G336 PolarHBondContact O-N 2.88Å; V332-G336 VanDerWaalsContact O-N 3.13Å; I333-G336 PolarHBondContact O-N 3.42Å; G336-A338 PolarHBondContact O-N 2.95Å; G336-R339 PolarHBondContact O-N 3.44Å; G336-H340 PolarHBondContact O-N 3.34Å; G336-H340 VanDerWaalsContact O-N 3.07Å
337	L	84.8	Confident	84.5	Confident	10 Å²	10	49 Å²	49	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-62.8	-24	176.9	-65	175.3	0	0	0	113.2	I333 V344 F348 A352 Y356 V368 F372	I333-L337 HydrophobicContact CG2-CD1 3.96Å; I333-L337 HydrophobicContact CG2-CG 4.34Å; I333-L337 WeakPolarHBondContact O-CG 3.42Å; I333-L337 PolarHBondContact O-N 2.99Å; L337-V344 HydrophobicContact CD2-CG1 4.12Å; L337-V344 HydrophobicContact CD2-CG2 3.88Å; L337-F348 HydrophobicContact CD2-CD1 4.02Å; L337-F348 HydrophobicContact CD2-CE1 3.88Å; L337-F348 HydrophobicContact CG-CE1 4.06Å; L337-A352 HydrophobicContact CD1-CB 4.34Å; L337-Y356 HydrophobicContact CD1-CE2 4.4Å; L337-V368 HydrophobicContact CD1-CG1 3.82Å; L337-V368 HydrophobicContact CD1-CG2 4.32Å; L337-F372 HydrophobicContact CB-CE2 4.29Å; L337-F372 HydrophobicContact CB-CZ 4.41Å; L337-F372 HydrophobicContact CD2-CD2 4.22Å; L337-F372 HydrophobicContact CD2-CE2 3.85Å; L337-F372 HydrophobicContact CD2-CZ 4.25Å; L337-F372 HydrophobicContact CG-CE2 4.48Å
338	A	84.1	Confident	84.4	Confident	74 Å²	74	44.8 Å²	44.8	61%	0.612	27%	0.272	S	S	*	.	H	α-helix	trans	-86.5	-43.7	176.7	0	0	0	0	0	113.1	E334 E335 G336	E334-A338 VanDerWaalsContact O-CB 3.25Å; E334-A338 WeakPolarHBondContact O-CB 3.21Å; E334-A338 PolarHBondContact O-N 3.48Å; E335-A338 PolarHBondContact O-N 3.49Å; G336-A338 PolarHBondContact O-N 2.95Å
339	R	80.6	Confident	84.4	Confident	93 Å²	93	44 Å²	44	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-77.3	-39.1	-175.5	-72.3	-173.7	-177.7	-156.2	11.4	113.8	L298 E335 G336 P341	L298-R339 PolarHBondContact O-NH1 3.06Å; E335-R339 HydrophobicContact CG-CG 4.14Å; E335-R339 WeakPolarHBondContact O-CB 3.29Å; E335-R339 WeakPolarHBondContact O-CG 3.48Å; E335-R339 PolarHBondContact O-N 3.39Å; E335-R339 IonicContact OE1-CZ 3.16Å; E335-R339 IonicContact OE1-NE 2.78Å; E335-R339 PolarHBondContact OE1-NE 3.29Å; E335-R339 IonicContact OE1-NH2 3.76Å; E335-R339 PolarHBondContact OE1-NH2 3.35Å; G336-R339 PolarHBondContact O-N 3.44Å; R339-P341 VanDerWaalsContact C-CD 3.47Å
340	H	80.8	Confident	84.4	Confident	19 Å²	19	45.4 Å²	45.4	9%	0.088	27%	0.274	C	S	.	.			trans	-127.6	59.9	-175.8	-61	-82.5	0	0	0	114.1	F309 M310 G336 G342 L343	F309-H340 AromaticContact CD1-CD2 3.84Å; F309-H340 AromaticContact CG-CD2 3.95Å; F309-H340 AromaticContact CG-NE2 3.95Å; M310-H340 HydrophobicContact CG-CB 4.35Å; M310-H340 HydrophobicContact SD-CB 4.17Å; G336-H340 PolarHBondContact O-N 3.34Å; G336-H340 VanDerWaalsContact O-N 3.07Å; H340-G342 PolarHBondContact O-N 3.3Å; H340-L343 HydrophobicContact CB-CB 4.33Å; H340-L343 HydrophobicContact CB-CD1 4.5Å; H340-L343 PolarHBondContact O-N 3.17Å; H340-L343 VanDerWaalsContact O-N 3.07Å
341	P	80.2	Confident	84.4	Confident	60 Å²	60	46.6 Å²	46.6	39%	0.39	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-56.6	-27.7	-177.9	-24.8	34.3	0	0	0	115.3	R339 F372	R339-P341 VanDerWaalsContact C-CD 3.47Å; P341-F372 HydrophobicContact CB-CE1 3.91Å; P341-F372 HydrophobicContact CB-CZ 4.34Å; P341-F372 WeakPolarHBondContact O-CE1 3.3Å
342	G	77	Confident	84.3	Confident	78 Å²	78	43 Å²	43	80%	0.804	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-88.3	1.4	-179.4	0	0	0	0	0	115.6	H340	H340-G342 PolarHBondContact O-N 3.3Å
343	L	80.8	Confident	84.3	Confident	81 Å²	81	42.8 Å²	42.8	42%	0.424	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-120.4	17.3	177.4	-62.9	175.4	0	0	0	112.1	M310 H340 S345	M310-L343 HydrophobicContact CG-CB 4.49Å; H340-L343 HydrophobicContact CB-CB 4.33Å; H340-L343 HydrophobicContact CB-CD1 4.5Å; H340-L343 PolarHBondContact O-N 3.17Å; H340-L343 VanDerWaalsContact O-N 3.07Å; L343-S345 PolarHBondContact O-N 3.33Å
344	V	81.8	Confident	84.4	Confident	31 Å²	31	45.8 Å²	45.8	19%	0.188	27%	0.267	C	S	.	.			trans	-72.8	113.5	174.7	-179.1	0	0	0	0	108.7	M310 L337 F348 L349 F372	M310-V344 HydrophobicContact CE-CB 4.49Å; M310-V344 HydrophobicContact CE-CG2 3.99Å; L337-V344 HydrophobicContact CD2-CG1 4.12Å; L337-V344 HydrophobicContact CD2-CG2 3.88Å; V344-F348 HydrophobicContact CG1-CD1 4.46Å; V344-L349 HydrophobicContact CG1-CB 4.18Å; V344-F372 HydrophobicContact CB-CD1 4.09Å; V344-F372 HydrophobicContact CB-CE1 4.44Å; V344-F372 HydrophobicContact CG1-CB 4.34Å; V344-F372 HydrophobicContact CG1-CD1 4.36Å; V344-F372 HydrophobicContact CG1-CG 4.3Å; V344-F372 HydrophobicContact CG2-CD1 3.92Å; V344-F372 HydrophobicContact CG2-CE1 3.77Å; V344-F372 HydrophobicContact CG2-CZ 4.24Å
345	S	83.6	Confident	84.4	Confident	63 Å²	63	42.2 Å²	42.2	44%	0.441	25%	0.251	S	S	.	.			trans	-88	156.7	170.2	57.9	0	0	0	0	111.4	L343 D347 F348 L349	L343-S345 PolarHBondContact O-N 3.33Å; S345-D347 PolarHBondContact O-N 3.22Å; S345-F348 WeakPolarHBondContact O-CB 3.32Å; S345-F348 PolarHBondContact O-N 3.41Å; S345-F348 PolarHBondContact OG-N 3.4Å; S345-L349 PolarHBondContact O-N 2.89Å
346	D	83.6	Confident	84.6	Confident	80 Å²	80	39.2 Å²	39.2	43%	0.428	24%	0.236	S	C	.	.	H	α-helix	trans	-52.1	-40.8	174.5	-60.8	-27.7	0	0	0	111.5	F348 L349 N350 P428 L431	D346-F348 VanDerWaalsContact C-N 3.33Å; D346-F348 PolarHBondContact O-N 3.4Å; D346-L349 CarbonylContact O-C 3.56Å; D346-L349 PolarHBondContact O-N 3.24Å; D346-N350 WeakPolarHBondContact O-CB 3.47Å; D346-N350 PolarHBondContact O-N 2.83Å; D346-P428 HydrophobicContact CB-CG 4.03Å; D346-L431 HydrophobicContact CB-CD1 4.31Å
347	D	84.6	Confident	84.8	Confident	95 Å²	95	40.8 Å²	40.8	51%	0.508	25%	0.245	S	C	.	.	H	α-helix	trans	-50.7	-45	171.7	-106.9	50.9	0	0	0	114	K314 S345 M351	K314-D347 IonicContact NZ-OD2 2.87Å; K314-D347 PolarHBondContact NZ-OD2 3.07Å; S345-D347 PolarHBondContact O-N 3.22Å; D347-M351 PolarHBondContact O-N 3.44Å
348	F	85.5	Confident	84.9	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	26%	0.26	C	S	.	.	H	α-helix	trans	-77.2	-38.1	-179.3	-167.3	-85.7	0	0	0	110.7	M310 K314 I333 L337 V344 S345 D346 N350 M351 A352	M310-F348 HydrophobicContact CE-CB 4.35Å; M310-F348 HydrophobicContact CE-CD1 3.55Å; M310-F348 HydrophobicContact CE-CD2 3.79Å; M310-F348 HydrophobicContact CE-CE1 3.64Å; M310-F348 HydrophobicContact CE-CE2 3.88Å; M310-F348 HydrophobicContact CE-CG 3.62Å; M310-F348 HydrophobicContact CE-CZ 3.8Å; M310-F348 WeakPolarHBondContact O-CE2 3.27Å; M310-F348 HydrophobicContact SD-CE1 4.43Å; M310-F348 HydrophobicContact SD-CE2 4.15Å; M310-F348 HydrophobicContact SD-CZ 4.09Å; K314-F348 HydrophobicContact CB-CD2 4.26Å; K314-F348 HydrophobicContact CB-CE2 4.48Å; I333-F348 HydrophobicContact CD1-CE1 3.96Å; I333-F348 HydrophobicContact CD1-CE2 3.95Å; I333-F348 HydrophobicContact CD1-CZ 3.55Å; I333-F348 HydrophobicContact CG2-CE1 4.41Å; L337-F348 HydrophobicContact CD2-CD1 4.02Å; L337-F348 HydrophobicContact CD2-CE1 3.88Å; L337-F348 HydrophobicContact CG-CE1 4.06Å; V344-F348 HydrophobicContact CG1-CD1 4.46Å; S345-F348 WeakPolarHBondContact O-CB 3.32Å; S345-F348 PolarHBondContact O-N 3.41Å; S345-F348 PolarHBondContact OG-N 3.4Å; D346-F348 VanDerWaalsContact C-N 3.33Å; D346-F348 PolarHBondContact O-N 3.4Å; F348-N350 VanDerWaalsContact C-N 3.34Å; F348-M351 PolarHBondContact O-N 3.2Å; F348-A352 WeakPolarHBondContact O-CB 3.28Å; F348-A352 PolarHBondContact O-N 2.98Å
349	L	86.8	Confident	85.1	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-36.8	175.1	-174.9	55.4	0	0	0	112	V344 S345 D346 A352 A353 V368 L369 F372 A373 L431	V344-L349 HydrophobicContact CG1-CB 4.18Å; S345-L349 PolarHBondContact O-N 2.89Å; D346-L349 CarbonylContact O-C 3.56Å; D346-L349 PolarHBondContact O-N 3.24Å; L349-A352 PolarHBondContact O-N 3.4Å; L349-A353 VanDerWaalsContact O-CB 3.31Å; L349-A353 WeakPolarHBondContact O-CB 3.4Å; L349-A353 PolarHBondContact O-N 2.97Å; L349-V368 HydrophobicContact CD1-CG1 3.63Å; L349-L369 HydrophobicContact CD1-CD2 4.11Å; L349-L369 HydrophobicContact CD2-CD2 4.26Å; L349-L369 HydrophobicContact CG-CD2 3.98Å; L349-F372 HydrophobicContact CD1-CB 4.17Å; L349-F372 HydrophobicContact CD2-CB 3.91Å; L349-A373 HydrophobicContact CD2-CB 3.88Å; L349-L431 HydrophobicContact CD2-CD1 3.88Å; L349-L431 HydrophobicContact CG-CD1 4.19Å; L349-L431 HydrophobicContact CG-CD2 4.24Å
350	N	88.9	Confident	85.4	Confident	30 Å²	30	44.8 Å²	44.8	16%	0.16	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-44.3	178	-164.3	11.3	0	0	0	111.6	D346 F348 E354 D430 L431 K434	D346-N350 WeakPolarHBondContact O-CB 3.47Å; D346-N350 PolarHBondContact O-N 2.83Å; F348-N350 VanDerWaalsContact C-N 3.34Å; N350-E354 PolarHBondContact O-N 3.32Å; N350-E354 VanDerWaalsContact O-N 3.15Å; N350-D430 PolarHBondContact ND2-OD2 3.38Å; N350-L431 HydrophobicContact CB-CD2 3.78Å; N350-K434 PolarHBondContact O-NZ 3.49Å; N350-K434 WeakPolarHBondContact OD1-CD 3.43Å; N350-K434 WeakPolarHBondContact OD1-CE 3.47Å; N350-K434 PolarHBondContact OD1-NZ 2.76Å
351	M	87	Confident	85.7	Confident	34 Å²	34	46.8 Å²	46.8	17%	0.167	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-44.9	172.7	179.8	60.1	61.3	0	0	111.8	I333 D347 F348 A353 E354 L355	I333-M351 HydrophobicContact CD1-CG 4.48Å; D347-M351 PolarHBondContact O-N 3.44Å; F348-M351 PolarHBondContact O-N 3.2Å; M351-A353 PolarHBondContact O-N 3.02Å; M351-E354 WeakPolarHBondContact O-CB 3.32Å; M351-E354 PolarHBondContact O-N 3.33Å; M351-L355 HydrophobicContact CG-CD1 4.13Å; M351-L355 WeakPolarHBondContact O-CG 3.28Å; M351-L355 PolarHBondContact O-N 2.85Å; M351-L355 VanDerWaalsContact O-N 3.15Å; M351-L355 HydrophobicContact SD-CD1 4.08Å; M351-L355 HydrophobicContact SD-CG 4.42Å
352	A	87.8	Confident	86	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-46.8	177.3	0	0	0	0	0	111.8	I333 L337 F348 L349 E354 L355 Y356	I333-A352 HydrophobicContact CG2-CB 3.46Å; I333-A352 VanDerWaalsContact CG2-CB 3.46Å; L337-A352 HydrophobicContact CD1-CB 4.34Å; F348-A352 WeakPolarHBondContact O-CB 3.28Å; F348-A352 PolarHBondContact O-N 2.98Å; L349-A352 PolarHBondContact O-N 3.4Å; A352-E354 VanDerWaalsContact C-N 3.32Å; A352-E354 PolarHBondContact O-N 3.3Å; A352-L355 PolarHBondContact O-N 2.75Å; A352-Y356 HydrophobicContact CB-CE2 4.36Å; A352-Y356 WeakPolarHBondContact O-CD2 3.4Å; A352-Y356 PolarHBondContact O-N 2.69Å; A352-Y356 VanDerWaalsContact O-N 3.1Å
353	A	87.9	Confident	86.4	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-39.3	179.1	0	0	0	0	0	112.5	L349 M351 I357 T365 L369 K434	L349-A353 VanDerWaalsContact O-CB 3.31Å; L349-A353 WeakPolarHBondContact O-CB 3.4Å; L349-A353 PolarHBondContact O-N 2.97Å; M351-A353 PolarHBondContact O-N 3.02Å; A353-I357 WeakPolarHBondContact O-CB 3.46Å; A353-I357 WeakPolarHBondContact O-CD1 3.33Å; A353-I357 VanDerWaalsContact O-CG1 3.23Å; A353-I357 WeakPolarHBondContact O-CG1 3.43Å; A353-I357 PolarHBondContact O-N 2.83Å; A353-T365 HydrophobicContact CB-CG2 3.74Å; A353-L369 HydrophobicContact CB-CD2 4.34Å; A353-K434 HydrophobicContact CB-CB 4.43Å; A353-K434 HydrophobicContact CB-CD 4.14Å
354	E	88.4	Confident	86.5	Confident	63 Å²	63	46.3 Å²	46.3	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-59.2	-52.1	175.1	-156.6	166.4	127	0	0	111.6	N350 M351 A352 Y356 I357 C358 K434	N350-E354 PolarHBondContact O-N 3.32Å; N350-E354 VanDerWaalsContact O-N 3.15Å; M351-E354 WeakPolarHBondContact O-CB 3.32Å; M351-E354 PolarHBondContact O-N 3.33Å; A352-E354 VanDerWaalsContact C-N 3.32Å; A352-E354 PolarHBondContact O-N 3.3Å; E354-Y356 VanDerWaalsContact C-N 3.34Å; E354-Y356 PolarHBondContact O-N 3.17Å; E354-I357 WeakPolarHBondContact O-CA 3.41Å; E354-I357 WeakPolarHBondContact O-CB 3.33Å; E354-I357 PolarHBondContact O-N 3.35Å; E354-C358 PolarHBondContact O-N 3.38Å; E354-C358 PolarHBondContact O-SG 3.3Å; E354-K434 IonicContact OE2-NZ 2.75Å; E354-K434 PolarHBondContact OE2-NZ 2.99Å
355	L	88.6	Confident	86.7	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-36.3	-177.9	-67.7	165.1	0	0	0	112.7	A317 Y321 L326 A329 L330 I333 M351 A352 N359	A317-L355 HydrophobicContact CB-CD1 3.99Å; Y321-L355 HydrophobicContact CD2-CD2 3.63Å; Y321-L355 HydrophobicContact CE2-CD2 4.33Å; Y321-L355 HydrophobicContact CG-CD2 4.14Å; L326-L355 HydrophobicContact CD2-CD2 4.22Å; A329-L355 HydrophobicContact CB-CD1 4.14Å; A329-L355 HydrophobicContact CB-CD2 3.98Å; L330-L355 HydrophobicContact CD2-CB 3.7Å; L330-L355 HydrophobicContact CG-CB 4.34Å; I333-L355 HydrophobicContact CG1-CD1 3.85Å; M351-L355 HydrophobicContact CG-CD1 4.13Å; M351-L355 WeakPolarHBondContact O-CG 3.28Å; M351-L355 PolarHBondContact O-N 2.85Å; M351-L355 VanDerWaalsContact O-N 3.15Å; M351-L355 HydrophobicContact SD-CD1 4.08Å; M351-L355 HydrophobicContact SD-CG 4.42Å; A352-L355 PolarHBondContact O-N 2.75Å; L355-N359 PolarHBondContact O-N 2.9Å; L355-N359 VanDerWaalsContact O-N 3.17Å
356	Y	89.1	Confident	86.7	Confident	6 Å²	6	42.5 Å²	42.5	2%	0.024	20%	0.204	C	C	.	.	H	α-helix	trans	-68.6	-37.9	172	-68.9	-61.6	0	0	0	112.4	L330 E334 L337 A352 E354 N359 R360 Q361 K364 T365 V368	L330-Y356 HydrophobicContact CD2-CD1 3.58Å; L330-Y356 HydrophobicContact CD2-CE1 3.75Å; L330-Y356 HydrophobicContact CD2-CG 4.08Å; E334-Y356 HydrophobicContact CG-CE1 4.41Å; E334-Y356 WeakPolarHBondContact CG-OH 3.25Å; L337-Y356 HydrophobicContact CD1-CE2 4.4Å; A352-Y356 HydrophobicContact CB-CE2 4.36Å; A352-Y356 WeakPolarHBondContact O-CD2 3.4Å; A352-Y356 PolarHBondContact O-N 2.69Å; A352-Y356 VanDerWaalsContact O-N 3.1Å; E354-Y356 VanDerWaalsContact C-N 3.34Å; E354-Y356 PolarHBondContact O-N 3.17Å; Y356-N359 CarbonylContact O-C 3.6Å; Y356-N359 PolarHBondContact O-N 3.22Å; Y356-R360 PolarHBondContact O-N 3.23Å; Y356-R360 VanDerWaalsContact O-N 3.13Å; Y356-Q361 HydrophobicContact CD1-CB 4.27Å; Y356-Q361 PolarHBondContact O-N 3.22Å; Y356-K364 HydrophobicContact CD1-CB 4.21Å; Y356-K364 HydrophobicContact CD1-CD 4.13Å; Y356-K364 HydrophobicContact CE1-CB 4.28Å; Y356-K364 HydrophobicContact CE1-CD 3.73Å; Y356-T365 WeakPolarHBondContact CB-OG1 3.14Å; Y356-V368 HydrophobicContact CE2-CG1 4.46Å; Y356-V368 HydrophobicContact CE2-CG2 4.01Å
357	I	88	Confident	86.7	Confident	34 Å²	34	44.5 Å²	44.5	17%	0.174	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-46.4	175.7	-75.4	166	0	0	0	110.7	A353 E354 N359 R360 Y362 T365 K434 V437	A353-I357 WeakPolarHBondContact O-CB 3.46Å; A353-I357 WeakPolarHBondContact O-CD1 3.33Å; A353-I357 VanDerWaalsContact O-CG1 3.23Å; A353-I357 WeakPolarHBondContact O-CG1 3.43Å; A353-I357 PolarHBondContact O-N 2.83Å; E354-I357 WeakPolarHBondContact O-CA 3.41Å; E354-I357 WeakPolarHBondContact O-CB 3.33Å; E354-I357 PolarHBondContact O-N 3.35Å; I357-N359 VanDerWaalsContact C-N 3.26Å; I357-N359 PolarHBondContact O-N 3.14Å; I357-R360 WeakPolarHBondContact O-CA 3.28Å; I357-R360 PolarHBondContact O-N 3.47Å; I357-Y362 HydrophobicContact CG1-CD1 4.32Å; I357-Y362 HydrophobicContact CG1-CE1 4.48Å; I357-Y362 HydrophobicContact CG2-CE1 4.31Å; I357-T365 HydrophobicContact CD1-CG2 4.4Å; I357-T365 HydrophobicContact CG1-CG2 4.28Å; I357-K434 HydrophobicContact CD1-CB 3.87Å; I357-K434 HydrophobicContact CD1-CG 3.91Å; I357-V437 HydrophobicContact CD1-CG1 4.43Å
358	C	86.9	Confident	86.7	Confident	54 Å²	54	40.9 Å²	40.9	37%	0.365	19%	0.192	S	C	.	.	H	α-helix	trans	-58.3	-37.2	175.5	-64.3	0	0	0	0	112.3	L326 E354 R360	L326-C358 HydrophobicContact CD1-CB 4.39Å; E354-C358 PolarHBondContact O-N 3.38Å; E354-C358 PolarHBondContact O-SG 3.3Å; C358-R360 VanDerWaalsContact C-N 3.27Å; C358-R360 PolarHBondContact O-N 2.76Å
359	N	88.8	Confident	86.6	Confident	63 Å²	63	40.8 Å²	40.8	34%	0.337	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	12.1	175.2	-160.6	23	0	0	0	113.7	L330 L355 Y356 I357 Q361	L330-N359 HydrophobicContact CD1-CB 3.74Å; L330-N359 WeakPolarHBondContact CD1-ND2 3.4Å; L355-N359 PolarHBondContact O-N 2.9Å; L355-N359 VanDerWaalsContact O-N 3.17Å; Y356-N359 CarbonylContact O-C 3.6Å; Y356-N359 PolarHBondContact O-N 3.22Å; I357-N359 VanDerWaalsContact C-N 3.26Å; I357-N359 PolarHBondContact O-N 3.14Å; N359-Q361 HydrophobicContact CB-CG 4.26Å; N359-Q361 PolarHBondContact ND2-NE2 3.02Å; N359-Q361 VanDerWaalsContact ND2-NE2 3.11Å; N359-Q361 WeakPolarHBondContact O-CG 3.2Å; N359-Q361 PolarHBondContact O-N 3.26Å; N359-Q361 VanDerWaalsContact O-N 3.13Å
360	R	86.3	Confident	86.4	Confident	143 Å²	143	42.6 Å²	42.6	54%	0.54	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	27.5	-179.8	-56.1	-166.8	172.1	-100.9	5	115.2	Y356 I357 C358 Y362 E476	Y356-R360 PolarHBondContact O-N 3.23Å; Y356-R360 VanDerWaalsContact O-N 3.13Å; I357-R360 WeakPolarHBondContact O-CA 3.28Å; I357-R360 PolarHBondContact O-N 3.47Å; C358-R360 VanDerWaalsContact C-N 3.27Å; C358-R360 PolarHBondContact O-N 2.76Å; R360-Y362 VanDerWaalsContact C-N 3.3Å; R360-Y362 HydrophobicContact CB-CE2 3.81Å; R360-Y362 HydrophobicContact CG-CE2 4.35Å; R360-Y362 WeakPolarHBondContact CG-OH 3.47Å; R360-Y362 PolarHBondContact NH1-OH 3.25Å; R360-Y362 WeakPolarHBondContact O-CD2 3.47Å; R360-Y362 PolarHBondContact O-N 2.99Å; R360-E476 IonicContact CZ-OE1 3.73Å; R360-E476 IonicContact CZ-OE2 2.97Å; R360-E476 IonicContact NH1-OE1 3.78Å; R360-E476 PolarHBondContact NH1-OE1 3.23Å; R360-E476 IonicContact NH1-OE2 3.98Å; R360-E476 PolarHBondContact NH1-OE2 3.48Å; R360-E476 IonicContact NH2-OE1 2.78Å; R360-E476 PolarHBondContact NH2-OE1 2.85Å; R360-E476 IonicContact NH2-OE2 2.68Å
361	Q	88.2	Confident	86	Confident	61 Å²	61	47.6 Å²	47.6	29%	0.285	22%	0.223	S	C	.	.			trans	-90	42.9	-178.5	-58.3	-160	-4.4	0	0	113.2	Y356 N359 K363 K364 T365	Y356-Q361 HydrophobicContact CD1-CB 4.27Å; Y356-Q361 PolarHBondContact O-N 3.22Å; N359-Q361 HydrophobicContact CB-CG 4.26Å; N359-Q361 PolarHBondContact ND2-NE2 3.02Å; N359-Q361 VanDerWaalsContact ND2-NE2 3.11Å; N359-Q361 WeakPolarHBondContact O-CG 3.2Å; N359-Q361 PolarHBondContact O-N 3.26Å; N359-Q361 VanDerWaalsContact O-N 3.13Å; Q361-K363 VanDerWaalsContact C-N 3.26Å; Q361-K363 PolarHBondContact O-N 2.7Å; Q361-K364 HydrophobicContact CB-CB 4.42Å; Q361-K364 WeakPolarHBondContact O-CB 3.28Å; Q361-K364 PolarHBondContact O-N 3.16Å; Q361-K364 VanDerWaalsContact OE1-CD 3.31Å; Q361-K364 VanDerWaalsContact OE1-CE 3.28Å; Q361-T365 PolarHBondContact O-N 2.85Å; Q361-T365 PolarHBondContact O-OG1 3.49Å
362	Y	86.3	Confident	85.5	Confident	27 Å²	27	47.7 Å²	47.7	11%	0.106	22%	0.223	C	C	.	.	H	α-helix	trans	-52.4	-34.7	-169.3	-46.4	-71.7	0	0	0	115.1	I357 R360 K364 T365 L366 Q441	I357-Y362 HydrophobicContact CG1-CD1 4.32Å; I357-Y362 HydrophobicContact CG1-CE1 4.48Å; I357-Y362 HydrophobicContact CG2-CE1 4.31Å; R360-Y362 VanDerWaalsContact C-N 3.3Å; R360-Y362 HydrophobicContact CB-CE2 3.81Å; R360-Y362 HydrophobicContact CG-CE2 4.35Å; R360-Y362 WeakPolarHBondContact CG-OH 3.47Å; R360-Y362 PolarHBondContact NH1-OH 3.25Å; R360-Y362 WeakPolarHBondContact O-CD2 3.47Å; R360-Y362 PolarHBondContact O-N 2.99Å; Y362-K364 PolarHBondContact O-N 2.79Å; Y362-T365 PolarHBondContact O-N 3.1Å; Y362-L366 PolarHBondContact O-N 2.9Å; Y362-Q441 HydrophobicContact CD1-CB 3.91Å; Y362-Q441 HydrophobicContact CD1-CG 4.18Å; Y362-Q441 HydrophobicContact CD2-CB 3.79Å; Y362-Q441 HydrophobicContact CE1-CB 3.97Å; Y362-Q441 HydrophobicContact CE1-CG 3.79Å; Y362-Q441 HydrophobicContact CE2-CB 3.84Å; Y362-Q441 HydrophobicContact CE2-CG 4.23Å; Y362-Q441 HydrophobicContact CG-CB 3.82Å
363	K	84.6	Confident	84.7	Confident	108 Å²	108	48.2 Å²	48.2	47%	0.47	23%	0.227	S	C	.	.	H	α-helix	trans	-60.2	-41.2	173.8	-81.9	-158	166.9	-160.2	0	112.5	Q361 Q367 D414 L442	Q361-K363 VanDerWaalsContact C-N 3.26Å; Q361-K363 PolarHBondContact O-N 2.7Å; K363-Q367 WeakPolarHBondContact O-CG 3.38Å; K363-Q367 PolarHBondContact O-N 2.75Å; K363-D414 IonicContact NZ-OD2 3.21Å; K363-D414 PolarHBondContact NZ-OD2 3.02Å; K363-L442 HydrophobicContact CG-CD1 4.5Å; K363-L442 HydrophobicContact CG-CD2 3.65Å
364	K	83.9	Confident	83.7	Confident	74 Å²	74	54.4 Å²	54.4	32%	0.322	26%	0.26	S	S	.	.	H	α-helix	trans	-68.1	-43.1	174.2	-75.4	-166.6	-172.9	167.9	0	111.1	E334 Y356 Q361 Y362 L366 Q367 V368	E334-K364 IonicContact OE1-NZ 3.69Å; E334-K364 PolarHBondContact OE1-NZ 2.78Å; Y356-K364 HydrophobicContact CD1-CB 4.21Å; Y356-K364 HydrophobicContact CD1-CD 4.13Å; Y356-K364 HydrophobicContact CE1-CB 4.28Å; Y356-K364 HydrophobicContact CE1-CD 3.73Å; Q361-K364 HydrophobicContact CB-CB 4.42Å; Q361-K364 WeakPolarHBondContact O-CB 3.28Å; Q361-K364 PolarHBondContact O-N 3.16Å; Q361-K364 VanDerWaalsContact OE1-CD 3.31Å; Q361-K364 VanDerWaalsContact OE1-CE 3.28Å; Y362-K364 PolarHBondContact O-N 2.79Å; K364-L366 VanDerWaalsContact C-N 3.28Å; K364-L366 PolarHBondContact O-N 3.37Å; K364-Q367 PolarHBondContact O-N 3.45Å; K364-Q367 VanDerWaalsContact O-N 3.13Å; K364-V368 WeakPolarHBondContact O-CB 3.45Å; K364-V368 WeakPolarHBondContact O-CG2 3.19Å; K364-V368 PolarHBondContact O-N 3.07Å
365	T	85.9	Confident	82.8	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-54.8	-47.2	178.3	-43.6	0	0	0	0	111	A353 Y356 I357 Q361 Y362 V368 L369 C438	A353-T365 HydrophobicContact CB-CG2 3.74Å; Y356-T365 WeakPolarHBondContact CB-OG1 3.14Å; I357-T365 HydrophobicContact CD1-CG2 4.4Å; I357-T365 HydrophobicContact CG1-CG2 4.28Å; Q361-T365 PolarHBondContact O-N 2.85Å; Q361-T365 PolarHBondContact O-OG1 3.49Å; Y362-T365 PolarHBondContact O-N 3.1Å; T365-V368 PolarHBondContact O-N 3.06Å; T365-L369 HydrophobicContact CG2-CD1 3.97Å; T365-L369 HydrophobicContact CG2-CG 4.39Å; T365-L369 WeakPolarHBondContact O-CB 3.42Å; T365-L369 VanDerWaalsContact O-CG 3.31Å; T365-L369 WeakPolarHBondContact O-CG 3.35Å; T365-L369 PolarHBondContact O-N 3.14Å; T365-C438 WeakPolarHBondContact CB-SG 3.41Å; T365-C438 WeakPolarHBondContact CG2-SG 3.32Å
366	L	83.9	Confident	81.8	Confident	14 Å²	14	55.6 Å²	55.6	7%	0.073	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-45.9	176.8	-176.8	62.8	0	0	0	112.1	Y362 K364 V368 L369 V370 L377 I418 L435 L439 L442	Y362-L366 PolarHBondContact O-N 2.9Å; K364-L366 VanDerWaalsContact C-N 3.28Å; K364-L366 PolarHBondContact O-N 3.37Å; L366-V368 VanDerWaalsContact C-N 3.34Å; L366-V368 PolarHBondContact O-N 2.87Å; L366-L369 PolarHBondContact O-N 2.92Å; L366-V370 HydrophobicContact CD1-CG2 4.19Å; L366-V370 VanDerWaalsContact O-CB 3.3Å; L366-V370 WeakPolarHBondContact O-CB 3.46Å; L366-V370 WeakPolarHBondContact O-CG2 3.33Å; L366-V370 PolarHBondContact O-N 2.93Å; L366-L377 HydrophobicContact CD1-CD2 4.47Å; L366-I418 HydrophobicContact CD2-CD1 3.81Å; L366-L435 HydrophobicContact CD1-CD1 3.53Å; L366-L439 HydrophobicContact CD1-CD2 4.29Å; L366-L442 HydrophobicContact CB-CD1 4.42Å; L366-L442 HydrophobicContact CD2-CD1 3.91Å
367	Q	84.4	Confident	80.5	Confident	121 Å²	121	57.4 Å²	57.4	57%	0.565	28%	0.281	S	S	*	.	H	α-helix	trans	-61.1	-40	176.5	-72.1	171.5	-10.6	0	0	112.8	K363 K364 K371	K363-Q367 WeakPolarHBondContact O-CG 3.38Å; K363-Q367 PolarHBondContact O-N 2.75Å; K364-Q367 PolarHBondContact O-N 3.45Å; K364-Q367 VanDerWaalsContact O-N 3.13Å; Q367-K371 VanDerWaalsContact O-CB 3.24Å; Q367-K371 WeakPolarHBondContact O-CB 3.39Å; Q367-K371 PolarHBondContact O-N 3.31Å
368	V	84.3	Confident	79.2	Confident	20 Å²	20	59.5 Å²	59.5	12%	0.121	29%	0.292	C	S	.	.	H	α-helix	trans	-71.3	-45.5	179.9	171.4	0	0	0	0	110.7	L337 L349 Y356 K364 T365 L366 K371 F372	L337-V368 HydrophobicContact CD1-CG1 3.82Å; L337-V368 HydrophobicContact CD1-CG2 4.32Å; L349-V368 HydrophobicContact CD1-CG1 3.63Å; Y356-V368 HydrophobicContact CE2-CG1 4.46Å; Y356-V368 HydrophobicContact CE2-CG2 4.01Å; K364-V368 WeakPolarHBondContact O-CB 3.45Å; K364-V368 WeakPolarHBondContact O-CG2 3.19Å; K364-V368 PolarHBondContact O-N 3.07Å; T365-V368 PolarHBondContact O-N 3.06Å; L366-V368 VanDerWaalsContact C-N 3.34Å; L366-V368 PolarHBondContact O-N 2.87Å; V368-K371 PolarHBondContact O-N 2.97Å; V368-F372 HydrophobicContact CG1-CD2 3.97Å; V368-F372 HydrophobicContact CG1-CE2 4.38Å; V368-F372 VanDerWaalsContact O-CD2 3.29Å; V368-F372 WeakPolarHBondContact O-CD2 3.38Å; V368-F372 PolarHBondContact O-N 3.42Å; V368-F372 VanDerWaalsContact O-N 3.13Å
369	L	83	Confident	78	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-47	174.7	-70.8	170.9	0	0	0	111.7	L349 A353 T365 L366 K371 F372 A373 I375 L431 L435	L349-L369 HydrophobicContact CD1-CD2 4.11Å; L349-L369 HydrophobicContact CD2-CD2 4.26Å; L349-L369 HydrophobicContact CG-CD2 3.98Å; A353-L369 HydrophobicContact CB-CD2 4.34Å; T365-L369 HydrophobicContact CG2-CD1 3.97Å; T365-L369 HydrophobicContact CG2-CG 4.39Å; T365-L369 WeakPolarHBondContact O-CB 3.42Å; T365-L369 VanDerWaalsContact O-CG 3.31Å; T365-L369 WeakPolarHBondContact O-CG 3.35Å; T365-L369 PolarHBondContact O-N 3.14Å; L366-L369 PolarHBondContact O-N 2.92Å; L369-K371 VanDerWaalsContact C-N 3.3Å; L369-K371 PolarHBondContact O-N 3.36Å; L369-F372 PolarHBondContact O-N 2.92Å; L369-A373 WeakPolarHBondContact O-CB 3.48Å; L369-A373 PolarHBondContact O-N 2.78Å; L369-I375 HydrophobicContact CB-CD1 4.13Å; L369-L431 HydrophobicContact CD2-CB 4.48Å; L369-L431 HydrophobicContact CD2-CD2 4.09Å; L369-L435 HydrophobicContact CD1-CB 4.09Å; L369-L435 HydrophobicContact CD1-CD1 4.08Å
370	V	81.9	Confident	75.8	Confident	38 Å²	38	66.8 Å²	66.8	23%	0.23	31%	0.314	C	S	.	.	H	α-helix	trans	-61.5	-36.4	177.2	165.7	0	0	0	0	112.4	L366 I375 L377	L366-V370 HydrophobicContact CD1-CG2 4.19Å; L366-V370 VanDerWaalsContact O-CB 3.3Å; L366-V370 WeakPolarHBondContact O-CB 3.46Å; L366-V370 WeakPolarHBondContact O-CG2 3.33Å; L366-V370 PolarHBondContact O-N 2.93Å; V370-I375 HydrophobicContact CG2-CB 4.39Å; V370-I375 HydrophobicContact CG2-CG2 4.42Å; V370-L377 HydrophobicContact CG1-CD1 4.19Å; V370-L377 HydrophobicContact CG1-CG 4.05Å; V370-L377 HydrophobicContact CG2-CD1 4.09Å; V370-L377 HydrophobicContact CG2-CD2 3.63Å; V370-L377 HydrophobicContact CG2-CG 3.72Å
371	K	80.5	Confident	73.4	Confident	135 Å²	135	68.8 Å²	68.8	59%	0.587	33%	0.329	S	S	*	.	H	α-helix	trans	-75.1	-27.9	-179.4	-177	179.8	173.5	-166.8	0	113.9	Q367 V368 L369	Q367-K371 VanDerWaalsContact O-CB 3.24Å; Q367-K371 WeakPolarHBondContact O-CB 3.39Å; Q367-K371 PolarHBondContact O-N 3.31Å; V368-K371 PolarHBondContact O-N 2.97Å; L369-K371 VanDerWaalsContact C-N 3.3Å; L369-K371 PolarHBondContact O-N 3.36Å
372	F	78.1	Confident	70.5	Confident	37 Å²	37	70.6 Å²	70.6	16%	0.162	35%	0.348	C	S	.	.	H	α-helix	trans	-121.6	-10.7	-168	-67.2	-67.7	0	0	0	115.7	L337 P341 V344 L349 V368 L369	L337-F372 HydrophobicContact CB-CE2 4.29Å; L337-F372 HydrophobicContact CB-CZ 4.41Å; L337-F372 HydrophobicContact CD2-CD2 4.22Å; L337-F372 HydrophobicContact CD2-CE2 3.85Å; L337-F372 HydrophobicContact CD2-CZ 4.25Å; L337-F372 HydrophobicContact CG-CE2 4.48Å; P341-F372 HydrophobicContact CB-CE1 3.91Å; P341-F372 HydrophobicContact CB-CZ 4.34Å; P341-F372 WeakPolarHBondContact O-CE1 3.3Å; V344-F372 HydrophobicContact CB-CD1 4.09Å; V344-F372 HydrophobicContact CB-CE1 4.44Å; V344-F372 HydrophobicContact CG1-CB 4.34Å; V344-F372 HydrophobicContact CG1-CD1 4.36Å; V344-F372 HydrophobicContact CG1-CG 4.3Å; V344-F372 HydrophobicContact CG2-CD1 3.92Å; V344-F372 HydrophobicContact CG2-CE1 3.77Å; V344-F372 HydrophobicContact CG2-CZ 4.24Å; L349-F372 HydrophobicContact CD1-CB 4.17Å; L349-F372 HydrophobicContact CD2-CB 3.91Å; V368-F372 HydrophobicContact CG1-CD2 3.97Å; V368-F372 HydrophobicContact CG1-CE2 4.38Å; V368-F372 VanDerWaalsContact O-CD2 3.29Å; V368-F372 WeakPolarHBondContact O-CD2 3.38Å; V368-F372 PolarHBondContact O-N 3.42Å; V368-F372 VanDerWaalsContact O-N 3.13Å; L369-F372 PolarHBondContact O-N 2.92Å
373	A	70.7	Confident	68.2	Low	10 Å²	10	75.8 Å²	75.8	8%	0.083	39%	0.385	C	S	.	.	S	Bend	trans	-115.7	20.4	176.6	0	0	0	0	0	113.7	L349 L369 I375 V427	L349-A373 HydrophobicContact CD2-CB 3.88Å; L369-A373 WeakPolarHBondContact O-CB 3.48Å; L369-A373 PolarHBondContact O-N 2.78Å; A373-I375 HydrophobicContact CB-CD1 4.01Å; A373-I375 HydrophobicContact CB-CG1 4.19Å; A373-I375 PolarHBondContact O-N 3.04Å; A373-V427 HydrophobicContact CB-CG2 4.25Å; A373-V427 WeakPolarHBondContact O-CG2 3.29Å
374	D	65.6	Low	65.5	Low	132 Å²	132	75.2 Å²	75.2	71%	0.706	40%	0.395	S	S	*	.			trans	51.8	27.7	179.4	-67.1	-24.9	0	0	0	115.3	V376 P424	D374-V376 PolarHBondContact O-N 2.72Å; D374-P424 HydrophobicContact CB-CG 4.44Å
375	I	70.9	Confident	62.8	Low	6 Å²	6	80.3 Å²	80.3	3%	0.031	42%	0.42	C	S	.	.			trans	-76.7	121.3	179.1	-59.7	158.5	0	0	0	109.8	L369 V370 A373 V423 L435	L369-I375 HydrophobicContact CB-CD1 4.13Å; V370-I375 HydrophobicContact CG2-CB 4.39Å; V370-I375 HydrophobicContact CG2-CG2 4.42Å; A373-I375 HydrophobicContact CB-CD1 4.01Å; A373-I375 HydrophobicContact CB-CG1 4.19Å; A373-I375 PolarHBondContact O-N 3.04Å; I375-V423 HydrophobicContact CG1-CG2 4.49Å; I375-V423 HydrophobicContact CG2-CG2 4.06Å; I375-L435 HydrophobicContact CD1-CD1 4.43Å; I375-L435 HydrophobicContact CD1-CD2 4.04Å
376	V	65.8	Low	60.1	Low	83 Å²	83	86.5 Å²	86.5	50%	0.503	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	114.8	-179.9	-176	0	0	0	0	110.5	D374 H422	D374-V376 PolarHBondContact O-N 2.72Å; V376-H422 HydrophobicContact CB-CB 4.29Å; V376-H422 PolarHBondContact N-O 3.14Å; V376-H422 PolarHBondContact O-N 3.25Å
377	L	63	Low	57.4	Low	44 Å²	44	90.9 Å²	90.9	23%	0.23	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	125.8	168.1	-60.6	-178.4	0	0	0	110.3	L366 V370 I418 L421	L366-L377 HydrophobicContact CD1-CD2 4.47Å; V370-L377 HydrophobicContact CG1-CD1 4.19Å; V370-L377 HydrophobicContact CG1-CG 4.05Å; V370-L377 HydrophobicContact CG2-CD1 4.09Å; V370-L377 HydrophobicContact CG2-CD2 3.63Å; V370-L377 HydrophobicContact CG2-CG 3.72Å; L377-I418 HydrophobicContact CD2-CD1 4.46Å; L377-I418 HydrophobicContact CD2-CG2 4.47Å; L377-L421 HydrophobicContact CD2-CD2 3.32Å
378	I	60.8	Low	54.6	Low	77 Å²	77	90.1 Å²	90.1	40%	0.395	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	112	166.8	-57.5	178.4	0	0	0	108.4	L419 D420	I378-L419 PolarHBondContact O-N 3.07Å; I378-L419 VanDerWaalsContact O-N 3.17Å; I378-D420 HydrophobicContact CB-CB 4.18Å; I378-D420 WeakPolarHBondContact CB-O 3.41Å; I378-D420 HydrophobicContact CD1-CB 4.22Å; I378-D420 PolarHBondContact N-O 2.63Å
379	R	62.4	Low	52	Low	114 Å²	114	97.6 Å²	97.6	43%	0.43	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	157.8	172.3	-59.3	-173.4	-175.8	-160.5	0.9	109.8	E381 D416	R379-E381 PolarHBondContact O-N 2.97Å; R379-D416 WeakPolarHBondContact CD-OD2 3.49Å; R379-D416 IonicContact CZ-OD2 2.58Å; R379-D416 IonicContact NE-OD2 2.97Å; R379-D416 IonicContact NH1-OD2 2.59Å; R379-D416 PolarHBondContact NH1-OD2 3.07Å
380	E	40.9	Very low	49.2	Very low	157 Å²	157	102.4 Å²	102.4	73%	0.734	58%	0.581	S	S	*	*			trans	-75	117.5	176.1	-153	170.2	-119.7	0	0	110.9	S382 L419	E380-S382 PolarHBondContact O-N 3.3Å; E380-L419 HydrophobicContact CB-CD1 3.76Å; E380-L419 HydrophobicContact CG-CD1 3.92Å
381	E	37	Very low	46.5	Very low	185 Å²	185	108.8 Å²	108.8	86%	0.864	61%	0.611	S	S	*	*			trans	-72	115.5	177.9	-73.6	-170.3	159.4	0	0	111.4	R379	R379-E381 PolarHBondContact O-N 2.97Å
382	S	27.4	Very low	44	Very low	98 Å²	98	110.8 Å²	110.8	69%	0.685	62%	0.619	S	S	*	*			trans	-68.8	127.9	163.5	73.4	0	0	0	0	110	E380 S384	E380-S382 PolarHBondContact O-N 3.3Å; S382-S384 PolarHBondContact O-N 3.17Å
383	P	36.8	Very low	41.4	Very low	136 Å²	136	116 Å²	116	88%	0.883	65%	0.649	S	S	*	*			trans	-83.2	73.7	-161	31.9	-37.7	0	0	0	114.9
384	S	28.8	Very low	39.2	Very low	97 Å²	97	123.2 Å²	123.2	68%	0.678	69%	0.685	S	S	*	*			trans	-163.5	131.1	165.3	54	0	0	0	0	110.4	S382	S382-S384 PolarHBondContact O-N 3.17Å
385	E	27.8	Very low	37.1	Very low	181 Å²	181	120.4 Å²	120.4	85%	0.846	69%	0.688	S	S	*	*			cis	-136.4	142.8	9.3	-61.1	-175.3	123.5	0	0	112.2	S387	E385-S387 PolarHBondContact O-N 2.86Å
386	S	28.1	Very low	34.9	Very low	131 Å²	131	127.2 Å²	127.2	92%	0.916	73%	0.73	S	S	*	*			trans	-100.5	62.7	-176.5	50.3	0	0	0	0	114.4
387	S	27.2	Very low	32.9	Very low	105 Å²	105	132 Å²	132	73%	0.734	75%	0.747	S	S	*	*			trans	-159.1	94	169	61.4	0	0	0	0	117	E385	E385-S387 PolarHBondContact O-N 2.86Å
388	A	26	Very low	31	Very low	106 Å²	106	137.5 Å²	137.5	88%	0.876	77%	0.771	S	S	*	*			trans	-165.5	70.4	153.3	0	0	0	0	0	113.2
389	L	28.6	Very low	29.3	Very low	176 Å²	176	141 Å²	141	92%	0.921	79%	0.786	S	S	*	*			trans	-80.3	125.7	168	-95.1	167.8	0	0	0	111
390	S	25	Very low	27.5	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	81%	0.806	S	S	*	*			trans	59.5	112.8	155.7	170.2	0	0	0	0	118.8
391	M	25.3	Very low	26.7	Very low	172 Å²	172	146.5 Å²	146.5	85%	0.847	81%	0.813	S	S	*	*				-167.7	163.5	116.6	-97.7	-91.4	-81.1	0	0	111.7
392	K	27.4	Very low	26	Very low	177 Å²	177	147 Å²	147	77%	0.77	82%	0.816	S	S	*	*			trans	-81.8	158	170.5	-56.4	169.6	179	176.3	0	109.9
393	D	24.4	Very low	25.7	Very low	148 Å²	148	145.8 Å²	145.8	79%	0.791	82%	0.819	S	S	*	*				-168	-179.4	111.8	-104.4	-20.2	0	0	0	113.3
394	L	23.6	Very low	25	Very low	160 Å²	160	148 Å²	148	84%	0.838	82%	0.818	S	S	*	*			trans	-84.4	154.5	-164.6	-80.9	67.3	0	0	0	113.8
395	G	22.4	Very low	24.8	Very low	74 Å²	74	152.9 Å²	152.9	76%	0.763	83%	0.83	S	S	*	*			trans	-75.3	-175.7	-172.2	0	0	0	0	0	117.8
396	T	23.6	Very low	24.5	Very low	148 Å²	148	147.7 Å²	147.7	91%	0.908	83%	0.825	S	S	*	*			trans	-151.3	156.8	158.4	4.1	0	0	0	0	109
397	E	24	Very low	24.3	Very low	183 Å²	183	148.4 Å²	148.4	86%	0.855	82%	0.823	S	S	*	*			trans	-87.1	156.3	175.8	-59.2	168.5	126.7	0	0	110.7
398	E	24.3	Very low	24.1	Very low	160 Å²	160	152.9 Å²	152.9	75%	0.748	83%	0.83	S	S	*	*				159.9	132.4	117.9	-81.2	-147.7	117.7	0	0	115.5
399	Q	23.6	Very low	24.2	Very low	150 Å²	150	152.8 Å²	152.8	70%	0.701	82%	0.823	S	S	*	*			trans	56.7	103.9	140.7	-57.3	-174.5	33.3	0	0	122.5
400	Q	24.5	Very low	24	Very low	181 Å²	181	151.3 Å²	151.3	85%	0.846	82%	0.816	S	S	*	*				29.4	131	123.7	-64.9	178.7	-25	0	0	121.3
401	K	24.5	Very low	24.2	Very low	206 Å²	206	153.1 Å²	153.1	90%	0.896	82%	0.823	S	S	*	*				-159.3	158.7	124.8	-116.4	161.7	-171.5	167.1	0	114.7
402	E	22.9	Very low	24.3	Very low	196 Å²	196	148.4 Å²	148.4	92%	0.916	81%	0.811	S	S	*	*			trans	-88.7	165.5	-177.8	-54.8	148.8	127	0	0	111.7
403	G	20.4	Very low	24.7	Very low	73 Å²	73	149 Å²	149	75%	0.753	82%	0.817	S	S	*	*			trans	154.6	83	164.7	0	0	0	0	0	117.7
404	E	23.2	Very low	25	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	80%	0.801	S	S	*	*			trans	35.1	132.1	140.5	-63.1	178.8	150.1	0	0	123.4
405	E	23.2	Very low	25.4	Very low	199 Å²	199	146.2 Å²	146.2	93%	0.93	80%	0.803	S	S	*	*			trans	47.9	134.5	143.5	-57.3	-162.1	154.5	0	0	122.5
406	G	21.5	Very low	26.2	Very low	72 Å²	72	147.1 Å²	147.1	74%	0.742	79%	0.79	S	S	*	*			trans	159.6	74.1	162.2	0	0	0	0	0	116.9	K408	G406-K408 PolarHBondContact O-N 2.91Å
407	T	23.5	Very low	27.5	Very low	145 Å²	145	147.8 Å²	147.8	89%	0.89	78%	0.783	S	S	*	*			trans	-21.3	120	167.9	32.4	0	0	0	0	117.7
408	K	24.5	Very low	29.2	Very low	199 Å²	199	140.1 Å²	140.1	87%	0.865	75%	0.748	S	S	*	*			trans	-153.6	130.5	142.5	-111.1	153.6	-167.4	170.4	0	112.6	G406	G406-K408 PolarHBondContact O-N 2.91Å
409	S	27.7	Very low	30.6	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	73%	0.731	S	S	*	*			trans	-81.6	109.3	173.4	51.5	0	0	0	0	110.4
410	N	25	Very low	32.1	Very low	144 Å²	144	133.1 Å²	133.1	77%	0.77	72%	0.72	S	S	*	*			trans	-103.9	87.9	162.7	-83.2	14.2	0	0	0	108.9	A412	N410-A412 VanDerWaalsContact C-N 3.28Å; N410-A412 PolarHBondContact O-N 3.3Å
411	T	27.5	Very low	34	Very low	140 Å²	140	125.2 Å²	125.2	86%	0.859	68%	0.683	S	S	*	*			trans	-87.1	72	167.5	51.5	0	0	0	0	109
412	A	29.5	Very low	36	Very low	74 Å²	74	121.4 Å²	121.4	61%	0.612	67%	0.668	S	S	*	*			trans	-151.3	160.2	175.2	0	0	0	0	0	108.3	N410	N410-A412 VanDerWaalsContact C-N 3.28Å; N410-A412 PolarHBondContact O-N 3.3Å
413	E	35.1	Very low	38.3	Very low	188 Å²	188	112.9 Å²	112.9	88%	0.879	63%	0.63	S	S	*	*	S	Bend	trans	68.3	78.7	-178.3	-61	158.3	-137.6	0	0	114.9
414	D	30.6	Very low	40.7	Very low	88 Å²	88	110.7 Å²	110.7	47%	0.471	60%	0.602	S	S	.	*			trans	-169.8	43.2	145.2	-144.1	33.7	0	0	0	111.9	K363	K363-D414 IonicContact NZ-OD2 3.21Å; K363-D414 PolarHBondContact NZ-OD2 3.02Å
415	N	32.3	Very low	42.7	Very low	162 Å²	162	109.2 Å²	109.2	87%	0.866	60%	0.6	S	S	*	*			trans	-120.5	34.2	-176.3	-109.7	47.1	0	0	0	111.5	E417	N415-E417 PolarHBondContact O-N 3.17Å
416	D	39.5	Very low	45	Very low	94 Å²	94	104.6 Å²	104.6	50%	0.503	59%	0.59	S	S	.	*			trans	-73.1	117.2	171	-63.1	-4.8	0	0	0	108.8	R379 I418	R379-D416 WeakPolarHBondContact CD-OD2 3.49Å; R379-D416 IonicContact CZ-OD2 2.58Å; R379-D416 IonicContact NE-OD2 2.97Å; R379-D416 IonicContact NH1-OD2 2.59Å; R379-D416 PolarHBondContact NH1-OD2 3.07Å; D416-I418 PolarHBondContact O-N 2.89Å
417	E	49.1	Very low	47.7	Very low	161 Å²	161	101.5 Å²	101.5	75%	0.752	56%	0.556	S	S	*	*			trans	-70.1	121.5	173.5	-65.3	-172.1	172.2	0	0	109.5	N415 L419	N415-E417 PolarHBondContact O-N 3.17Å; E417-L419 PolarHBondContact O-N 3.28Å
418	I	60.1	Low	50.6	Low	22 Å²	22	96.7 Å²	96.7	11%	0.113	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.2	177	-61.5	173.2	0	0	0	107.4	L366 L377 D416 L421 V444	L366-I418 HydrophobicContact CD2-CD1 3.81Å; L377-I418 HydrophobicContact CD2-CD1 4.46Å; L377-I418 HydrophobicContact CD2-CG2 4.47Å; D416-I418 PolarHBondContact O-N 2.89Å; I418-L421 HydrophobicContact CG2-CD2 3.77Å; I418-L421 HydrophobicContact CG2-CG 4.3Å; I418-V444 HydrophobicContact CB-CG1 4.02Å; I418-V444 HydrophobicContact CG2-CG1 4.39Å
419	L	53.7	Low	53.4	Low	76 Å²	76	88.7 Å²	88.7	40%	0.398	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-44	-172.2	-68.7	176.6	0	0	0	112.6	I378 E380 E417	I378-L419 PolarHBondContact O-N 3.07Å; I378-L419 VanDerWaalsContact O-N 3.17Å; E380-L419 HydrophobicContact CB-CD1 3.76Å; E380-L419 HydrophobicContact CG-CD1 3.92Å; E417-L419 PolarHBondContact O-N 3.28Å
420	D	55.5	Low	56.1	Low	88 Å²	88	86.9 Å²	86.9	47%	0.471	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	159	-174.3	-166.1	13.8	0	0	0	111.7	I378	I378-D420 HydrophobicContact CB-CB 4.18Å; I378-D420 WeakPolarHBondContact CB-O 3.41Å; I378-D420 HydrophobicContact CD1-CB 4.22Å; I378-D420 PolarHBondContact N-O 2.63Å
421	L	65	Low	58.9	Low	14 Å²	14	80.1 Å²	80.1	7%	0.073	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	118.5	-173.6	-66.3	-178.9	0	0	0	111.4	L377 I418 L439 P447 L451	L377-L421 HydrophobicContact CD2-CD2 3.32Å; I418-L421 HydrophobicContact CG2-CD2 3.77Å; I418-L421 HydrophobicContact CG2-CG 4.3Å; L421-L439 HydrophobicContact CD1-CD1 3.34Å; L421-L439 HydrophobicContact CD1-CD2 3.84Å; L421-L439 HydrophobicContact CD1-CG 4.22Å; L421-P447 HydrophobicContact CB-CB 4.1Å; L421-P447 HydrophobicContact CD1-CB 3.76Å; L421-P447 HydrophobicContact CD1-CG 3.85Å; L421-P447 HydrophobicContact CG-CB 3.71Å; L421-P447 HydrophobicContact CG-CG 3.98Å; L421-L451 HydrophobicContact CD1-CD1 4.07Å
422	H	66.6	Low	61.6	Low	126 Å²	126	75.5 Å²	75.5	58%	0.583	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	105.6	167.8	-163.6	60	0	0	0	110.3	V376	V376-H422 HydrophobicContact CB-CB 4.29Å; V376-H422 PolarHBondContact N-O 3.14Å; V376-H422 PolarHBondContact O-N 3.25Å
423	V	70	Confident	64.3	Low	18 Å²	18	72.1 Å²	72.1	11%	0.109	38%	0.38	C	S	.	.			trans	-97.6	118.3	173.8	179.2	0	0	0	0	108.5	I375 V427 R432 L435 L451	I375-V423 HydrophobicContact CG1-CG2 4.49Å; I375-V423 HydrophobicContact CG2-CG2 4.06Å; V423-V427 HydrophobicContact CG1-CB 4.09Å; V423-V427 HydrophobicContact CG1-CG1 4.41Å; V423-V427 HydrophobicContact CG1-CG2 4.16Å; V423-R432 HydrophobicContact CG1-CG 4.12Å; V423-L435 HydrophobicContact CG2-CD2 3.67Å; V423-L451 HydrophobicContact CB-CD2 4.27Å; V423-L451 HydrophobicContact CG2-CD1 4.29Å; V423-L451 HydrophobicContact CG2-CD2 3.81Å
424	P	72.6	Confident	66.8	Low	27 Å²	27	64.1 Å²	64.1	18%	0.175	34%	0.342	C	S	.	.			trans	-63.4	146.3	178.4	-24.3	34.5	0	0	0	113.4	D374 S426 V427	D374-P424 HydrophobicContact CB-CG 4.44Å; P424-S426 PolarHBondContact O-N 3.02Å; P424-S426 VanDerWaalsContact O-N 3.08Å; P424-V427 HydrophobicContact CB-CG2 4.31Å; P424-V427 HydrophobicContact CG-CG2 4.46Å; P424-V427 WeakPolarHBondContact O-CB 3.35Å; P424-V427 WeakPolarHBondContact O-CG2 3.5Å; P424-V427 PolarHBondContact O-N 2.99Å
425	D	65.3	Low	69.4	Low	151 Å²	151	60 Å²	60	81%	0.807	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.9	177.4	-83.1	-37.8	0	0	0	114.3	V427 R432	D425-V427 VanDerWaalsContact C-N 3.32Å; D425-R432 VanDerWaalsContact C-NH2 3.32Å; D425-R432 PolarHBondContact O-NH2 3.13Å; D425-R432 IonicContact OD1-NH1 3.05Å
426	S	70.9	Confident	71.9	Confident	102 Å²	102	52.3 Å²	52.3	71%	0.713	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.2	173.5	49.5	0	0	0	0	114.2	P424 P428	P424-S426 PolarHBondContact O-N 3.02Å; P424-S426 VanDerWaalsContact O-N 3.08Å; S426-P428 WeakPolarHBondContact O-CD 3.4Å
427	V	78.3	Confident	74.2	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.042	26%	0.259	C	S	.	.	S	Bend	trans	-72.2	124.3	-175.7	179.7	0	0	0	0	110.5	A373 V423 P424 D425 L431 R432	A373-V427 HydrophobicContact CB-CG2 4.25Å; A373-V427 WeakPolarHBondContact O-CG2 3.29Å; V423-V427 HydrophobicContact CG1-CB 4.09Å; V423-V427 HydrophobicContact CG1-CG1 4.41Å; V423-V427 HydrophobicContact CG1-CG2 4.16Å; P424-V427 HydrophobicContact CB-CG2 4.31Å; P424-V427 HydrophobicContact CG-CG2 4.46Å; P424-V427 WeakPolarHBondContact O-CB 3.35Å; P424-V427 WeakPolarHBondContact O-CG2 3.5Å; P424-V427 PolarHBondContact O-N 2.99Å; D425-V427 VanDerWaalsContact C-N 3.32Å; V427-L431 HydrophobicContact CG1-CB 3.75Å; V427-L431 HydrophobicContact CG1-CD1 4.34Å; V427-R432 HydrophobicContact CB-CG 4.5Å; V427-R432 HydrophobicContact CG1-CG 4.09Å; V427-R432 VanDerWaalsContact O-CZ 3.31Å; V427-R432 PolarHBondContact O-NE 3.41Å; V427-R432 PolarHBondContact O-NH2 3.44Å
428	P	83.6	Confident	75.9	Confident	45 Å²	45	40.8 Å²	40.8	29%	0.292	22%	0.223	S	C	.	.			trans	-56.6	150.4	176	-29	36.8	0	0	0	114.2	D346 S426 D430 L431 R432	D346-P428 HydrophobicContact CB-CG 4.03Å; S426-P428 WeakPolarHBondContact O-CD 3.4Å; P428-D430 VanDerWaalsContact C-N 3.32Å; P428-D430 PolarHBondContact O-N 3.02Å; P428-L431 PolarHBondContact O-N 3.12Å; P428-L431 VanDerWaalsContact O-N 3.13Å; P428-R432 PolarHBondContact O-N 2.87Å
429	V	83.1	Confident	77.1	Confident	30 Å²	30	39.8 Å²	39.8	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-41.2	-174.6	-170.6	0	0	0	0	111.9	L431 R432 A433 L455 I463 L466	V429-L431 VanDerWaalsContact C-N 3.26Å; V429-L431 PolarHBondContact O-N 2.98Å; V429-R432 CarbonylContact O-C 3.47Å; V429-R432 WeakPolarHBondContact O-CA 3.3Å; V429-R432 WeakPolarHBondContact O-CB 3.22Å; V429-R432 PolarHBondContact O-N 3.27Å; V429-A433 PolarHBondContact O-N 3.47Å; V429-L455 HydrophobicContact CG1-CD1 3.57Å; V429-I463 HydrophobicContact CG1-CD1 4.17Å; V429-I463 HydrophobicContact CG1-CG2 4.1Å; V429-I463 HydrophobicContact CG2-CD1 4.44Å; V429-L466 HydrophobicContact CB-CD1 4.39Å; V429-L466 HydrophobicContact CG1-CD1 3.9Å
430	D	84	Confident	78.6	Confident	68 Å²	68	36.1 Å²	36.1	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-52.6	-43.3	176.8	-46.4	-3.3	0	0	0	112.2	N350 P428 A433 K434	N350-D430 PolarHBondContact ND2-OD2 3.38Å; P428-D430 VanDerWaalsContact C-N 3.32Å; P428-D430 PolarHBondContact O-N 3.02Å; D430-A433 PolarHBondContact O-N 3.06Å; D430-K434 WeakPolarHBondContact O-CB 3.49Å; D430-K434 WeakPolarHBondContact O-CG 3.46Å; D430-K434 PolarHBondContact O-N 2.8Å
431	L	84.6	Confident	80.1	Confident	1 Å²	1	33 Å²	33	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-71.5	-34.5	177.8	-62.2	-172.7	0	0	0	111.4	D346 L349 N350 L369 V427 P428 V429 L435	D346-L431 HydrophobicContact CB-CD1 4.31Å; L349-L431 HydrophobicContact CD2-CD1 3.88Å; L349-L431 HydrophobicContact CG-CD1 4.19Å; L349-L431 HydrophobicContact CG-CD2 4.24Å; N350-L431 HydrophobicContact CB-CD2 3.78Å; L369-L431 HydrophobicContact CD2-CB 4.48Å; L369-L431 HydrophobicContact CD2-CD2 4.09Å; V427-L431 HydrophobicContact CG1-CB 3.75Å; V427-L431 HydrophobicContact CG1-CD1 4.34Å; P428-L431 PolarHBondContact O-N 3.12Å; P428-L431 VanDerWaalsContact O-N 3.13Å; V429-L431 VanDerWaalsContact C-N 3.26Å; V429-L431 PolarHBondContact O-N 2.98Å; L431-L435 WeakPolarHBondContact O-CB 3.37Å; L431-L435 PolarHBondContact O-N 3.36Å
432	R	84.6	Confident	81	Confident	44 Å²	44	34.8 Å²	34.8	17%	0.166	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-41.5	172.6	-54.4	-169.9	-159.2	-164.8	6.9	111.3	V423 D425 V427 P428 V429 L435 I436	V423-R432 HydrophobicContact CG1-CG 4.12Å; D425-R432 VanDerWaalsContact C-NH2 3.32Å; D425-R432 PolarHBondContact O-NH2 3.13Å; D425-R432 IonicContact OD1-NH1 3.05Å; V427-R432 HydrophobicContact CB-CG 4.5Å; V427-R432 HydrophobicContact CG1-CG 4.09Å; V427-R432 VanDerWaalsContact O-CZ 3.31Å; V427-R432 PolarHBondContact O-NE 3.41Å; V427-R432 PolarHBondContact O-NH2 3.44Å; P428-R432 PolarHBondContact O-N 2.87Å; V429-R432 CarbonylContact O-C 3.47Å; V429-R432 WeakPolarHBondContact O-CA 3.3Å; V429-R432 WeakPolarHBondContact O-CB 3.22Å; V429-R432 PolarHBondContact O-N 3.27Å; R432-L435 WeakPolarHBondContact O-CB 3.42Å; R432-L435 PolarHBondContact O-N 2.9Å; R432-I436 WeakPolarHBondContact O-CD1 3.36Å; R432-I436 VanDerWaalsContact O-CG1 3.22Å; R432-I436 WeakPolarHBondContact O-CG1 3.18Å; R432-I436 PolarHBondContact O-N 2.93Å
433	A	85.7	Confident	81.6	Confident	2 Å²	2	33 Å²	33	2%	0.017	19%	0.186	C	C	.	.	H	α-helix	trans	-66.4	-46.4	176.4	0	0	0	0	0	112	V429 D430 L435 I436 V437 L466 V470	V429-A433 PolarHBondContact O-N 3.47Å; D430-A433 PolarHBondContact O-N 3.06Å; A433-L435 VanDerWaalsContact C-N 3.28Å; A433-L435 PolarHBondContact O-N 2.85Å; A433-I436 WeakPolarHBondContact O-CB 3.42Å; A433-I436 PolarHBondContact O-N 3.46Å; A433-I436 VanDerWaalsContact O-N 3.15Å; A433-V437 WeakPolarHBondContact O-CG2 3.48Å; A433-V437 PolarHBondContact O-N 3.43Å; A433-L466 HydrophobicContact CB-CB 3.73Å; A433-L466 HydrophobicContact CB-CD1 3.7Å; A433-L466 HydrophobicContact CB-CD2 4.04Å; A433-L466 HydrophobicContact CB-CG 4.03Å; A433-V470 HydrophobicContact CB-CG2 4.42Å
434	K	87.9	Confident	82.1	Confident	20 Å²	20	33.5 Å²	33.5	9%	0.087	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-32.9	175	-74.2	173.8	175.8	171.6	0	112.3	N350 A353 E354 I357 D430 C438	N350-K434 PolarHBondContact O-NZ 3.49Å; N350-K434 WeakPolarHBondContact OD1-CD 3.43Å; N350-K434 WeakPolarHBondContact OD1-CE 3.47Å; N350-K434 PolarHBondContact OD1-NZ 2.76Å; A353-K434 HydrophobicContact CB-CB 4.43Å; A353-K434 HydrophobicContact CB-CD 4.14Å; E354-K434 IonicContact OE2-NZ 2.75Å; E354-K434 PolarHBondContact OE2-NZ 2.99Å; I357-K434 HydrophobicContact CD1-CB 3.87Å; I357-K434 HydrophobicContact CD1-CG 3.91Å; D430-K434 WeakPolarHBondContact O-CB 3.49Å; D430-K434 WeakPolarHBondContact O-CG 3.46Å; D430-K434 PolarHBondContact O-N 2.8Å; K434-C438 PolarHBondContact O-N 2.92Å; K434-C438 VanDerWaalsContact O-N 3.09Å; K434-C438 PolarHBondContact O-SG 2.87Å
435	L	84.9	Confident	82.1	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-63.8	-50.7	169	-179	70.2	0	0	0	111.7	L366 L369 I375 V423 L431 R432 A433 V437 C438 L439 L451	L366-L435 HydrophobicContact CD1-CD1 3.53Å; L369-L435 HydrophobicContact CD1-CB 4.09Å; L369-L435 HydrophobicContact CD1-CD1 4.08Å; I375-L435 HydrophobicContact CD1-CD1 4.43Å; I375-L435 HydrophobicContact CD1-CD2 4.04Å; V423-L435 HydrophobicContact CG2-CD2 3.67Å; L431-L435 WeakPolarHBondContact O-CB 3.37Å; L431-L435 PolarHBondContact O-N 3.36Å; R432-L435 WeakPolarHBondContact O-CB 3.42Å; R432-L435 PolarHBondContact O-N 2.9Å; A433-L435 VanDerWaalsContact C-N 3.28Å; A433-L435 PolarHBondContact O-N 2.85Å; L435-V437 VanDerWaalsContact C-N 3.34Å; L435-V437 PolarHBondContact O-N 3.49Å; L435-C438 PolarHBondContact O-N 3.44Å; L435-C438 VanDerWaalsContact O-N 3.12Å; L435-L439 HydrophobicContact CD1-CD1 4.45Å; L435-L439 HydrophobicContact CG-CD1 3.99Å; L435-L439 WeakPolarHBondContact O-CG 3.35Å; L435-L439 PolarHBondContact O-N 3.09Å; L435-L451 HydrophobicContact CD2-CD1 4.07Å
436	I	85.6	Confident	82.4	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-54.8	-48.9	176.7	-72.2	162.2	0	0	0	110.7	R432 A433 C438 L439 I440 L451 V452 L455 V470	R432-I436 WeakPolarHBondContact O-CD1 3.36Å; R432-I436 VanDerWaalsContact O-CG1 3.22Å; R432-I436 WeakPolarHBondContact O-CG1 3.18Å; R432-I436 PolarHBondContact O-N 2.93Å; A433-I436 WeakPolarHBondContact O-CB 3.42Å; A433-I436 PolarHBondContact O-N 3.46Å; A433-I436 VanDerWaalsContact O-N 3.15Å; I436-C438 VanDerWaalsContact C-N 3.32Å; I436-C438 PolarHBondContact O-N 3.42Å; I436-L439 PolarHBondContact O-N 2.87Å; I436-I440 HydrophobicContact CG2-CD1 3.58Å; I436-I440 HydrophobicContact CG2-CG1 4.37Å; I436-I440 VanDerWaalsContact O-CG1 3.28Å; I436-I440 WeakPolarHBondContact O-CG1 3.32Å; I436-I440 PolarHBondContact O-N 3.11Å; I436-L451 HydrophobicContact CD1-CB 3.86Å; I436-L451 HydrophobicContact CG1-CB 3.68Å; I436-L451 HydrophobicContact CG1-CD1 4.35Å; I436-V452 HydrophobicContact CD1-CG2 4.1Å; I436-V452 HydrophobicContact CG1-CG2 4.4Å; I436-V452 HydrophobicContact CG2-CG2 3.52Å; I436-L455 HydrophobicContact CD1-CB 4.47Å; I436-L455 HydrophobicContact CD1-CD2 4.29Å; I436-V470 HydrophobicContact CB-CG2 4.25Å; I436-V470 HydrophobicContact CG2-CB 4.38Å; I436-V470 HydrophobicContact CG2-CG1 3.67Å; I436-V470 HydrophobicContact CG2-CG2 3.75Å
437	V	86.6	Confident	82.5	Confident	14 Å²	14	27.1 Å²	27.1	9%	0.085	15%	0.148	C	C	.	.	H	α-helix	trans	-56.3	-45.4	176.3	167.9	0	0	0	0	111	I357 A433 L435 L439 I440 Q441 D469 V470 A473	I357-V437 HydrophobicContact CD1-CG1 4.43Å; A433-V437 WeakPolarHBondContact O-CG2 3.48Å; A433-V437 PolarHBondContact O-N 3.43Å; L435-V437 VanDerWaalsContact C-N 3.34Å; L435-V437 PolarHBondContact O-N 3.49Å; V437-L439 PolarHBondContact O-N 3.19Å; V437-I440 PolarHBondContact O-N 3.33Å; V437-Q441 HydrophobicContact CG1-CG 4.39Å; V437-Q441 WeakPolarHBondContact O-CB 3.41Å; V437-Q441 WeakPolarHBondContact O-CG 3.33Å; V437-Q441 PolarHBondContact O-N 3.25Å; V437-D469 HydrophobicContact CG2-CB 4.34Å; V437-V470 HydrophobicContact CG2-CG2 4.04Å; V437-A473 HydrophobicContact CB-CB 4.4Å; V437-A473 HydrophobicContact CG1-CB 4.12Å; V437-A473 HydrophobicContact CG2-CB 4.15Å
438	C	85.6	Confident	82.3	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.8	-39.2	177.9	-67.9	0	0	0	0	113	T365 K434 L435 I436 Q441 L442	T365-C438 WeakPolarHBondContact CB-SG 3.41Å; T365-C438 WeakPolarHBondContact CG2-SG 3.32Å; K434-C438 PolarHBondContact O-N 2.92Å; K434-C438 VanDerWaalsContact O-N 3.09Å; K434-C438 PolarHBondContact O-SG 2.87Å; L435-C438 PolarHBondContact O-N 3.44Å; L435-C438 VanDerWaalsContact O-N 3.12Å; I436-C438 VanDerWaalsContact C-N 3.32Å; I436-C438 PolarHBondContact O-N 3.42Å; C438-Q441 PolarHBondContact O-N 3.41Å; C438-L442 WeakPolarHBondContact O-CB 3.39Å; C438-L442 WeakPolarHBondContact O-CG 3.5Å; C438-L442 PolarHBondContact O-N 2.87Å
439	L	84.5	Confident	82	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.4	-44.5	178.1	-66.7	164.4	0	0	0	111.8	L366 L421 L435 I436 V437 Q441 L442 N443 V444 L451	L366-L439 HydrophobicContact CD1-CD2 4.29Å; L421-L439 HydrophobicContact CD1-CD1 3.34Å; L421-L439 HydrophobicContact CD1-CD2 3.84Å; L421-L439 HydrophobicContact CD1-CG 4.22Å; L435-L439 HydrophobicContact CD1-CD1 4.45Å; L435-L439 HydrophobicContact CG-CD1 3.99Å; L435-L439 WeakPolarHBondContact O-CG 3.35Å; L435-L439 PolarHBondContact O-N 3.09Å; I436-L439 PolarHBondContact O-N 2.87Å; V437-L439 PolarHBondContact O-N 3.19Å; L439-Q441 PolarHBondContact O-N 2.94Å; L439-L442 CarbonylContact O-C 3.36Å; L439-L442 PolarHBondContact O-N 3.44Å; L439-N443 PolarHBondContact O-N 3.41Å; L439-N443 VanDerWaalsContact O-N 3.12Å; L439-V444 HydrophobicContact CB-CB 4.49Å; L439-V444 HydrophobicContact CD2-CB 4.21Å; L439-V444 HydrophobicContact CD2-CG1 4.12Å; L439-V444 PolarHBondContact O-N 2.89Å; L439-L451 HydrophobicContact CD1-CD1 3.96Å
440	I	85.7	Confident	81.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.1	-48.4	174.8	-68	165	0	0	0	110.3	I436 V437 L442 N443 F445 V470 A473 Y474 Q477	I436-I440 HydrophobicContact CG2-CD1 3.58Å; I436-I440 HydrophobicContact CG2-CG1 4.37Å; I436-I440 VanDerWaalsContact O-CG1 3.28Å; I436-I440 WeakPolarHBondContact O-CG1 3.32Å; I436-I440 PolarHBondContact O-N 3.11Å; V437-I440 PolarHBondContact O-N 3.33Å; I440-L442 VanDerWaalsContact C-N 3.25Å; I440-L442 PolarHBondContact O-N 3.15Å; I440-N443 WeakPolarHBondContact O-CA 3.47Å; I440-N443 PolarHBondContact O-N 3.36Å; I440-F445 HydrophobicContact CG2-CE1 4.3Å; I440-V470 HydrophobicContact CD1-CG1 4.01Å; I440-A473 HydrophobicContact CB-CB 4.31Å; I440-A473 HydrophobicContact CD1-CB 4.3Å; I440-A473 HydrophobicContact CG2-CB 3.92Å; I440-A473 WeakPolarHBondContact CG2-O 3.44Å; I440-Y474 HydrophobicContact CD1-CD1 3.95Å; I440-Y474 HydrophobicContact CD1-CD2 3.8Å; I440-Y474 HydrophobicContact CD1-CE1 3.67Å; I440-Y474 HydrophobicContact CD1-CE2 3.51Å; I440-Y474 HydrophobicContact CD1-CG 4.01Å; I440-Y474 VanDerWaalsContact CD1-CZ 3.43Å; I440-Y474 HydrophobicContact CG1-CD1 4.09Å; I440-Y474 HydrophobicContact CG1-CE1 3.65Å; I440-Y474 HydrophobicContact CG1-CE2 4.38Å; I440-Y474 HydrophobicContact CG2-CD1 3.88Å; I440-Y474 HydrophobicContact CG2-CE1 4.24Å; I440-Y474 HydrophobicContact CG2-CG 4.38Å; I440-Q477 HydrophobicContact CG2-CB 4.5Å; I440-Q477 HydrophobicContact CG2-CG 4.03Å
441	Q	86.1	Confident	81.5	Confident	22 Å²	22	27.3 Å²	27.3	10%	0.103	15%	0.151	C	C	.	.	H	α-helix	trans	-68.4	-22.6	-179.9	-66.1	-75.3	10.2	0	0	113.4	Y362 V437 C438 L439 N443 E476	Y362-Q441 HydrophobicContact CD1-CB 3.91Å; Y362-Q441 HydrophobicContact CD1-CG 4.18Å; Y362-Q441 HydrophobicContact CD2-CB 3.79Å; Y362-Q441 HydrophobicContact CE1-CB 3.97Å; Y362-Q441 HydrophobicContact CE1-CG 3.79Å; Y362-Q441 HydrophobicContact CE2-CB 3.84Å; Y362-Q441 HydrophobicContact CE2-CG 4.23Å; Y362-Q441 HydrophobicContact CG-CB 3.82Å; V437-Q441 HydrophobicContact CG1-CG 4.39Å; V437-Q441 WeakPolarHBondContact O-CB 3.41Å; V437-Q441 WeakPolarHBondContact O-CG 3.33Å; V437-Q441 PolarHBondContact O-N 3.25Å; C438-Q441 PolarHBondContact O-N 3.41Å; L439-Q441 PolarHBondContact O-N 2.94Å; Q441-N443 VanDerWaalsContact C-N 3.34Å; Q441-E476 PolarHBondContact NE2-OE2 2.95Å
442	L	84.6	Confident	81.3	Confident	51 Å²	51	27.9 Å²	27.9	27%	0.267	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	4	170.7	-67.3	171.5	0	0	0	113.4	K363 L366 C438 L439 I440 V444	K363-L442 HydrophobicContact CG-CD1 4.5Å; K363-L442 HydrophobicContact CG-CD2 3.65Å; L366-L442 HydrophobicContact CB-CD1 4.42Å; L366-L442 HydrophobicContact CD2-CD1 3.91Å; C438-L442 WeakPolarHBondContact O-CB 3.39Å; C438-L442 WeakPolarHBondContact O-CG 3.5Å; C438-L442 PolarHBondContact O-N 2.87Å; L439-L442 CarbonylContact O-C 3.36Å; L439-L442 PolarHBondContact O-N 3.44Å; I440-L442 VanDerWaalsContact C-N 3.25Å; I440-L442 PolarHBondContact O-N 3.15Å; L442-V444 VanDerWaalsContact C-N 3.27Å; L442-V444 HydrophobicContact CB-CG2 4.25Å; L442-V444 PolarHBondContact O-N 2.86Å
443	N	79.9	Confident	81.3	Confident	90 Å²	90	28.8 Å²	28.8	48%	0.481	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	24.8	-177.1	-74.5	-96.8	0	0	0	115.1	L439 I440 Q441 F445 Q477	L439-N443 PolarHBondContact O-N 3.41Å; L439-N443 VanDerWaalsContact O-N 3.12Å; I440-N443 WeakPolarHBondContact O-CA 3.47Å; I440-N443 PolarHBondContact O-N 3.36Å; Q441-N443 VanDerWaalsContact C-N 3.34Å; N443-F445 HydrophobicContact CB-CE2 3.82Å; N443-F445 HydrophobicContact CB-CZ 4.16Å; N443-F445 VanDerWaalsContact O-CD2 3.27Å; N443-F445 WeakPolarHBondContact O-CD2 3.24Å; N443-F445 WeakPolarHBondContact O-CE2 3.22Å; N443-F445 PolarHBondContact O-N 2.84Å; N443-F445 WeakPolarHBondContact OD1-CE2 3.5Å; N443-F445 WeakPolarHBondContact OD1-CZ 3.42Å; N443-Q477 PolarHBondContact ND2-OE1 2.85Å
444	V	80	Confident	81.1	Confident	27 Å²	27	31.6 Å²	31.6	16%	0.164	19%	0.185	C	C	.	.			trans	-96	82.3	178.4	-178.3	0	0	0	0	109.6	I418 L439 L442 P447	I418-V444 HydrophobicContact CB-CG1 4.02Å; I418-V444 HydrophobicContact CG2-CG1 4.39Å; L439-V444 HydrophobicContact CB-CB 4.49Å; L439-V444 HydrophobicContact CD2-CB 4.21Å; L439-V444 HydrophobicContact CD2-CG1 4.12Å; L439-V444 PolarHBondContact O-N 2.89Å; L442-V444 VanDerWaalsContact C-N 3.27Å; L442-V444 HydrophobicContact CB-CG2 4.25Å; L442-V444 PolarHBondContact O-N 2.86Å; V444-P447 HydrophobicContact CG1-CG 3.82Å
445	F	73.1	Confident	80.8	Confident	37 Å²	37	30.9 Å²	30.9	16%	0.162	18%	0.182	C	C	.	.	H	α-helix	trans	-85.9	-26.2	-168.9	-59.6	-69.6	0	0	0	115.5	I440 N443 S448 E449 Y474 R479	I440-F445 HydrophobicContact CG2-CE1 4.3Å; N443-F445 HydrophobicContact CB-CE2 3.82Å; N443-F445 HydrophobicContact CB-CZ 4.16Å; N443-F445 VanDerWaalsContact O-CD2 3.27Å; N443-F445 WeakPolarHBondContact O-CD2 3.24Å; N443-F445 WeakPolarHBondContact O-CE2 3.22Å; N443-F445 PolarHBondContact O-N 2.84Å; N443-F445 WeakPolarHBondContact OD1-CE2 3.5Å; N443-F445 WeakPolarHBondContact OD1-CZ 3.42Å; F445-S448 WeakPolarHBondContact CA-OG 3.47Å; F445-S448 PolarHBondContact O-N 3.43Å; F445-S448 PolarHBondContact O-OG 2.96Å; F445-S448 VanDerWaalsContact O-OG 3.09Å; F445-E449 PolarHBondContact O-N 2.96Å; F445-Y474 HydrophobicContact CD1-CE1 4.25Å; F445-Y474 HydrophobicContact CE1-CE1 4.42Å; F445-R479 HydrophobicContact CE1-CG 4.05Å; F445-R479 HydrophobicContact CZ-CG 4.12Å
446	T	71.6	Confident	80.7	Confident	102 Å²	102	34.7 Å²	34.7	63%	0.626	20%	0.201	S	C	*	.	H	α-helix	trans	-60.2	-52	-174	30.1	0	0	0	0	113.9
447	P	72.2	Confident	80.5	Confident	8 Å²	8	42.8 Å²	42.8	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-76	-24.1	172.9	31.3	-36.6	0	0	0	112.8	L421 V444 G450 L451	L421-P447 HydrophobicContact CB-CB 4.1Å; L421-P447 HydrophobicContact CD1-CB 3.76Å; L421-P447 HydrophobicContact CD1-CG 3.85Å; L421-P447 HydrophobicContact CG-CB 3.71Å; L421-P447 HydrophobicContact CG-CG 3.98Å; V444-P447 HydrophobicContact CG1-CG 3.82Å; P447-G450 PolarHBondContact O-N 3.48Å; P447-L451 WeakPolarHBondContact O-CG 3.45Å; P447-L451 PolarHBondContact O-N 3.18Å
448	S	74.2	Confident	80.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-70	-34.8	-178.6	81.6	0	0	0	0	112.4	F445 G450 L451 V452 Y474	F445-S448 WeakPolarHBondContact CA-OG 3.47Å; F445-S448 PolarHBondContact O-N 3.43Å; F445-S448 PolarHBondContact O-OG 2.96Å; F445-S448 VanDerWaalsContact O-OG 3.09Å; S448-G450 VanDerWaalsContact C-N 3.34Å; S448-L451 PolarHBondContact O-N 2.87Å; S448-V452 VanDerWaalsContact O-CB 3.3Å; S448-V452 WeakPolarHBondContact O-CB 3.43Å; S448-V452 WeakPolarHBondContact O-CG2 3.21Å; S448-V452 PolarHBondContact O-N 3.49Å; S448-Y474 PolarHBondContact OG-OH 3.19Å
449	E	77.6	Confident	79.9	Confident	94 Å²	94	47.4 Å²	47.4	44%	0.439	26%	0.263	S	S	.	.	H	α-helix	trans	-65	-37.2	175.5	-72.2	-177.9	178.2	0	0	111.6	F445 S453 R479	F445-E449 PolarHBondContact O-N 2.96Å; E449-S453 PolarHBondContact O-N 3.12Å; E449-S453 VanDerWaalsContact O-N 3.12Å; E449-R479 IonicContact OE1-NH2 3.52Å; E449-R479 PolarHBondContact OE1-NH2 2.82Å
450	G	77.4	Confident	79.7	Confident	39 Å²	39	49.1 Å²	49.1	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-66.3	-49.8	172.7	0	0	0	0	0	112.7	P447 S448 V452 S453 T454	P447-G450 PolarHBondContact O-N 3.48Å; S448-G450 VanDerWaalsContact C-N 3.34Å; G450-V452 VanDerWaalsContact C-N 3.33Å; G450-V452 PolarHBondContact O-N 3.39Å; G450-S453 PolarHBondContact O-N 3.45Å; G450-S453 VanDerWaalsContact O-N 3.08Å; G450-S453 PolarHBondContact O-OG 3.45Å; G450-T454 PolarHBondContact O-N 2.99Å
451	L	78.6	Confident	79.4	Confident	21 Å²	21	53.9 Å²	53.9	11%	0.11	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-39	178	-69.5	172.3	0	0	0	112.1	L421 V423 L435 I436 L439 P447 S448 S453 T454 L455	L421-L451 HydrophobicContact CD1-CD1 4.07Å; V423-L451 HydrophobicContact CB-CD2 4.27Å; V423-L451 HydrophobicContact CG2-CD1 4.29Å; V423-L451 HydrophobicContact CG2-CD2 3.81Å; L435-L451 HydrophobicContact CD2-CD1 4.07Å; I436-L451 HydrophobicContact CD1-CB 3.86Å; I436-L451 HydrophobicContact CG1-CB 3.68Å; I436-L451 HydrophobicContact CG1-CD1 4.35Å; L439-L451 HydrophobicContact CD1-CD1 3.96Å; P447-L451 WeakPolarHBondContact O-CG 3.45Å; P447-L451 PolarHBondContact O-N 3.18Å; S448-L451 PolarHBondContact O-N 2.87Å; L451-S453 VanDerWaalsContact C-N 3.32Å; L451-S453 PolarHBondContact O-N 3.18Å; L451-T454 PolarHBondContact O-N 2.95Å; L451-T454 VanDerWaalsContact O-N 3.15Å; L451-T454 PolarHBondContact O-OG1 2.82Å; L451-L455 PolarHBondContact O-N 3.11Å
452	V	81.8	Confident	79.1	Confident	12 Å²	12	59.9 Å²	59.9	7%	0.073	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-37	173.4	168.3	0	0	0	0	111.9	I436 S448 G450 T454 L455 M456 V470 Y474 L486	I436-V452 HydrophobicContact CD1-CG2 4.1Å; I436-V452 HydrophobicContact CG1-CG2 4.4Å; I436-V452 HydrophobicContact CG2-CG2 3.52Å; S448-V452 VanDerWaalsContact O-CB 3.3Å; S448-V452 WeakPolarHBondContact O-CB 3.43Å; S448-V452 WeakPolarHBondContact O-CG2 3.21Å; S448-V452 PolarHBondContact O-N 3.49Å; G450-V452 VanDerWaalsContact C-N 3.33Å; G450-V452 PolarHBondContact O-N 3.39Å; V452-T454 VanDerWaalsContact C-N 3.3Å; V452-T454 PolarHBondContact O-N 3.06Å; V452-L455 PolarHBondContact O-N 2.9Å; V452-M456 HydrophobicContact CG1-CG 4.35Å; V452-M456 HydrophobicContact CG1-SD 4.21Å; V452-M456 WeakPolarHBondContact O-CG 3.41Å; V452-M456 PolarHBondContact O-N 3.43Å; V452-V470 HydrophobicContact CG2-CG1 3.91Å; V452-Y474 HydrophobicContact CG2-CE2 4.14Å; V452-L486 HydrophobicContact CG1-CD1 4.39Å; V452-L486 HydrophobicContact CG1-CD2 4.27Å
453	S	83.3	Confident	79	Confident	64 Å²	64	58.6 Å²	58.6	45%	0.448	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-36.8	173.8	71.4	0	0	0	0	112.8	E449 G450 L451 M456 E457	E449-S453 PolarHBondContact O-N 3.12Å; E449-S453 VanDerWaalsContact O-N 3.12Å; G450-S453 PolarHBondContact O-N 3.45Å; G450-S453 VanDerWaalsContact O-N 3.08Å; G450-S453 PolarHBondContact O-OG 3.45Å; L451-S453 VanDerWaalsContact C-N 3.32Å; L451-S453 PolarHBondContact O-N 3.18Å; S453-M456 PolarHBondContact O-N 3.15Å; S453-E457 PolarHBondContact O-N 3.29Å
454	T	82.3	Confident	79.1	Confident	60 Å²	60	54.3 Å²	54.3	37%	0.368	30%	0.295	S	S	.	.	H	α-helix	trans	-70.7	-32.7	175.6	66.2	0	0	0	0	112.9	G450 L451 V452 M456 E457	G450-T454 PolarHBondContact O-N 2.99Å; L451-T454 PolarHBondContact O-N 2.95Å; L451-T454 VanDerWaalsContact O-N 3.15Å; L451-T454 PolarHBondContact O-OG1 2.82Å; V452-T454 VanDerWaalsContact C-N 3.3Å; V452-T454 PolarHBondContact O-N 3.06Å; T454-M456 VanDerWaalsContact C-N 3.32Å; T454-E457 PolarHBondContact O-N 3.4Å
455	L	82.3	Confident	79.4	Confident	5 Å²	5	57 Å²	57	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-37.9	171.4	-175.3	64.6	0	0	0	110.9	V429 I436 L451 V452 E457 Q458 Y467 V470	V429-L455 HydrophobicContact CG1-CD1 3.57Å; I436-L455 HydrophobicContact CD1-CB 4.47Å; I436-L455 HydrophobicContact CD1-CD2 4.29Å; L451-L455 PolarHBondContact O-N 3.11Å; V452-L455 PolarHBondContact O-N 2.9Å; L455-E457 PolarHBondContact O-N 2.88Å; L455-Q458 PolarHBondContact O-N 2.87Å; L455-Q458 VanDerWaalsContact O-N 3.17Å; L455-Y467 HydrophobicContact CD1-CE2 4.37Å; L455-Y467 HydrophobicContact CD2-CD2 4.39Å; L455-Y467 HydrophobicContact CG-CD2 4.22Å; L455-Y467 HydrophobicContact CG-CE2 3.98Å; L455-Y467 PolarHBondContact O-OH 2.71Å; L455-V470 HydrophobicContact CD2-CG2 4.11Å
456	M	81	Confident	80.1	Confident	82 Å²	82	55.8 Å²	55.8	40%	0.404	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-10	178.4	-72.3	-173.3	73.3	0	0	115	V452 S453 T454 Q458 Y467 P485 L486	V452-M456 HydrophobicContact CG1-CG 4.35Å; V452-M456 HydrophobicContact CG1-SD 4.21Å; V452-M456 WeakPolarHBondContact O-CG 3.41Å; V452-M456 PolarHBondContact O-N 3.43Å; S453-M456 PolarHBondContact O-N 3.15Å; T454-M456 VanDerWaalsContact C-N 3.32Å; M456-Q458 VanDerWaalsContact C-N 3.31Å; M456-Y467 WeakPolarHBondContact CA-OH 3.41Å; M456-P485 HydrophobicContact CE-CB 4.04Å; M456-L486 HydrophobicContact CG-CD2 3.61Å; M456-L486 HydrophobicContact SD-CD2 3.8Å
457	E	82.4	Confident	80.9	Confident	170 Å²	170	51 Å²	51	79%	0.794	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-16.1	170.7	-65.5	-173.7	160.2	0	0	112.8	S453 T454 L455	S453-E457 PolarHBondContact O-N 3.29Å; T454-E457 PolarHBondContact O-N 3.4Å; L455-E457 PolarHBondContact O-N 2.88Å
458	Q	81.5	Confident	81.7	Confident	73 Å²	73	52.1 Å²	52.1	34%	0.341	28%	0.279	S	S	.	.	S	Bend	trans	-89.5	167.5	-178.9	-58.2	-177	-37.5	0	0	111.2	L455 M456 P460 I463 Y467	L455-Q458 PolarHBondContact O-N 2.87Å; L455-Q458 VanDerWaalsContact O-N 3.17Å; M456-Q458 VanDerWaalsContact C-N 3.31Å; Q458-P460 WeakPolarHBondContact O-CD 3.4Å; Q458-I463 HydrophobicContact CB-CD1 3.71Å; Q458-I463 HydrophobicContact CG-CD1 4.34Å; Q458-I463 VanDerWaalsContact OE1-CD1 3.26Å; Q458-Y467 PolarHBondContact O-OH 3.18Å
459	S	78.8	Confident	82.4	Confident	38 Å²	38	56 Å²	56	27%	0.266	30%	0.3	S	S	.	.			trans	-81.2	125.7	-172	88.7	0	0	0	0	111.8	E461 E462 I463	S459-E461 PolarHBondContact O-N 2.98Å; S459-E462 PolarHBondContact O-N 3.46Å; S459-E462 VanDerWaalsContact O-N 3.09Å; S459-E462 WeakPolarHBondContact OG-CB 3.24Å; S459-E462 VanDerWaalsContact OG-CG 3.23Å; S459-E462 WeakPolarHBondContact OG-CG 3.45Å; S459-E462 PolarHBondContact OG-N 3.1Å; S459-E462 PolarHBondContact OG-OE2 2.74Å; S459-I463 PolarHBondContact O-N 3.01Å
460	P	79.1	Confident	83	Confident	37 Å²	37	51.5 Å²	51.5	24%	0.24	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	0	173.9	-19.8	32.3	0	0	0	114	Q458 Y467 A489 S493 Y496	Q458-P460 WeakPolarHBondContact O-CD 3.4Å; P460-Y467 HydrophobicContact CB-CE1 4.2Å; P460-Y467 HydrophobicContact CG-CE1 3.89Å; P460-A489 HydrophobicContact CG-CB 4.12Å; P460-S493 PolarHBondContact O-OG 2.94Å; P460-Y496 WeakPolarHBondContact O-CD2 3.19Å
461	E	80.1	Confident	83.6	Confident	99 Å²	99	49.6 Å²	49.6	46%	0.463	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-18.5	176.7	-95.4	-159.5	-121.3	0	0	113.4	S459 K495	S459-E461 PolarHBondContact O-N 2.98Å; E461-K495 HydrophobicContact CB-CD 4.2Å; E461-K495 HydrophobicContact CG-CD 4.19Å; E461-K495 WeakPolarHBondContact O-CD 3.3Å; E461-K495 WeakPolarHBondContact O-CE 3.45Å; E461-K495 PolarHBondContact O-NZ 3.29Å; E461-K495 WeakPolarHBondContact OE2-CE 3.5Å; E461-K495 IonicContact OE2-NZ 3.83Å; E461-K495 PolarHBondContact OE2-NZ 3.49Å
462	E	79.3	Confident	84.2	Confident	149 Å²	149	51.4 Å²	51.4	70%	0.696	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-24	-180	-69.8	166.2	144.3	0	0	111.8	S459	S459-E462 PolarHBondContact O-N 3.46Å; S459-E462 VanDerWaalsContact O-N 3.09Å; S459-E462 WeakPolarHBondContact OG-CB 3.24Å; S459-E462 VanDerWaalsContact OG-CG 3.23Å; S459-E462 WeakPolarHBondContact OG-CG 3.45Å; S459-E462 PolarHBondContact OG-N 3.1Å; S459-E462 PolarHBondContact OG-OE2 2.74Å
463	I	82.9	Confident	84.6	Confident	23 Å²	23	51 Å²	51	12%	0.118	27%	0.265	C	S	.	.	S	Bend	trans	-136.9	28.5	-165.8	-31.8	-173.3	0	0	0	111.9	V429 Q458 S459 D465 L466 Y467	V429-I463 HydrophobicContact CG1-CD1 4.17Å; V429-I463 HydrophobicContact CG1-CG2 4.1Å; V429-I463 HydrophobicContact CG2-CD1 4.44Å; Q458-I463 HydrophobicContact CB-CD1 3.71Å; Q458-I463 HydrophobicContact CG-CD1 4.34Å; Q458-I463 VanDerWaalsContact OE1-CD1 3.26Å; S459-I463 PolarHBondContact O-N 3.01Å; I463-D465 VanDerWaalsContact C-N 3.29Å; I463-D465 PolarHBondContact O-N 2.77Å; I463-L466 HydrophobicContact CG2-CB 3.9Å; I463-L466 HydrophobicContact CG2-CD1 3.41Å; I463-L466 VanDerWaalsContact CG2-CD1 3.41Å; I463-L466 HydrophobicContact CG2-CG 3.69Å; I463-L466 PolarHBondContact O-N 2.83Å; I463-Y467 VanDerWaalsContact O-CD2 3.27Å; I463-Y467 WeakPolarHBondContact O-CD2 3.5Å; I463-Y467 PolarHBondContact O-N 3.07Å
464	G	82.1	Confident	84.9	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-75.6	-14.2	-171	0	0	0	0	0	115.1	L468 L490 Y496	G464-L468 PolarHBondContact O-N 2.94Å; G464-L490 VanDerWaalsContact O-CD2 3.25Å; G464-L490 WeakPolarHBondContact O-CD2 3.27Å; G464-Y496 PolarHBondContact N-OH 3.38Å
465	D	86	Confident	85.3	Confident	83 Å²	83	46.2 Å²	46.2	44%	0.444	23%	0.232	S	C	.	.	H	α-helix	trans	-70.8	-48.6	168.8	46.8	2.3	0	0	0	111.4	I463 Y467 L468 D469 Y496	I463-D465 VanDerWaalsContact C-N 3.29Å; I463-D465 PolarHBondContact O-N 2.77Å; D465-Y467 VanDerWaalsContact C-N 3.26Å; D465-Y467 PolarHBondContact O-N 3.26Å; D465-L468 WeakPolarHBondContact O-CA 3.24Å; D465-L468 WeakPolarHBondContact O-CB 3.42Å; D465-L468 PolarHBondContact O-N 3.5Å; D465-D469 PolarHBondContact O-N 2.72Å; D465-Y496 HydrophobicContact CB-CE1 4.48Å; D465-Y496 PolarHBondContact N-OH 2.99Å
466	L	87.3	Confident	85.6	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-32.8	176.7	-54.7	-171.9	0	0	0	112.4	V429 A433 I463 L468 D469 V470	V429-L466 HydrophobicContact CB-CD1 4.39Å; V429-L466 HydrophobicContact CG1-CD1 3.9Å; A433-L466 HydrophobicContact CB-CB 3.73Å; A433-L466 HydrophobicContact CB-CD1 3.7Å; A433-L466 HydrophobicContact CB-CD2 4.04Å; A433-L466 HydrophobicContact CB-CG 4.03Å; I463-L466 HydrophobicContact CG2-CB 3.9Å; I463-L466 HydrophobicContact CG2-CD1 3.41Å; I463-L466 VanDerWaalsContact CG2-CD1 3.41Å; I463-L466 HydrophobicContact CG2-CG 3.69Å; I463-L466 PolarHBondContact O-N 2.83Å; L466-L468 VanDerWaalsContact C-N 3.3Å; L466-D469 PolarHBondContact O-N 2.83Å; L466-V470 WeakPolarHBondContact O-CB 3.48Å; L466-V470 VanDerWaalsContact O-CG2 3.3Å; L466-V470 WeakPolarHBondContact O-CG2 3.38Å; L466-V470 PolarHBondContact O-N 3.39Å
467	Y	88.1	Confident	86	Confident	3 Å²	3	50.2 Å²	50.2	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-62.6	-37.2	170.7	-86.5	-130.3	0	0	0	111.9	L455 M456 Q458 P460 I463 D465 A471 L486 A489 L490	L455-Y467 HydrophobicContact CD1-CE2 4.37Å; L455-Y467 HydrophobicContact CD2-CD2 4.39Å; L455-Y467 HydrophobicContact CG-CD2 4.22Å; L455-Y467 HydrophobicContact CG-CE2 3.98Å; L455-Y467 PolarHBondContact O-OH 2.71Å; M456-Y467 WeakPolarHBondContact CA-OH 3.41Å; Q458-Y467 PolarHBondContact O-OH 3.18Å; P460-Y467 HydrophobicContact CB-CE1 4.2Å; P460-Y467 HydrophobicContact CG-CE1 3.89Å; I463-Y467 VanDerWaalsContact O-CD2 3.27Å; I463-Y467 WeakPolarHBondContact O-CD2 3.5Å; I463-Y467 PolarHBondContact O-N 3.07Å; D465-Y467 VanDerWaalsContact C-N 3.26Å; D465-Y467 PolarHBondContact O-N 3.26Å; Y467-A471 VanDerWaalsContact O-CB 3.24Å; Y467-A471 WeakPolarHBondContact O-CB 3.13Å; Y467-A471 PolarHBondContact O-N 3.21Å; Y467-L486 HydrophobicContact CD1-CB 4.41Å; Y467-L486 HydrophobicContact CD1-CD2 3.82Å; Y467-L486 HydrophobicContact CE1-CD2 4.13Å; Y467-L486 HydrophobicContact CG-CD2 4.35Å; Y467-A489 HydrophobicContact CE1-CB 4.25Å; Y467-L490 HydrophobicContact CD1-CD2 4.44Å; Y467-L490 HydrophobicContact CG-CD2 4.39Å
468	L	90	Very high	86.1	Confident	30 Å²	30	43.7 Å²	43.7	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-70.6	-46.1	177.2	-177.1	60.9	0	0	0	110.5	G464 D465 L466 V470 A471 E472 L487 L490 V501 R504	G464-L468 PolarHBondContact O-N 2.94Å; D465-L468 WeakPolarHBondContact O-CA 3.24Å; D465-L468 WeakPolarHBondContact O-CB 3.42Å; D465-L468 PolarHBondContact O-N 3.5Å; L466-L468 VanDerWaalsContact C-N 3.3Å; L468-V470 PolarHBondContact O-N 2.84Å; L468-A471 CarbonylContact O-C 3.46Å; L468-A471 WeakPolarHBondContact O-CB 3.44Å; L468-A471 PolarHBondContact O-N 3.04Å; L468-A471 VanDerWaalsContact O-N 3.13Å; L468-E472 HydrophobicContact CD1-CG 4.24Å; L468-E472 HydrophobicContact CG-CG 4.43Å; L468-E472 WeakPolarHBondContact O-CG 3.34Å; L468-E472 PolarHBondContact O-N 3.22Å; L468-L487 HydrophobicContact CD1-CD2 4.16Å; L468-L490 HydrophobicContact CB-CD1 4.04Å; L468-V501 HydrophobicContact CD1-CG2 4.5Å; L468-V501 HydrophobicContact CD2-CG2 4.41Å; L468-R504 HydrophobicContact CD1-CG 4.18Å
469	D	88.8	Confident	86.5	Confident	81 Å²	81	44.5 Å²	44.5	43%	0.433	23%	0.228	S	C	.	.	H	α-helix	trans	-56.7	-46.8	176.5	-74.3	-8.9	0	0	0	112.2	V437 D465 L466 E472 A473	V437-D469 HydrophobicContact CG2-CB 4.34Å; D465-D469 PolarHBondContact O-N 2.72Å; L466-D469 PolarHBondContact O-N 2.83Å; D469-E472 PolarHBondContact O-N 3.19Å; D469-A473 PolarHBondContact O-N 3.29Å
470	V	89.7	Confident	87	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-38.2	176.9	172.5	0	0	0	0	111.3	A433 I436 V437 I440 V452 L455 L466 L468 Y474 L486	A433-V470 HydrophobicContact CB-CG2 4.42Å; I436-V470 HydrophobicContact CB-CG2 4.25Å; I436-V470 HydrophobicContact CG2-CB 4.38Å; I436-V470 HydrophobicContact CG2-CG1 3.67Å; I436-V470 HydrophobicContact CG2-CG2 3.75Å; V437-V470 HydrophobicContact CG2-CG2 4.04Å; I440-V470 HydrophobicContact CD1-CG1 4.01Å; V452-V470 HydrophobicContact CG2-CG1 3.91Å; L455-V470 HydrophobicContact CD2-CG2 4.11Å; L466-V470 WeakPolarHBondContact O-CB 3.48Å; L466-V470 VanDerWaalsContact O-CG2 3.3Å; L466-V470 WeakPolarHBondContact O-CG2 3.38Å; L466-V470 PolarHBondContact O-N 3.39Å; L468-V470 PolarHBondContact O-N 2.84Å; V470-Y474 HydrophobicContact CG1-CD2 4.07Å; V470-Y474 HydrophobicContact CG1-CE2 3.86Å; V470-Y474 VanDerWaalsContact O-CD2 3.32Å; V470-Y474 WeakPolarHBondContact O-CD2 3.43Å; V470-Y474 PolarHBondContact O-N 3.46Å; V470-Y474 VanDerWaalsContact O-N 3.15Å; V470-L486 HydrophobicContact CB-CD1 4.21Å; V470-L486 HydrophobicContact CG1-CD1 3.59Å
471	A	90.2	Very high	87.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-44.1	174.5	0	0	0	0	0	112	Y467 L468 A473 Y474 L475 L486 L487	Y467-A471 VanDerWaalsContact O-CB 3.24Å; Y467-A471 WeakPolarHBondContact O-CB 3.13Å; Y467-A471 PolarHBondContact O-N 3.21Å; L468-A471 CarbonylContact O-C 3.46Å; L468-A471 WeakPolarHBondContact O-CB 3.44Å; L468-A471 PolarHBondContact O-N 3.04Å; L468-A471 VanDerWaalsContact O-N 3.13Å; A471-A473 VanDerWaalsContact C-N 3.33Å; A471-A473 PolarHBondContact O-N 3.22Å; A471-Y474 PolarHBondContact O-N 2.99Å; A471-L475 WeakPolarHBondContact O-CG 3.23Å; A471-L475 PolarHBondContact O-N 2.76Å; A471-L486 HydrophobicContact CB-CB 4.28Å; A471-L486 HydrophobicContact CB-CD1 4.47Å; A471-L487 HydrophobicContact CB-CD1 4.31Å; A471-L487 HydrophobicContact CB-CD2 3.74Å; A471-L487 HydrophobicContact CB-CG 3.75Å
472	E	90.9	Very high	87.9	Confident	59 Å²	59	45.6 Å²	45.6	28%	0.276	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-38.8	176.7	-68.2	-149.2	169.4	0	0	111.9	L468 D469 Y474 L475 E476 R504	L468-E472 HydrophobicContact CD1-CG 4.24Å; L468-E472 HydrophobicContact CG-CG 4.43Å; L468-E472 WeakPolarHBondContact O-CG 3.34Å; L468-E472 PolarHBondContact O-N 3.22Å; D469-E472 PolarHBondContact O-N 3.19Å; E472-Y474 PolarHBondContact O-N 3.41Å; E472-L475 PolarHBondContact O-N 3.09Å; E472-L475 VanDerWaalsContact O-N 3.11Å; E472-E476 PolarHBondContact O-N 3.33Å; E472-R504 IonicContact OE1-CZ 3.81Å; E472-R504 VanDerWaalsContact OE1-CZ 3.24Å; E472-R504 IonicContact OE1-NE 3.77Å; E472-R504 PolarHBondContact OE1-NE 2.74Å; E472-R504 IonicContact OE1-NH2 2.89Å; E472-R504 PolarHBondContact OE1-NH2 3.29Å; E472-R504 IonicContact OE2-CZ 2.7Å; E472-R504 IonicContact OE2-NH2 3.79Å; E472-R504 PolarHBondContact OE2-NH2 2.89Å
473	A	89.7	Confident	88.5	Confident	2 Å²	2	38.5 Å²	38.5	2%	0.017	20%	0.199	C	C	.	.	H	α-helix	trans	-60.3	-42.3	172.7	0	0	0	0	0	112.5	V437 I440 D469 A471 L475 Q477	V437-A473 HydrophobicContact CB-CB 4.4Å; V437-A473 HydrophobicContact CG1-CB 4.12Å; V437-A473 HydrophobicContact CG2-CB 4.15Å; I440-A473 HydrophobicContact CB-CB 4.31Å; I440-A473 HydrophobicContact CD1-CB 4.3Å; I440-A473 HydrophobicContact CG2-CB 3.92Å; I440-A473 WeakPolarHBondContact CG2-O 3.44Å; D469-A473 PolarHBondContact O-N 3.29Å; A471-A473 VanDerWaalsContact C-N 3.33Å; A471-A473 PolarHBondContact O-N 3.22Å; A473-L475 VanDerWaalsContact C-N 3.34Å; A473-Q477 PolarHBondContact O-N 2.96Å
474	Y	90.5	Very high	88.9	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-67.5	-32	172.9	-79.3	-56.2	0	0	0	112.8	I440 F445 S448 V452 V470 A471 E472 G478 R479 L486	I440-Y474 HydrophobicContact CD1-CD1 3.95Å; I440-Y474 HydrophobicContact CD1-CD2 3.8Å; I440-Y474 HydrophobicContact CD1-CE1 3.67Å; I440-Y474 HydrophobicContact CD1-CE2 3.51Å; I440-Y474 HydrophobicContact CD1-CG 4.01Å; I440-Y474 VanDerWaalsContact CD1-CZ 3.43Å; I440-Y474 HydrophobicContact CG1-CD1 4.09Å; I440-Y474 HydrophobicContact CG1-CE1 3.65Å; I440-Y474 HydrophobicContact CG1-CE2 4.38Å; I440-Y474 HydrophobicContact CG2-CD1 3.88Å; I440-Y474 HydrophobicContact CG2-CE1 4.24Å; I440-Y474 HydrophobicContact CG2-CG 4.38Å; F445-Y474 HydrophobicContact CD1-CE1 4.25Å; F445-Y474 HydrophobicContact CE1-CE1 4.42Å; S448-Y474 PolarHBondContact OG-OH 3.19Å; V452-Y474 HydrophobicContact CG2-CE2 4.14Å; V470-Y474 HydrophobicContact CG1-CD2 4.07Å; V470-Y474 HydrophobicContact CG1-CE2 3.86Å; V470-Y474 VanDerWaalsContact O-CD2 3.32Å; V470-Y474 WeakPolarHBondContact O-CD2 3.43Å; V470-Y474 PolarHBondContact O-N 3.46Å; V470-Y474 VanDerWaalsContact O-N 3.15Å; A471-Y474 PolarHBondContact O-N 2.99Å; E472-Y474 PolarHBondContact O-N 3.41Å; Y474-G478 PolarHBondContact O-N 3.3Å; Y474-R479 HydrophobicContact CD1-CB 3.81Å; Y474-R479 PolarHBondContact O-N 3.45Å; Y474-L486 HydrophobicContact CD2-CD1 4.35Å; Y474-L486 HydrophobicContact CE2-CD1 4.41Å
475	L	90.3	Very high	89.3	Confident	22 Å²	22	41.9 Å²	41.9	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-70.3	-41.9	175.3	-67.7	179.1	0	0	0	112.4	A471 E472 A473 Q477 G478 Y480 A483 L487 R504 C508	A471-L475 WeakPolarHBondContact O-CG 3.23Å; A471-L475 PolarHBondContact O-N 2.76Å; E472-L475 PolarHBondContact O-N 3.09Å; E472-L475 VanDerWaalsContact O-N 3.11Å; A473-L475 VanDerWaalsContact C-N 3.34Å; L475-Q477 VanDerWaalsContact C-N 3.29Å; L475-Q477 PolarHBondContact O-N 3.16Å; L475-G478 PolarHBondContact O-N 3.25Å; L475-G478 VanDerWaalsContact O-N 3.07Å; L475-Y480 HydrophobicContact CD2-CD1 3.5Å; L475-Y480 VanDerWaalsContact CD2-CD1 3.5Å; L475-Y480 HydrophobicContact CD2-CE1 3.85Å; L475-A483 HydrophobicContact CD2-CB 3.91Å; L475-A483 HydrophobicContact CG-CB 4.16Å; L475-L487 HydrophobicContact CD1-CD1 4.32Å; L475-R504 HydrophobicContact CD1-CB 3.97Å; L475-R504 HydrophobicContact CD1-CG 4.28Å; L475-C508 HydrophobicContact CD2-CB 3.93Å
476	E	88.8	Confident	89.4	Confident	108 Å²	108	38 Å²	38	51%	0.505	20%	0.199	S	C	.	.	H	α-helix	trans	-59.4	-39.4	174.6	-77.7	-154.4	142.4	0	0	111.6	R360 Q441 E472 G478	R360-E476 IonicContact CZ-OE1 3.73Å; R360-E476 IonicContact CZ-OE2 2.97Å; R360-E476 IonicContact NH1-OE1 3.78Å; R360-E476 PolarHBondContact NH1-OE1 3.23Å; R360-E476 IonicContact NH1-OE2 3.98Å; R360-E476 PolarHBondContact NH1-OE2 3.48Å; R360-E476 IonicContact NH2-OE1 2.78Å; R360-E476 PolarHBondContact NH2-OE1 2.85Å; R360-E476 IonicContact NH2-OE2 2.68Å; Q441-E476 PolarHBondContact NE2-OE2 2.95Å; E472-E476 PolarHBondContact O-N 3.33Å; E476-G478 VanDerWaalsContact C-N 3.28Å; E476-G478 PolarHBondContact O-N 3.37Å
477	Q	88.9	Confident	89.6	Confident	63 Å²	63	37.4 Å²	37.4	29%	0.294	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	5.7	177	-61.1	-66.1	-29.2	0	0	113.8	I440 N443 A473 L475 R479	I440-Q477 HydrophobicContact CG2-CB 4.5Å; I440-Q477 HydrophobicContact CG2-CG 4.03Å; N443-Q477 PolarHBondContact ND2-OE1 2.85Å; A473-Q477 PolarHBondContact O-N 2.96Å; L475-Q477 VanDerWaalsContact C-N 3.29Å; L475-Q477 PolarHBondContact O-N 3.16Å; Q477-R479 PolarHBondContact O-N 2.82Å
478	G	86.3	Confident	89.7	Confident	34 Å²	34	39.6 Å²	39.6	35%	0.351	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	16.4	177.7	0	0	0	0	0	115.6	Y474 L475 E476 Y480	Y474-G478 PolarHBondContact O-N 3.3Å; L475-G478 PolarHBondContact O-N 3.25Å; L475-G478 VanDerWaalsContact O-N 3.07Å; E476-G478 VanDerWaalsContact C-N 3.28Å; E476-G478 PolarHBondContact O-N 3.37Å; G478-Y480 VanDerWaalsContact C-N 3.25Å; G478-Y480 WeakPolarHBondContact O-CD2 3.41Å; G478-Y480 VanDerWaalsContact O-CE2 3.29Å; G478-Y480 WeakPolarHBondContact O-CE2 3.45Å; G478-Y480 PolarHBondContact O-N 3.2Å; G478-Y480 VanDerWaalsContact O-N 3.13Å
479	R	88.9	Confident	89.6	Confident	89 Å²	89	39.5 Å²	39.5	34%	0.336	22%	0.216	S	C	.	.			trans	-88.3	52.6	-178.9	-72.8	-72.5	-64.4	-144	-5.3	111.7	F445 E449 Y474 Q477 T481 S482 A483	F445-R479 HydrophobicContact CE1-CG 4.05Å; F445-R479 HydrophobicContact CZ-CG 4.12Å; E449-R479 IonicContact OE1-NH2 3.52Å; E449-R479 PolarHBondContact OE1-NH2 2.82Å; Y474-R479 HydrophobicContact CD1-CB 3.81Å; Y474-R479 PolarHBondContact O-N 3.45Å; Q477-R479 PolarHBondContact O-N 2.82Å; R479-T481 PolarHBondContact O-N 3.37Å; R479-T481 VanDerWaalsContact O-N 3.07Å; R479-S482 PolarHBondContact O-N 2.65Å; R479-A483 PolarHBondContact O-N 3.32Å
480	Y	90.3	Very high	89.6	Confident	81 Å²	81	35.7 Å²	35.7	32%	0.318	20%	0.195	S	C	.	.	H	α-helix	trans	-52.5	-34.7	-173.6	-52.9	-71.3	0	0	0	114.3	L475 G478 S482 A483 L484 C508 A511	L475-Y480 HydrophobicContact CD2-CD1 3.5Å; L475-Y480 VanDerWaalsContact CD2-CD1 3.5Å; L475-Y480 HydrophobicContact CD2-CE1 3.85Å; G478-Y480 VanDerWaalsContact C-N 3.25Å; G478-Y480 WeakPolarHBondContact O-CD2 3.41Å; G478-Y480 VanDerWaalsContact O-CE2 3.29Å; G478-Y480 WeakPolarHBondContact O-CE2 3.45Å; G478-Y480 PolarHBondContact O-N 3.2Å; G478-Y480 VanDerWaalsContact O-N 3.13Å; Y480-S482 VanDerWaalsContact C-N 3.26Å; Y480-S482 PolarHBondContact O-N 3.37Å; Y480-A483 PolarHBondContact O-N 2.67Å; Y480-L484 PolarHBondContact O-N 3.1Å; Y480-C508 PolarHBondContact O-SG 3.47Å; Y480-A511 HydrophobicContact CD1-CB 3.61Å; Y480-A511 HydrophobicContact CD2-CB 3.66Å; Y480-A511 HydrophobicContact CE1-CB 3.58Å; Y480-A511 HydrophobicContact CE2-CB 3.6Å; Y480-A511 HydrophobicContact CG-CB 3.68Å
481	T	89.4	Confident	89.5	Confident	95 Å²	95	36.7 Å²	36.7	58%	0.583	20%	0.201	S	C	*	.	H	α-helix	trans	-61.3	-31.7	177.2	50.8	0	0	0	0	113.7	R479 P485 L512	R479-T481 PolarHBondContact O-N 3.37Å; R479-T481 VanDerWaalsContact O-N 3.07Å; T481-P485 WeakPolarHBondContact O-CD 3.49Å; T481-L512 HydrophobicContact CG2-CD2 3.68Å
482	S	88.1	Confident	89.3	Confident	22 Å²	22	42.5 Å²	42.5	15%	0.154	24%	0.237	C	C	.	.	H	α-helix	trans	-87.7	-26.7	179.5	-54.9	0	0	0	0	112	R479 Y480	R479-S482 PolarHBondContact O-N 2.65Å; Y480-S482 VanDerWaalsContact C-N 3.26Å; Y480-S482 PolarHBondContact O-N 3.37Å
483	A	91	Very high	89.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-75.3	-36.2	175.4	0	0	0	0	0	113.2	L475 R479 Y480 L486 L487	L475-A483 HydrophobicContact CD2-CB 3.91Å; L475-A483 HydrophobicContact CG-CB 4.16Å; R479-A483 PolarHBondContact O-N 3.32Å; Y480-A483 PolarHBondContact O-N 2.67Å; A483-L486 PolarHBondContact O-N 2.75Å; A483-L487 HydrophobicContact CB-CD1 4.26Å; A483-L487 WeakPolarHBondContact O-CG 3.49Å; A483-L487 PolarHBondContact O-N 3.15Å; A483-L487 VanDerWaalsContact O-N 3.13Å
484	L	91.6	Very high	88.7	Confident	39 Å²	39	49.1 Å²	49.1	20%	0.204	27%	0.268	C	S	.	.	H	α-helix	trans	-57.8	-43.9	-172.6	-176	63.3	0	0	0	114.4	Y480 L486 L487 S488 L509 L512	Y480-L484 PolarHBondContact O-N 3.1Å; L484-L486 PolarHBondContact O-N 2.98Å; L484-L487 PolarHBondContact O-N 3.25Å; L484-S488 VanDerWaalsContact O-CB 3.32Å; L484-S488 WeakPolarHBondContact O-CB 3.48Å; L484-S488 PolarHBondContact O-N 3.36Å; L484-S488 PolarHBondContact O-OG 3.44Å; L484-L509 HydrophobicContact CD1-CD2 3.77Å; L484-L509 HydrophobicContact CD1-CG 3.92Å; L484-L509 HydrophobicContact CD2-CD2 3.93Å; L484-L512 HydrophobicContact CB-CD1 4.23Å; L484-L512 HydrophobicContact CD2-CD1 3.8Å
485	P	90.6	Very high	88.3	Confident	54 Å²	54	54.4 Å²	54.4	35%	0.351	29%	0.291	S	S	.	.	H	α-helix	trans	-58.6	-45.3	178	-25.8	36	0	0	0	113.1	M456 T481 S488 A489	M456-P485 HydrophobicContact CE-CB 4.04Å; T481-P485 WeakPolarHBondContact O-CD 3.49Å; P485-S488 PolarHBondContact O-N 3.25Å; P485-S488 PolarHBondContact O-OG 3.08Å; P485-A489 PolarHBondContact O-N 3.36Å
486	L	89	Confident	87.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-49.5	179	-62.5	172.1	0	0	0	111.2	V452 M456 Y467 V470 A471 Y474 A483 L484 S488 A489 L490	V452-L486 HydrophobicContact CG1-CD1 4.39Å; V452-L486 HydrophobicContact CG1-CD2 4.27Å; M456-L486 HydrophobicContact CG-CD2 3.61Å; M456-L486 HydrophobicContact SD-CD2 3.8Å; Y467-L486 HydrophobicContact CD1-CB 4.41Å; Y467-L486 HydrophobicContact CD1-CD2 3.82Å; Y467-L486 HydrophobicContact CE1-CD2 4.13Å; Y467-L486 HydrophobicContact CG-CD2 4.35Å; V470-L486 HydrophobicContact CB-CD1 4.21Å; V470-L486 HydrophobicContact CG1-CD1 3.59Å; A471-L486 HydrophobicContact CB-CB 4.28Å; A471-L486 HydrophobicContact CB-CD1 4.47Å; Y474-L486 HydrophobicContact CD2-CD1 4.35Å; Y474-L486 HydrophobicContact CE2-CD1 4.41Å; A483-L486 PolarHBondContact O-N 2.75Å; L484-L486 PolarHBondContact O-N 2.98Å; L486-S488 VanDerWaalsContact C-N 3.3Å; L486-S488 PolarHBondContact O-N 2.64Å; L486-A489 PolarHBondContact O-N 3.05Å; L486-L490 PolarHBondContact O-N 2.73Å; L486-L490 VanDerWaalsContact O-N 3.15Å
487	L	90.5	Very high	87.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-36.8	177.6	-66.4	167.9	0	0	0	112.1	L468 A471 L475 A483 L484 A489 L490 V491 R504 H505 C508	L468-L487 HydrophobicContact CD1-CD2 4.16Å; A471-L487 HydrophobicContact CB-CD1 4.31Å; A471-L487 HydrophobicContact CB-CD2 3.74Å; A471-L487 HydrophobicContact CB-CG 3.75Å; L475-L487 HydrophobicContact CD1-CD1 4.32Å; A483-L487 HydrophobicContact CB-CD1 4.26Å; A483-L487 WeakPolarHBondContact O-CG 3.49Å; A483-L487 PolarHBondContact O-N 3.15Å; A483-L487 VanDerWaalsContact O-N 3.13Å; L484-L487 PolarHBondContact O-N 3.25Å; L487-A489 VanDerWaalsContact C-N 3.35Å; L487-L490 PolarHBondContact O-N 3.27Å; L487-V491 WeakPolarHBondContact O-CB 3.49Å; L487-V491 WeakPolarHBondContact O-CG2 3.26Å; L487-V491 PolarHBondContact O-N 3.4Å; L487-R504 HydrophobicContact CD1-CB 4.2Å; L487-R504 HydrophobicContact CD2-CB 3.75Å; L487-H505 HydrophobicContact CB-CB 4.35Å; L487-C508 HydrophobicContact CD1-CB 3.95Å
488	S	89.9	Confident	87.6	Confident	50 Å²	50	55.5 Å²	55.5	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-31.3	177.1	75.9	0	0	0	0	113.1	L484 P485 L486 V492	L484-S488 VanDerWaalsContact O-CB 3.32Å; L484-S488 WeakPolarHBondContact O-CB 3.48Å; L484-S488 PolarHBondContact O-N 3.36Å; L484-S488 PolarHBondContact O-OG 3.44Å; P485-S488 PolarHBondContact O-N 3.25Å; P485-S488 PolarHBondContact O-OG 3.08Å; L486-S488 VanDerWaalsContact C-N 3.3Å; L486-S488 PolarHBondContact O-N 2.64Å; S488-V492 WeakPolarHBondContact O-CG2 3.35Å
489	A	88.6	Confident	87.8	Confident	28 Å²	28	55 Å²	55	23%	0.231	29%	0.292	C	S	.	.	H	α-helix	trans	-70.3	-41.4	174.2	0	0	0	0	0	111.7	P460 Y467 P485 L486 L487 V492 S493	P460-A489 HydrophobicContact CG-CB 4.12Å; Y467-A489 HydrophobicContact CE1-CB 4.25Å; P485-A489 PolarHBondContact O-N 3.36Å; L486-A489 PolarHBondContact O-N 3.05Å; L487-A489 VanDerWaalsContact C-N 3.35Å; A489-V492 PolarHBondContact O-N 3.39Å; A489-S493 PolarHBondContact O-N 3.24Å
490	L	87.7	Confident	87.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-42	174.6	-65.4	177.7	0	0	0	112.6	G464 Y467 L468 L486 L487 V492 S493 Y496 V501	G464-L490 VanDerWaalsContact O-CD2 3.25Å; G464-L490 WeakPolarHBondContact O-CD2 3.27Å; Y467-L490 HydrophobicContact CD1-CD2 4.44Å; Y467-L490 HydrophobicContact CG-CD2 4.39Å; L468-L490 HydrophobicContact CB-CD1 4.04Å; L486-L490 PolarHBondContact O-N 2.73Å; L486-L490 VanDerWaalsContact O-N 3.15Å; L487-L490 PolarHBondContact O-N 3.27Å; L490-V492 PolarHBondContact O-N 2.94Å; L490-V492 VanDerWaalsContact O-N 3.1Å; L490-S493 WeakPolarHBondContact O-CB 3.37Å; L490-S493 PolarHBondContact O-N 3.3Å; L490-Y496 HydrophobicContact CD2-CD1 4.48Å; L490-Y496 HydrophobicContact CD2-CD2 4.5Å; L490-Y496 HydrophobicContact CD2-CG 4.13Å; L490-V501 HydrophobicContact CB-CG1 3.54Å; L490-V501 HydrophobicContact CD1-CG1 4.16Å; L490-V501 HydrophobicContact CD1-CG2 4.49Å
491	V	87.9	Confident	87.9	Confident	22 Å²	22	51 Å²	51	13%	0.133	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-19.4	175.8	144.6	0	0	0	0	114	L487 V501 W502 H505	L487-V491 WeakPolarHBondContact O-CB 3.49Å; L487-V491 WeakPolarHBondContact O-CG2 3.26Å; L487-V491 PolarHBondContact O-N 3.4Å; V491-V501 HydrophobicContact CG2-CG1 4.19Å; V491-W502 HydrophobicContact CB-CH2 4.37Å; V491-W502 HydrophobicContact CB-CZ2 4.14Å; V491-W502 HydrophobicContact CG1-CH2 3.41Å; V491-W502 VanDerWaalsContact CG1-CH2 3.41Å; V491-W502 HydrophobicContact CG1-CZ2 3.47Å; V491-W502 VanDerWaalsContact CG1-CZ2 3.47Å; V491-W502 HydrophobicContact CG1-CZ3 4.13Å; V491-W502 HydrophobicContact CG2-CD2 3.89Å; V491-W502 HydrophobicContact CG2-CE3 4.1Å; V491-W502 HydrophobicContact CG2-CG 4.41Å; V491-W502 HydrophobicContact CG2-CH2 4.13Å; V491-W502 HydrophobicContact CG2-CZ2 3.93Å; V491-W502 HydrophobicContact CG2-CZ3 4.22Å; V491-H505 HydrophobicContact CG2-CB 4.09Å
492	V	87.1	Confident	88.1	Confident	122 Å²	122	47.2 Å²	47.2	74%	0.739	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-10.6	177.7	175.3	0	0	0	0	112.3	S488 A489 L490	S488-V492 WeakPolarHBondContact O-CG2 3.35Å; A489-V492 PolarHBondContact O-N 3.39Å; L490-V492 PolarHBondContact O-N 2.94Å; L490-V492 VanDerWaalsContact O-N 3.1Å
493	S	87.3	Confident	88.4	Confident	11 Å²	11	47.2 Å²	47.2	8%	0.077	26%	0.259	C	S	.	.			trans	-84.8	125.8	-177.9	-177	0	0	0	0	112	P460 A489 L490 K495 Y496 D497	P460-S493 PolarHBondContact O-OG 2.94Å; A489-S493 PolarHBondContact O-N 3.24Å; L490-S493 WeakPolarHBondContact O-CB 3.37Å; L490-S493 PolarHBondContact O-N 3.3Å; S493-K495 PolarHBondContact O-N 3.03Å; S493-K495 VanDerWaalsContact O-N 3.07Å; S493-Y496 PolarHBondContact O-N 3.19Å; S493-Y496 VanDerWaalsContact O-N 3.07Å; S493-D497 PolarHBondContact O-N 3.41Å; S493-D497 VanDerWaalsContact O-N 3.13Å
494	E	80.2	Confident	88.5	Confident	188 Å²	188	50.5 Å²	50.5	88%	0.879	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.6	-179.5	-62.7	-169.1	168.2	0	0	113.6
495	K	81.1	Confident	88.6	Confident	113 Å²	113	49.6 Å²	49.6	49%	0.491	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-26.5	178.6	-69.6	163.7	179.2	152.7	0	113.7	E461 S493	E461-K495 HydrophobicContact CB-CD 4.2Å; E461-K495 HydrophobicContact CG-CD 4.19Å; E461-K495 WeakPolarHBondContact O-CD 3.3Å; E461-K495 WeakPolarHBondContact O-CE 3.45Å; E461-K495 PolarHBondContact O-NZ 3.29Å; E461-K495 WeakPolarHBondContact OE2-CE 3.5Å; E461-K495 IonicContact OE2-NZ 3.83Å; E461-K495 PolarHBondContact OE2-NZ 3.49Å; S493-K495 PolarHBondContact O-N 3.03Å; S493-K495 VanDerWaalsContact O-N 3.07Å
496	Y	81.2	Confident	88.8	Confident	43 Å²	43	47 Å²	47	17%	0.169	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	14.9	-172.1	-66.1	-91.5	0	0	0	113.1	P460 G464 D465 L490 S493 L498	P460-Y496 WeakPolarHBondContact O-CD2 3.19Å; G464-Y496 PolarHBondContact N-OH 3.38Å; D465-Y496 HydrophobicContact CB-CE1 4.48Å; D465-Y496 PolarHBondContact N-OH 2.99Å; L490-Y496 HydrophobicContact CD2-CD1 4.48Å; L490-Y496 HydrophobicContact CD2-CD2 4.5Å; L490-Y496 HydrophobicContact CD2-CG 4.13Å; S493-Y496 PolarHBondContact O-N 3.19Å; S493-Y496 VanDerWaalsContact O-N 3.07Å; Y496-L498 PolarHBondContact O-N 3.13Å
497	D	84.1	Confident	89	Confident	83 Å²	83	49.9 Å²	49.9	44%	0.444	26%	0.262	S	S	.	.			trans	-67.9	63.8	165.8	-166.2	25.2	0	0	0	111	S493 W502	S493-D497 PolarHBondContact O-N 3.41Å; S493-D497 VanDerWaalsContact O-N 3.13Å; D497-W502 PolarHBondContact OD1-NE1 2.74Å
498	L	89.3	Confident	89.2	Confident	91 Å²	91	49.9 Å²	49.9	48%	0.476	26%	0.262	S	S	.	.			trans	-115.3	144.7	-171.2	-63.7	174	0	0	0	110.7	Y496 V500 V501 W502	Y496-L498 PolarHBondContact O-N 3.13Å; L498-V500 PolarHBondContact O-N 3.15Å; L498-V500 VanDerWaalsContact O-N 3.09Å; L498-V501 HydrophobicContact CB-CG2 4.32Å; L498-V501 PolarHBondContact O-N 3.17Å; L498-W502 PolarHBondContact O-N 3.39Å
499	A	89.3	Confident	89.4	Confident	23 Å²	23	47.7 Å²	47.7	19%	0.19	25%	0.247	C	C	.	.	H	α-helix	trans	-56.3	-30.2	-179.6	0	0	0	0	0	113.9	L503 M528 A529	A499-L503 WeakPolarHBondContact O-CB 3.42Å; A499-L503 PolarHBondContact O-N 3.43Å; A499-M528 HydrophobicContact CB-CB 4.07Å; A499-M528 HydrophobicContact CB-CE 4.21Å; A499-M528 HydrophobicContact CB-SD 4.36Å; A499-A529 HydrophobicContact CB-CB 3.88Å
500	V	91.1	Very high	89.6	Confident	84 Å²	84	49 Å²	49	51%	0.509	25%	0.247	S	C	.	.	H	α-helix	trans	-68.4	-47	176.2	-177.7	0	0	0	0	111.3	L498 W502 L503 R504	L498-V500 PolarHBondContact O-N 3.15Å; L498-V500 VanDerWaalsContact O-N 3.09Å; V500-W502 PolarHBondContact O-N 3.31Å; V500-L503 WeakPolarHBondContact O-CB 3.43Å; V500-L503 PolarHBondContact O-N 3.02Å; V500-R504 PolarHBondContact O-N 3.02Å
501	V	91.8	Very high	89.8	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-45.4	178.1	178.4	0	0	0	0	110.2	L468 L490 V491 L498 L503 R504 H505	L468-V501 HydrophobicContact CD1-CG2 4.5Å; L468-V501 HydrophobicContact CD2-CG2 4.41Å; L490-V501 HydrophobicContact CB-CG1 3.54Å; L490-V501 HydrophobicContact CD1-CG1 4.16Å; L490-V501 HydrophobicContact CD1-CG2 4.49Å; V491-V501 HydrophobicContact CG2-CG1 4.19Å; L498-V501 HydrophobicContact CB-CG2 4.32Å; L498-V501 PolarHBondContact O-N 3.17Å; V501-L503 VanDerWaalsContact C-N 3.3Å; V501-L503 PolarHBondContact O-N 3.19Å; V501-R504 PolarHBondContact O-N 3.13Å; V501-H505 WeakPolarHBondContact O-CB 3.31Å; V501-H505 PolarHBondContact O-N 3.28Å
502	W	93.7	Very high	90.1	Very high	17 Å²	17	53 Å²	53	6%	0.064	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-32.1	175.5	-81.9	97.9	0	0	0	113.5	V491 D497 L498 V500 H505 A506 K524 V525 M528	V491-W502 HydrophobicContact CB-CH2 4.37Å; V491-W502 HydrophobicContact CB-CZ2 4.14Å; V491-W502 HydrophobicContact CG1-CH2 3.41Å; V491-W502 VanDerWaalsContact CG1-CH2 3.41Å; V491-W502 HydrophobicContact CG1-CZ2 3.47Å; V491-W502 VanDerWaalsContact CG1-CZ2 3.47Å; V491-W502 HydrophobicContact CG1-CZ3 4.13Å; V491-W502 HydrophobicContact CG2-CD2 3.89Å; V491-W502 HydrophobicContact CG2-CE3 4.1Å; V491-W502 HydrophobicContact CG2-CG 4.41Å; V491-W502 HydrophobicContact CG2-CH2 4.13Å; V491-W502 HydrophobicContact CG2-CZ2 3.93Å; V491-W502 HydrophobicContact CG2-CZ3 4.22Å; D497-W502 PolarHBondContact OD1-NE1 2.74Å; L498-W502 PolarHBondContact O-N 3.39Å; V500-W502 PolarHBondContact O-N 3.31Å; W502-H505 AromaticContact CZ3-ND1 3.92Å; W502-A506 VanDerWaalsContact O-CB 3.28Å; W502-A506 WeakPolarHBondContact O-CB 3.44Å; W502-A506 PolarHBondContact O-N 3.06Å; W502-K524 HydrophobicContact CD2-CB 4.21Å; W502-K524 HydrophobicContact CD2-CD 3.86Å; W502-K524 HydrophobicContact CE3-CB 4.33Å; W502-K524 HydrophobicContact CE3-CD 3.88Å; W502-K524 HydrophobicContact CH2-CD 3.48Å; W502-K524 VanDerWaalsContact CH2-CD 3.48Å; W502-K524 HydrophobicContact CZ2-CD 3.42Å; W502-K524 VanDerWaalsContact CZ2-CD 3.42Å; W502-K524 HydrophobicContact CZ3-CD 3.7Å; W502-V525 VanDerWaalsContact C-CG2 3.49Å; W502-V525 HydrophobicContact CB-CG2 3.58Å; W502-M528 HydrophobicContact CB-CE 3.89Å; W502-M528 HydrophobicContact CG-CE 3.71Å
503	L	94.1	Very high	90.3	Very high	21 Å²	21	49.3 Å²	49.3	11%	0.11	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-49.7	173.6	-178.4	69.1	0	0	0	110.6	A499 V500 V501 H505 A506 E507 Y522 V525 A535	A499-L503 WeakPolarHBondContact O-CB 3.42Å; A499-L503 PolarHBondContact O-N 3.43Å; V500-L503 WeakPolarHBondContact O-CB 3.43Å; V500-L503 PolarHBondContact O-N 3.02Å; V501-L503 VanDerWaalsContact C-N 3.3Å; V501-L503 PolarHBondContact O-N 3.19Å; L503-H505 VanDerWaalsContact C-N 3.34Å; L503-H505 PolarHBondContact O-N 3.05Å; L503-A506 PolarHBondContact O-N 3.07Å; L503-E507 WeakPolarHBondContact O-CG 3.35Å; L503-E507 PolarHBondContact O-N 3.5Å; L503-Y522 HydrophobicContact CD1-CD1 4.4Å; L503-Y522 HydrophobicContact CD1-CE1 3.92Å; L503-V525 HydrophobicContact CB-CG1 4.44Å; L503-V525 HydrophobicContact CB-CG2 4.21Å; L503-V525 HydrophobicContact CD1-CG1 4.44Å; L503-A535 HydrophobicContact CD1-CB 4.12Å
504	R	92.7	Very high	90.6	Very high	69 Å²	69	53 Å²	53	26%	0.26	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-41.2	176.1	-63.9	-44	-165.4	-179.7	10	112.7	L468 E472 L475 L487 V500 V501 E507 C508	L468-R504 HydrophobicContact CD1-CG 4.18Å; E472-R504 IonicContact OE1-CZ 3.81Å; E472-R504 VanDerWaalsContact OE1-CZ 3.24Å; E472-R504 IonicContact OE1-NE 3.77Å; E472-R504 PolarHBondContact OE1-NE 2.74Å; E472-R504 IonicContact OE1-NH2 2.89Å; E472-R504 PolarHBondContact OE1-NH2 3.29Å; E472-R504 IonicContact OE2-CZ 2.7Å; E472-R504 IonicContact OE2-NH2 3.79Å; E472-R504 PolarHBondContact OE2-NH2 2.89Å; L475-R504 HydrophobicContact CD1-CB 3.97Å; L475-R504 HydrophobicContact CD1-CG 4.28Å; L487-R504 HydrophobicContact CD1-CB 4.2Å; L487-R504 HydrophobicContact CD2-CB 3.75Å; V500-R504 PolarHBondContact O-N 3.02Å; V501-R504 PolarHBondContact O-N 3.13Å; R504-E507 VanDerWaalsContact CD-OE2 3.28Å; R504-E507 WeakPolarHBondContact CD-OE2 3.43Å; R504-E507 IonicContact CZ-OE2 3.17Å; R504-E507 IonicContact NE-OE2 2.78Å; R504-E507 IonicContact NH1-OE2 3.25Å; R504-E507 PolarHBondContact NH1-OE2 2.99Å; R504-E507 PolarHBondContact O-N 3.38Å; R504-C508 VanDerWaalsContact O-CB 3.27Å; R504-C508 WeakPolarHBondContact O-CB 3.48Å; R504-C508 PolarHBondContact O-N 3.18Å
505	H	94.1	Very high	91.2	Very high	20 Å²	20	46.4 Å²	46.4	9%	0.093	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-44.8	174.2	-173	-106.2	0	0	0	111.7	L487 V491 V501 W502 L503 C508 L509 S521	L487-H505 HydrophobicContact CB-CB 4.35Å; V491-H505 HydrophobicContact CG2-CB 4.09Å; V501-H505 WeakPolarHBondContact O-CB 3.31Å; V501-H505 PolarHBondContact O-N 3.28Å; W502-H505 AromaticContact CZ3-ND1 3.92Å; L503-H505 VanDerWaalsContact C-N 3.34Å; L503-H505 PolarHBondContact O-N 3.05Å; H505-C508 PolarHBondContact O-N 3.1Å; H505-L509 WeakPolarHBondContact CE1-CD1 3.45Å; H505-L509 WeakPolarHBondContact O-CG 3.33Å; H505-L509 PolarHBondContact O-N 3.09Å; H505-S521 PolarHBondContact ND1-OG 3.15Å
506	A	94.1	Very high	91.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.2	-40.1	177.6	0	0	0	0	0	113.1	W502 L503 K510 Y522	W502-A506 VanDerWaalsContact O-CB 3.28Å; W502-A506 WeakPolarHBondContact O-CB 3.44Å; W502-A506 PolarHBondContact O-N 3.06Å; L503-A506 PolarHBondContact O-N 3.07Å; A506-K510 WeakPolarHBondContact O-CB 3.33Å; A506-K510 PolarHBondContact O-N 3.43Å; A506-Y522 HydrophobicContact CB-CD1 3.57Å; A506-Y522 HydrophobicContact CB-CD2 3.7Å; A506-Y522 HydrophobicContact CB-CE1 3.59Å; A506-Y522 HydrophobicContact CB-CE2 3.69Å; A506-Y522 HydrophobicContact CB-CG 3.61Å
507	E	93.2	Very high	92.4	Very high	61 Å²	61	49.6 Å²	49.6	29%	0.285	26%	0.263	S	S	.	.	H	α-helix	trans	-61	-45.9	173.6	-73.7	174.1	165.3	0	0	111.3	L503 R504 K510 A511	L503-E507 WeakPolarHBondContact O-CG 3.35Å; L503-E507 PolarHBondContact O-N 3.5Å; R504-E507 VanDerWaalsContact CD-OE2 3.28Å; R504-E507 WeakPolarHBondContact CD-OE2 3.43Å; R504-E507 IonicContact CZ-OE2 3.17Å; R504-E507 IonicContact NE-OE2 2.78Å; R504-E507 IonicContact NH1-OE2 3.25Å; R504-E507 PolarHBondContact NH1-OE2 2.99Å; R504-E507 PolarHBondContact O-N 3.38Å; E507-K510 PolarHBondContact O-N 3.33Å; E507-A511 WeakPolarHBondContact O-CB 3.33Å; E507-A511 PolarHBondContact O-N 2.69Å
508	C	94.3	Very high	92.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-51.5	177.1	-169.1	0	0	0	0	112	L475 Y480 L487 R504 H505 K510 A511 L512	L475-C508 HydrophobicContact CD2-CB 3.93Å; Y480-C508 PolarHBondContact O-SG 3.47Å; L487-C508 HydrophobicContact CD1-CB 3.95Å; R504-C508 VanDerWaalsContact O-CB 3.27Å; R504-C508 WeakPolarHBondContact O-CB 3.48Å; R504-C508 PolarHBondContact O-N 3.18Å; H505-C508 PolarHBondContact O-N 3.1Å; C508-K510 VanDerWaalsContact C-N 3.34Å; C508-K510 PolarHBondContact O-N 2.88Å; C508-A511 PolarHBondContact O-N 3.46Å; C508-L512 WeakPolarHBondContact O-CG 3.27Å; C508-L512 PolarHBondContact O-N 2.89Å
509	L	93.9	Very high	93.1	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-37.8	177.6	-72.3	167.9	0	0	0	112.5	L484 H505 L512 G513 H514 E517 A518	L484-L509 HydrophobicContact CD1-CD2 3.77Å; L484-L509 HydrophobicContact CD1-CG 3.92Å; L484-L509 HydrophobicContact CD2-CD2 3.93Å; H505-L509 WeakPolarHBondContact CE1-CD1 3.45Å; H505-L509 WeakPolarHBondContact O-CG 3.33Å; H505-L509 PolarHBondContact O-N 3.09Å; L509-L512 PolarHBondContact O-N 3.39Å; L509-G513 PolarHBondContact O-N 3.15Å; L509-G513 VanDerWaalsContact O-N 3.13Å; L509-H514 HydrophobicContact CB-CB 4.12Å; L509-H514 HydrophobicContact CD2-CB 3.72Å; L509-H514 PolarHBondContact O-N 3.39Å; L509-E517 HydrophobicContact CD1-CB 3.81Å; L509-E517 HydrophobicContact CD2-CB 4.28Å; L509-A518 HydrophobicContact CB-CB 3.76Å
510	K	94.1	Very high	93.4	Very high	56 Å²	56	45.7 Å²	45.7	24%	0.243	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-43.8	175.2	-179.8	-179.1	-178.2	176.6	0	111.3	A506 E507 C508 G513 M515 A518 Y522 S538 T541 V542	A506-K510 WeakPolarHBondContact O-CB 3.33Å; A506-K510 PolarHBondContact O-N 3.43Å; E507-K510 PolarHBondContact O-N 3.33Å; C508-K510 VanDerWaalsContact C-N 3.34Å; C508-K510 PolarHBondContact O-N 2.88Å; K510-G513 PolarHBondContact O-N 3.12Å; K510-G513 VanDerWaalsContact O-N 3.15Å; K510-M515 HydrophobicContact CG-SD 4.39Å; K510-A518 HydrophobicContact CB-CB 4.16Å; K510-Y522 HydrophobicContact CB-CE2 4.31Å; K510-Y522 HydrophobicContact CD-CE2 3.94Å; K510-Y522 WeakPolarHBondContact CD-OH 3.48Å; K510-S538 PolarHBondContact NZ-OG 3.3Å; K510-T541 PolarHBondContact NZ-OG1 3.19Å; K510-V542 HydrophobicContact CD-CG2 3.86Å; K510-V542 HydrophobicContact CG-CG2 4.03Å
511	A	92.1	Very high	93.5	Very high	52 Å²	52	42 Å²	42	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-68.2	-35.6	177.8	0	0	0	0	0	112.9	Y480 E507 C508 G513	Y480-A511 HydrophobicContact CD1-CB 3.61Å; Y480-A511 HydrophobicContact CD2-CB 3.66Å; Y480-A511 HydrophobicContact CE1-CB 3.58Å; Y480-A511 HydrophobicContact CE2-CB 3.6Å; Y480-A511 HydrophobicContact CG-CB 3.68Å; E507-A511 WeakPolarHBondContact O-CB 3.33Å; E507-A511 PolarHBondContact O-N 2.69Å; C508-A511 PolarHBondContact O-N 3.46Å; A511-G513 PolarHBondContact O-N 2.94Å
512	L	92.9	Very high	93.6	Very high	54 Å²	54	42 Å²	42	28%	0.283	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.4	171.5	-68.6	168.5	0	0	0	113.7	T481 L484 C508 L509 H514	T481-L512 HydrophobicContact CG2-CD2 3.68Å; L484-L512 HydrophobicContact CB-CD1 4.23Å; L484-L512 HydrophobicContact CD2-CD1 3.8Å; C508-L512 WeakPolarHBondContact O-CG 3.27Å; C508-L512 PolarHBondContact O-N 2.89Å; L509-L512 PolarHBondContact O-N 3.39Å; L512-H514 VanDerWaalsContact C-N 3.34Å
513	G	91	Very high	93.6	Very high	45 Å²	45	43.4 Å²	43.4	46%	0.464	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	8.6	-177.7	0	0	0	0	0	115	L509 K510 A511 M515	L509-G513 PolarHBondContact O-N 3.15Å; L509-G513 VanDerWaalsContact O-N 3.13Å; K510-G513 PolarHBondContact O-N 3.12Å; K510-G513 VanDerWaalsContact O-N 3.15Å; A511-G513 PolarHBondContact O-N 2.94Å; G513-M515 PolarHBondContact O-N 3.42Å
514	H	94.1	Very high	93.6	Very high	88 Å²	88	46.3 Å²	46.3	41%	0.407	24%	0.236	S	C	.	.			trans	-75.9	54.9	176.3	-77.8	-117.5	0	0	0	111.8	L509 L512 K516 E517 A518	L509-H514 HydrophobicContact CB-CB 4.12Å; L509-H514 HydrophobicContact CD2-CB 3.72Å; L509-H514 PolarHBondContact O-N 3.39Å; L512-H514 VanDerWaalsContact C-N 3.34Å; H514-K516 PolarHBondContact O-N 2.87Å; H514-E517 IonicContact CE1-OE2 2.73Å; H514-E517 IonicContact CG-OE2 3.35Å; H514-E517 IonicContact ND1-OE1 2.77Å; H514-E517 IonicContact ND1-OE2 2.95Å; H514-E517 PolarHBondContact ND1-OE2 3.44Å; H514-E517 PolarHBondContact O-N 2.9Å; H514-A518 WeakPolarHBondContact O-CB 3.49Å; H514-A518 PolarHBondContact O-N 2.9Å
515	M	93.1	Very high	93.6	Very high	50 Å²	50	43 Å²	43	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-56.6	-27	-166.7	-65.5	-60	-176.1	0	0	115	K510 G513 A519 V542 Q545 L546	K510-M515 HydrophobicContact CG-SD 4.39Å; G513-M515 PolarHBondContact O-N 3.42Å; M515-A519 VanDerWaalsContact O-CB 3.31Å; M515-A519 WeakPolarHBondContact O-CB 3.25Å; M515-A519 PolarHBondContact O-N 3.37Å; M515-V542 HydrophobicContact CB-CG1 4.06Å; M515-V542 WeakPolarHBondContact O-CG1 3.38Å; M515-V542 HydrophobicContact SD-CG1 3.96Å; M515-V542 HydrophobicContact SD-CG2 4.23Å; M515-Q545 VanDerWaalsContact CE-OE1 3.28Å; M515-L546 HydrophobicContact CB-CD2 3.8Å; M515-L546 HydrophobicContact CB-CG 4.16Å
516	K	94.3	Very high	93.5	Very high	130 Å²	130	43.1 Å²	43.1	57%	0.565	23%	0.226	S	C	*	.	H	α-helix	trans	-72.6	-55	177.8	-64.7	177.7	-174.5	171.2	0	111.6	H514 A518 A519 E520 L546	H514-K516 PolarHBondContact O-N 2.87Å; K516-A518 VanDerWaalsContact C-N 3.27Å; K516-A518 PolarHBondContact O-N 3.4Å; K516-A519 WeakPolarHBondContact O-CB 3.4Å; K516-A519 PolarHBondContact O-N 2.79Å; K516-A519 VanDerWaalsContact O-N 3.11Å; K516-E520 PolarHBondContact O-N 3.41Å; K516-L546 HydrophobicContact CG-CD2 4.02Å
517	E	93.1	Very high	93.4	Very high	92 Å²	92	50.3 Å²	50.3	43%	0.43	26%	0.259	S	S	.	.	H	α-helix	trans	-64	-34.8	177.7	-65.7	136	-134.9	0	0	111	L509 H514 E520 S521	L509-E517 HydrophobicContact CD1-CB 3.81Å; L509-E517 HydrophobicContact CD2-CB 4.28Å; H514-E517 IonicContact CE1-OE2 2.73Å; H514-E517 IonicContact CG-OE2 3.35Å; H514-E517 IonicContact ND1-OE1 2.77Å; H514-E517 IonicContact ND1-OE2 2.95Å; H514-E517 PolarHBondContact ND1-OE2 3.44Å; H514-E517 PolarHBondContact O-N 2.9Å; E517-E520 PolarHBondContact O-N 2.69Å; E517-S521 WeakPolarHBondContact O-CB 3.49Å; E517-S521 PolarHBondContact O-N 3.45Å; E517-S521 PolarHBondContact O-OG 3.09Å
518	A	95	Very high	93.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-45.3	171	0	0	0	0	0	111.8	L509 K510 H514 K516 E520 S521 Y522	L509-A518 HydrophobicContact CB-CB 3.76Å; K510-A518 HydrophobicContact CB-CB 4.16Å; H514-A518 WeakPolarHBondContact O-CB 3.49Å; H514-A518 PolarHBondContact O-N 2.9Å; K516-A518 VanDerWaalsContact C-N 3.27Å; K516-A518 PolarHBondContact O-N 3.4Å; A518-E520 VanDerWaalsContact C-N 3.35Å; A518-E520 PolarHBondContact O-N 3.42Å; A518-S521 PolarHBondContact O-N 2.8Å; A518-Y522 WeakPolarHBondContact O-CB 3.41Å; A518-Y522 WeakPolarHBondContact O-CD2 3.27Å; A518-Y522 PolarHBondContact O-N 3.39Å
519	A	94	Very high	93.1	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-39.4	177.1	0	0	0	0	0	112.4	M515 K516 Y522 T523 L539 V542 L546	M515-A519 VanDerWaalsContact O-CB 3.31Å; M515-A519 WeakPolarHBondContact O-CB 3.25Å; M515-A519 PolarHBondContact O-N 3.37Å; K516-A519 WeakPolarHBondContact O-CB 3.4Å; K516-A519 PolarHBondContact O-N 2.79Å; K516-A519 VanDerWaalsContact O-N 3.11Å; A519-Y522 PolarHBondContact O-N 3.36Å; A519-T523 PolarHBondContact O-N 3.31Å; A519-T523 PolarHBondContact O-OG1 2.99Å; A519-T523 VanDerWaalsContact O-OG1 3.09Å; A519-L539 HydrophobicContact CB-CD1 4.46Å; A519-L539 WeakPolarHBondContact O-CD1 3.37Å; A519-V542 HydrophobicContact CB-CG1 3.91Å; A519-L546 HydrophobicContact CB-CD1 3.93Å
520	E	93.6	Very high	92.9	Very high	115 Å²	115	55 Å²	55	54%	0.537	29%	0.291	S	S	.	.	H	α-helix	trans	-67	-39.4	176.5	-72.8	164.4	-154.8	0	0	111.6	K516 E517 A518 T523 K524	K516-E520 PolarHBondContact O-N 3.41Å; E517-E520 PolarHBondContact O-N 2.69Å; A518-E520 VanDerWaalsContact C-N 3.35Å; A518-E520 PolarHBondContact O-N 3.42Å; E520-T523 VanDerWaalsContact C-OG1 3.31Å; E520-T523 VanDerWaalsContact CA-OG1 3.29Å; E520-T523 WeakPolarHBondContact CA-OG1 3.47Å; E520-T523 PolarHBondContact O-N 3.03Å; E520-T523 PolarHBondContact O-OG1 3.21Å; E520-K524 PolarHBondContact O-N 2.83Å
521	S	93.5	Very high	92.6	Very high	5 Å²	5	56.8 Å²	56.8	4%	0.035	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-48	172.3	-58.7	0	0	0	0	111.7	H505 E517 A518 T523 K524 V525	H505-S521 PolarHBondContact ND1-OG 3.15Å; E517-S521 WeakPolarHBondContact O-CB 3.49Å; E517-S521 PolarHBondContact O-N 3.45Å; E517-S521 PolarHBondContact O-OG 3.09Å; A518-S521 PolarHBondContact O-N 2.8Å; S521-T523 VanDerWaalsContact C-N 3.33Å; S521-T523 PolarHBondContact O-N 2.95Å; S521-K524 WeakPolarHBondContact O-CB 3.41Å; S521-K524 PolarHBondContact O-N 3.49Å; S521-V525 PolarHBondContact O-N 3.44Å; S521-V525 VanDerWaalsContact O-N 3.17Å
522	Y	95.2	Very high	92.5	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-63.4	-33	176.1	-79.2	-59.8	0	0	0	113	L503 A506 K510 A518 A519 V525 V526 V542	L503-Y522 HydrophobicContact CD1-CD1 4.4Å; L503-Y522 HydrophobicContact CD1-CE1 3.92Å; A506-Y522 HydrophobicContact CB-CD1 3.57Å; A506-Y522 HydrophobicContact CB-CD2 3.7Å; A506-Y522 HydrophobicContact CB-CE1 3.59Å; A506-Y522 HydrophobicContact CB-CE2 3.69Å; A506-Y522 HydrophobicContact CB-CG 3.61Å; K510-Y522 HydrophobicContact CB-CE2 4.31Å; K510-Y522 HydrophobicContact CD-CE2 3.94Å; K510-Y522 WeakPolarHBondContact CD-OH 3.48Å; A518-Y522 WeakPolarHBondContact O-CB 3.41Å; A518-Y522 WeakPolarHBondContact O-CD2 3.27Å; A518-Y522 PolarHBondContact O-N 3.39Å; A519-Y522 PolarHBondContact O-N 3.36Å; Y522-V525 PolarHBondContact O-N 3.02Å; Y522-V526 WeakPolarHBondContact O-CG2 3.3Å; Y522-V526 PolarHBondContact O-N 2.87Å; Y522-V526 VanDerWaalsContact O-N 3.09Å; Y522-V542 HydrophobicContact CD2-CG2 4.36Å; Y522-V542 HydrophobicContact CE2-CG2 4.13Å
523	T	93.8	Very high	92.4	Very high	45 Å²	45	55.3 Å²	55.3	28%	0.276	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-42.8	173	33.7	0	0	0	0	111.8	A519 E520 S521 V525 V526 E527 L539	A519-T523 PolarHBondContact O-N 3.31Å; A519-T523 PolarHBondContact O-OG1 2.99Å; A519-T523 VanDerWaalsContact O-OG1 3.09Å; E520-T523 VanDerWaalsContact C-OG1 3.31Å; E520-T523 VanDerWaalsContact CA-OG1 3.29Å; E520-T523 WeakPolarHBondContact CA-OG1 3.47Å; E520-T523 PolarHBondContact O-N 3.03Å; E520-T523 PolarHBondContact O-OG1 3.21Å; S521-T523 VanDerWaalsContact C-N 3.33Å; S521-T523 PolarHBondContact O-N 2.95Å; T523-V525 VanDerWaalsContact C-N 3.35Å; T523-V525 PolarHBondContact O-N 3.3Å; T523-V526 CarbonylContact O-C 3.54Å; T523-V526 PolarHBondContact O-N 3.13Å; T523-V526 VanDerWaalsContact O-N 3.1Å; T523-E527 WeakPolarHBondContact O-CG 3.34Å; T523-E527 PolarHBondContact O-N 3.47Å; T523-L539 HydrophobicContact CG2-CD1 3.96Å; T523-L539 HydrophobicContact CG2-CD2 3.88Å
524	K	92.8	Very high	92.3	Very high	83 Å²	83	59.6 Å²	59.6	36%	0.361	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-40	174.9	-75.3	-173.5	165.6	-157	0	113	W502 E520 S521 V526 E527 M528	W502-K524 HydrophobicContact CD2-CB 4.21Å; W502-K524 HydrophobicContact CD2-CD 3.86Å; W502-K524 HydrophobicContact CE3-CB 4.33Å; W502-K524 HydrophobicContact CE3-CD 3.88Å; W502-K524 HydrophobicContact CH2-CD 3.48Å; W502-K524 VanDerWaalsContact CH2-CD 3.48Å; W502-K524 HydrophobicContact CZ2-CD 3.42Å; W502-K524 VanDerWaalsContact CZ2-CD 3.42Å; W502-K524 HydrophobicContact CZ3-CD 3.7Å; E520-K524 PolarHBondContact O-N 2.83Å; S521-K524 WeakPolarHBondContact O-CB 3.41Å; S521-K524 PolarHBondContact O-N 3.49Å; K524-V526 VanDerWaalsContact C-N 3.28Å; K524-V526 PolarHBondContact O-N 3.33Å; K524-E527 PolarHBondContact O-N 3.02Å; K524-M528 HydrophobicContact CB-CE 4.18Å; K524-M528 VanDerWaalsContact O-CE 3.3Å; K524-M528 WeakPolarHBondContact O-CE 3.44Å; K524-M528 PolarHBondContact O-N 3.27Å
525	V	94.1	Very high	92.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.5	-42.2	173.4	-176.9	0	0	0	0	111	W502 L503 S521 Y522 T523 A529 A535	W502-V525 VanDerWaalsContact C-CG2 3.49Å; W502-V525 HydrophobicContact CB-CG2 3.58Å; L503-V525 HydrophobicContact CB-CG1 4.44Å; L503-V525 HydrophobicContact CB-CG2 4.21Å; L503-V525 HydrophobicContact CD1-CG1 4.44Å; S521-V525 PolarHBondContact O-N 3.44Å; S521-V525 VanDerWaalsContact O-N 3.17Å; Y522-V525 PolarHBondContact O-N 3.02Å; T523-V525 VanDerWaalsContact C-N 3.35Å; T523-V525 PolarHBondContact O-N 3.3Å; V525-A529 WeakPolarHBondContact O-CA 3.41Å; V525-A529 WeakPolarHBondContact O-CB 3.42Å; V525-A529 PolarHBondContact O-N 3.23Å; V525-A535 HydrophobicContact CB-CB 4.23Å; V525-A535 HydrophobicContact CG1-CB 3.53Å
526	V	92	Very high	92.3	Very high	22 Å²	22	54.8 Å²	54.8	13%	0.133	27%	0.269	C	S	.	.	H	α-helix	trans	-74.8	-26.7	179.7	177.1	0	0	0	0	112.8	Y522 T523 K524 P530 A535 R536 L539	Y522-V526 WeakPolarHBondContact O-CG2 3.3Å; Y522-V526 PolarHBondContact O-N 2.87Å; Y522-V526 VanDerWaalsContact O-N 3.09Å; T523-V526 CarbonylContact O-C 3.54Å; T523-V526 PolarHBondContact O-N 3.13Å; T523-V526 VanDerWaalsContact O-N 3.1Å; K524-V526 VanDerWaalsContact C-N 3.28Å; K524-V526 PolarHBondContact O-N 3.33Å; V526-P530 VanDerWaalsContact O-CA 3.25Å; V526-P530 WeakPolarHBondContact O-CA 3.3Å; V526-A535 HydrophobicContact CG2-CB 4.28Å; V526-R536 HydrophobicContact CB-CG 4.48Å; V526-R536 HydrophobicContact CG1-CG 3.9Å; V526-R536 HydrophobicContact CG2-CG 3.66Å; V526-L539 HydrophobicContact CB-CD2 4.46Å; V526-L539 HydrophobicContact CG2-CD2 4.01Å
527	E	91.6	Very high	92.2	Very high	151 Å²	151	49.9 Å²	49.9	71%	0.706	25%	0.249	S	C	*	.	H	α-helix	trans	-71.9	-43.6	172.6	-73.7	167.6	178.7	0	0	111.9	T523 K524	T523-E527 WeakPolarHBondContact O-CG 3.34Å; T523-E527 PolarHBondContact O-N 3.47Å; K524-E527 PolarHBondContact O-N 3.02Å
528	M	90.4	Very high	92.2	Very high	80 Å²	80	46.7 Å²	46.7	39%	0.394	24%	0.237	S	C	.	.	H	α-helix	trans	-75.3	-41.2	176.4	-68.9	-178.9	-80.3	0	0	113.4	A499 W502 K524	A499-M528 HydrophobicContact CB-CB 4.07Å; A499-M528 HydrophobicContact CB-CE 4.21Å; A499-M528 HydrophobicContact CB-SD 4.36Å; W502-M528 HydrophobicContact CB-CE 3.89Å; W502-M528 HydrophobicContact CG-CE 3.71Å; K524-M528 HydrophobicContact CB-CE 4.18Å; K524-M528 VanDerWaalsContact O-CE 3.3Å; K524-M528 WeakPolarHBondContact O-CE 3.44Å; K524-M528 PolarHBondContact O-N 3.27Å
529	A	90.9	Very high	92.1	Very high	26 Å²	26	47 Å²	47	22%	0.215	24%	0.239	C	C	.	.			trans	-128.9	68.2	-172	0	0	0	0	0	111.1	A499 V525 L531 H532	A499-A529 HydrophobicContact CB-CB 3.88Å; V525-A529 WeakPolarHBondContact O-CA 3.41Å; V525-A529 WeakPolarHBondContact O-CB 3.42Å; V525-A529 PolarHBondContact O-N 3.23Å; A529-L531 PolarHBondContact O-N 3.48Å; A529-L531 VanDerWaalsContact O-N 3.12Å; A529-H532 HydrophobicContact CB-CB 4.28Å; A529-H532 VanDerWaalsContact O-CB 3.24Å; A529-H532 WeakPolarHBondContact O-CB 3.25Å; A529-H532 PolarHBondContact O-N 2.86Å
530	P	88.6	Confident	92.1	Very high	56 Å²	56	47.2 Å²	47.2	36%	0.364	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-30.1	-174.1	20.7	-33.1	0	0	0	114.1	V526 H532 R536	V526-P530 VanDerWaalsContact O-CA 3.25Å; V526-P530 WeakPolarHBondContact O-CA 3.3Å; P530-H532 PolarHBondContact O-N 3.49Å; P530-R536 PolarHBondContact O-NE 3.09Å; P530-R536 PolarHBondContact O-NH1 3.49Å; P530-R536 PolarHBondContact O-NH2 2.9Å
531	L	89.2	Confident	92.1	Very high	94 Å²	94	43.8 Å²	43.8	49%	0.492	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	4.8	179.5	-56.7	-178.2	0	0	0	114.1	A529 L533 M559 Y560	A529-L531 PolarHBondContact O-N 3.48Å; A529-L531 VanDerWaalsContact O-N 3.12Å; L531-L533 PolarHBondContact O-N 3.31Å; L531-M559 VanDerWaalsContact CD2-O 3.24Å; L531-M559 WeakPolarHBondContact CD2-O 3.41Å; L531-Y560 HydrophobicContact CD1-CE1 4.34Å; L531-Y560 HydrophobicContact CD2-CD1 4.18Å; L531-Y560 HydrophobicContact CD2-CE1 3.81Å
532	H	90	Very high	92.1	Very high	59 Å²	59	43.5 Å²	43.5	27%	0.273	23%	0.226	S	C	.	.			trans	-81.9	94.5	-179.9	-162	-34.5	0	0	0	112.1	A529 P530 E534 A535 R536	A529-H532 HydrophobicContact CB-CB 4.28Å; A529-H532 VanDerWaalsContact O-CB 3.24Å; A529-H532 WeakPolarHBondContact O-CB 3.25Å; A529-H532 PolarHBondContact O-N 2.86Å; P530-H532 PolarHBondContact O-N 3.49Å; H532-E534 PolarHBondContact ND1-N 3.05Å; H532-E534 PolarHBondContact O-N 2.92Å; H532-A535 HydrophobicContact CB-CB 4.07Å; H532-A535 PolarHBondContact ND1-N 2.83Å; H532-A535 PolarHBondContact O-N 2.99Å; H532-R536 PolarHBondContact O-N 3.37Å
533	L	89.6	Confident	92	Very high	17 Å²	17	44 Å²	44	9%	0.089	23%	0.228	C	C	.	.	H	α-helix	trans	-51	-53.7	-179.8	178.1	63.8	0	0	0	113.1	L531 A535 R536 L537 M559 K574 K577 L578	L531-L533 PolarHBondContact O-N 3.31Å; L533-A535 VanDerWaalsContact C-N 3.35Å; L533-A535 PolarHBondContact O-N 3.13Å; L533-R536 WeakPolarHBondContact O-CB 3.42Å; L533-R536 PolarHBondContact O-N 3.26Å; L533-R536 VanDerWaalsContact O-N 3.1Å; L533-L537 HydrophobicContact CD1-CD1 3.98Å; L533-L537 HydrophobicContact CD1-CD2 4.18Å; L533-L537 HydrophobicContact CD1-CG 3.88Å; L533-L537 HydrophobicContact CD2-CD1 4.46Å; L533-L537 HydrophobicContact CG-CD1 3.96Å; L533-L537 HydrophobicContact CG-CG 4.18Å; L533-L537 WeakPolarHBondContact O-CG 3.48Å; L533-L537 PolarHBondContact O-N 3.34Å; L533-M559 HydrophobicContact CB-CE 4.15Å; L533-M559 HydrophobicContact CD1-CE 3.86Å; L533-M559 HydrophobicContact CD1-SD 4.23Å; L533-K574 HydrophobicContact CD2-CB 4.12Å; L533-K574 HydrophobicContact CD2-CG 4.12Å; L533-K577 HydrophobicContact CD2-CB 4.17Å; L533-K577 HydrophobicContact CD2-CD 3.87Å; L533-L578 HydrophobicContact CD1-CB 3.98Å; L533-L578 HydrophobicContact CD1-CD1 4.45Å
534	E	90.6	Very high	91.9	Very high	134 Å²	134	45.7 Å²	45.7	63%	0.626	23%	0.232	S	C	*	.	H	α-helix	trans	-69.6	-31.1	-169.9	-60.1	176.7	162.2	0	0	113.2	H532 S538	H532-E534 PolarHBondContact ND1-N 3.05Å; H532-E534 PolarHBondContact O-N 2.92Å; E534-S538 WeakPolarHBondContact O-CB 3.43Å; E534-S538 PolarHBondContact O-N 3.13Å; E534-S538 PolarHBondContact O-OG 2.89Å; E534-S538 VanDerWaalsContact O-OG 3.06Å
535	A	92.2	Very high	91.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-44.5	169	0	0	0	0	0	111.5	L503 V525 V526 H532 L533 S538 L539	L503-A535 HydrophobicContact CD1-CB 4.12Å; V525-A535 HydrophobicContact CB-CB 4.23Å; V525-A535 HydrophobicContact CG1-CB 3.53Å; V526-A535 HydrophobicContact CG2-CB 4.28Å; H532-A535 HydrophobicContact CB-CB 4.07Å; H532-A535 PolarHBondContact ND1-N 2.83Å; H532-A535 PolarHBondContact O-N 2.99Å; L533-A535 VanDerWaalsContact C-N 3.35Å; L533-A535 PolarHBondContact O-N 3.13Å; A535-S538 PolarHBondContact O-N 3.45Å; A535-L539 VanDerWaalsContact O-CB 3.28Å; A535-L539 WeakPolarHBondContact O-CB 3.34Å; A535-L539 PolarHBondContact O-N 3.07Å
536	R	93.2	Very high	91.8	Very high	37 Å²	37	50 Å²	50	14%	0.14	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-45.6	175.4	-79.2	-174.3	169.2	177.7	-0.5	112.9	V526 P530 H532 L533 L539 A540 A555 M559 L578	V526-R536 HydrophobicContact CB-CG 4.48Å; V526-R536 HydrophobicContact CG1-CG 3.9Å; V526-R536 HydrophobicContact CG2-CG 3.66Å; P530-R536 PolarHBondContact O-NE 3.09Å; P530-R536 PolarHBondContact O-NH1 3.49Å; P530-R536 PolarHBondContact O-NH2 2.9Å; H532-R536 PolarHBondContact O-N 3.37Å; L533-R536 WeakPolarHBondContact O-CB 3.42Å; L533-R536 PolarHBondContact O-N 3.26Å; L533-R536 VanDerWaalsContact O-N 3.1Å; R536-L539 PolarHBondContact O-N 2.88Å; R536-A540 WeakPolarHBondContact O-CB 3.44Å; R536-A540 PolarHBondContact O-N 2.65Å; R536-A555 WeakPolarHBondContact CB-O 3.46Å; R536-M559 VanDerWaalsContact NH1-CG 3.29Å; R536-L578 HydrophobicContact CB-CD1 4.47Å
537	L	93.1	Very high	91.6	Very high	28 Å²	28	51.3 Å²	51.3	15%	0.147	27%	0.273	C	S	.	.	H	α-helix	trans	-62.7	-44	175	-63.2	-175.6	0	0	0	111	L533 A540 T541 L556 H581	L533-L537 HydrophobicContact CD1-CD1 3.98Å; L533-L537 HydrophobicContact CD1-CD2 4.18Å; L533-L537 HydrophobicContact CD1-CG 3.88Å; L533-L537 HydrophobicContact CD2-CD1 4.46Å; L533-L537 HydrophobicContact CG-CD1 3.96Å; L533-L537 HydrophobicContact CG-CG 4.18Å; L533-L537 WeakPolarHBondContact O-CG 3.48Å; L533-L537 PolarHBondContact O-N 3.34Å; L537-A540 PolarHBondContact O-N 3.11Å; L537-T541 WeakPolarHBondContact O-CG2 3.31Å; L537-T541 PolarHBondContact O-N 3.25Å; L537-L556 HydrophobicContact CD2-CD2 3.71Å; L537-H581 HydrophobicContact CD2-CB 4.01Å
538	S	92.6	Very high	91.6	Very high	24 Å²	24	49.3 Å²	49.3	17%	0.168	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-46.4	176.3	-75.4	0	0	0	0	112.4	K510 E534 A535 A540 T541 V542	K510-S538 PolarHBondContact NZ-OG 3.3Å; E534-S538 WeakPolarHBondContact O-CB 3.43Å; E534-S538 PolarHBondContact O-N 3.13Å; E534-S538 PolarHBondContact O-OG 2.89Å; E534-S538 VanDerWaalsContact O-OG 3.06Å; A535-S538 PolarHBondContact O-N 3.45Å; S538-A540 VanDerWaalsContact C-N 3.31Å; S538-A540 PolarHBondContact O-N 3.02Å; S538-T541 PolarHBondContact O-N 3.17Å; S538-T541 PolarHBondContact O-OG1 3.05Å; S538-V542 WeakPolarHBondContact O-CG2 3.47Å; S538-V542 PolarHBondContact O-N 3.05Å
539	L	93.9	Very high	91.4	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-54.6	-47.2	173.7	-179.9	56	0	0	0	111.2	A519 T523 V526 A535 R536 T541 V542 Q543 A555	A519-L539 HydrophobicContact CB-CD1 4.46Å; A519-L539 WeakPolarHBondContact O-CD1 3.37Å; T523-L539 HydrophobicContact CG2-CD1 3.96Å; T523-L539 HydrophobicContact CG2-CD2 3.88Å; V526-L539 HydrophobicContact CB-CD2 4.46Å; V526-L539 HydrophobicContact CG2-CD2 4.01Å; A535-L539 VanDerWaalsContact O-CB 3.28Å; A535-L539 WeakPolarHBondContact O-CB 3.34Å; A535-L539 PolarHBondContact O-N 3.07Å; R536-L539 PolarHBondContact O-N 2.88Å; L539-T541 PolarHBondContact O-N 2.87Å; L539-V542 PolarHBondContact O-N 3.14Å; L539-Q543 HydrophobicContact CD1-CG 3.8Å; L539-Q543 HydrophobicContact CG-CG 4.28Å; L539-Q543 WeakPolarHBondContact O-CB 3.41Å; L539-Q543 WeakPolarHBondContact O-CG 3.31Å; L539-Q543 PolarHBondContact O-N 3.33Å; L539-A555 HydrophobicContact CB-CB 4.21Å; L539-A555 HydrophobicContact CD2-CB 3.75Å; L539-A555 HydrophobicContact CG-CB 3.82Å
540	A	93.5	Very high	91.2	Very high	5 Å²	5	51.9 Å²	51.9	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-44.9	178.2	0	0	0	0	0	112.2	R536 L537 S538 V542 Q543 Q544 A552 A555 L556	R536-A540 WeakPolarHBondContact O-CB 3.44Å; R536-A540 PolarHBondContact O-N 2.65Å; L537-A540 PolarHBondContact O-N 3.11Å; S538-A540 VanDerWaalsContact C-N 3.31Å; S538-A540 PolarHBondContact O-N 3.02Å; A540-V542 PolarHBondContact O-N 3.2Å; A540-Q543 PolarHBondContact O-N 3.46Å; A540-Q544 VanDerWaalsContact O-CB 3.27Å; A540-Q544 WeakPolarHBondContact O-CB 3.42Å; A540-Q544 PolarHBondContact O-N 3.19Å; A540-A552 HydrophobicContact CB-CB 4.44Å; A540-A552 WeakPolarHBondContact O-CB 3.48Å; A540-A555 HydrophobicContact CB-CB 4.22Å; A540-L556 HydrophobicContact CB-CD1 3.77Å; A540-L556 HydrophobicContact CB-CD2 3.79Å; A540-L556 HydrophobicContact CB-CG 3.62Å
541	T	92.7	Very high	91.2	Very high	42 Å²	42	52 Å²	52	26%	0.258	27%	0.272	S	S	.	.	H	α-helix	trans	-62.6	-41.3	176.8	59.8	0	0	0	0	112.8	K510 L537 S538 L539 Q544 Q545	K510-T541 PolarHBondContact NZ-OG1 3.19Å; L537-T541 WeakPolarHBondContact O-CG2 3.31Å; L537-T541 PolarHBondContact O-N 3.25Å; S538-T541 PolarHBondContact O-N 3.17Å; S538-T541 PolarHBondContact O-OG1 3.05Å; L539-T541 PolarHBondContact O-N 2.87Å; T541-Q544 PolarHBondContact O-N 2.75Å; T541-Q545 VanDerWaalsContact O-CG 3.28Å; T541-Q545 WeakPolarHBondContact O-CG 3.44Å; T541-Q545 PolarHBondContact O-N 3.27Å
542	V	94	Very high	91.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-70.5	-42	179	176.9	0	0	0	0	110.9	K510 M515 A519 Y522 S538 L539 A540 Q544 Q545 L546	K510-V542 HydrophobicContact CD-CG2 3.86Å; K510-V542 HydrophobicContact CG-CG2 4.03Å; M515-V542 HydrophobicContact CB-CG1 4.06Å; M515-V542 WeakPolarHBondContact O-CG1 3.38Å; M515-V542 HydrophobicContact SD-CG1 3.96Å; M515-V542 HydrophobicContact SD-CG2 4.23Å; A519-V542 HydrophobicContact CB-CG1 3.91Å; Y522-V542 HydrophobicContact CD2-CG2 4.36Å; Y522-V542 HydrophobicContact CE2-CG2 4.13Å; S538-V542 WeakPolarHBondContact O-CG2 3.47Å; S538-V542 PolarHBondContact O-N 3.05Å; L539-V542 PolarHBondContact O-N 3.14Å; A540-V542 PolarHBondContact O-N 3.2Å; V542-Q544 VanDerWaalsContact C-N 3.32Å; V542-Q544 PolarHBondContact O-N 2.79Å; V542-Q545 PolarHBondContact O-N 3.05Å; V542-L546 HydrophobicContact CG1-CD1 4.36Å; V542-L546 WeakPolarHBondContact O-CG 3.24Å; V542-L546 PolarHBondContact O-N 2.86Å
543	Q	93.2	Very high	91.2	Very high	14 Å²	14	45.4 Å²	45.4	7%	0.065	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-35.5	175.3	-65.2	-75.6	10.5	0	0	111.7	L539 A540 L546 G547 R548 C551 A552	L539-Q543 HydrophobicContact CD1-CG 3.8Å; L539-Q543 HydrophobicContact CG-CG 4.28Å; L539-Q543 WeakPolarHBondContact O-CB 3.41Å; L539-Q543 WeakPolarHBondContact O-CG 3.31Å; L539-Q543 PolarHBondContact O-N 3.33Å; A540-Q543 PolarHBondContact O-N 3.46Å; Q543-L546 CarbonylContact O-C 3.53Å; Q543-L546 PolarHBondContact O-N 3.06Å; Q543-G547 PolarHBondContact O-N 3.32Å; Q543-R548 HydrophobicContact CB-CB 4.42Å; Q543-R548 PolarHBondContact O-N 2.84Å; Q543-C551 HydrophobicContact CB-CB 4.3Å; Q543-C551 HydrophobicContact CG-CB 4.16Å; Q543-A552 HydrophobicContact CB-CB 3.92Å
544	Q	92.1	Very high	91.1	Very high	79 Å²	79	51.4 Å²	51.4	37%	0.369	26%	0.264	S	S	.	.	H	α-helix	trans	-63.5	-44.3	172.1	-173.6	-175.1	13.2	0	0	111.5	A540 T541 V542 L546 G547 M549 L585	A540-Q544 VanDerWaalsContact O-CB 3.27Å; A540-Q544 WeakPolarHBondContact O-CB 3.42Å; A540-Q544 PolarHBondContact O-N 3.19Å; T541-Q544 PolarHBondContact O-N 2.75Å; V542-Q544 VanDerWaalsContact C-N 3.32Å; V542-Q544 PolarHBondContact O-N 2.79Å; Q544-L546 VanDerWaalsContact C-N 3.31Å; Q544-L546 PolarHBondContact O-N 3.44Å; Q544-G547 PolarHBondContact O-N 2.87Å; Q544-M549 HydrophobicContact CG-CE 3.94Å; Q544-M549 HydrophobicContact CG-SD 4.02Å; Q544-L585 HydrophobicContact CG-CD1 4.13Å
545	Q	91.7	Very high	91	Very high	125 Å²	125	45.4 Å²	45.4	58%	0.584	24%	0.237	S	C	*	.	H	α-helix	trans	-64.2	-32.6	174.8	-73.2	169.5	-16.8	0	0	112.7	M515 T541 V542 G547	M515-Q545 VanDerWaalsContact CE-OE1 3.28Å; T541-Q545 VanDerWaalsContact O-CG 3.28Å; T541-Q545 WeakPolarHBondContact O-CG 3.44Å; T541-Q545 PolarHBondContact O-N 3.27Å; V542-Q545 PolarHBondContact O-N 3.05Å; Q545-G547 PolarHBondContact O-N 2.81Å
546	L	92.3	Very high	90.8	Very high	50 Å²	50	45.5 Å²	45.5	26%	0.262	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-1.5	170.5	-69.7	174.1	0	0	0	114	M515 K516 A519 V542 Q543 Q544 R548	M515-L546 HydrophobicContact CB-CD2 3.8Å; M515-L546 HydrophobicContact CB-CG 4.16Å; K516-L546 HydrophobicContact CG-CD2 4.02Å; A519-L546 HydrophobicContact CB-CD1 3.93Å; V542-L546 HydrophobicContact CG1-CD1 4.36Å; V542-L546 WeakPolarHBondContact O-CG 3.24Å; V542-L546 PolarHBondContact O-N 2.86Å; Q543-L546 CarbonylContact O-C 3.53Å; Q543-L546 PolarHBondContact O-N 3.06Å; Q544-L546 VanDerWaalsContact C-N 3.31Å; Q544-L546 PolarHBondContact O-N 3.44Å; L546-R548 HydrophobicContact CB-CG 4.18Å; L546-R548 PolarHBondContact O-N 3.22Å
547	G	88.9	Confident	90.5	Very high	49 Å²	49	48.7 Å²	48.7	51%	0.505	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	5.4	-175.5	0	0	0	0	0	114.9	Q543 Q544 Q545 M549	Q543-G547 PolarHBondContact O-N 3.32Å; Q544-G547 PolarHBondContact O-N 2.87Å; Q545-G547 PolarHBondContact O-N 2.81Å; G547-M549 VanDerWaalsContact C-N 3.26Å; G547-M549 PolarHBondContact O-N 3.13Å
548	R	91.1	Very high	90.1	Very high	108 Å²	108	50.9 Å²	50.9	41%	0.408	27%	0.272	S	S	.	.			trans	-85.5	63.2	-176	-67.7	172.4	170.2	177.9	-5	110.9	Q543 L546 D550 C551 A552	Q543-R548 HydrophobicContact CB-CB 4.42Å; Q543-R548 PolarHBondContact O-N 2.84Å; L546-R548 HydrophobicContact CB-CG 4.18Å; L546-R548 PolarHBondContact O-N 3.22Å; R548-D550 PolarHBondContact O-N 3.33Å; R548-C551 HydrophobicContact CB-CB 4.06Å; R548-C551 WeakPolarHBondContact O-CB 3.02Å; R548-C551 PolarHBondContact O-N 3.34Å; R548-A552 PolarHBondContact O-N 2.97Å
549	M	86.7	Confident	89.6	Confident	61 Å²	61	50.4 Å²	50.4	30%	0.3	27%	0.267	S	S	.	.	H	α-helix	trans	-56.7	-39.8	-169.2	-66.7	-58.2	168.9	0	0	114.6	Q544 G547 A552 L553 L585	Q544-M549 HydrophobicContact CG-CE 3.94Å; Q544-M549 HydrophobicContact CG-SD 4.02Å; G547-M549 VanDerWaalsContact C-N 3.26Å; G547-M549 PolarHBondContact O-N 3.13Å; M549-A552 PolarHBondContact O-N 3.32Å; M549-L553 WeakPolarHBondContact O-CG 3.29Å; M549-L553 PolarHBondContact O-N 3.5Å; M549-L585 HydrophobicContact SD-CD1 3.92Å
550	D	87.1	Confident	89.1	Confident	100 Å²	100	51.8 Å²	51.8	54%	0.535	27%	0.272	S	S	.	.	H	α-helix	trans	-75.4	-25.3	178.8	-53.3	-60.8	0	0	0	112.7	R548 K554 K591	R548-D550 PolarHBondContact O-N 3.33Å; D550-K554 WeakPolarHBondContact O-CG 3.21Å; D550-K554 PolarHBondContact O-N 3.49Å; D550-K554 VanDerWaalsContact O-N 3.15Å; D550-K591 IonicContact OD1-NZ 2.66Å; D550-K591 PolarHBondContact OD1-NZ 3.37Å
551	C	87.8	Confident	88.5	Confident	59 Å²	59	57.5 Å²	57.5	40%	0.399	30%	0.302	S	S	.	.	H	α-helix	trans	-70.8	-38.1	169.9	-62.5	0	0	0	0	111.4	Q543 R548 L553 K554 A555	Q543-C551 HydrophobicContact CB-CB 4.3Å; Q543-C551 HydrophobicContact CG-CB 4.16Å; R548-C551 HydrophobicContact CB-CB 4.06Å; R548-C551 WeakPolarHBondContact O-CB 3.02Å; R548-C551 PolarHBondContact O-N 3.34Å; C551-L553 VanDerWaalsContact C-N 3.34Å; C551-K554 PolarHBondContact O-N 3.26Å; C551-A555 PolarHBondContact O-N 2.94Å; C551-A555 VanDerWaalsContact O-N 3.11Å
552	A	90.2	Very high	87.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-37.9	173.4	0	0	0	0	0	112	A540 Q543 R548 M549 A555 L556 L585	A540-A552 HydrophobicContact CB-CB 4.44Å; A540-A552 WeakPolarHBondContact O-CB 3.48Å; Q543-A552 HydrophobicContact CB-CB 3.92Å; R548-A552 PolarHBondContact O-N 2.97Å; M549-A552 PolarHBondContact O-N 3.32Å; A552-A555 PolarHBondContact O-N 3.38Å; A552-L556 WeakPolarHBondContact O-CG 3.49Å; A552-L556 PolarHBondContact O-N 2.98Å; A552-L585 HydrophobicContact CB-CD2 3.73Å
553	L	88.4	Confident	86.5	Confident	14 Å²	14	66 Å²	66	7%	0.073	35%	0.353	C	S	.	.	H	α-helix	trans	-67.9	-33.5	174.8	-71.4	172.4	0	0	0	113.5	M549 C551 L556 R582 L585 L586 K591	M549-L553 WeakPolarHBondContact O-CG 3.29Å; M549-L553 PolarHBondContact O-N 3.5Å; C551-L553 VanDerWaalsContact C-N 3.34Å; L553-L556 CarbonylContact O-C 3.37Å; L553-L556 PolarHBondContact O-N 3.5Å; L553-R582 HydrophobicContact CD2-CG 4.29Å; L553-R582 PolarHBondContact O-NH1 3.27Å; L553-L585 HydrophobicContact CD2-CD2 3.8Å; L553-L585 HydrophobicContact CD2-CG 4.09Å; L553-L585 HydrophobicContact CG-CD2 4.07Å; L553-L586 HydrophobicContact CD1-CD2 3.73Å; L553-L586 HydrophobicContact CD2-CD1 4.42Å; L553-L586 HydrophobicContact CD2-CD2 3.53Å; L553-L586 HydrophobicContact CD2-CG 3.68Å; L553-L586 HydrophobicContact CG-CD2 4.31Å; L553-K591 HydrophobicContact CD1-CD 4.47Å
554	K	88.2	Confident	85.8	Confident	143 Å²	143	67.4 Å²	67.4	62%	0.622	36%	0.363	S	S	*	.	H	α-helix	trans	-67.5	-38.8	173	-73.9	177.4	176.9	-170.1	0	112.9	D550 C551 L556 E557	D550-K554 WeakPolarHBondContact O-CG 3.21Å; D550-K554 PolarHBondContact O-N 3.49Å; D550-K554 VanDerWaalsContact O-N 3.15Å; C551-K554 PolarHBondContact O-N 3.26Å; K554-L556 PolarHBondContact O-N 3.1Å; K554-E557 PolarHBondContact O-N 3.05Å
555	A	87.8	Confident	85	Confident	7 Å²	7	65.2 Å²	65.2	6%	0.058	35%	0.353	C	S	.	.	H	α-helix	trans	-64.3	-17.4	173.7	0	0	0	0	0	113.3	R536 L539 A540 C551 A552	R536-A555 WeakPolarHBondContact CB-O 3.46Å; L539-A555 HydrophobicContact CB-CB 4.21Å; L539-A555 HydrophobicContact CD2-CB 3.75Å; L539-A555 HydrophobicContact CG-CB 3.82Å; A540-A555 HydrophobicContact CB-CB 4.22Å; C551-A555 PolarHBondContact O-N 2.94Å; C551-A555 VanDerWaalsContact O-N 3.11Å; A552-A555 PolarHBondContact O-N 3.38Å
556	L	88.8	Confident	84.1	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.016	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	31.7	179.2	-59.8	173.3	0	0	0	112.4	L537 A540 A552 L553 K554 L578 H581 R582 L585	L537-L556 HydrophobicContact CD2-CD2 3.71Å; A540-L556 HydrophobicContact CB-CD1 3.77Å; A540-L556 HydrophobicContact CB-CD2 3.79Å; A540-L556 HydrophobicContact CB-CG 3.62Å; A552-L556 WeakPolarHBondContact O-CG 3.49Å; A552-L556 PolarHBondContact O-N 2.98Å; L553-L556 CarbonylContact O-C 3.37Å; L553-L556 PolarHBondContact O-N 3.5Å; K554-L556 PolarHBondContact O-N 3.1Å; L556-L578 HydrophobicContact CB-CG 4.36Å; L556-L578 HydrophobicContact CD2-CD1 4.15Å; L556-L578 HydrophobicContact CD2-CG 4.01Å; L556-L578 WeakPolarHBondContact O-CD2 3.09Å; L556-H581 HydrophobicContact CD1-CB 4.16Å; L556-H581 HydrophobicContact CD2-CB 4.21Å; L556-R582 VanDerWaalsContact C-NH1 3.32Å; L556-R582 HydrophobicContact CB-CB 4.12Å; L556-R582 HydrophobicContact CB-CG 4.24Å; L556-R582 HydrophobicContact CD1-CB 4.47Å; L556-R582 WeakPolarHBondContact O-CD 3.46Å; L556-R582 PolarHBondContact O-NH1 2.95Å; L556-L585 HydrophobicContact CD1-CD2 4.11Å
557	E	87.1	Confident	83.2	Confident	103 Å²	103	65.6 Å²	65.6	48%	0.481	36%	0.359	S	S	.	.	S	Bend	trans	-81.7	158.3	168.5	-73.6	172.4	-168.2	0	0	111.6	K554 M559	K554-E557 PolarHBondContact O-N 3.05Å; E557-M559 PolarHBondContact O-N 3.04Å
558	S	84.4	Confident	82.7	Confident	74 Å²	74	67.2 Å²	67.2	52%	0.517	36%	0.356	S	S	.	.			trans	-52.4	135	-173.7	-170.5	0	0	0	0	111.7	Y560 E575	S558-Y560 PolarHBondContact OG-O 3.34Å; S558-E575 WeakPolarHBondContact CA-OE1 3.21Å
559	M	81.1	Confident	82.1	Confident	15 Å²	15	63.7 Å²	63.7	7%	0.074	35%	0.349	C	S	.	.			trans	-89.8	-19.5	-177.7	-46.3	-152.4	-70.5	0	0	113.3	L531 L533 R536 E557 K574 E575 L578	L531-M559 VanDerWaalsContact CD2-O 3.24Å; L531-M559 WeakPolarHBondContact CD2-O 3.41Å; L533-M559 HydrophobicContact CB-CE 4.15Å; L533-M559 HydrophobicContact CD1-CE 3.86Å; L533-M559 HydrophobicContact CD1-SD 4.23Å; R536-M559 VanDerWaalsContact NH1-CG 3.29Å; E557-M559 PolarHBondContact O-N 3.04Å; M559-K574 HydrophobicContact CE-CB 3.66Å; M559-E575 WeakPolarHBondContact CB-OE2 3.44Å; M559-E575 WeakPolarHBondContact CG-OE2 3.32Å; M559-E575 PolarHBondContact N-OE2 3.09Å; M559-L578 HydrophobicContact CG-CD1 3.75Å; M559-L578 HydrophobicContact SD-CD1 3.75Å
560	Y	83.4	Confident	81.9	Confident	36 Å²	36	64.1 Å²	64.1	14%	0.141	36%	0.357	C	S	.	.	S	Bend	trans	-137.4	156.9	-169.3	-60.6	-73.5	0	0	0	111.7	L531 S558 T564 L565 A571 K574 E575	L531-Y560 HydrophobicContact CD1-CE1 4.34Å; L531-Y560 HydrophobicContact CD2-CD1 4.18Å; L531-Y560 HydrophobicContact CD2-CE1 3.81Å; S558-Y560 PolarHBondContact OG-O 3.34Å; Y560-T564 HydrophobicContact CD1-CG2 3.93Å; Y560-T564 HydrophobicContact CG-CG2 4.46Å; Y560-L565 HydrophobicContact CD2-CD2 3.93Å; Y560-L565 HydrophobicContact CG-CD2 4.22Å; Y560-A571 HydrophobicContact CD1-CB 4.06Å; Y560-A571 HydrophobicContact CD2-CB 3.8Å; Y560-A571 HydrophobicContact CE1-CB 3.91Å; Y560-A571 HydrophobicContact CE2-CB 3.63Å; Y560-A571 HydrophobicContact CG-CB 4Å; Y560-K574 HydrophobicContact CE2-CB 4.35Å; Y560-K574 WeakPolarHBondContact OH-CD 3.39Å; Y560-E575 HydrophobicContact CD2-CB 4.45Å
561	D	80.8	Confident	81.7	Confident	126 Å²	126	59.4 Å²	59.4	67%	0.674	33%	0.333	S	S	*	.			trans	-76.8	156.8	168.8	-68.8	-49.6	0	0	0	111.5	D563 T564 L565	D561-D563 PolarHBondContact O-N 2.98Å; D561-D563 VanDerWaalsContact O-N 3.12Å; D561-T564 PolarHBondContact O-N 3.17Å; D561-L565 WeakPolarHBondContact O-CG 3.45Å; D561-L565 PolarHBondContact O-N 3.15Å; D561-L565 VanDerWaalsContact O-N 3.1Å
562	S	73.3	Confident	81.4	Confident	97 Å²	97	56.9 Å²	56.9	68%	0.678	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.6	-175.2	-172.4	0	0	0	0	114.3	A566	S562-A566 PolarHBondContact O-N 3.28Å
563	D	72.9	Confident	81.2	Confident	122 Å²	122	59.6 Å²	59.6	65%	0.652	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-41.1	179.4	-66.3	-32.6	0	0	0	111.4	D561 L565 A566 Q567	D561-D563 PolarHBondContact O-N 2.98Å; D561-D563 VanDerWaalsContact O-N 3.12Å; D563-L565 VanDerWaalsContact C-N 3.32Å; D563-L565 PolarHBondContact O-N 2.69Å; D563-A566 WeakPolarHBondContact O-CB 3.42Å; D563-A566 PolarHBondContact O-N 3.4Å; D563-A566 VanDerWaalsContact O-N 3.11Å; D563-Q567 PolarHBondContact O-N 3.45Å
564	T	78.4	Confident	81.1	Confident	45 Å²	45	62.8 Å²	62.8	28%	0.276	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-44.3	172.2	-49.4	0	0	0	0	110.6	Y560 D561 A566 Q567 D568 A571	Y560-T564 HydrophobicContact CD1-CG2 3.93Å; Y560-T564 HydrophobicContact CG-CG2 4.46Å; D561-T564 PolarHBondContact O-N 3.17Å; T564-A566 PolarHBondContact O-N 2.98Å; T564-Q567 PolarHBondContact O-N 3.29Å; T564-D568 HydrophobicContact CG2-CB 4.43Å; T564-D568 PolarHBondContact O-N 3.1Å; T564-A571 HydrophobicContact CG2-CB 4.25Å
565	L	75.6	Confident	81.1	Confident	32 Å²	32	56.1 Å²	56.1	17%	0.168	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-21.5	176.4	-67.6	172.9	0	0	0	114	Y560 D561 D563 A571 E575 M605	Y560-L565 HydrophobicContact CD2-CD2 3.93Å; Y560-L565 HydrophobicContact CG-CD2 4.22Å; D561-L565 WeakPolarHBondContact O-CG 3.45Å; D561-L565 PolarHBondContact O-N 3.15Å; D561-L565 VanDerWaalsContact O-N 3.1Å; D563-L565 VanDerWaalsContact C-N 3.32Å; D563-L565 PolarHBondContact O-N 2.69Å; L565-A571 HydrophobicContact CD2-CB 4.47Å; L565-E575 HydrophobicContact CD1-CG 4.18Å; L565-E575 HydrophobicContact CD2-CB 3.65Å; L565-E575 HydrophobicContact CD2-CG 3.86Å; L565-M605 HydrophobicContact CD2-CE 4.38Å
566	A	71.1	Confident	81.1	Confident	31 Å²	31	56 Å²	56	26%	0.256	31%	0.311	S	S	.	.	H	α-helix	trans	-83	-30.5	176.4	0	0	0	0	0	113	S562 D563 T564 K654	S562-A566 PolarHBondContact O-N 3.28Å; D563-A566 WeakPolarHBondContact O-CB 3.42Å; D563-A566 PolarHBondContact O-N 3.4Å; D563-A566 VanDerWaalsContact O-N 3.11Å; T564-A566 PolarHBondContact O-N 2.98Å; A566-K654 PolarHBondContact O-NZ 3.05Å; A566-K654 VanDerWaalsContact O-NZ 3.14Å
567	Q	74.2	Confident	81.1	Confident	152 Å²	152	60.4 Å²	60.4	71%	0.71	33%	0.33	S	S	*	.	H	α-helix	trans	-94.1	-52.5	-175.8	-62.3	178.5	21.3	0	0	111.7	D563 T564 S569	D563-Q567 PolarHBondContact O-N 3.45Å; T564-Q567 PolarHBondContact O-N 3.29Å; Q567-S569 PolarHBondContact O-N 3.08Å
568	D	78.6	Confident	81.3	Confident	83 Å²	83	55.5 Å²	55.5	44%	0.444	31%	0.307	S	S	.	.			trans	-88.7	104.3	-172.9	-77.2	-42.2	0	0	0	112.7	T564 S570 A571 A572	T564-D568 HydrophobicContact CG2-CB 4.43Å; T564-D568 PolarHBondContact O-N 3.1Å; D568-S570 VanDerWaalsContact C-N 3.26Å; D568-S570 PolarHBondContact O-N 2.85Å; D568-A571 HydrophobicContact CB-CB 3.65Å; D568-A571 WeakPolarHBondContact O-CB 3.06Å; D568-A571 PolarHBondContact O-N 3.25Å; D568-A571 VanDerWaalsContact O-N 3.14Å; D568-A572 PolarHBondContact O-N 3.3Å
569	S	78.2	Confident	81.5	Confident	35 Å²	35	52.7 Å²	52.7	25%	0.245	29%	0.286	C	S	.	.	H	α-helix	trans	-53.8	-42.1	171.8	168.5	0	0	0	0	112.5	Q567 A571 A572 Q573 C653	Q567-S569 PolarHBondContact O-N 3.08Å; S569-A571 VanDerWaalsContact C-N 3.31Å; S569-A571 PolarHBondContact O-N 2.83Å; S569-A572 PolarHBondContact O-N 2.93Å; S569-Q573 WeakPolarHBondContact O-CB 3.41Å; S569-Q573 VanDerWaalsContact O-CG 3.27Å; S569-Q573 WeakPolarHBondContact O-CG 3.26Å; S569-Q573 PolarHBondContact O-N 3.35Å; S569-Q573 PolarHBondContact OG-NE2 3.3Å; S569-C653 PolarHBondContact OG-O 3.11Å
570	S	81.9	Confident	82	Confident	69 Å²	69	54.2 Å²	54.2	48%	0.483	29%	0.294	S	S	.	.	H	α-helix	trans	-67.9	-30	-179.2	69.1	0	0	0	0	113	D568 K574	D568-S570 VanDerWaalsContact C-N 3.26Å; D568-S570 PolarHBondContact O-N 2.85Å; S570-K574 WeakPolarHBondContact O-CD 3.35Å; S570-K574 VanDerWaalsContact O-CG 3.26Å; S570-K574 WeakPolarHBondContact O-CG 3.23Å; S570-K574 PolarHBondContact O-N 3.5Å
571	A	83.3	Confident	82.3	Confident	2 Å²	2	56.2 Å²	56.2	2%	0.017	31%	0.305	C	S	.	.	H	α-helix	trans	-70.6	-49.6	172.4	0	0	0	0	0	110.6	Y560 T564 L565 D568 S569 Q573 K574 E575	Y560-A571 HydrophobicContact CD1-CB 4.06Å; Y560-A571 HydrophobicContact CD2-CB 3.8Å; Y560-A571 HydrophobicContact CE1-CB 3.91Å; Y560-A571 HydrophobicContact CE2-CB 3.63Å; Y560-A571 HydrophobicContact CG-CB 4Å; T564-A571 HydrophobicContact CG2-CB 4.25Å; L565-A571 HydrophobicContact CD2-CB 4.47Å; D568-A571 HydrophobicContact CB-CB 3.65Å; D568-A571 WeakPolarHBondContact O-CB 3.06Å; D568-A571 PolarHBondContact O-N 3.25Å; D568-A571 VanDerWaalsContact O-N 3.14Å; S569-A571 VanDerWaalsContact C-N 3.31Å; S569-A571 PolarHBondContact O-N 2.83Å; A571-Q573 VanDerWaalsContact C-N 3.32Å; A571-Q573 PolarHBondContact O-N 2.95Å; A571-K574 PolarHBondContact O-N 3.05Å; A571-K574 VanDerWaalsContact O-N 3.09Å; A571-E575 WeakPolarHBondContact O-CB 3.4Å; A571-E575 PolarHBondContact O-N 3.39Å
572	A	81.9	Confident	82.9	Confident	5 Å²	5	53.1 Å²	53.1	4%	0.041	28%	0.284	C	S	.	.	H	α-helix	trans	-57.4	-41.4	176.9	0	0	0	0	0	112.8	D568 S569 E575 L576 M605	D568-A572 PolarHBondContact O-N 3.3Å; S569-A572 PolarHBondContact O-N 2.93Å; A572-E575 PolarHBondContact O-N 3.06Å; A572-L576 VanDerWaalsContact O-CB 3.29Å; A572-L576 WeakPolarHBondContact O-CB 3.44Å; A572-L576 PolarHBondContact O-N 2.77Å; A572-M605 HydrophobicContact CB-CE 3.88Å
573	Q	85.1	Confident	83.8	Confident	57 Å²	57	48.6 Å²	48.6	27%	0.266	25%	0.252	S	S	.	.	H	α-helix	trans	-64.4	-37.2	175.4	-74.4	-176.8	21	0	0	113.2	S569 A571 C653 V657	S569-Q573 WeakPolarHBondContact O-CB 3.41Å; S569-Q573 VanDerWaalsContact O-CG 3.27Å; S569-Q573 WeakPolarHBondContact O-CG 3.26Å; S569-Q573 PolarHBondContact O-N 3.35Å; S569-Q573 PolarHBondContact OG-NE2 3.3Å; A571-Q573 VanDerWaalsContact C-N 3.32Å; A571-Q573 PolarHBondContact O-N 2.95Å; Q573-C653 PolarHBondContact NE2-O 3.41Å; Q573-V657 HydrophobicContact CB-CG2 3.63Å; Q573-V657 HydrophobicContact CG-CG2 3.78Å
574	K	86.4	Confident	84.6	Confident	82 Å²	82	46.4 Å²	46.4	36%	0.357	24%	0.243	S	C	.	.	H	α-helix	trans	-71.6	-44.7	176.1	-73.1	169.6	179.3	179.8	0	111.6	L533 M559 Y560 S570 A571 L576 K577 L578	L533-K574 HydrophobicContact CD2-CB 4.12Å; L533-K574 HydrophobicContact CD2-CG 4.12Å; M559-K574 HydrophobicContact CE-CB 3.66Å; Y560-K574 HydrophobicContact CE2-CB 4.35Å; Y560-K574 WeakPolarHBondContact OH-CD 3.39Å; S570-K574 WeakPolarHBondContact O-CD 3.35Å; S570-K574 VanDerWaalsContact O-CG 3.26Å; S570-K574 WeakPolarHBondContact O-CG 3.23Å; S570-K574 PolarHBondContact O-N 3.5Å; A571-K574 PolarHBondContact O-N 3.05Å; A571-K574 VanDerWaalsContact O-N 3.09Å; K574-L576 VanDerWaalsContact C-N 3.33Å; K574-L576 PolarHBondContact O-N 2.82Å; K574-K577 PolarHBondContact O-N 2.95Å; K574-L578 PolarHBondContact O-N 3.05Å
575	E	88.4	Confident	85.1	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-42.8	177.6	-169.2	58.4	-132.6	0	0	111.2	S558 M559 Y560 L565 A571 A572 K577 L578 L579 M605	S558-E575 WeakPolarHBondContact CA-OE1 3.21Å; M559-E575 WeakPolarHBondContact CB-OE2 3.44Å; M559-E575 WeakPolarHBondContact CG-OE2 3.32Å; M559-E575 PolarHBondContact N-OE2 3.09Å; Y560-E575 HydrophobicContact CD2-CB 4.45Å; L565-E575 HydrophobicContact CD1-CG 4.18Å; L565-E575 HydrophobicContact CD2-CB 3.65Å; L565-E575 HydrophobicContact CD2-CG 3.86Å; A571-E575 WeakPolarHBondContact O-CB 3.4Å; A571-E575 PolarHBondContact O-N 3.39Å; A572-E575 PolarHBondContact O-N 3.06Å; E575-K577 VanDerWaalsContact C-N 3.3Å; E575-K577 PolarHBondContact O-N 3.24Å; E575-L578 PolarHBondContact O-N 2.92Å; E575-L578 WeakPolarHBondContact OE1-CD2 3.48Å; E575-L579 HydrophobicContact CG-CD1 4.13Å; E575-L579 HydrophobicContact CG-CG 4.38Å; E575-L579 WeakPolarHBondContact O-CG 3.34Å; E575-L579 PolarHBondContact O-N 3.21Å; E575-M605 HydrophobicContact CB-CE 4.47Å
576	L	87.8	Confident	85.9	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-58.6	-37.4	176.6	-179.1	59.4	0	0	0	113.3	A572 K574 L580 M602 V657 L658 W663	A572-L576 VanDerWaalsContact O-CB 3.29Å; A572-L576 WeakPolarHBondContact O-CB 3.44Å; A572-L576 PolarHBondContact O-N 2.77Å; K574-L576 VanDerWaalsContact C-N 3.33Å; K574-L576 PolarHBondContact O-N 2.82Å; L576-L580 WeakPolarHBondContact O-CB 3.44Å; L576-L580 PolarHBondContact O-N 3.22Å; L576-L580 VanDerWaalsContact O-N 3.1Å; L576-M602 HydrophobicContact CD1-CB 4.18Å; L576-M602 HydrophobicContact CD1-CE 3.79Å; L576-M602 HydrophobicContact CD1-CG 3.94Å; L576-V657 HydrophobicContact CD2-CB 4.2Å; L576-V657 HydrophobicContact CD2-CG1 4.5Å; L576-L658 HydrophobicContact CD1-CD1 4.02Å; L576-L658 HydrophobicContact CD2-CD1 4.03Å; L576-L658 HydrophobicContact CD2-CG 4.27Å; L576-L658 HydrophobicContact CG-CD1 4.1Å; L576-W663 HydrophobicContact CD1-CH2 3.52Å; L576-W663 HydrophobicContact CD1-CZ2 4.05Å; L576-W663 HydrophobicContact CD1-CZ3 4.28Å; L576-W663 HydrophobicContact CD2-CH2 3.84Å; L576-W663 HydrophobicContact CD2-CZ2 3.46Å; L576-W663 VanDerWaalsContact CD2-CZ2 3.46Å; L576-W663 HydrophobicContact CG-CH2 4.35Å; L576-W663 HydrophobicContact CG-CZ2 4.4Å
577	K	88.8	Confident	86.7	Confident	97 Å²	97	46.8 Å²	46.8	42%	0.422	23%	0.234	S	C	.	.	H	α-helix	trans	-66.5	-40.6	174.5	-68.7	179.6	177.1	-177.7	0	111.8	L533 K574 E575 H581 V657	L533-K577 HydrophobicContact CD2-CB 4.17Å; L533-K577 HydrophobicContact CD2-CD 3.87Å; K574-K577 PolarHBondContact O-N 2.95Å; E575-K577 VanDerWaalsContact C-N 3.3Å; E575-K577 PolarHBondContact O-N 3.24Å; K577-H581 PolarHBondContact O-N 3.28Å; K577-H581 PolarHBondContact O-ND1 3.34Å; K577-V657 HydrophobicContact CD-CG1 4.34Å; K577-V657 HydrophobicContact CG-CG1 3.66Å
578	L	90.8	Very high	87.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-69	-44.8	178.7	178.1	136.3	0	0	0	111.7	L533 R536 L556 M559 K574 E575 L580 H581 R582	L533-L578 HydrophobicContact CD1-CB 3.98Å; L533-L578 HydrophobicContact CD1-CD1 4.45Å; R536-L578 HydrophobicContact CB-CD1 4.47Å; L556-L578 HydrophobicContact CB-CG 4.36Å; L556-L578 HydrophobicContact CD2-CD1 4.15Å; L556-L578 HydrophobicContact CD2-CG 4.01Å; L556-L578 WeakPolarHBondContact O-CD2 3.09Å; M559-L578 HydrophobicContact CG-CD1 3.75Å; M559-L578 HydrophobicContact SD-CD1 3.75Å; K574-L578 PolarHBondContact O-N 3.05Å; E575-L578 PolarHBondContact O-N 2.92Å; E575-L578 WeakPolarHBondContact OE1-CD2 3.48Å; L578-L580 VanDerWaalsContact C-N 3.31Å; L578-L580 PolarHBondContact O-N 3.43Å; L578-H581 PolarHBondContact O-N 2.91Å; L578-R582 WeakPolarHBondContact O-CB 3.37Å; L578-R582 PolarHBondContact O-N 3.13Å
579	L	90.7	Very high	87.8	Confident	14 Å²	14	43.1 Å²	43.1	7%	0.073	22%	0.222	C	C	.	.	H	α-helix	trans	-61.1	-36.2	174.1	-70.6	173.4	0	0	0	112.7	E575 R582 S583 T601 M602 M605	E575-L579 HydrophobicContact CG-CD1 4.13Å; E575-L579 HydrophobicContact CG-CG 4.38Å; E575-L579 WeakPolarHBondContact O-CG 3.34Å; E575-L579 PolarHBondContact O-N 3.21Å; L579-R582 PolarHBondContact O-N 3.37Å; L579-S583 WeakPolarHBondContact O-CB 3.46Å; L579-S583 PolarHBondContact O-N 2.94Å; L579-S583 PolarHBondContact O-OG 3.02Å; L579-T601 HydrophobicContact CD1-CG2 3.78Å; L579-M602 HydrophobicContact CB-CG 3.57Å; L579-M602 HydrophobicContact CB-SD 3.84Å; L579-M602 HydrophobicContact CD1-CG 3.86Å; L579-M602 HydrophobicContact CG-CG 4.35Å; L579-M605 HydrophobicContact CD1-SD 4.06Å
580	L	91.1	Very high	88.2	Confident	48 Å²	48	43.9 Å²	43.9	25%	0.251	24%	0.235	S	C	.	.	H	α-helix	trans	-65.5	-39	174.3	-175.5	70.8	0	0	0	112.5	L576 L578 S583 T584 M602 L658 L666	L576-L580 WeakPolarHBondContact O-CB 3.44Å; L576-L580 PolarHBondContact O-N 3.22Å; L576-L580 VanDerWaalsContact O-N 3.1Å; L578-L580 VanDerWaalsContact C-N 3.31Å; L578-L580 PolarHBondContact O-N 3.43Å; L580-S583 PolarHBondContact O-OG 3.12Å; L580-T584 WeakPolarHBondContact O-CG2 3.46Å; L580-T584 PolarHBondContact O-N 3.27Å; L580-T584 PolarHBondContact O-OG1 3.04Å; L580-M602 HydrophobicContact CB-CE 4.21Å; L580-M602 HydrophobicContact CD1-CE 3.98Å; L580-L658 HydrophobicContact CD2-CD2 4.2Å; L580-L666 HydrophobicContact CD1-CD2 4.08Å
581	H	90	Very high	88.5	Confident	78 Å²	78	43.7 Å²	43.7	36%	0.361	23%	0.226	S	C	.	.	H	α-helix	trans	-71.1	-35.7	173.2	-79	49.3	0	0	0	111.6	L537 L556 K577 L578 T584 L585	L537-H581 HydrophobicContact CD2-CB 4.01Å; L556-H581 HydrophobicContact CD1-CB 4.16Å; L556-H581 HydrophobicContact CD2-CB 4.21Å; K577-H581 PolarHBondContact O-N 3.28Å; K577-H581 PolarHBondContact O-ND1 3.34Å; L578-H581 PolarHBondContact O-N 2.91Å; H581-T584 WeakPolarHBondContact CA-OG1 3.25Å; H581-T584 PolarHBondContact O-OG1 2.89Å; H581-T584 VanDerWaalsContact O-OG1 3.11Å; H581-L585 VanDerWaalsContact O-CB 3.27Å; H581-L585 WeakPolarHBondContact O-CB 3.42Å; H581-L585 PolarHBondContact O-N 3.42Å; H581-L585 VanDerWaalsContact O-N 3.12Å
582	R	92.2	Very high	88.7	Confident	60 Å²	60	46.2 Å²	46.2	23%	0.226	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-48.6	174.5	-164.5	-170.3	177.9	81.9	2.2	111.4	L553 L556 L578 L579 L585 L586	L553-R582 HydrophobicContact CD2-CG 4.29Å; L553-R582 PolarHBondContact O-NH1 3.27Å; L556-R582 VanDerWaalsContact C-NH1 3.32Å; L556-R582 HydrophobicContact CB-CB 4.12Å; L556-R582 HydrophobicContact CB-CG 4.24Å; L556-R582 HydrophobicContact CD1-CB 4.47Å; L556-R582 WeakPolarHBondContact O-CD 3.46Å; L556-R582 PolarHBondContact O-NH1 2.95Å; L578-R582 WeakPolarHBondContact O-CB 3.37Å; L578-R582 PolarHBondContact O-N 3.13Å; L579-R582 PolarHBondContact O-N 3.37Å; R582-L585 PolarHBondContact O-N 3.35Å; R582-L586 HydrophobicContact CG-CD1 3.88Å; R582-L586 WeakPolarHBondContact O-CB 3.42Å; R582-L586 VanDerWaalsContact O-CG 3.23Å; R582-L586 WeakPolarHBondContact O-CG 3.45Å; R582-L586 PolarHBondContact O-N 3.49Å
583	S	91.6	Very high	89	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-68.2	-42	-176.5	67	0	0	0	0	112.2	L579 L580 L586 K587 Y595	L579-S583 WeakPolarHBondContact O-CB 3.46Å; L579-S583 PolarHBondContact O-N 2.94Å; L579-S583 PolarHBondContact O-OG 3.02Å; L580-S583 PolarHBondContact O-OG 3.12Å; S583-L586 PolarHBondContact O-N 2.88Å; S583-K587 WeakPolarHBondContact O-CB 3.15Å; S583-K587 PolarHBondContact O-N 3.34Å; S583-Y595 WeakPolarHBondContact O-CD2 3.48Å
584	T	90.8	Very high	89.2	Confident	77 Å²	77	47.8 Å²	47.8	47%	0.472	25%	0.246	S	C	.	.	H	α-helix	trans	-61.2	-44.7	173.5	48.1	0	0	0	0	111.8	L580 H581 K587 T588	L580-T584 WeakPolarHBondContact O-CG2 3.46Å; L580-T584 PolarHBondContact O-N 3.27Å; L580-T584 PolarHBondContact O-OG1 3.04Å; H581-T584 WeakPolarHBondContact CA-OG1 3.25Å; H581-T584 PolarHBondContact O-OG1 2.89Å; H581-T584 VanDerWaalsContact O-OG1 3.11Å; T584-K587 PolarHBondContact O-N 2.85Å; T584-T588 WeakPolarHBondContact O-CG2 3.5Å; T584-T588 PolarHBondContact O-N 3.25Å; T584-T588 VanDerWaalsContact O-N 3.08Å
585	L	89.8	Confident	89.4	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-47.2	175.4	-179.6	58.9	0	0	0	112.3	Q544 M549 A552 L553 L556 H581 R582 K587 T588 Q589	Q544-L585 HydrophobicContact CG-CD1 4.13Å; M549-L585 HydrophobicContact SD-CD1 3.92Å; A552-L585 HydrophobicContact CB-CD2 3.73Å; L553-L585 HydrophobicContact CD2-CD2 3.8Å; L553-L585 HydrophobicContact CD2-CG 4.09Å; L553-L585 HydrophobicContact CG-CD2 4.07Å; L556-L585 HydrophobicContact CD1-CD2 4.11Å; H581-L585 VanDerWaalsContact O-CB 3.27Å; H581-L585 WeakPolarHBondContact O-CB 3.42Å; H581-L585 PolarHBondContact O-N 3.42Å; H581-L585 VanDerWaalsContact O-N 3.12Å; R582-L585 PolarHBondContact O-N 3.35Å; L585-K587 VanDerWaalsContact C-N 3.34Å; L585-K587 PolarHBondContact O-N 3.35Å; L585-T588 PolarHBondContact O-N 3.39Å; L585-T588 PolarHBondContact O-OG1 3.02Å; L585-Q589 WeakPolarHBondContact O-CG 3.47Å; L585-Q589 PolarHBondContact O-N 3.31Å
586	L	91	Very high	89.5	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-39.9	177.3	-71.7	166	0	0	0	112.6	L553 R582 S583 T588 Q589 G590 K591 D594	L553-L586 HydrophobicContact CD1-CD2 3.73Å; L553-L586 HydrophobicContact CD2-CD1 4.42Å; L553-L586 HydrophobicContact CD2-CD2 3.53Å; L553-L586 HydrophobicContact CD2-CG 3.68Å; L553-L586 HydrophobicContact CG-CD2 4.31Å; R582-L586 HydrophobicContact CG-CD1 3.88Å; R582-L586 WeakPolarHBondContact O-CB 3.42Å; R582-L586 VanDerWaalsContact O-CG 3.23Å; R582-L586 WeakPolarHBondContact O-CG 3.45Å; R582-L586 PolarHBondContact O-N 3.49Å; S583-L586 PolarHBondContact O-N 2.88Å; L586-T588 PolarHBondContact O-N 3.14Å; L586-Q589 CarbonylContact O-C 3.56Å; L586-Q589 PolarHBondContact O-N 3.1Å; L586-Q589 VanDerWaalsContact O-N 3.09Å; L586-G590 PolarHBondContact O-N 3.19Å; L586-K591 HydrophobicContact CD2-CB 4.04Å; L586-K591 HydrophobicContact CD2-CD 3.85Å; L586-K591 PolarHBondContact O-N 3.1Å; L586-D594 HydrophobicContact CD1-CB 3.8Å; L586-D594 HydrophobicContact CD2-CB 3.73Å; L586-D594 HydrophobicContact CG-CB 4.28Å
587	K	88.8	Confident	89.6	Confident	106 Å²	106	44.9 Å²	44.9	46%	0.461	23%	0.234	S	C	.	.	H	α-helix	trans	-61.9	-40.4	175	-164.9	172.1	-168.2	161.6	0	111.9	S583 T584 L585 Q589 G590 Y595	S583-K587 WeakPolarHBondContact O-CB 3.15Å; S583-K587 PolarHBondContact O-N 3.34Å; T584-K587 PolarHBondContact O-N 2.85Å; L585-K587 VanDerWaalsContact C-N 3.34Å; L585-K587 PolarHBondContact O-N 3.35Å; K587-Q589 VanDerWaalsContact C-N 3.26Å; K587-Q589 PolarHBondContact O-N 3.46Å; K587-G590 PolarHBondContact O-N 3.12Å; K587-Y595 HydrophobicContact CB-CD2 3.89Å; K587-Y595 HydrophobicContact CB-CE2 4.12Å; K587-Y595 HydrophobicContact CB-CG 4.45Å; K587-Y595 HydrophobicContact CD-CD2 4.36Å; K587-Y595 HydrophobicContact CD-CE2 3.76Å; K587-Y595 HydrophobicContact CG-CD2 4.39Å; K587-Y595 HydrophobicContact CG-CE2 4.27Å; K587-Y595 PolarHBondContact NZ-OH 3.15Å; K587-Y595 VanDerWaalsContact NZ-OH 3.09Å
588	T	88.4	Confident	89.6	Confident	104 Å²	104	40.4 Å²	40.4	64%	0.638	22%	0.215	S	C	*	.	H	α-helix	trans	-67.9	-22.6	174	63.1	0	0	0	0	114	T584 L585 L586	T584-T588 WeakPolarHBondContact O-CG2 3.5Å; T584-T588 PolarHBondContact O-N 3.25Å; T584-T588 VanDerWaalsContact O-N 3.08Å; L585-T588 PolarHBondContact O-N 3.39Å; L585-T588 PolarHBondContact O-OG1 3.02Å; L586-T588 PolarHBondContact O-N 3.14Å
589	Q	87.6	Confident	89.6	Confident	55 Å²	55	40.5 Å²	40.5	26%	0.257	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-7.4	174.4	-65.3	176.3	35.8	0	0	113.4	L585 L586 K587 K591	L585-Q589 WeakPolarHBondContact O-CG 3.47Å; L585-Q589 PolarHBondContact O-N 3.31Å; L586-Q589 CarbonylContact O-C 3.56Å; L586-Q589 PolarHBondContact O-N 3.1Å; L586-Q589 VanDerWaalsContact O-N 3.09Å; K587-Q589 VanDerWaalsContact C-N 3.26Å; K587-Q589 PolarHBondContact O-N 3.46Å; Q589-K591 HydrophobicContact CB-CD 4.24Å; Q589-K591 HydrophobicContact CB-CG 4.15Å; Q589-K591 PolarHBondContact O-N 3.37Å
590	G	86	Confident	89.6	Confident	51 Å²	51	40.1 Å²	40.1	53%	0.526	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	12.3	-173.7	0	0	0	0	0	114.6	L586 K587 M592	L586-G590 PolarHBondContact O-N 3.19Å; K587-G590 PolarHBondContact O-N 3.12Å; G590-M592 VanDerWaalsContact C-N 3.27Å; G590-M592 PolarHBondContact O-N 3.29Å
591	K	88.1	Confident	89.5	Confident	65 Å²	65	40 Å²	40	28%	0.283	21%	0.214	S	C	.	.			trans	-77.9	74.4	177.4	-71.1	175.7	175.6	167.3	0	109.8	D550 L553 L586 Q589 E593 D594 Y595	D550-K591 IonicContact OD1-NZ 2.66Å; D550-K591 PolarHBondContact OD1-NZ 3.37Å; L553-K591 HydrophobicContact CD1-CD 4.47Å; L586-K591 HydrophobicContact CD2-CB 4.04Å; L586-K591 HydrophobicContact CD2-CD 3.85Å; L586-K591 PolarHBondContact O-N 3.1Å; Q589-K591 HydrophobicContact CB-CD 4.24Å; Q589-K591 HydrophobicContact CB-CG 4.15Å; Q589-K591 PolarHBondContact O-N 3.37Å; K591-E593 PolarHBondContact O-N 3.4Å; K591-D594 HydrophobicContact CB-CB 4.22Å; K591-Y595 VanDerWaalsContact O-CB 3.32Å; K591-Y595 WeakPolarHBondContact O-CB 3.44Å; K591-Y595 PolarHBondContact O-N 3.14Å
592	M	87.6	Confident	89.5	Confident	54 Å²	54	36.3 Å²	36.3	27%	0.266	20%	0.198	S	C	.	.	H	α-helix	trans	-65.6	-37.9	-168.6	-69.2	-67.1	-78.1	0	0	114.5	G590 Y595 L596 D676 L677	G590-M592 VanDerWaalsContact C-N 3.27Å; G590-M592 PolarHBondContact O-N 3.29Å; M592-Y595 PolarHBondContact O-N 3.35Å; M592-Y595 HydrophobicContact SD-CD1 4.49Å; M592-L596 WeakPolarHBondContact O-CG 3.03Å; M592-L596 PolarHBondContact O-N 2.98Å; M592-D676 HydrophobicContact CE-CB 4.41Å; M592-L677 HydrophobicContact CB-CD1 4.3Å; M592-L677 HydrophobicContact CB-CD2 4.27Å
593	E	88.6	Confident	89.2	Confident	51 Å²	51	33.7 Å²	33.7	24%	0.238	19%	0.188	C	C	.	.	H	α-helix	trans	-67.8	-50.9	177.3	-64.1	-82.6	-140.3	0	0	110.6	K591 Y595 L596 D597 L677 R679	K591-E593 PolarHBondContact O-N 3.4Å; E593-Y595 VanDerWaalsContact C-N 3.25Å; E593-Y595 PolarHBondContact O-N 3.49Å; E593-L596 CarbonylContact O-C 3.6Å; E593-L596 WeakPolarHBondContact O-CA 3.46Å; E593-L596 WeakPolarHBondContact O-CB 3.48Å; E593-L596 PolarHBondContact O-N 3.4Å; E593-D597 VanDerWaalsContact O-CG 3.31Å; E593-D597 PolarHBondContact O-N 3.4Å; E593-L677 VanDerWaalsContact CD-CD1 3.49Å; E593-L677 HydrophobicContact CG-CD1 3.94Å; E593-L677 WeakPolarHBondContact OE2-CD1 3.45Å; E593-R679 IonicContact OE2-CZ 3.55Å; E593-R679 IonicContact OE2-NH1 2.8Å; E593-R679 PolarHBondContact OE2-NH1 3.16Å
594	D	88.4	Confident	88.9	Confident	45 Å²	45	35 Å²	35	24%	0.241	20%	0.198	C	C	.	.	H	α-helix	trans	-56.2	-38.8	174.4	-62.8	-30.3	0	0	0	112.3	L586 K591 D597 A598 H628	L586-D594 HydrophobicContact CD1-CB 3.8Å; L586-D594 HydrophobicContact CD2-CB 3.73Å; L586-D594 HydrophobicContact CG-CB 4.28Å; K591-D594 HydrophobicContact CB-CB 4.22Å; D594-D597 PolarHBondContact O-N 3.36Å; D594-A598 PolarHBondContact O-N 3.35Å; D594-A598 VanDerWaalsContact O-N 3.14Å; D594-H628 IonicContact OD1-CE1 2.84Å; D594-H628 PolarHBondContact OD1-CE1 2.89Å; D594-H628 IonicContact OD1-ND1 3.97Å
595	Y	91.4	Very high	88.6	Confident	7 Å²	7	33.5 Å²	33.5	3%	0.027	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-45.6	175.1	159.1	-101.3	0	0	0	111.1	S583 K587 K591 M592 E593 D597 A598 M599 S669	S583-Y595 WeakPolarHBondContact O-CD2 3.48Å; K587-Y595 HydrophobicContact CB-CD2 3.89Å; K587-Y595 HydrophobicContact CB-CE2 4.12Å; K587-Y595 HydrophobicContact CB-CG 4.45Å; K587-Y595 HydrophobicContact CD-CD2 4.36Å; K587-Y595 HydrophobicContact CD-CE2 3.76Å; K587-Y595 HydrophobicContact CG-CD2 4.39Å; K587-Y595 HydrophobicContact CG-CE2 4.27Å; K587-Y595 PolarHBondContact NZ-OH 3.15Å; K587-Y595 VanDerWaalsContact NZ-OH 3.09Å; K591-Y595 VanDerWaalsContact O-CB 3.32Å; K591-Y595 WeakPolarHBondContact O-CB 3.44Å; K591-Y595 PolarHBondContact O-N 3.14Å; M592-Y595 PolarHBondContact O-N 3.35Å; M592-Y595 HydrophobicContact SD-CD1 4.49Å; E593-Y595 VanDerWaalsContact C-N 3.25Å; E593-Y595 PolarHBondContact O-N 3.49Å; Y595-D597 VanDerWaalsContact C-N 3.31Å; Y595-D597 PolarHBondContact O-N 2.79Å; Y595-A598 PolarHBondContact O-N 3.33Å; Y595-M599 HydrophobicContact CD2-CG 4.02Å; Y595-M599 HydrophobicContact CE1-CG 4.21Å; Y595-M599 HydrophobicContact CE2-CG 3.64Å; Y595-M599 HydrophobicContact CE2-SD 3.93Å; Y595-M599 HydrophobicContact CG-CG 4.47Å; Y595-M599 WeakPolarHBondContact O-CG 3.3Å; Y595-M599 PolarHBondContact O-N 2.72Å; Y595-S669 PolarHBondContact OH-O 3.26Å; Y595-S669 VanDerWaalsContact OH-O 3.07Å
596	L	90.3	Very high	88.2	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.4	-35.5	175.7	-74.4	172.6	0	0	0	112	M592 E593 M599 I600 L674 L677	M592-L596 WeakPolarHBondContact O-CG 3.03Å; M592-L596 PolarHBondContact O-N 2.98Å; E593-L596 CarbonylContact O-C 3.6Å; E593-L596 WeakPolarHBondContact O-CA 3.46Å; E593-L596 WeakPolarHBondContact O-CB 3.48Å; E593-L596 PolarHBondContact O-N 3.4Å; L596-M599 PolarHBondContact O-N 2.7Å; L596-I600 VanDerWaalsContact O-CB 3.29Å; L596-I600 WeakPolarHBondContact O-CB 3.22Å; L596-I600 WeakPolarHBondContact O-CG1 3.42Å; L596-I600 PolarHBondContact O-N 3.11Å; L596-L674 HydrophobicContact CD1-CD2 4.04Å; L596-L674 HydrophobicContact CD1-CG 4.43Å; L596-L674 HydrophobicContact CD2-CD2 4.37Å; L596-L674 HydrophobicContact CD2-CG 4.05Å; L596-L677 HydrophobicContact CD1-CD1 3.56Å; L596-L677 HydrophobicContact CD1-CG 4.25Å
597	D	89.6	Confident	87.6	Confident	19 Å²	19	33.3 Å²	33.3	10%	0.102	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-45.9	175.3	-62.9	-26.1	0	0	0	111.6	E593 D594 Y595 M599 T601 H628 L629	E593-D597 VanDerWaalsContact O-CG 3.31Å; E593-D597 PolarHBondContact O-N 3.4Å; D594-D597 PolarHBondContact O-N 3.36Å; Y595-D597 VanDerWaalsContact C-N 3.31Å; Y595-D597 PolarHBondContact O-N 2.79Å; D597-M599 PolarHBondContact O-N 2.8Å; D597-T601 WeakPolarHBondContact O-CB 3.47Å; D597-T601 PolarHBondContact O-N 2.64Å; D597-T601 PolarHBondContact O-OG1 3.13Å; D597-H628 WeakPolarHBondContact OD2-CA 3.32Å; D597-H628 IonicContact OD2-CE1 3.52Å; D597-H628 IonicContact OD2-CG 3.88Å; D597-H628 IonicContact OD2-ND1 2.84Å; D597-H628 PolarHBondContact OD2-ND1 3.13Å; D597-L629 HydrophobicContact CB-CB 4.45Å; D597-L629 HydrophobicContact CB-CD1 4.15Å; D597-L629 HydrophobicContact CB-CG 4.09Å; D597-L629 WeakPolarHBondContact OD1-CB 3.43Å; D597-L629 PolarHBondContact OD1-N 2.99Å
598	A	89.8	Confident	87.1	Confident	4 Å²	4	33.2 Å²	33.2	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-42.5	174.6	0	0	0	0	0	111.8	D594 Y595 T601 M602	D594-A598 PolarHBondContact O-N 3.35Å; D594-A598 VanDerWaalsContact O-N 3.14Å; Y595-A598 PolarHBondContact O-N 3.33Å; A598-T601 WeakPolarHBondContact O-CB 3.44Å; A598-T601 PolarHBondContact O-N 3.09Å; A598-M602 VanDerWaalsContact O-CG 3.3Å; A598-M602 WeakPolarHBondContact O-CG 3.39Å; A598-M602 PolarHBondContact O-N 3Å
599	M	90.8	Very high	86.5	Confident	1 Å²	1	29 Å²	29	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-67.1	-43.6	178.6	-68.2	-67.5	-62.9	0	0	112.7	Y595 L596 D597 T601 M602 I603 L666 C670	Y595-M599 HydrophobicContact CD2-CG 4.02Å; Y595-M599 HydrophobicContact CE1-CG 4.21Å; Y595-M599 HydrophobicContact CE2-CG 3.64Å; Y595-M599 HydrophobicContact CE2-SD 3.93Å; Y595-M599 HydrophobicContact CG-CG 4.47Å; Y595-M599 WeakPolarHBondContact O-CG 3.3Å; Y595-M599 PolarHBondContact O-N 2.72Å; L596-M599 PolarHBondContact O-N 2.7Å; D597-M599 PolarHBondContact O-N 2.8Å; M599-T601 VanDerWaalsContact C-N 3.31Å; M599-T601 PolarHBondContact O-N 2.95Å; M599-M602 PolarHBondContact O-N 3.26Å; M599-M602 HydrophobicContact SD-SD 4.48Å; M599-I603 WeakPolarHBondContact O-CB 3.47Å; M599-I603 VanDerWaalsContact O-CG1 3.26Å; M599-I603 WeakPolarHBondContact O-CG1 3.44Å; M599-I603 PolarHBondContact O-N 3.07Å; M599-L666 HydrophobicContact CE-CB 3.9Å; M599-L666 HydrophobicContact CE-CD2 3.66Å; M599-L666 HydrophobicContact CE-CG 4.4Å; M599-L666 WeakPolarHBondContact CE-O 3.49Å; M599-L666 HydrophobicContact SD-CD2 3.87Å; M599-C670 HydrophobicContact CB-CB 4.25Å; M599-C670 HydrophobicContact CE-CB 4.05Å
600	I	90.4	Very high	86.2	Confident	6 Å²	6	26.7 Å²	26.7	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-63	-40.5	175.4	-71.7	166	0	0	0	109.8	L596 I603 S604 V618 L629 L631	L596-I600 VanDerWaalsContact O-CB 3.29Å; L596-I600 WeakPolarHBondContact O-CB 3.22Å; L596-I600 WeakPolarHBondContact O-CG1 3.42Å; L596-I600 PolarHBondContact O-N 3.11Å; I600-I603 PolarHBondContact O-N 3.07Å; I600-S604 VanDerWaalsContact O-CB 3.22Å; I600-S604 WeakPolarHBondContact O-CB 3.35Å; I600-S604 PolarHBondContact O-N 3.13Å; I600-S604 PolarHBondContact O-OG 2.88Å; I600-V618 HydrophobicContact CG2-CG1 3.88Å; I600-V618 HydrophobicContact CG2-CG2 3.93Å; I600-L629 HydrophobicContact CG2-CB 4.29Å; I600-L631 HydrophobicContact CG2-CD2 4.03Å
601	T	89.3	Confident	86	Confident	45 Å²	45	24.6 Å²	24.6	28%	0.276	13%	0.125	S	C	.	.	H	α-helix	trans	-58.7	-56.2	173.8	-55.3	0	0	0	0	110.5	L579 D597 A598 M599 I603 S604 M605 L629	L579-T601 HydrophobicContact CD1-CG2 3.78Å; D597-T601 WeakPolarHBondContact O-CB 3.47Å; D597-T601 PolarHBondContact O-N 2.64Å; D597-T601 PolarHBondContact O-OG1 3.13Å; A598-T601 WeakPolarHBondContact O-CB 3.44Å; A598-T601 PolarHBondContact O-N 3.09Å; M599-T601 VanDerWaalsContact C-N 3.31Å; M599-T601 PolarHBondContact O-N 2.95Å; T601-I603 VanDerWaalsContact C-N 3.34Å; T601-I603 PolarHBondContact O-N 2.85Å; T601-S604 PolarHBondContact O-N 3.44Å; T601-S604 VanDerWaalsContact O-N 3.16Å; T601-S604 PolarHBondContact O-OG 3.31Å; T601-M605 WeakPolarHBondContact O-CG 3.14Å; T601-M605 PolarHBondContact O-N 3.38Å; T601-M605 VanDerWaalsContact O-N 3.09Å; T601-L629 WeakPolarHBondContact OG1-CD1 3.4Å
602	M	88.5	Confident	85.6	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-55.6	-45	178.6	-69.1	168.3	62.8	0	0	112.9	L576 L579 L580 A598 M599 M605 L606 L658 W663 L666	L576-M602 HydrophobicContact CD1-CB 4.18Å; L576-M602 HydrophobicContact CD1-CE 3.79Å; L576-M602 HydrophobicContact CD1-CG 3.94Å; L579-M602 HydrophobicContact CB-CG 3.57Å; L579-M602 HydrophobicContact CB-SD 3.84Å; L579-M602 HydrophobicContact CD1-CG 3.86Å; L579-M602 HydrophobicContact CG-CG 4.35Å; L580-M602 HydrophobicContact CB-CE 4.21Å; L580-M602 HydrophobicContact CD1-CE 3.98Å; A598-M602 VanDerWaalsContact O-CG 3.3Å; A598-M602 WeakPolarHBondContact O-CG 3.39Å; A598-M602 PolarHBondContact O-N 3Å; M599-M602 PolarHBondContact O-N 3.26Å; M599-M602 HydrophobicContact SD-SD 4.48Å; M602-M605 PolarHBondContact O-N 3.32Å; M602-L606 PolarHBondContact O-N 2.71Å; M602-L658 HydrophobicContact CE-CD1 4.44Å; M602-W663 HydrophobicContact CB-CZ3 4.39Å; M602-L666 HydrophobicContact CE-CD1 3.75Å; M602-L666 HydrophobicContact CE-CD2 4.1Å
603	I	87.1	Confident	85.1	Confident	4 Å²	4	23.6 Å²	23.6	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-71.8	-33.8	-178.7	-64.3	164.6	0	0	0	111.1	M599 I600 T601 M605 L606 L607 L667 C670 L686	M599-I603 WeakPolarHBondContact O-CB 3.47Å; M599-I603 VanDerWaalsContact O-CG1 3.26Å; M599-I603 WeakPolarHBondContact O-CG1 3.44Å; M599-I603 PolarHBondContact O-N 3.07Å; I600-I603 PolarHBondContact O-N 3.07Å; T601-I603 VanDerWaalsContact C-N 3.34Å; T601-I603 PolarHBondContact O-N 2.85Å; I603-M605 VanDerWaalsContact C-N 3.31Å; I603-M605 PolarHBondContact O-N 3.36Å; I603-L606 PolarHBondContact O-N 3.15Å; I603-L607 HydrophobicContact CG2-CD1 3.55Å; I603-L607 HydrophobicContact CG2-CG 3.94Å; I603-L607 WeakPolarHBondContact O-CB 3.41Å; I603-L607 PolarHBondContact O-N 3.23Å; I603-L667 HydrophobicContact CD1-CD1 4.35Å; I603-L667 HydrophobicContact CG2-CD1 4.47Å; I603-C670 HydrophobicContact CD1-CB 3.49Å; I603-C670 VanDerWaalsContact CD1-CB 3.49Å; I603-L686 HydrophobicContact CG2-CD1 3.93Å
604	S	85.6	Confident	84.6	Confident	31 Å²	31	21.7 Å²	21.7	22%	0.217	11%	0.112	C	C	.	.	H	α-helix	trans	-67.2	-29.5	174.5	74.9	0	0	0	0	113.3	I600 T601 K608	I600-S604 VanDerWaalsContact O-CB 3.22Å; I600-S604 WeakPolarHBondContact O-CB 3.35Å; I600-S604 PolarHBondContact O-N 3.13Å; I600-S604 PolarHBondContact O-OG 2.88Å; T601-S604 PolarHBondContact O-N 3.44Å; T601-S604 VanDerWaalsContact O-N 3.16Å; T601-S604 PolarHBondContact O-OG 3.31Å; S604-K608 WeakPolarHBondContact O-CA 3.48Å; S604-K608 WeakPolarHBondContact O-CB 3.35Å; S604-K608 PolarHBondContact O-N 2.78Å; S604-K608 VanDerWaalsContact O-N 3.07Å
605	M	82.7	Confident	84.4	Confident	44 Å²	44	23.2 Å²	23.2	22%	0.217	12%	0.116	C	C	.	.	H	α-helix	trans	-67.1	-43.4	171	-65.3	171	72.9	0	0	111.5	L565 A572 E575 L579 T601 M602 I603	L565-M605 HydrophobicContact CD2-CE 4.38Å; A572-M605 HydrophobicContact CB-CE 3.88Å; E575-M605 HydrophobicContact CB-CE 4.47Å; L579-M605 HydrophobicContact CD1-SD 4.06Å; T601-M605 WeakPolarHBondContact O-CG 3.14Å; T601-M605 PolarHBondContact O-N 3.38Å; T601-M605 VanDerWaalsContact O-N 3.09Å; M602-M605 PolarHBondContact O-N 3.32Å; I603-M605 VanDerWaalsContact C-N 3.31Å; I603-M605 PolarHBondContact O-N 3.36Å
606	L	81.6	Confident	84.1	Confident	4 Å²	4	23.2 Å²	23.2	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-68.4	-47.1	176.1	177.2	71.8	0	0	0	112.8	M602 I603 N651 T655 W663 F693 F696	M602-L606 PolarHBondContact O-N 2.71Å; I603-L606 PolarHBondContact O-N 3.15Å; L606-N651 PolarHBondContact O-ND2 3.35Å; L606-T655 HydrophobicContact CD1-CG2 3.93Å; L606-W663 HydrophobicContact CB-CE3 4.24Å; L606-W663 HydrophobicContact CB-CH2 3.84Å; L606-W663 HydrophobicContact CB-CZ2 4.15Å; L606-W663 HydrophobicContact CB-CZ3 3.9Å; L606-W663 HydrophobicContact CD1-CD2 4.2Å; L606-W663 HydrophobicContact CD1-CG 4.47Å; L606-W663 HydrophobicContact CD1-CZ2 4.19Å; L606-W663 HydrophobicContact CD2-CB 4.18Å; L606-W663 HydrophobicContact CD2-CD2 3.71Å; L606-W663 HydrophobicContact CD2-CE3 3.69Å; L606-W663 HydrophobicContact CD2-CG 3.97Å; L606-W663 HydrophobicContact CD2-CZ3 4.22Å; L606-W663 HydrophobicContact CG-CD2 4.35Å; L606-W663 HydrophobicContact CG-CE3 4.41Å; L606-F693 HydrophobicContact CD1-CZ 4.12Å; L606-F693 HydrophobicContact CG-CZ 4.44Å; L606-F696 HydrophobicContact CD2-CZ 4.39Å
607	L	78.5	Confident	83.7	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-96.7	9.4	-168.4	-62.2	-173.9	0	0	0	113.6	I603 V609 A610 M611 A690 F693 F696	I603-L607 HydrophobicContact CG2-CD1 3.55Å; I603-L607 HydrophobicContact CG2-CG 3.94Å; I603-L607 WeakPolarHBondContact O-CB 3.41Å; I603-L607 PolarHBondContact O-N 3.23Å; L607-V609 VanDerWaalsContact C-N 3.31Å; L607-V609 PolarHBondContact O-N 3.42Å; L607-A610 HydrophobicContact CB-CB 4.45Å; L607-A610 CarbonylContact O-C 3.49Å; L607-A610 WeakPolarHBondContact O-CA 3.45Å; L607-A610 WeakPolarHBondContact O-CB 3.25Å; L607-A610 PolarHBondContact O-N 3.01Å; L607-M611 HydrophobicContact CB-CG 3.95Å; L607-M611 HydrophobicContact CB-SD 4.3Å; L607-M611 PolarHBondContact O-N 2.68Å; L607-A690 HydrophobicContact CD1-CB 4.47Å; L607-F693 HydrophobicContact CD2-CB 3.77Å; L607-F693 HydrophobicContact CD2-CD1 4.04Å; L607-F693 HydrophobicContact CD2-CD2 3.77Å; L607-F693 HydrophobicContact CD2-CE2 4.35Å; L607-F693 HydrophobicContact CD2-CG 3.59Å; L607-F696 HydrophobicContact CD2-CE2 4.41Å
608	K	79	Confident	83.5	Confident	104 Å²	104	25.9 Å²	25.9	45%	0.452	14%	0.135	S	C	.	.	H	α-helix	trans	-39.1	-53.4	-173.4	-170.7	175.7	-179.7	178.8	0	114.3	S604 Q612	S604-K608 WeakPolarHBondContact O-CA 3.48Å; S604-K608 WeakPolarHBondContact O-CB 3.35Å; S604-K608 PolarHBondContact O-N 2.78Å; S604-K608 VanDerWaalsContact O-N 3.07Å; K608-Q612 WeakPolarHBondContact O-CG 3.47Å; K608-Q612 PolarHBondContact O-N 3.22Å
609	V	76.4	Confident	83.3	Confident	15 Å²	15	32.5 Å²	32.5	9%	0.091	16%	0.159	C	C	.	.	H	α-helix	trans	-73.1	-35.8	-179	-170.9	0	0	0	0	112.7	L607 Q612 R613 I641 A647	L607-V609 VanDerWaalsContact C-N 3.31Å; L607-V609 PolarHBondContact O-N 3.42Å; V609-Q612 PolarHBondContact O-N 3.26Å; V609-R613 WeakPolarHBondContact O-CG 2.92Å; V609-R613 PolarHBondContact O-N 3.11Å; V609-I641 HydrophobicContact CG1-CB 4.29Å; V609-I641 HydrophobicContact CG1-CD1 4.2Å; V609-I641 HydrophobicContact CG2-CD1 3.94Å; V609-A647 HydrophobicContact CB-CB 4.23Å; V609-A647 HydrophobicContact CG1-CB 3.86Å; V609-A647 HydrophobicContact CG2-CB 4.18Å
610	A	80.3	Confident	82.9	Confident	7 Å²	7	36.6 Å²	36.6	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-69.7	-39.5	177.6	0	0	0	0	0	111.6	L607 R613 A614 S689 E692 F693	L607-A610 HydrophobicContact CB-CB 4.45Å; L607-A610 CarbonylContact O-C 3.49Å; L607-A610 WeakPolarHBondContact O-CA 3.45Å; L607-A610 WeakPolarHBondContact O-CB 3.25Å; L607-A610 PolarHBondContact O-N 3.01Å; A610-R613 PolarHBondContact O-N 2.91Å; A610-A614 WeakPolarHBondContact O-CB 3.49Å; A610-A614 PolarHBondContact O-N 3.48Å; A610-S689 VanDerWaalsContact CB-O 3.32Å; A610-S689 WeakPolarHBondContact CB-O 3.45Å; A610-E692 HydrophobicContact CB-CB 4.01Å; A610-F693 HydrophobicContact CB-CB 4.33Å
611	M	81.9	Confident	82.6	Confident	8 Å²	8	39 Å²	39	4%	0.039	20%	0.203	C	C	.	.	H	α-helix	trans	-62.9	-44.6	171.2	-69.2	-177.6	72.4	0	0	111.7	L607 R613 A614 K615 V616 V618 L631	L607-M611 HydrophobicContact CB-CG 3.95Å; L607-M611 HydrophobicContact CB-SD 4.3Å; L607-M611 PolarHBondContact O-N 2.68Å; M611-R613 VanDerWaalsContact C-N 3.3Å; M611-R613 PolarHBondContact O-N 2.85Å; M611-A614 CarbonylContact O-C 3.55Å; M611-A614 PolarHBondContact O-N 3.19Å; M611-K615 PolarHBondContact O-N 3.06Å; M611-V616 CarbonylContact C-O 3.43Å; M611-V616 HydrophobicContact CB-CB 4.47Å; M611-V616 HydrophobicContact CE-CB 4.33Å; M611-V616 HydrophobicContact CE-CG1 3.83Å; M611-V616 PolarHBondContact O-N 3.38Å; M611-V618 HydrophobicContact CE-CG2 4.03Å; M611-L631 HydrophobicContact CE-CD2 3.65Å
612	Q	79.5	Confident	82.2	Confident	47 Å²	47	41.3 Å²	41.3	22%	0.22	22%	0.217	C	C	.	.	H	α-helix	trans	-56.4	-43.1	173.8	-77.6	173.2	-41.1	0	0	112	K608 V609 K615	K608-Q612 WeakPolarHBondContact O-CG 3.47Å; K608-Q612 PolarHBondContact O-N 3.22Å; V609-Q612 PolarHBondContact O-N 3.26Å; Q612-K615 PolarHBondContact O-N 2.95Å
613	R	78.1	Confident	81.4	Confident	51 Å²	51	44 Å²	44	19%	0.192	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-43.8	177.3	-72.3	169.3	171.6	-140.3	-2.7	113.1	V609 A610 M611 K615 P639 I641 A642 D643 H644	V609-R613 WeakPolarHBondContact O-CG 2.92Å; V609-R613 PolarHBondContact O-N 3.11Å; A610-R613 PolarHBondContact O-N 2.91Å; M611-R613 VanDerWaalsContact C-N 3.3Å; M611-R613 PolarHBondContact O-N 2.85Å; R613-K615 PolarHBondContact O-N 3.07Å; R613-K615 VanDerWaalsContact O-N 3.13Å; R613-P639 HydrophobicContact CG-CB 4.24Å; R613-I641 PolarHBondContact NH2-O 3.15Å; R613-A642 PolarHBondContact NH2-O 2.9Å; R613-D643 PolarHBondContact NH2-O 3.38Å; R613-H644 PolarHBondContact NH1-CD2 3.02Å; R613-H644 VanDerWaalsContact NH1-CD2 3.34Å; R613-H644 PolarHBondContact NH1-CE1 3.3Å; R613-H644 PolarHBondContact NH1-ND1 3.22Å; R613-H644 PolarHBondContact NH1-NE2 3.37Å
614	A	78.2	Confident	80.5	Confident	11 Å²	11	49.5 Å²	49.5	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-4.9	171.9	0	0	0	0	0	113.5	A610 M611 V616 K633 E688 E692	A610-A614 WeakPolarHBondContact O-CB 3.49Å; A610-A614 PolarHBondContact O-N 3.48Å; M611-A614 CarbonylContact O-C 3.55Å; M611-A614 PolarHBondContact O-N 3.19Å; A614-V616 VanDerWaalsContact C-N 3.3Å; A614-V616 HydrophobicContact CB-CG2 4.01Å; A614-V616 PolarHBondContact O-N 3.23Å; A614-K633 WeakPolarHBondContact O-CE 3.31Å; A614-K633 PolarHBondContact O-NZ 3.31Å; A614-E688 HydrophobicContact CB-CB 4.4Å; A614-E692 HydrophobicContact CB-CG 4.47Å
615	K	83.6	Confident	79.8	Confident	76 Å²	76	51.2 Å²	51.2	33%	0.33	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	29.8	-176	-62.6	-165.2	174.7	-167	0	114.4	M611 Q612 R613 K633 I634 E635 M637	M611-K615 PolarHBondContact O-N 3.06Å; Q612-K615 PolarHBondContact O-N 2.95Å; R613-K615 PolarHBondContact O-N 3.07Å; R613-K615 VanDerWaalsContact O-N 3.13Å; K615-K633 HydrophobicContact CB-CG 4.31Å; K615-K633 CarbonylContact O-C 3.57Å; K615-K633 VanDerWaalsContact O-CA 3.31Å; K615-K633 WeakPolarHBondContact O-CA 3.36Å; K615-K633 WeakPolarHBondContact O-CG 3.3Å; K615-I634 WeakPolarHBondContact CB-O 3.33Å; K615-I634 PolarHBondContact O-N 3.42Å; K615-E635 PolarHBondContact NZ-O 3.33Å; K615-M637 VanDerWaalsContact CE-O 3.26Å; K615-M637 WeakPolarHBondContact CE-O 3.44Å; K615-M637 HydrophobicContact CG-CB 4.49Å
616	V	84.6	Confident	79.5	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.048	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	135.9	179	-174.1	0	0	0	0	110.2	M611 A614 L631 L685 S689	M611-V616 CarbonylContact C-O 3.43Å; M611-V616 HydrophobicContact CB-CB 4.47Å; M611-V616 HydrophobicContact CE-CB 4.33Å; M611-V616 HydrophobicContact CE-CG1 3.83Å; M611-V616 PolarHBondContact O-N 3.38Å; A614-V616 VanDerWaalsContact C-N 3.3Å; A614-V616 HydrophobicContact CB-CG2 4.01Å; A614-V616 PolarHBondContact O-N 3.23Å; V616-L631 HydrophobicContact CG1-CB 4.08Å; V616-L631 HydrophobicContact CG1-CD2 4.2Å; V616-L685 HydrophobicContact CG1-CB 4.1Å; V616-L685 HydrophobicContact CG2-CB 4Å; V616-L685 HydrophobicContact CG2-CD2 4.15Å; V616-S689 WeakPolarHBondContact CG2-OG 3.4Å
617	C	82.9	Confident	79.5	Confident	24 Å²	24	59.8 Å²	59.8	16%	0.162	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	161	172.8	71.2	0	0	0	0	111	L631 V632 I634	C617-L631 WeakPolarHBondContact O-CA 3.46Å; C617-V632 PolarHBondContact N-O 3.17Å; C617-V632 PolarHBondContact O-N 3.26Å; C617-V632 PolarHBondContact SG-O 3.19Å; C617-I634 HydrophobicContact CB-CD1 4.25Å; C617-I634 WeakPolarHBondContact SG-CD1 3.26Å
618	V	85.6	Confident	79.9	Confident	51 Å²	51	60.3 Å²	60.3	31%	0.309	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.7	168.9	-171.1	0	0	0	0	108.6	I600 M611 L629 R630 L631	I600-V618 HydrophobicContact CG2-CG1 3.88Å; I600-V618 HydrophobicContact CG2-CG2 3.93Å; M611-V618 HydrophobicContact CE-CG2 4.03Å; V618-L629 HydrophobicContact CG1-CB 3.78Å; V618-L629 HydrophobicContact CG1-CD1 4.11Å; V618-L629 HydrophobicContact CG1-CD2 4.05Å; V618-L629 HydrophobicContact CG1-CG 4.19Å; V618-R630 CarbonylContact C-O 3.58Å; V618-R630 WeakPolarHBondContact CA-O 3.43Å; V618-L631 HydrophobicContact CG2-CD2 4.01Å
619	R	84.1	Confident	80.3	Confident	143 Å²	143	57.2 Å²	57.2	54%	0.54	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.9	175.3	-56.8	-172.8	71.6	167.5	2.8	110.4	R630 V632	R619-R630 PolarHBondContact N-O 2.81Å; R619-R630 PolarHBondContact O-N 3.47Å; R619-V632 HydrophobicContact CB-CG2 4.41Å; R619-V632 HydrophobicContact CG-CB 4.34Å; R619-V632 HydrophobicContact CG-CG2 4.24Å
620	S	82.4	Confident	80.8	Confident	87 Å²	87	60 Å²	60	61%	0.608	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	135.5	170.4	48.5	0	0	0	0	110.9	H628	S620-H628 CarbonylContact C-O 3.59Å; S620-H628 WeakPolarHBondContact CA-O 3.43Å
621	V	83.9	Confident	81.1	Confident	57 Å²	57	60 Å²	60	35%	0.345	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.3	179.1	180	0	0	0	0	108.2	L623 H628 R630	V621-L623 HydrophobicContact CB-CD1 4.43Å; V621-L623 HydrophobicContact CG1-CD1 4.08Å; V621-L623 PolarHBondContact O-N 3.23Å; V621-H628 PolarHBondContact N-O 3.39Å; V621-H628 PolarHBondContact O-N 2.89Å; V621-R630 HydrophobicContact CB-CG 4.36Å; V621-R630 HydrophobicContact CG2-CB 4.22Å; V621-R630 HydrophobicContact CG2-CG 4.09Å
622	T	81.3	Confident	81.3	Confident	93 Å²	93	62 Å²	62	57%	0.571	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	116.7	179.4	-44.1	0	0	0	0	110.8	Q626 N627	T622-Q626 CarbonylContact C-O 3.52Å; T622-Q626 VanDerWaalsContact CA-O 3.25Å; T622-Q626 WeakPolarHBondContact CA-O 3.27Å; T622-N627 WeakPolarHBondContact CB-OD1 3.49Å; T622-N627 PolarHBondContact OG1-OD1 3.14Å
623	L	72.8	Confident	81.5	Confident	59 Å²	59	64.2 Å²	64.2	31%	0.309	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.7	167.1	-66.5	103	0	0	0	109.4	V621 G625 Q626 H628	V621-L623 HydrophobicContact CB-CD1 4.43Å; V621-L623 HydrophobicContact CG1-CD1 4.08Å; V621-L623 PolarHBondContact O-N 3.23Å; L623-G625 PolarHBondContact O-N 2.96Å; L623-Q626 PolarHBondContact N-O 2.95Å; L623-Q626 PolarHBondContact O-N 3.14Å; L623-H628 HydrophobicContact CD1-CB 4.4Å
624	A	67.1	Low	81.6	Confident	119 Å²	119	64.2 Å²	64.2	98%	0.983	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	11.6	179.7	0	0	0	0	0	116.9
625	G	70.9	Confident	81.2	Confident	67 Å²	67	71.4 Å²	71.4	69%	0.691	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.8	-1.5	-175.4	0	0	0	0	0	115	L623	L623-G625 PolarHBondContact O-N 2.96Å
626	Q	76.2	Confident	80	Confident	120 Å²	120	75.1 Å²	75.1	56%	0.561	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	151.6	172.6	-67.8	178.2	-53.1	0	0	110.3	T622 L623	T622-Q626 CarbonylContact C-O 3.52Å; T622-Q626 VanDerWaalsContact CA-O 3.25Å; T622-Q626 WeakPolarHBondContact CA-O 3.27Å; L623-Q626 PolarHBondContact N-O 2.95Å; L623-Q626 PolarHBondContact O-N 3.14Å
627	N	82.9	Confident	78.8	Confident	107 Å²	107	78.2 Å²	78.2	57%	0.572	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	113.7	-178	-72.8	-22.4	0	0	0	110	T622	T622-N627 WeakPolarHBondContact CB-OD1 3.49Å; T622-N627 PolarHBondContact OG1-OD1 3.14Å
628	H	86.4	Confident	77.5	Confident	13 Å²	13	84.4 Å²	84.4	6%	0.06	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	154.3	177.5	-61.7	-64.3	0	0	0	111.1	D594 D597 S620 V621 L623	D594-H628 IonicContact OD1-CE1 2.84Å; D594-H628 PolarHBondContact OD1-CE1 2.89Å; D594-H628 IonicContact OD1-ND1 3.97Å; D597-H628 WeakPolarHBondContact OD2-CA 3.32Å; D597-H628 IonicContact OD2-CE1 3.52Å; D597-H628 IonicContact OD2-CG 3.88Å; D597-H628 IonicContact OD2-ND1 2.84Å; D597-H628 PolarHBondContact OD2-ND1 3.13Å; S620-H628 CarbonylContact C-O 3.59Å; S620-H628 WeakPolarHBondContact CA-O 3.43Å; V621-H628 PolarHBondContact N-O 3.39Å; V621-H628 PolarHBondContact O-N 2.89Å; L623-H628 HydrophobicContact CD1-CB 4.4Å
629	L	86.7	Confident	76	Confident	39 Å²	39	85.5 Å²	85.5	20%	0.204	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.8	-177.5	-58	-176.5	0	0	0	110.5	D597 I600 T601 V618 R679	D597-L629 HydrophobicContact CB-CB 4.45Å; D597-L629 HydrophobicContact CB-CD1 4.15Å; D597-L629 HydrophobicContact CB-CG 4.09Å; D597-L629 WeakPolarHBondContact OD1-CB 3.43Å; D597-L629 PolarHBondContact OD1-N 2.99Å; I600-L629 HydrophobicContact CG2-CB 4.29Å; T601-L629 WeakPolarHBondContact OG1-CD1 3.4Å; V618-L629 HydrophobicContact CG1-CB 3.78Å; V618-L629 HydrophobicContact CG1-CD1 4.11Å; V618-L629 HydrophobicContact CG1-CD2 4.05Å; V618-L629 HydrophobicContact CG1-CG 4.19Å; L629-R679 PolarHBondContact O-NH2 2.68Å
630	R	87.1	Confident	74.6	Confident	72 Å²	72	86.6 Å²	86.6	27%	0.272	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146	174.2	-63.1	-159.4	172	-141.5	-5.7	112.4	V618 R619 V621 E682	V618-R630 CarbonylContact C-O 3.58Å; V618-R630 WeakPolarHBondContact CA-O 3.43Å; R619-R630 PolarHBondContact N-O 2.81Å; R619-R630 PolarHBondContact O-N 3.47Å; V621-R630 HydrophobicContact CB-CG 4.36Å; V621-R630 HydrophobicContact CG2-CB 4.22Å; V621-R630 HydrophobicContact CG2-CG 4.09Å; R630-E682 WeakPolarHBondContact CA-OE2 3.45Å; R630-E682 WeakPolarHBondContact CB-OE2 3.33Å; R630-E682 IonicContact NH1-OE1 3.84Å
631	L	86.2	Confident	73.4	Confident	8 Å²	8	85.2 Å²	85.2	4%	0.042	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	130.4	172.3	-60.4	-178.8	0	0	0	110.1	I600 M611 V616 C617 V618 E682 L685 L686	I600-L631 HydrophobicContact CG2-CD2 4.03Å; M611-L631 HydrophobicContact CE-CD2 3.65Å; V616-L631 HydrophobicContact CG1-CB 4.08Å; V616-L631 HydrophobicContact CG1-CD2 4.2Å; C617-L631 WeakPolarHBondContact O-CA 3.46Å; V618-L631 HydrophobicContact CG2-CD2 4.01Å; L631-E682 HydrophobicContact CB-CB 4.17Å; L631-E682 HydrophobicContact CB-CG 4.26Å; L631-E682 HydrophobicContact CD1-CB 4.46Å; L631-E682 PolarHBondContact N-OE2 3.11Å; L631-L685 HydrophobicContact CB-CB 4.38Å; L631-L685 HydrophobicContact CB-CD1 4.21Å; L631-L686 HydrophobicContact CD1-CB 3.81Å; L631-L686 HydrophobicContact CD1-CD1 4.14Å; L631-L686 HydrophobicContact CD1-CG 4.4Å
632	V	86.4	Confident	71.9	Confident	50 Å²	50	86.6 Å²	86.6	30%	0.303	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	138.4	-178.4	-177	0	0	0	0	110	C617 R619	C617-V632 PolarHBondContact N-O 3.17Å; C617-V632 PolarHBondContact O-N 3.26Å; C617-V632 PolarHBondContact SG-O 3.19Å; R619-V632 HydrophobicContact CB-CG2 4.41Å; R619-V632 HydrophobicContact CG-CB 4.34Å; R619-V632 HydrophobicContact CG-CG2 4.24Å
633	K	83.8	Confident	70.8	Confident	93 Å²	93	87.6 Å²	87.6	40%	0.404	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	134.2	175.9	-154.6	160.3	-169.7	148.7	0	111.1	A614 K615 L685 E688	A614-K633 WeakPolarHBondContact O-CE 3.31Å; A614-K633 PolarHBondContact O-NZ 3.31Å; K615-K633 HydrophobicContact CB-CG 4.31Å; K615-K633 CarbonylContact O-C 3.57Å; K615-K633 VanDerWaalsContact O-CA 3.31Å; K615-K633 WeakPolarHBondContact O-CA 3.36Å; K615-K633 WeakPolarHBondContact O-CG 3.3Å; K633-L685 HydrophobicContact CB-CD2 3.96Å; K633-L685 HydrophobicContact CD-CD2 3.86Å; K633-L685 HydrophobicContact CG-CD2 4.3Å; K633-E688 IonicContact NZ-OE1 3.36Å; K633-E688 PolarHBondContact NZ-OE1 2.9Å; K633-E688 IonicContact NZ-OE2 3.7Å; K633-E688 PolarHBondContact NZ-OE2 3.27Å
634	I	81.6	Confident	70.1	Confident	51 Å²	51	89.6 Å²	89.6	26%	0.262	50%	0.498	S	S	.	.			trans	-125.7	114.7	178.4	-64.1	-175.3	0	0	0	109.8	K615 C617 D636 M637	K615-I634 WeakPolarHBondContact CB-O 3.33Å; K615-I634 PolarHBondContact O-N 3.42Å; C617-I634 HydrophobicContact CB-CD1 4.25Å; C617-I634 WeakPolarHBondContact SG-CD1 3.26Å; I634-D636 VanDerWaalsContact C-N 3.32Å; I634-D636 PolarHBondContact O-N 3.36Å; I634-M637 HydrophobicContact CB-CG 3.86Å; I634-M637 HydrophobicContact CG2-CG 3.79Å; I634-M637 HydrophobicContact CG2-SD 4.16Å
635	E	67.9	Low	69.5	Low	163 Å²	163	91.5 Å²	91.5	76%	0.762	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-28.7	-172.7	-57.9	-167.2	146.5	0	0	113.7	K615 M637	K615-E635 PolarHBondContact NZ-O 3.33Å; E635-M637 VanDerWaalsContact C-N 3.35Å; E635-M637 PolarHBondContact O-N 3.46Å
636	D	59.5	Low	68.8	Low	154 Å²	154	91.1 Å²	91.1	82%	0.824	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-1	-174.9	-63.2	-48.9	0	0	0	115.4	I634 L638	I634-D636 VanDerWaalsContact C-N 3.32Å; I634-D636 PolarHBondContact O-N 3.36Å; D636-L638 PolarHBondContact O-N 3.44Å
637	M	58.5	Low	67.9	Low	72 Å²	72	85.9 Å²	85.9	36%	0.355	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-70	119.1	179.3	-58.8	-64.3	-78.5	0	0	110.9	K615 I634 E635	K615-M637 VanDerWaalsContact CE-O 3.26Å; K615-M637 WeakPolarHBondContact CE-O 3.44Å; K615-M637 HydrophobicContact CG-CB 4.49Å; I634-M637 HydrophobicContact CB-CG 3.86Å; I634-M637 HydrophobicContact CG2-CG 3.79Å; I634-M637 HydrophobicContact CG2-SD 4.16Å; E635-M637 VanDerWaalsContact C-N 3.35Å; E635-M637 PolarHBondContact O-N 3.46Å
638	L	55.3	Low	66.7	Low	155 Å²	155	83.3 Å²	83.3	81%	0.812	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-89.6	129	168.7	-69.3	172.9	0	0	0	109.6	D636 E640	D636-L638 PolarHBondContact O-N 3.44Å; L638-E640 PolarHBondContact O-N 3.06Å
639	P	56.1	Low	65.3	Low	73 Å²	73	88 Å²	88	47%	0.474	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-75.8	117.3	176.2	29.6	-32.6	0	0	0	110.6	R613 I641	R613-P639 HydrophobicContact CG-CB 4.24Å; P639-I641 VanDerWaalsContact C-N 3.32Å; P639-I641 PolarHBondContact O-N 3.24Å
640	E	54.3	Low	63.8	Low	167 Å²	167	89.7 Å²	89.7	78%	0.78	47%	0.467	S	S	*	.	S	Bend	trans	-72.7	-22.5	-178.6	-62	178.2	131.9	0	0	113.5	L638	L638-E640 PolarHBondContact O-N 3.06Å
641	I	57	Low	62.4	Low	57 Å²	57	86.8 Å²	86.8	29%	0.292	46%	0.457	S	S	.	.			trans	-115.6	109.8	-172.6	-52.4	172.5	0	0	0	110.3	V609 R613 P639 A647	V609-I641 HydrophobicContact CG1-CB 4.29Å; V609-I641 HydrophobicContact CG1-CD1 4.2Å; V609-I641 HydrophobicContact CG2-CD1 3.94Å; R613-I641 PolarHBondContact NH2-O 3.15Å; P639-I641 VanDerWaalsContact C-N 3.32Å; P639-I641 PolarHBondContact O-N 3.24Å; I641-A647 HydrophobicContact CG2-CB 4.14Å
642	A	52.3	Low	61	Low	87 Å²	87	88.1 Å²	88.1	72%	0.719	46%	0.463	S	S	*	.			trans	-77.7	-42	-179	0	0	0	0	0	113.7	R613	R613-A642 PolarHBondContact NH2-O 2.9Å
643	D	58.1	Low	59.4	Low	114 Å²	114	89.3 Å²	89.3	61%	0.61	47%	0.473	S	S	*	.			trans	-81.5	140.4	-174.3	-63.3	-48.4	0	0	0	113	R613	R613-D643 PolarHBondContact NH2-O 3.38Å
644	H	57	Low	58.2	Low	101 Å²	101	86.8 Å²	86.8	47%	0.468	46%	0.462	S	S	.	.	H	α-helix	trans	-76.3	-37.4	176.8	-74.9	-107.5	0	0	0	112.5	R613 Y648	R613-H644 PolarHBondContact NH1-CD2 3.02Å; R613-H644 VanDerWaalsContact NH1-CD2 3.34Å; R613-H644 PolarHBondContact NH1-CE1 3.3Å; R613-H644 PolarHBondContact NH1-ND1 3.22Å; R613-H644 PolarHBondContact NH1-NE2 3.37Å; H644-Y648 WeakPolarHBondContact O-CB 3.46Å; H644-Y648 PolarHBondContact O-N 2.63Å; H644-Y648 VanDerWaalsContact O-N 3.1Å
645	E	55.8	Low	57.2	Low	159 Å²	159	84.7 Å²	84.7	74%	0.743	45%	0.451	S	S	*	.	H	α-helix	trans	-70.7	-43.3	-173	-63	-171.8	150	0	0	112.5	Y648 L649	E645-Y648 PolarHBondContact O-N 3.31Å; E645-L649 WeakPolarHBondContact O-CB 3.41Å; E645-L649 VanDerWaalsContact O-CG 3.27Å; E645-L649 WeakPolarHBondContact O-CG 3.28Å; E645-L649 PolarHBondContact O-N 3.46Å
646	S	56.4	Low	57.1	Low	58 Å²	58	82.2 Å²	82.2	41%	0.406	44%	0.443	S	S	.	.	H	α-helix	trans	-64.8	-42.1	179	56.4	0	0	0	0	112.2	Y648 L649 D650	S646-Y648 VanDerWaalsContact C-N 3.35Å; S646-Y648 PolarHBondContact O-N 2.96Å; S646-L649 PolarHBondContact O-N 3.06Å; S646-D650 PolarHBondContact O-N 2.79Å; S646-D650 VanDerWaalsContact O-N 3.11Å
647	A	57.3	Low	57.7	Low	11 Å²	11	77 Å²	77	9%	0.091	42%	0.417	C	S	.	.	H	α-helix	trans	-61.3	-40.3	173.2	0	0	0	0	0	112.8	V609 I641 N651	V609-A647 HydrophobicContact CB-CB 4.23Å; V609-A647 HydrophobicContact CG1-CB 3.86Å; V609-A647 HydrophobicContact CG2-CB 4.18Å; I641-A647 HydrophobicContact CG2-CB 4.14Å; A647-N651 PolarHBondContact O-N 2.92Å
648	Y	58.1	Low	58.6	Low	53 Å²	53	74.7 Å²	74.7	21%	0.208	41%	0.406	C	S	.	.	H	α-helix	trans	-68.6	-40.5	177.9	174.1	-99	0	0	0	112.3	H644 E645 S646 N651 M652 K660 Y694	H644-Y648 WeakPolarHBondContact O-CB 3.46Å; H644-Y648 PolarHBondContact O-N 2.63Å; H644-Y648 VanDerWaalsContact O-N 3.1Å; E645-Y648 PolarHBondContact O-N 3.31Å; S646-Y648 VanDerWaalsContact C-N 3.35Å; S646-Y648 PolarHBondContact O-N 2.96Å; Y648-N651 PolarHBondContact O-N 2.96Å; Y648-M652 HydrophobicContact CD1-CG 4.28Å; Y648-M652 HydrophobicContact CD2-CG 4.31Å; Y648-M652 HydrophobicContact CE1-CG 3.83Å; Y648-M652 HydrophobicContact CE2-CE 3.85Å; Y648-M652 HydrophobicContact CE2-CG 3.86Å; Y648-M652 HydrophobicContact CE2-SD 4.15Å; Y648-M652 WeakPolarHBondContact O-CB 3.48Å; Y648-M652 WeakPolarHBondContact O-CG 3.37Å; Y648-M652 PolarHBondContact O-N 3.07Å; Y648-K660 PolarHBondContact OH-NZ 3.14Å; Y648-Y694 HydrophobicContact CD2-CD1 4.42Å
649	L	55.3	Low	59.8	Low	110 Å²	110	70 Å²	70	58%	0.576	39%	0.386	S	S	*	.	H	α-helix	trans	-66.1	-43	178.9	-72.3	167.1	0	0	0	112.4	E645 S646 C653	E645-L649 WeakPolarHBondContact O-CB 3.41Å; E645-L649 VanDerWaalsContact O-CG 3.27Å; E645-L649 WeakPolarHBondContact O-CG 3.28Å; E645-L649 PolarHBondContact O-N 3.46Å; S646-L649 PolarHBondContact O-N 3.06Å; L649-C653 PolarHBondContact O-N 3.5Å; L649-C653 PolarHBondContact O-SG 3.34Å
650	D	55	Low	60.9	Low	75 Å²	75	71.1 Å²	71.1	40%	0.401	38%	0.383	S	S	.	.	H	α-helix	trans	-61.7	-45.7	175.7	-174.3	47.4	0	0	0	111.7	S646 C653 K654	S646-D650 PolarHBondContact O-N 2.79Å; S646-D650 VanDerWaalsContact O-N 3.11Å; D650-C653 PolarHBondContact O-N 2.83Å; D650-K654 WeakPolarHBondContact O-CG 3.5Å; D650-K654 PolarHBondContact O-N 3.07Å; D650-K654 WeakPolarHBondContact OD1-CE 3.47Å; D650-K654 IonicContact OD1-NZ 2.65Å; D650-K654 PolarHBondContact OD1-NZ 3.2Å; D650-K654 IonicContact OD2-NZ 3.38Å; D650-K654 PolarHBondContact OD2-NZ 3.25Å
651	N	59.4	Low	62.4	Low	12 Å²	12	67.2 Å²	67.2	6%	0.064	37%	0.365	C	S	.	.	H	α-helix	trans	-70.5	-35.4	-179	-77.8	15	0	0	0	113.3	L606 A647 Y648 K654 T655	L606-N651 PolarHBondContact O-ND2 3.35Å; A647-N651 PolarHBondContact O-N 2.92Å; Y648-N651 PolarHBondContact O-N 2.96Å; N651-K654 PolarHBondContact O-N 2.93Å; N651-T655 WeakPolarHBondContact O-CB 3.35Å; N651-T655 WeakPolarHBondContact O-CG2 3.46Å; N651-T655 PolarHBondContact O-N 2.96Å; N651-T655 PolarHBondContact O-OG1 3.43Å
652	M	55.5	Low	63.7	Low	36 Å²	36	68.1 Å²	68.1	18%	0.177	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-49	174.6	-79.7	-78.2	115.9	0	0	111.2	Y648 K654 T655 N656	Y648-M652 HydrophobicContact CD1-CG 4.28Å; Y648-M652 HydrophobicContact CD2-CG 4.31Å; Y648-M652 HydrophobicContact CE1-CG 3.83Å; Y648-M652 HydrophobicContact CE2-CE 3.85Å; Y648-M652 HydrophobicContact CE2-CG 3.86Å; Y648-M652 HydrophobicContact CE2-SD 4.15Å; Y648-M652 WeakPolarHBondContact O-CB 3.48Å; Y648-M652 WeakPolarHBondContact O-CG 3.37Å; Y648-M652 PolarHBondContact O-N 3.07Å; M652-K654 PolarHBondContact O-N 3.02Å; M652-K654 VanDerWaalsContact O-N 3.14Å; M652-T655 PolarHBondContact O-N 3.38Å; M652-N656 PolarHBondContact O-N 3.36Å; M652-N656 PolarHBondContact O-ND2 3.06Å; M652-N656 PolarHBondContact O-OD1 3.28Å
653	C	53.2	Low	65.4	Low	74 Å²	74	64.4 Å²	64.4	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-55.2	-33.2	175.8	-72.4	0	0	0	0	113.1	S569 Q573 L649 D650	S569-C653 PolarHBondContact OG-O 3.11Å; Q573-C653 PolarHBondContact NE2-O 3.41Å; L649-C653 PolarHBondContact O-N 3.5Å; L649-C653 PolarHBondContact O-SG 3.34Å; D650-C653 PolarHBondContact O-N 2.83Å
654	K	58.5	Low	66.8	Low	41 Å²	41	59.4 Å²	59.4	18%	0.178	31%	0.31	C	S	.	.	H	α-helix	trans	-84.5	-16.2	179.7	-67.3	170.2	-176.6	174.3	0	114.3	A566 D650 N651 M652	A566-K654 PolarHBondContact O-NZ 3.05Å; A566-K654 VanDerWaalsContact O-NZ 3.14Å; D650-K654 WeakPolarHBondContact O-CG 3.5Å; D650-K654 PolarHBondContact O-N 3.07Å; D650-K654 WeakPolarHBondContact OD1-CE 3.47Å; D650-K654 IonicContact OD1-NZ 2.65Å; D650-K654 PolarHBondContact OD1-NZ 3.2Å; D650-K654 IonicContact OD2-NZ 3.38Å; D650-K654 PolarHBondContact OD2-NZ 3.25Å; N651-K654 PolarHBondContact O-N 2.93Å; M652-K654 PolarHBondContact O-N 3.02Å; M652-K654 VanDerWaalsContact O-N 3.14Å
655	T	60.6	Low	68.3	Low	7 Å²	7	59 Å²	59	4%	0.043	31%	0.309	C	S	.	.	H	α-helix	trans	-124.5	5.3	-168.6	58.5	0	0	0	0	116.2	L606 N651 M652 V657 L658 W663	L606-T655 HydrophobicContact CD1-CG2 3.93Å; N651-T655 WeakPolarHBondContact O-CB 3.35Å; N651-T655 WeakPolarHBondContact O-CG2 3.46Å; N651-T655 PolarHBondContact O-N 2.96Å; N651-T655 PolarHBondContact O-OG1 3.43Å; M652-T655 PolarHBondContact O-N 3.38Å; T655-V657 PolarHBondContact O-N 2.92Å; T655-L658 PolarHBondContact O-N 3.45Å; T655-W663 HydrophobicContact CG2-CZ2 3.85Å
656	N	66.3	Low	69.9	Low	111 Å²	111	52.4 Å²	52.4	59%	0.594	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-3.6	178.5	-80.4	-26.1	0	0	0	117.5	M652	M652-N656 PolarHBondContact O-N 3.36Å; M652-N656 PolarHBondContact O-ND2 3.06Å; M652-N656 PolarHBondContact O-OD1 3.28Å
657	V	71.5	Confident	71.6	Confident	44 Å²	44	49.8 Å²	49.8	27%	0.267	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-27.1	176.8	167.1	0	0	0	0	113	Q573 L576 K577 T655	Q573-V657 HydrophobicContact CB-CG2 3.63Å; Q573-V657 HydrophobicContact CG-CG2 3.78Å; L576-V657 HydrophobicContact CD2-CB 4.2Å; L576-V657 HydrophobicContact CD2-CG1 4.5Å; K577-V657 HydrophobicContact CD-CG1 4.34Å; K577-V657 HydrophobicContact CG-CG1 3.66Å; T655-V657 PolarHBondContact O-N 2.92Å
658	L	77.1	Confident	73.2	Confident	24 Å²	24	50.3 Å²	50.3	13%	0.126	26%	0.261	C	S	.	.	S	Bend	trans	-121.9	142.5	-176.1	-68.9	177.4	0	0	0	110.4	L576 L580 M602 T655 D662 W663 L666	L576-L658 HydrophobicContact CD1-CD1 4.02Å; L576-L658 HydrophobicContact CD2-CD1 4.03Å; L576-L658 HydrophobicContact CD2-CG 4.27Å; L576-L658 HydrophobicContact CG-CD1 4.1Å; L580-L658 HydrophobicContact CD2-CD2 4.2Å; M602-L658 HydrophobicContact CE-CD1 4.44Å; T655-L658 PolarHBondContact O-N 3.45Å; L658-D662 HydrophobicContact CB-CB 4.18Å; L658-D662 HydrophobicContact CD2-CB 4.17Å; L658-W663 HydrophobicContact CB-CD2 4.31Å; L658-W663 HydrophobicContact CB-CG 4.28Å; L658-W663 HydrophobicContact CD1-CD2 4.13Å; L658-W663 HydrophobicContact CD1-CE3 4.32Å; L658-W663 HydrophobicContact CD1-CH2 4.29Å; L658-W663 HydrophobicContact CD1-CZ2 4.08Å; L658-W663 HydrophobicContact CD1-CZ3 4.4Å; L658-L666 HydrophobicContact CD1-CD1 3.58Å
659	S	81.9	Confident	74.8	Confident	55 Å²	55	49.5 Å²	49.5	39%	0.385	26%	0.263	S	S	.	.			trans	-73.5	165.4	179.3	78.5	0	0	0	0	112.2	E661 D662 W663	S659-E661 PolarHBondContact O-N 2.66Å; S659-E661 VanDerWaalsContact O-N 3.12Å; S659-E661 PolarHBondContact OG-N 2.98Å; S659-D662 WeakPolarHBondContact CA-OD2 3.48Å; S659-D662 WeakPolarHBondContact CB-OD2 3.27Å; S659-D662 PolarHBondContact N-OD2 3.34Å; S659-D662 PolarHBondContact O-N 3.44Å; S659-D662 PolarHBondContact OG-N 2.98Å; S659-D662 VanDerWaalsContact OG-N 3.11Å; S659-D662 PolarHBondContact OG-OD2 3.42Å; S659-W663 PolarHBondContact O-N 2.9Å
660	K	79.2	Confident	76.5	Confident	97 Å²	97	44.3 Å²	44.3	42%	0.422	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.4	171.8	-66.4	-171.2	171.5	-155.2	0	113.9	Y648 S695 R702	Y648-K660 PolarHBondContact OH-NZ 3.14Å; K660-S695 WeakPolarHBondContact CD-OG 3.4Å; K660-S695 WeakPolarHBondContact CE-OG 3.45Å; K660-S695 PolarHBondContact NZ-OG 2.9Å; K660-R702 PolarHBondContact O-NH1 2.89Å; K660-R702 PolarHBondContact O-NH2 2.74Å
661	E	84.1	Confident	78.3	Confident	86 Å²	86	40.7 Å²	40.7	40%	0.402	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-44.5	170.3	-170.6	56.9	-133.1	0	0	110.9	S659 W663 W664 Q665 R702	S659-E661 PolarHBondContact O-N 2.66Å; S659-E661 VanDerWaalsContact O-N 3.12Å; S659-E661 PolarHBondContact OG-N 2.98Å; E661-W663 VanDerWaalsContact C-N 3.32Å; E661-W663 PolarHBondContact O-N 2.98Å; E661-W664 WeakPolarHBondContact O-CA 3.43Å; E661-W664 WeakPolarHBondContact O-CB 3.49Å; E661-W664 PolarHBondContact O-N 2.92Å; E661-Q665 HydrophobicContact CG-CG 4.41Å; E661-Q665 WeakPolarHBondContact O-CG 3.37Å; E661-Q665 PolarHBondContact O-N 2.59Å; E661-Q665 PolarHBondContact OE1-NE2 3.21Å; E661-R702 IonicContact OE2-CZ 4Å; E661-R702 IonicContact OE2-NH2 3.62Å; E661-R702 PolarHBondContact OE2-NH2 3.05Å
662	D	86.1	Confident	79.9	Confident	75 Å²	75	44.4 Å²	44.4	40%	0.401	24%	0.236	S	C	.	.	H	α-helix	trans	-58.4	-44.6	177.6	-54.3	-56.6	0	0	0	111.5	L658 S659 W664 Q665 L666	L658-D662 HydrophobicContact CB-CB 4.18Å; L658-D662 HydrophobicContact CD2-CB 4.17Å; S659-D662 WeakPolarHBondContact CA-OD2 3.48Å; S659-D662 WeakPolarHBondContact CB-OD2 3.27Å; S659-D662 PolarHBondContact N-OD2 3.34Å; S659-D662 PolarHBondContact O-N 3.44Å; S659-D662 PolarHBondContact OG-N 2.98Å; S659-D662 VanDerWaalsContact OG-N 3.11Å; S659-D662 PolarHBondContact OG-OD2 3.42Å; D662-W664 PolarHBondContact O-N 3.48Å; D662-Q665 PolarHBondContact O-N 2.98Å; D662-L666 WeakPolarHBondContact O-CB 3.37Å; D662-L666 VanDerWaalsContact O-CG 3.22Å; D662-L666 WeakPolarHBondContact O-CG 3.32Å; D662-L666 PolarHBondContact O-N 3.04Å
663	W	86.3	Confident	81.5	Confident	10 Å²	10	42.9 Å²	42.9	4%	0.038	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-31.8	174.5	-81.2	123.4	0	0	0	113.6	L576 M602 L606 T655 L658 S659 E661 L666 L667	L576-W663 HydrophobicContact CD1-CH2 3.52Å; L576-W663 HydrophobicContact CD1-CZ2 4.05Å; L576-W663 HydrophobicContact CD1-CZ3 4.28Å; L576-W663 HydrophobicContact CD2-CH2 3.84Å; L576-W663 HydrophobicContact CD2-CZ2 3.46Å; L576-W663 VanDerWaalsContact CD2-CZ2 3.46Å; L576-W663 HydrophobicContact CG-CH2 4.35Å; L576-W663 HydrophobicContact CG-CZ2 4.4Å; M602-W663 HydrophobicContact CB-CZ3 4.39Å; L606-W663 HydrophobicContact CB-CE3 4.24Å; L606-W663 HydrophobicContact CB-CH2 3.84Å; L606-W663 HydrophobicContact CB-CZ2 4.15Å; L606-W663 HydrophobicContact CB-CZ3 3.9Å; L606-W663 HydrophobicContact CD1-CD2 4.2Å; L606-W663 HydrophobicContact CD1-CG 4.47Å; L606-W663 HydrophobicContact CD1-CZ2 4.19Å; L606-W663 HydrophobicContact CD2-CB 4.18Å; L606-W663 HydrophobicContact CD2-CD2 3.71Å; L606-W663 HydrophobicContact CD2-CE3 3.69Å; L606-W663 HydrophobicContact CD2-CG 3.97Å; L606-W663 HydrophobicContact CD2-CZ3 4.22Å; L606-W663 HydrophobicContact CG-CD2 4.35Å; L606-W663 HydrophobicContact CG-CE3 4.41Å; T655-W663 HydrophobicContact CG2-CZ2 3.85Å; L658-W663 HydrophobicContact CB-CD2 4.31Å; L658-W663 HydrophobicContact CB-CG 4.28Å; L658-W663 HydrophobicContact CD1-CD2 4.13Å; L658-W663 HydrophobicContact CD1-CE3 4.32Å; L658-W663 HydrophobicContact CD1-CH2 4.29Å; L658-W663 HydrophobicContact CD1-CZ2 4.08Å; L658-W663 HydrophobicContact CD1-CZ3 4.4Å; S659-W663 PolarHBondContact O-N 2.9Å; E661-W663 VanDerWaalsContact C-N 3.32Å; E661-W663 PolarHBondContact O-N 2.98Å; W663-L666 HydrophobicContact CE3-CD1 4.12Å; W663-L667 WeakPolarHBondContact O-CB 3.48Å; W663-L667 PolarHBondContact O-N 3.06Å; W663-L667 VanDerWaalsContact O-N 3.08Å
664	W	88.1	Confident	83.3	Confident	8 Å²	8	39.3 Å²	39.3	3%	0.03	21%	0.205	C	C	.	.	H	α-helix	trans	-75.1	-44.6	176.4	176.7	-111.4	0	0	0	111.3	E661 D662 L666 L667 L668 F696 R702 E705 L706	E661-W664 WeakPolarHBondContact O-CA 3.43Å; E661-W664 WeakPolarHBondContact O-CB 3.49Å; E661-W664 PolarHBondContact O-N 2.92Å; D662-W664 PolarHBondContact O-N 3.48Å; W664-L666 VanDerWaalsContact C-N 3.3Å; W664-L666 PolarHBondContact O-N 2.97Å; W664-L667 HydrophobicContact CE3-CD2 4.11Å; W664-L667 HydrophobicContact CZ3-CD2 4.03Å; W664-L667 PolarHBondContact O-N 3.36Å; W664-L668 HydrophobicContact CD2-CD1 4.49Å; W664-L668 HydrophobicContact CD2-CG 4.48Å; W664-L668 HydrophobicContact CH2-CD2 4.45Å; W664-L668 HydrophobicContact CZ2-CD1 4.2Å; W664-L668 HydrophobicContact CZ2-CD2 4.08Å; W664-L668 HydrophobicContact CZ2-CG 4.27Å; W664-L668 WeakPolarHBondContact O-CG 3.26Å; W664-L668 PolarHBondContact O-N 3.1Å; W664-F696 HydrophobicContact CB-CE1 4.31Å; W664-F696 AromaticContact CE3-CD1 3.96Å; W664-F696 HydrophobicContact CE3-CD1 3.96Å; W664-F696 HydrophobicContact CE3-CE1 4.03Å; W664-F696 HydrophobicContact CE3-CG 4.33Å; W664-F696 HydrophobicContact CE3-CZ 4.45Å; W664-F696 HydrophobicContact CZ3-CG 4.49Å; W664-R702 HydrophobicContact CD2-CG 4.04Å; W664-R702 HydrophobicContact CE3-CB 4.41Å; W664-R702 HydrophobicContact CE3-CG 4.38Å; W664-R702 HydrophobicContact CH2-CB 3.66Å; W664-R702 HydrophobicContact CH2-CG 4.11Å; W664-R702 WeakPolarHBondContact CH2-O 3.29Å; W664-R702 HydrophobicContact CZ2-CB 3.76Å; W664-R702 HydrophobicContact CZ2-CG 3.72Å; W664-R702 HydrophobicContact CZ3-CB 3.99Å; W664-R702 HydrophobicContact CZ3-CG 4.4Å; W664-E705 HydrophobicContact CH2-CB 4.41Å; W664-E705 HydrophobicContact CZ2-CB 4.22Å; W664-E705 WeakPolarHBondContact CZ2-OE2 3.41Å; W664-L706 HydrophobicContact CH2-CD2 4.01Å; W664-L706 HydrophobicContact CH2-CG 3.87Å; W664-L706 HydrophobicContact CZ3-CD1 4.21Å; W664-L706 HydrophobicContact CZ3-CD2 3.95Å; W664-L706 HydrophobicContact CZ3-CG 3.94Å
665	Q	89.3	Confident	84.8	Confident	92 Å²	92	39.2 Å²	39.2	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-63.5	-34.2	174.6	-64.2	-59.2	-34.1	0	0	112.4	E661 D662 S669	E661-Q665 HydrophobicContact CG-CG 4.41Å; E661-Q665 WeakPolarHBondContact O-CG 3.37Å; E661-Q665 PolarHBondContact O-N 2.59Å; E661-Q665 PolarHBondContact OE1-NE2 3.21Å; D662-Q665 PolarHBondContact O-N 2.98Å; Q665-S669 WeakPolarHBondContact O-CB 3.21Å; Q665-S669 PolarHBondContact O-N 3.33Å; Q665-S669 PolarHBondContact O-OG 3.12Å
666	L	89.4	Confident	86.2	Confident	22 Å²	22	44.3 Å²	44.3	12%	0.115	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-45.1	172.2	-72.8	166.3	0	0	0	111.8	L580 M599 M602 L658 D662 W663 W664 S669 C670	L580-L666 HydrophobicContact CD1-CD2 4.08Å; M599-L666 HydrophobicContact CE-CB 3.9Å; M599-L666 HydrophobicContact CE-CD2 3.66Å; M599-L666 HydrophobicContact CE-CG 4.4Å; M599-L666 WeakPolarHBondContact CE-O 3.49Å; M599-L666 HydrophobicContact SD-CD2 3.87Å; M602-L666 HydrophobicContact CE-CD1 3.75Å; M602-L666 HydrophobicContact CE-CD2 4.1Å; L658-L666 HydrophobicContact CD1-CD1 3.58Å; D662-L666 WeakPolarHBondContact O-CB 3.37Å; D662-L666 VanDerWaalsContact O-CG 3.22Å; D662-L666 WeakPolarHBondContact O-CG 3.32Å; D662-L666 PolarHBondContact O-N 3.04Å; W663-L666 HydrophobicContact CE3-CD1 4.12Å; W664-L666 VanDerWaalsContact C-N 3.3Å; W664-L666 PolarHBondContact O-N 2.97Å; L666-S669 PolarHBondContact O-N 3.1Å; L666-C670 PolarHBondContact O-N 3.26Å
667	L	90.8	Very high	87.2	Confident	3 Å²	3	42 Å²	42	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-50.3	175.1	178.9	63.1	0	0	0	111.2	I603 W663 W664 S669 C670 L671 L686 A690 F696 L706	I603-L667 HydrophobicContact CD1-CD1 4.35Å; I603-L667 HydrophobicContact CG2-CD1 4.47Å; W663-L667 WeakPolarHBondContact O-CB 3.48Å; W663-L667 PolarHBondContact O-N 3.06Å; W663-L667 VanDerWaalsContact O-N 3.08Å; W664-L667 HydrophobicContact CE3-CD2 4.11Å; W664-L667 HydrophobicContact CZ3-CD2 4.03Å; W664-L667 PolarHBondContact O-N 3.36Å; L667-S669 VanDerWaalsContact C-N 3.33Å; L667-S669 PolarHBondContact O-N 2.89Å; L667-C670 WeakPolarHBondContact O-CB 3.28Å; L667-C670 PolarHBondContact O-N 3.18Å; L667-C670 VanDerWaalsContact O-N 3.12Å; L667-L671 HydrophobicContact CD1-CD1 4.32Å; L667-L671 HydrophobicContact CD1-CG 4.41Å; L667-L671 HydrophobicContact CG-CD1 4.03Å; L667-L671 WeakPolarHBondContact O-CG 3.29Å; L667-L671 PolarHBondContact O-N 3.43Å; L667-L686 HydrophobicContact CD1-CD1 4.18Å; L667-L686 HydrophobicContact CD1-CD2 4.06Å; L667-L686 HydrophobicContact CD1-CG 3.91Å; L667-A690 HydrophobicContact CD2-CB 3.78Å; L667-F696 HydrophobicContact CD2-CD2 4.11Å; L667-F696 HydrophobicContact CD2-CE2 3.76Å; L667-F696 HydrophobicContact CD2-CZ 4.34Å; L667-L706 HydrophobicContact CD2-CD2 4.15Å
668	L	91.6	Very high	88.1	Confident	22 Å²	22	47 Å²	47	12%	0.115	24%	0.244	C	C	.	.	H	α-helix	trans	-58.6	-43.1	174.9	-69.5	177.7	0	0	0	112	W664 C670 L671 L672 F709	W664-L668 HydrophobicContact CD2-CD1 4.49Å; W664-L668 HydrophobicContact CD2-CG 4.48Å; W664-L668 HydrophobicContact CH2-CD2 4.45Å; W664-L668 HydrophobicContact CZ2-CD1 4.2Å; W664-L668 HydrophobicContact CZ2-CD2 4.08Å; W664-L668 HydrophobicContact CZ2-CG 4.27Å; W664-L668 WeakPolarHBondContact O-CG 3.26Å; W664-L668 PolarHBondContact O-N 3.1Å; L668-C670 PolarHBondContact O-N 3.13Å; L668-L671 PolarHBondContact O-N 2.9Å; L668-L672 WeakPolarHBondContact O-CB 3.21Å; L668-L672 VanDerWaalsContact O-CG 3.31Å; L668-L672 WeakPolarHBondContact O-CG 3.25Å; L668-L672 PolarHBondContact O-N 3.33Å; L668-F709 HydrophobicContact CD2-CD2 4.3Å; L668-F709 HydrophobicContact CD2-CE2 3.49Å; L668-F709 VanDerWaalsContact CD2-CE2 3.49Å; L668-F709 HydrophobicContact CD2-CZ 4.03Å
669	S	91.1	Very high	88.6	Confident	36 Å²	36	46.5 Å²	46.5	25%	0.252	24%	0.241	S	C	.	.	H	α-helix	trans	-66.3	-21.1	177.3	-66.4	0	0	0	0	114.1	Y595 Q665 L666 L667	Y595-S669 PolarHBondContact OH-O 3.26Å; Y595-S669 VanDerWaalsContact OH-O 3.07Å; Q665-S669 WeakPolarHBondContact O-CB 3.21Å; Q665-S669 PolarHBondContact O-N 3.33Å; Q665-S669 PolarHBondContact O-OG 3.12Å; L666-S669 PolarHBondContact O-N 3.1Å; L667-S669 VanDerWaalsContact C-N 3.33Å; L667-S669 PolarHBondContact O-N 2.89Å
670	C	92.4	Very high	89	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-85.7	-44.6	172.7	-167.6	0	0	0	0	111.4	M599 I603 L666 L667 L668 L672 G673 L674 L686	M599-C670 HydrophobicContact CB-CB 4.25Å; M599-C670 HydrophobicContact CE-CB 4.05Å; I603-C670 HydrophobicContact CD1-CB 3.49Å; I603-C670 VanDerWaalsContact CD1-CB 3.49Å; L666-C670 PolarHBondContact O-N 3.26Å; L667-C670 WeakPolarHBondContact O-CB 3.28Å; L667-C670 PolarHBondContact O-N 3.18Å; L667-C670 VanDerWaalsContact O-N 3.12Å; L668-C670 PolarHBondContact O-N 3.13Å; C670-L672 VanDerWaalsContact C-N 3.33Å; C670-L672 PolarHBondContact O-N 2.98Å; C670-G673 PolarHBondContact O-N 3.06Å; C670-L674 WeakPolarHBondContact O-CG 3.37Å; C670-L674 PolarHBondContact O-N 3.09Å; C670-L686 HydrophobicContact CB-CD2 4.38Å
671	L	92.3	Very high	89.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-44.4	175.9	-68.8	166.5	0	0	0	111.3	L667 L668 L674 C675 V683 L686 V687 L706 F709	L667-L671 HydrophobicContact CD1-CD1 4.32Å; L667-L671 HydrophobicContact CD1-CG 4.41Å; L667-L671 HydrophobicContact CG-CD1 4.03Å; L667-L671 WeakPolarHBondContact O-CG 3.29Å; L667-L671 PolarHBondContact O-N 3.43Å; L668-L671 PolarHBondContact O-N 2.9Å; L671-L674 PolarHBondContact O-N 3.44Å; L671-C675 PolarHBondContact O-N 2.87Å; L671-C675 PolarHBondContact O-SG 3.28Å; L671-C675 VanDerWaalsContact O-SG 3.42Å; L671-V683 HydrophobicContact CD2-CG1 3.76Å; L671-L686 HydrophobicContact CD2-CB 4.08Å; L671-L686 HydrophobicContact CD2-CD2 3.84Å; L671-L686 HydrophobicContact CD2-CG 4.04Å; L671-L686 HydrophobicContact CG-CD2 4.23Å; L671-V687 HydrophobicContact CD2-CG2 3.93Å; L671-L706 HydrophobicContact CD1-CD2 4.25Å; L671-F709 HydrophobicContact CD1-CD2 4.43Å
672	L	91.6	Very high	89.8	Confident	90 Å²	90	43 Å²	43	47%	0.471	22%	0.219	S	C	.	.	H	α-helix	trans	-64.6	-45.2	175.8	-69.2	171.5	0	0	0	112.1	L668 C670 L674 C675 D676 F709	L668-L672 WeakPolarHBondContact O-CB 3.21Å; L668-L672 VanDerWaalsContact O-CG 3.31Å; L668-L672 WeakPolarHBondContact O-CG 3.25Å; L668-L672 PolarHBondContact O-N 3.33Å; C670-L672 VanDerWaalsContact C-N 3.33Å; C670-L672 PolarHBondContact O-N 2.98Å; L672-L674 VanDerWaalsContact C-N 3.32Å; L672-L674 PolarHBondContact O-N 2.92Å; L672-C675 WeakPolarHBondContact O-CA 2.98Å; L672-C675 WeakPolarHBondContact O-CB 3.48Å; L672-C675 PolarHBondContact O-N 3.29Å; L672-C675 VanDerWaalsContact O-N 3.1Å; L672-D676 PolarHBondContact O-N 2.89Å; L672-F709 HydrophobicContact CD2-CE1 4.27Å
673	G	89.6	Confident	90	Very high	3 Å²	3	39.5 Å²	39.5	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-34.1	177.8	0	0	0	0	0	113.7	C670 D676 L677	C670-G673 PolarHBondContact O-N 3.06Å; G673-D676 PolarHBondContact O-N 3.06Å; G673-L677 PolarHBondContact O-N 3.32Å
674	L	90.8	Very high	90.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-38.7	171.8	-73.4	167.1	0	0	0	111.7	L596 C670 L671 L672 L677 Q678 R679 E682 V683 L686	L596-L674 HydrophobicContact CD1-CD2 4.04Å; L596-L674 HydrophobicContact CD1-CG 4.43Å; L596-L674 HydrophobicContact CD2-CD2 4.37Å; L596-L674 HydrophobicContact CD2-CG 4.05Å; C670-L674 WeakPolarHBondContact O-CG 3.37Å; C670-L674 PolarHBondContact O-N 3.09Å; L671-L674 PolarHBondContact O-N 3.44Å; L672-L674 VanDerWaalsContact C-N 3.32Å; L672-L674 PolarHBondContact O-N 2.92Å; L674-L677 CarbonylContact O-C 3.54Å; L674-L677 PolarHBondContact O-N 3.4Å; L674-Q678 PolarHBondContact O-N 3.44Å; L674-Q678 VanDerWaalsContact O-N 3.14Å; L674-R679 HydrophobicContact CB-CB 4.35Å; L674-R679 HydrophobicContact CD2-CB 3.8Å; L674-R679 HydrophobicContact CD2-CG 4.46Å; L674-R679 PolarHBondContact O-N 3.16Å; L674-E682 HydrophobicContact CD1-CB 4.41Å; L674-E682 HydrophobicContact CD2-CB 4.21Å; L674-V683 HydrophobicContact CB-CG2 3.5Å; L674-V683 HydrophobicContact CD1-CG2 4.3Å; L674-L686 HydrophobicContact CD1-CD2 3.99Å
675	C	90.3	Very high	90.3	Very high	38 Å²	38	39.1 Å²	39.1	26%	0.257	20%	0.199	S	C	.	.	H	α-helix	trans	-64.2	-40.8	172.9	-75.8	0	0	0	0	112.7	L671 L672 L677 Q678 F680	L671-C675 PolarHBondContact O-N 2.87Å; L671-C675 PolarHBondContact O-SG 3.28Å; L671-C675 VanDerWaalsContact O-SG 3.42Å; L672-C675 WeakPolarHBondContact O-CA 2.98Å; L672-C675 WeakPolarHBondContact O-CB 3.48Å; L672-C675 PolarHBondContact O-N 3.29Å; L672-C675 VanDerWaalsContact O-N 3.1Å; C675-L677 PolarHBondContact O-N 2.92Å; C675-Q678 PolarHBondContact O-N 3.41Å; C675-F680 HydrophobicContact CB-CE1 4.36Å
676	D	89.4	Confident	90.4	Very high	114 Å²	114	34.9 Å²	34.9	61%	0.61	18%	0.18	S	C	*	.	H	α-helix	trans	-59.3	-36.7	176.4	-69.6	-28.8	0	0	0	111.8	M592 L672 G673 Q678	M592-D676 HydrophobicContact CE-CB 4.41Å; L672-D676 PolarHBondContact O-N 2.89Å; G673-D676 PolarHBondContact O-N 3.06Å; D676-Q678 VanDerWaalsContact C-N 3.34Å
677	L	88.6	Confident	90.4	Very high	62 Å²	62	33.9 Å²	33.9	33%	0.325	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	8.1	174.5	-58.6	-168.3	0	0	0	114.2	M592 E593 L596 G673 L674 C675 R679	M592-L677 HydrophobicContact CB-CD1 4.3Å; M592-L677 HydrophobicContact CB-CD2 4.27Å; E593-L677 VanDerWaalsContact CD-CD1 3.49Å; E593-L677 HydrophobicContact CG-CD1 3.94Å; E593-L677 WeakPolarHBondContact OE2-CD1 3.45Å; L596-L677 HydrophobicContact CD1-CD1 3.56Å; L596-L677 HydrophobicContact CD1-CG 4.25Å; G673-L677 PolarHBondContact O-N 3.32Å; L674-L677 CarbonylContact O-C 3.54Å; L674-L677 PolarHBondContact O-N 3.4Å; C675-L677 PolarHBondContact O-N 2.92Å; L677-R679 HydrophobicContact CB-CG 4.08Å; L677-R679 PolarHBondContact O-N 2.98Å
678	Q	89.3	Confident	90.3	Very high	149 Å²	149	35.7 Å²	35.7	70%	0.696	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	23.1	-179.6	-53	-178.1	4.4	0	0	114.6	L674 C675 D676 F680	L674-Q678 PolarHBondContact O-N 3.44Å; L674-Q678 VanDerWaalsContact O-N 3.14Å; C675-Q678 PolarHBondContact O-N 3.41Å; D676-Q678 VanDerWaalsContact C-N 3.34Å; Q678-F680 HydrophobicContact CB-CD2 4.36Å; Q678-F680 HydrophobicContact CB-CE2 3.69Å; Q678-F680 HydrophobicContact CB-CZ 3.91Å; Q678-F680 HydrophobicContact CG-CE2 4.16Å; Q678-F680 HydrophobicContact CG-CZ 4.03Å; Q678-F680 WeakPolarHBondContact O-CD2 3.21Å; Q678-F680 PolarHBondContact O-N 3.32Å
679	R	89.4	Confident	90.1	Very high	15 Å²	15	34.7 Å²	34.7	6%	0.057	18%	0.178	C	C	.	.			trans	-79.2	48.2	179.5	-66.8	171.8	64	178.7	-11.8	111.5	E593 L629 L674 L677 E681 E682 V683	E593-R679 IonicContact OE2-CZ 3.55Å; E593-R679 IonicContact OE2-NH1 2.8Å; E593-R679 PolarHBondContact OE2-NH1 3.16Å; L629-R679 PolarHBondContact O-NH2 2.68Å; L674-R679 HydrophobicContact CB-CB 4.35Å; L674-R679 HydrophobicContact CD2-CB 3.8Å; L674-R679 HydrophobicContact CD2-CG 4.46Å; L674-R679 PolarHBondContact O-N 3.16Å; L677-R679 HydrophobicContact CB-CG 4.08Å; L677-R679 PolarHBondContact O-N 2.98Å; R679-E681 VanDerWaalsContact C-N 3.33Å; R679-E681 PolarHBondContact O-N 3Å; R679-E682 IonicContact CZ-OE1 3.91Å; R679-E682 IonicContact CZ-OE2 3.59Å; R679-E682 IonicContact NE-OE1 3.95Å; R679-E682 PolarHBondContact NE-OE1 2.98Å; R679-E682 IonicContact NE-OE2 3.4Å; R679-E682 VanDerWaalsContact NH2-CD 3.3Å; R679-E682 IonicContact NH2-OE1 2.98Å; R679-E682 PolarHBondContact NH2-OE1 3.13Å; R679-E682 VanDerWaalsContact NH2-OE1 3.16Å; R679-E682 IonicContact NH2-OE2 2.97Å; R679-E682 PolarHBondContact NH2-OE2 3.1Å; R679-E682 WeakPolarHBondContact O-CB 3.32Å; R679-E682 PolarHBondContact O-N 3.49Å; R679-V683 PolarHBondContact O-N 2.93Å
680	F	90.4	Very high	89.9	Confident	37 Å²	37	33 Å²	33	16%	0.162	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-29.2	-167.3	-56.1	-58.1	0	0	0	115.2	C675 Q678 E682 V683 D684 L716 N717	C675-F680 HydrophobicContact CB-CE1 4.36Å; Q678-F680 HydrophobicContact CB-CD2 4.36Å; Q678-F680 HydrophobicContact CB-CE2 3.69Å; Q678-F680 HydrophobicContact CB-CZ 3.91Å; Q678-F680 HydrophobicContact CG-CE2 4.16Å; Q678-F680 HydrophobicContact CG-CZ 4.03Å; Q678-F680 WeakPolarHBondContact O-CD2 3.21Å; Q678-F680 PolarHBondContact O-N 3.32Å; F680-E682 VanDerWaalsContact C-N 3.3Å; F680-E682 PolarHBondContact O-N 2.79Å; F680-V683 PolarHBondContact O-N 3.39Å; F680-D684 PolarHBondContact O-N 3.27Å; F680-L716 HydrophobicContact CD1-CB 4.09Å; F680-L716 HydrophobicContact CD1-CD1 4Å; F680-L716 HydrophobicContact CD2-CB 3.86Å; F680-L716 HydrophobicContact CE1-CB 4.24Å; F680-L716 HydrophobicContact CE1-CD1 3.62Å; F680-L716 HydrophobicContact CE2-CB 4.01Å; F680-L716 HydrophobicContact CG-CB 3.9Å; F680-L716 HydrophobicContact CZ-CB 4.2Å; F680-L716 HydrophobicContact CZ-CD1 3.95Å; F680-N717 HydrophobicContact CB-CB 4Å
681	E	89	Confident	89.6	Confident	119 Å²	119	34.7 Å²	34.7	56%	0.556	17%	0.174	S	C	*	.	H	α-helix	trans	-62.2	-39.4	172.9	-172.8	174	-172.8	0	0	111.7	R679 V683 D684 L685 N717	R679-E681 VanDerWaalsContact C-N 3.33Å; R679-E681 PolarHBondContact O-N 3Å; E681-V683 VanDerWaalsContact C-N 3.35Å; E681-D684 PolarHBondContact O-N 3.01Å; E681-L685 WeakPolarHBondContact O-CG 3.46Å; E681-L685 PolarHBondContact O-N 3.26Å; E681-L685 VanDerWaalsContact O-N 3.07Å; E681-N717 WeakPolarHBondContact CB-ND2 3.5Å
682	E	89.8	Confident	89	Confident	9 Å²	9	38.8 Å²	38.8	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-75	-28.5	-178.3	-56.5	-175.6	-115.2	0	0	111.5	R630 L631 L674 R679 F680 L686	R630-E682 WeakPolarHBondContact CA-OE2 3.45Å; R630-E682 WeakPolarHBondContact CB-OE2 3.33Å; R630-E682 IonicContact NH1-OE1 3.84Å; L631-E682 HydrophobicContact CB-CB 4.17Å; L631-E682 HydrophobicContact CB-CG 4.26Å; L631-E682 HydrophobicContact CD1-CB 4.46Å; L631-E682 PolarHBondContact N-OE2 3.11Å; L674-E682 HydrophobicContact CD1-CB 4.41Å; L674-E682 HydrophobicContact CD2-CB 4.21Å; R679-E682 IonicContact CZ-OE1 3.91Å; R679-E682 IonicContact CZ-OE2 3.59Å; R679-E682 IonicContact NE-OE1 3.95Å; R679-E682 PolarHBondContact NE-OE1 2.98Å; R679-E682 IonicContact NE-OE2 3.4Å; R679-E682 VanDerWaalsContact NH2-CD 3.3Å; R679-E682 IonicContact NH2-OE1 2.98Å; R679-E682 PolarHBondContact NH2-OE1 3.13Å; R679-E682 VanDerWaalsContact NH2-OE1 3.16Å; R679-E682 IonicContact NH2-OE2 2.97Å; R679-E682 PolarHBondContact NH2-OE2 3.1Å; R679-E682 WeakPolarHBondContact O-CB 3.32Å; R679-E682 PolarHBondContact O-N 3.49Å; F680-E682 VanDerWaalsContact C-N 3.3Å; F680-E682 PolarHBondContact O-N 2.79Å; E682-L686 VanDerWaalsContact O-CB 3.22Å; E682-L686 WeakPolarHBondContact O-CB 3.37Å; E682-L686 PolarHBondContact O-N 3.28Å
683	V	91.3	Very high	88.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-45.3	169.8	-177.5	0	0	0	0	110.8	L671 L674 R679 F680 E681 L686 V687 A713	L671-V683 HydrophobicContact CD2-CG1 3.76Å; L674-V683 HydrophobicContact CB-CG2 3.5Å; L674-V683 HydrophobicContact CD1-CG2 4.3Å; R679-V683 PolarHBondContact O-N 2.93Å; F680-V683 PolarHBondContact O-N 3.39Å; E681-V683 VanDerWaalsContact C-N 3.35Å; V683-L686 PolarHBondContact O-N 3.08Å; V683-V687 WeakPolarHBondContact O-CB 3.34Å; V683-V687 VanDerWaalsContact O-CG2 3.32Å; V683-V687 WeakPolarHBondContact O-CG2 3.46Å; V683-V687 PolarHBondContact O-N 3.08Å; V683-A713 HydrophobicContact CB-CB 3.84Å; V683-A713 HydrophobicContact CG1-CB 3.67Å
684	D	90.3	Very high	87.3	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-45	176.9	169.3	44.6	0	0	0	111.6	F680 E681 L686 V687 E688 A713 T714 K722	F680-D684 PolarHBondContact O-N 3.27Å; E681-D684 PolarHBondContact O-N 3.01Å; D684-L686 PolarHBondContact O-N 2.6Å; D684-V687 PolarHBondContact O-N 3.15Å; D684-E688 WeakPolarHBondContact O-CG 3.48Å; D684-E688 PolarHBondContact O-N 3.28Å; D684-A713 HydrophobicContact CB-CB 4.41Å; D684-T714 HydrophobicContact CB-CG2 4.07Å; D684-T714 VanDerWaalsContact CG-CG2 3.5Å; D684-T714 WeakPolarHBondContact OD1-CG2 3.29Å; D684-K722 IonicContact OD1-NZ 2.69Å; D684-K722 PolarHBondContact OD1-NZ 3Å; D684-K722 WeakPolarHBondContact OD2-CD 3.38Å; D684-K722 WeakPolarHBondContact OD2-CE 3.35Å; D684-K722 IonicContact OD2-NZ 3.55Å; D684-K722 PolarHBondContact OD2-NZ 3.35Å
685	L	90.6	Very high	86.3	Confident	6 Å²	6	41.8 Å²	41.8	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-64.6	-36	174.3	-63.6	-179.8	0	0	0	113.3	V616 L631 K633 E681 S689	V616-L685 HydrophobicContact CG1-CB 4.1Å; V616-L685 HydrophobicContact CG2-CB 4Å; V616-L685 HydrophobicContact CG2-CD2 4.15Å; L631-L685 HydrophobicContact CB-CB 4.38Å; L631-L685 HydrophobicContact CB-CD1 4.21Å; K633-L685 HydrophobicContact CB-CD2 3.96Å; K633-L685 HydrophobicContact CD-CD2 3.86Å; K633-L685 HydrophobicContact CG-CD2 4.3Å; E681-L685 WeakPolarHBondContact O-CG 3.46Å; E681-L685 PolarHBondContact O-N 3.26Å; E681-L685 VanDerWaalsContact O-N 3.07Å; L685-S689 WeakPolarHBondContact O-CB 3.32Å; L685-S689 PolarHBondContact O-N 3.26Å; L685-S689 PolarHBondContact O-OG 3.21Å
686	L	90.1	Very high	85.3	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-72.2	-36.1	177.5	-170.8	56.2	0	0	0	111.8	I603 L631 L667 C670 L671 L674 E682 V683 D684 S689 A690	I603-L686 HydrophobicContact CG2-CD1 3.93Å; L631-L686 HydrophobicContact CD1-CB 3.81Å; L631-L686 HydrophobicContact CD1-CD1 4.14Å; L631-L686 HydrophobicContact CD1-CG 4.4Å; L667-L686 HydrophobicContact CD1-CD1 4.18Å; L667-L686 HydrophobicContact CD1-CD2 4.06Å; L667-L686 HydrophobicContact CD1-CG 3.91Å; C670-L686 HydrophobicContact CB-CD2 4.38Å; L671-L686 HydrophobicContact CD2-CB 4.08Å; L671-L686 HydrophobicContact CD2-CD2 3.84Å; L671-L686 HydrophobicContact CD2-CG 4.04Å; L671-L686 HydrophobicContact CG-CD2 4.23Å; L674-L686 HydrophobicContact CD1-CD2 3.99Å; E682-L686 VanDerWaalsContact O-CB 3.22Å; E682-L686 WeakPolarHBondContact O-CB 3.37Å; E682-L686 PolarHBondContact O-N 3.28Å; V683-L686 PolarHBondContact O-N 3.08Å; D684-L686 PolarHBondContact O-N 2.6Å; L686-S689 PolarHBondContact O-N 3.15Å; L686-A690 WeakPolarHBondContact O-CB 3.45Å; L686-A690 PolarHBondContact O-N 3.05Å
687	V	90.5	Very high	84	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.5	-46.9	171.7	167.9	0	0	0	0	111.2	L671 V683 D684 S689 A690 M691 L706 F709	L671-V687 HydrophobicContact CD2-CG2 3.93Å; V683-V687 WeakPolarHBondContact O-CB 3.34Å; V683-V687 VanDerWaalsContact O-CG2 3.32Å; V683-V687 WeakPolarHBondContact O-CG2 3.46Å; V683-V687 PolarHBondContact O-N 3.08Å; D684-V687 PolarHBondContact O-N 3.15Å; V687-S689 PolarHBondContact O-N 3.29Å; V687-A690 PolarHBondContact O-N 2.91Å; V687-A690 VanDerWaalsContact O-N 3.14Å; V687-M691 HydrophobicContact CG1-CG 4.21Å; V687-M691 VanDerWaalsContact O-CG 3.22Å; V687-M691 WeakPolarHBondContact O-CG 3.29Å; V687-M691 PolarHBondContact O-N 2.84Å; V687-L706 HydrophobicContact CG1-CB 4.33Å; V687-L706 WeakPolarHBondContact CG1-O 3.37Å; V687-L706 HydrophobicContact CG2-CD2 4.47Å; V687-F709 HydrophobicContact CG2-CB 3.99Å
688	E	87.9	Confident	83.2	Confident	42 Å²	42	43 Å²	43	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-53.5	-44.5	172.9	-76.8	-177.5	149.4	0	0	111.1	A614 K633 D684 K722	A614-E688 HydrophobicContact CB-CB 4.4Å; K633-E688 IonicContact NZ-OE1 3.36Å; K633-E688 PolarHBondContact NZ-OE1 2.9Å; K633-E688 IonicContact NZ-OE2 3.7Å; K633-E688 PolarHBondContact NZ-OE2 3.27Å; D684-E688 WeakPolarHBondContact O-CG 3.48Å; D684-E688 PolarHBondContact O-N 3.28Å; E688-K722 VanDerWaalsContact OE1-CE 3.29Å; E688-K722 WeakPolarHBondContact OE1-CE 3.35Å; E688-K722 IonicContact OE1-NZ 2.75Å; E688-K722 PolarHBondContact OE1-NZ 3.36Å; E688-K722 IonicContact OE2-NZ 3.66Å; E688-K722 PolarHBondContact OE2-NZ 3.26Å
689	S	87.8	Confident	82.7	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-32.6	178.7	-56.1	0	0	0	0	113.9	A610 V616 L685 L686 V687	A610-S689 VanDerWaalsContact CB-O 3.32Å; A610-S689 WeakPolarHBondContact CB-O 3.45Å; V616-S689 WeakPolarHBondContact CG2-OG 3.4Å; L685-S689 WeakPolarHBondContact O-CB 3.32Å; L685-S689 PolarHBondContact O-N 3.26Å; L685-S689 PolarHBondContact O-OG 3.21Å; L686-S689 PolarHBondContact O-N 3.15Å; V687-S689 PolarHBondContact O-N 3.29Å
690	A	87.6	Confident	82.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-78.8	-30.6	179.2	0	0	0	0	0	112.9	L607 L667 L686 V687 E692 F693 F696 L706	L607-A690 HydrophobicContact CD1-CB 4.47Å; L667-A690 HydrophobicContact CD2-CB 3.78Å; L686-A690 WeakPolarHBondContact O-CB 3.45Å; L686-A690 PolarHBondContact O-N 3.05Å; V687-A690 PolarHBondContact O-N 2.91Å; V687-A690 VanDerWaalsContact O-N 3.14Å; A690-E692 VanDerWaalsContact C-N 3.33Å; A690-F693 WeakPolarHBondContact O-CB 3.37Å; A690-F693 PolarHBondContact O-N 2.91Å; A690-F696 HydrophobicContact CB-CD2 4.37Å; A690-L706 HydrophobicContact CB-CD1 3.81Å; A690-L706 HydrophobicContact CB-CD2 4.18Å
691	M	84.3	Confident	82	Confident	36 Å²	36	48.2 Å²	48.2	18%	0.177	23%	0.228	C	C	.	.	H	α-helix	trans	-68.7	-30.5	178	-71.1	-72.2	-75.2	0	0	112.8	V687 F693 R703 L706 E707	V687-M691 HydrophobicContact CG1-CG 4.21Å; V687-M691 VanDerWaalsContact O-CG 3.22Å; V687-M691 WeakPolarHBondContact O-CG 3.29Å; V687-M691 PolarHBondContact O-N 2.84Å; M691-F693 PolarHBondContact O-N 2.97Å; M691-R703 HydrophobicContact CE-CG 3.79Å; M691-R703 HydrophobicContact SD-CG 3.95Å; M691-L706 HydrophobicContact CG-CB 4.32Å; M691-L706 HydrophobicContact CG-CD1 4.2Å; M691-L706 HydrophobicContact SD-CB 3.65Å; M691-L706 HydrophobicContact SD-CD1 3.81Å; M691-L706 HydrophobicContact SD-CG 4.39Å; M691-E707 HydrophobicContact CE-CG 3.61Å; M691-E707 WeakPolarHBondContact CE-OE1 3.44Å; M691-E707 HydrophobicContact SD-CG 4.34Å
692	E	80.1	Confident	81.8	Confident	87 Å²	87	43.6 Å²	43.6	41%	0.407	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-11.4	172.2	-72.2	-67.6	145.5	0	0	113.5	A610 A614 A690	A610-E692 HydrophobicContact CB-CB 4.01Å; A614-E692 HydrophobicContact CB-CG 4.47Å; A690-E692 VanDerWaalsContact C-N 3.33Å
693	F	77.3	Confident	81.5	Confident	16 Å²	16	46.1 Å²	46.1	7%	0.07	22%	0.215	C	C	.	.			trans	-90	112.3	-175.7	-170.5	-112.1	0	0	0	112.5	L606 L607 A610 A690 M691 S695 F696 Y697	L606-F693 HydrophobicContact CD1-CZ 4.12Å; L606-F693 HydrophobicContact CG-CZ 4.44Å; L607-F693 HydrophobicContact CD2-CB 3.77Å; L607-F693 HydrophobicContact CD2-CD1 4.04Å; L607-F693 HydrophobicContact CD2-CD2 3.77Å; L607-F693 HydrophobicContact CD2-CE2 4.35Å; L607-F693 HydrophobicContact CD2-CG 3.59Å; A610-F693 HydrophobicContact CB-CB 4.33Å; A690-F693 WeakPolarHBondContact O-CB 3.37Å; A690-F693 PolarHBondContact O-N 2.91Å; M691-F693 PolarHBondContact O-N 2.97Å; F693-S695 VanDerWaalsContact C-N 3.29Å; F693-S695 PolarHBondContact O-N 3.35Å; F693-F696 HydrophobicContact CB-CD2 4.21Å; F693-F696 HydrophobicContact CD1-CD1 4.48Å; F693-F696 AromaticContact CD1-CD2 3.63Å; F693-F696 HydrophobicContact CD1-CD2 3.63Å; F693-F696 AromaticContact CD1-CE2 3.82Å; F693-F696 HydrophobicContact CD1-CE2 3.82Å; F693-F696 AromaticContact CD1-CG 3.99Å; F693-F696 HydrophobicContact CD1-CG 3.99Å; F693-F696 HydrophobicContact CD1-CZ 4.34Å; F693-F696 HydrophobicContact CE1-CE2 4.37Å; F693-F696 HydrophobicContact CE1-CZ 4.49Å; F693-F696 HydrophobicContact CG-CD2 4.36Å; F693-F696 PolarHBondContact O-N 3.23Å; F693-Y697 PolarHBondContact O-N 3.09Å
694	Y	69.1	Low	81.3	Confident	125 Å²	125	49.3 Å²	49.3	49%	0.49	23%	0.229	S	C	.	.	H	α-helix	trans	-46.4	-43.9	-173.3	-178.5	-106	0	0	0	114.8	Y648 F696 Y697 D698	Y648-Y694 HydrophobicContact CD2-CD1 4.42Å; Y694-F696 VanDerWaalsContact C-N 3.28Å; Y694-F696 PolarHBondContact O-N 2.72Å; Y694-Y697 PolarHBondContact O-N 2.92Å; Y694-D698 PolarHBondContact O-N 3.02Å; Y694-D698 VanDerWaalsContact O-N 3.07Å
695	S	68.9	Low	81.2	Confident	15 Å²	15	53.1 Å²	53.1	11%	0.105	25%	0.247	C	C	.	.	H	α-helix	trans	-77.6	-5.4	-177.4	-167.1	0	0	0	0	115.3	K660 F693	K660-S695 WeakPolarHBondContact CD-OG 3.4Å; K660-S695 WeakPolarHBondContact CE-OG 3.45Å; K660-S695 PolarHBondContact NZ-OG 2.9Å; F693-S695 VanDerWaalsContact C-N 3.29Å; F693-S695 PolarHBondContact O-N 3.35Å
696	F	68.9	Low	81.2	Confident	5 Å²	5	52.9 Å²	52.9	2%	0.022	25%	0.245	C	C	.	.	H	α-helix	trans	-101.3	-33.9	165.3	-60.1	-33.4	0	0	0	111	L606 L607 W664 L667 A690 F693 Y694 N699 L706	L606-F696 HydrophobicContact CD2-CZ 4.39Å; L607-F696 HydrophobicContact CD2-CE2 4.41Å; W664-F696 HydrophobicContact CB-CE1 4.31Å; W664-F696 AromaticContact CE3-CD1 3.96Å; W664-F696 HydrophobicContact CE3-CD1 3.96Å; W664-F696 HydrophobicContact CE3-CE1 4.03Å; W664-F696 HydrophobicContact CE3-CG 4.33Å; W664-F696 HydrophobicContact CE3-CZ 4.45Å; W664-F696 HydrophobicContact CZ3-CG 4.49Å; L667-F696 HydrophobicContact CD2-CD2 4.11Å; L667-F696 HydrophobicContact CD2-CE2 3.76Å; L667-F696 HydrophobicContact CD2-CZ 4.34Å; A690-F696 HydrophobicContact CB-CD2 4.37Å; F693-F696 HydrophobicContact CB-CD2 4.21Å; F693-F696 HydrophobicContact CD1-CD1 4.48Å; F693-F696 AromaticContact CD1-CD2 3.63Å; F693-F696 HydrophobicContact CD1-CD2 3.63Å; F693-F696 AromaticContact CD1-CE2 3.82Å; F693-F696 HydrophobicContact CD1-CE2 3.82Å; F693-F696 AromaticContact CD1-CG 3.99Å; F693-F696 HydrophobicContact CD1-CG 3.99Å; F693-F696 HydrophobicContact CD1-CZ 4.34Å; F693-F696 HydrophobicContact CE1-CE2 4.37Å; F693-F696 HydrophobicContact CE1-CZ 4.49Å; F693-F696 HydrophobicContact CG-CD2 4.36Å; F693-F696 PolarHBondContact O-N 3.23Å; Y694-F696 VanDerWaalsContact C-N 3.28Å; Y694-F696 PolarHBondContact O-N 2.72Å; F696-N699 PolarHBondContact O-N 3.44Å; F696-L706 HydrophobicContact CB-CD1 4.47Å
697	Y	62.9	Low	81.1	Confident	123 Å²	123	53.1 Å²	53.1	48%	0.482	25%	0.247	S	C	.	.	H	α-helix	trans	-58	-46.6	175.9	-176.7	-87.4	0	0	0	113.6	F693 Y694 N699 R703	F693-Y697 PolarHBondContact O-N 3.09Å; Y694-Y697 PolarHBondContact O-N 2.92Å; Y697-N699 VanDerWaalsContact C-N 3.28Å; Y697-N699 PolarHBondContact O-N 3.14Å; Y697-R703 VanDerWaalsContact CZ-NH1 3.35Å; Y697-R703 PolarHBondContact OH-NH1 2.97Å
698	D	71	Confident	81.1	Confident	112 Å²	112	57.9 Å²	57.9	60%	0.599	27%	0.267	S	S	*	.	S	Bend	trans	-62.4	-33.1	-177.6	-175.3	50.1	0	0	0	112.9	Y694 K700	Y694-D698 PolarHBondContact O-N 3.02Å; Y694-D698 VanDerWaalsContact O-N 3.07Å; D698-K700 PolarHBondContact O-N 3.36Å
699	N	80.3	Confident	81.3	Confident	65 Å²	65	58.2 Å²	58.2	35%	0.348	27%	0.268	S	S	.	.	S	Bend	trans	-85.9	83.6	-177.2	-166.2	-5.9	0	0	0	111.6	F696 Y697 P701 R702 R703	F696-N699 PolarHBondContact O-N 3.44Å; Y697-N699 VanDerWaalsContact C-N 3.28Å; Y697-N699 PolarHBondContact O-N 3.14Å; N699-P701 VanDerWaalsContact C-CD 3.49Å; N699-P701 VanDerWaalsContact O-N 3.08Å; N699-P701 VanDerWaalsContact OD1-CD 3.24Å; N699-P701 WeakPolarHBondContact OD1-CD 3.18Å; N699-P701 VanDerWaalsContact OD1-CG 3.23Å; N699-P701 WeakPolarHBondContact OD1-CG 3.23Å; N699-R702 HydrophobicContact CB-CB 4.3Å; N699-R702 HydrophobicContact CB-CG 4.33Å; N699-R702 WeakPolarHBondContact ND2-CD 3.45Å; N699-R702 PolarHBondContact ND2-NE 3.4Å; N699-R702 WeakPolarHBondContact O-CB 3.3Å; N699-R702 PolarHBondContact O-N 3.4Å; N699-R703 PolarHBondContact O-N 2.84Å; N699-R703 VanDerWaalsContact O-N 3.14Å
700	K	80.1	Confident	81.3	Confident	166 Å²	166	58.2 Å²	58.2	72%	0.722	27%	0.268	S	S	*	.	H	α-helix	trans	-35.5	-49.9	-177.2	-63.8	-172.1	179.3	-175.2	0	116.1	D698 R703 K704	D698-K700 PolarHBondContact O-N 3.36Å; K700-R703 PolarHBondContact O-N 2.91Å; K700-K704 PolarHBondContact O-N 3.07Å; K700-K704 VanDerWaalsContact O-N 3.13Å
701	P	84.6	Confident	81.5	Confident	78 Å²	78	58.5 Å²	58.5	51%	0.506	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-44.1	176.5	23.2	-34.5	0	0	0	114.1	N699 R703 K704 E705	N699-P701 VanDerWaalsContact C-CD 3.49Å; N699-P701 VanDerWaalsContact O-N 3.08Å; N699-P701 VanDerWaalsContact OD1-CD 3.24Å; N699-P701 WeakPolarHBondContact OD1-CD 3.18Å; N699-P701 VanDerWaalsContact OD1-CG 3.23Å; N699-P701 WeakPolarHBondContact OD1-CG 3.23Å; P701-R703 VanDerWaalsContact C-N 3.29Å; P701-R703 PolarHBondContact O-N 3.46Å; P701-K704 PolarHBondContact O-N 3.22Å; P701-K704 VanDerWaalsContact O-N 3.11Å; P701-E705 PolarHBondContact O-N 2.92Å
702	R	84.4	Confident	81.8	Confident	23 Å²	23	59.7 Å²	59.7	9%	0.087	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-39.2	177.1	-69.8	-172.4	177.8	-178.2	-1.5	111.6	K660 E661 W664 N699 E705 L706	K660-R702 PolarHBondContact O-NH1 2.89Å; K660-R702 PolarHBondContact O-NH2 2.74Å; E661-R702 IonicContact OE2-CZ 4Å; E661-R702 IonicContact OE2-NH2 3.62Å; E661-R702 PolarHBondContact OE2-NH2 3.05Å; W664-R702 HydrophobicContact CD2-CG 4.04Å; W664-R702 HydrophobicContact CE3-CB 4.41Å; W664-R702 HydrophobicContact CE3-CG 4.38Å; W664-R702 HydrophobicContact CH2-CB 3.66Å; W664-R702 HydrophobicContact CH2-CG 4.11Å; W664-R702 WeakPolarHBondContact CH2-O 3.29Å; W664-R702 HydrophobicContact CZ2-CB 3.76Å; W664-R702 HydrophobicContact CZ2-CG 3.72Å; W664-R702 HydrophobicContact CZ3-CB 3.99Å; W664-R702 HydrophobicContact CZ3-CG 4.4Å; N699-R702 HydrophobicContact CB-CB 4.3Å; N699-R702 HydrophobicContact CB-CG 4.33Å; N699-R702 WeakPolarHBondContact ND2-CD 3.45Å; N699-R702 PolarHBondContact ND2-NE 3.4Å; N699-R702 WeakPolarHBondContact O-CB 3.3Å; N699-R702 PolarHBondContact O-N 3.4Å; R702-E705 PolarHBondContact O-N 2.98Å; R702-L706 PolarHBondContact O-N 3.25Å
703	R	84.8	Confident	82.2	Confident	61 Å²	61	55.6 Å²	55.6	23%	0.23	26%	0.263	C	S	.	.	H	α-helix	trans	-58.8	-47.1	172.8	-179.4	-177.3	160.7	162.8	-3.3	111.7	M691 Y697 N699 K700 P701 E705 L706 E707	M691-R703 HydrophobicContact CE-CG 3.79Å; M691-R703 HydrophobicContact SD-CG 3.95Å; Y697-R703 VanDerWaalsContact CZ-NH1 3.35Å; Y697-R703 PolarHBondContact OH-NH1 2.97Å; N699-R703 PolarHBondContact O-N 2.84Å; N699-R703 VanDerWaalsContact O-N 3.14Å; K700-R703 PolarHBondContact O-N 2.91Å; P701-R703 VanDerWaalsContact C-N 3.29Å; P701-R703 PolarHBondContact O-N 3.46Å; R703-E705 VanDerWaalsContact C-N 3.32Å; R703-E705 PolarHBondContact O-N 3.38Å; R703-L706 WeakPolarHBondContact O-CB 3.06Å; R703-L706 PolarHBondContact O-N 3.26Å; R703-E707 IonicContact CZ-OE1 2.62Å; R703-E707 IonicContact NE-OE1 3.78Å; R703-E707 PolarHBondContact NE-OE1 3.49Å; R703-E707 IonicContact NH2-OE1 3.96Å; R703-E707 PolarHBondContact NH2-OE1 2.65Å; R703-E707 WeakPolarHBondContact O-CG 3.27Å; R703-E707 PolarHBondContact O-N 3.2Å
704	K	86.1	Confident	82.8	Confident	67 Å²	67	54.9 Å²	54.9	29%	0.291	26%	0.26	S	S	.	.	H	α-helix	trans	-62.6	-38.3	176.9	-65.8	-163.9	-170.8	-146.8	0	112.1	K700 P701 E707 F708 E733	K700-K704 PolarHBondContact O-N 3.07Å; K700-K704 VanDerWaalsContact O-N 3.13Å; P701-K704 PolarHBondContact O-N 3.22Å; P701-K704 VanDerWaalsContact O-N 3.11Å; K704-E707 PolarHBondContact O-N 3.26Å; K704-F708 WeakPolarHBondContact O-CD2 3.3Å; K704-F708 PolarHBondContact O-N 3.3Å; K704-E733 WeakPolarHBondContact CE-OE2 3.37Å; K704-E733 IonicContact NZ-OE2 3.19Å; K704-E733 PolarHBondContact NZ-OE2 3.33Å
705	E	88.6	Confident	83.8	Confident	85 Å²	85	51.5 Å²	51.5	40%	0.397	25%	0.25	S	C	.	.	H	α-helix	trans	-60.4	-44.3	173.1	-72.4	173.7	-148.6	0	0	112	W664 P701 R702 R703 E707 F708 F709	W664-E705 HydrophobicContact CH2-CB 4.41Å; W664-E705 HydrophobicContact CZ2-CB 4.22Å; W664-E705 WeakPolarHBondContact CZ2-OE2 3.41Å; P701-E705 PolarHBondContact O-N 2.92Å; R702-E705 PolarHBondContact O-N 2.98Å; R703-E705 VanDerWaalsContact C-N 3.32Å; R703-E705 PolarHBondContact O-N 3.38Å; E705-E707 PolarHBondContact O-N 3.11Å; E705-F708 WeakPolarHBondContact O-CB 3.48Å; E705-F708 PolarHBondContact O-N 3.19Å; E705-F709 WeakPolarHBondContact O-CD2 3.16Å; E705-F709 PolarHBondContact O-N 2.7Å
706	L	89.6	Confident	84.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-42.7	172.5	-70.3	178.9	0	0	0	112.5	W664 L667 L671 V687 A690 M691 F696 R702 R703 F708 F709 G710	W664-L706 HydrophobicContact CH2-CD2 4.01Å; W664-L706 HydrophobicContact CH2-CG 3.87Å; W664-L706 HydrophobicContact CZ3-CD1 4.21Å; W664-L706 HydrophobicContact CZ3-CD2 3.95Å; W664-L706 HydrophobicContact CZ3-CG 3.94Å; L667-L706 HydrophobicContact CD2-CD2 4.15Å; L671-L706 HydrophobicContact CD1-CD2 4.25Å; V687-L706 HydrophobicContact CG1-CB 4.33Å; V687-L706 WeakPolarHBondContact CG1-O 3.37Å; V687-L706 HydrophobicContact CG2-CD2 4.47Å; A690-L706 HydrophobicContact CB-CD1 3.81Å; A690-L706 HydrophobicContact CB-CD2 4.18Å; M691-L706 HydrophobicContact CG-CB 4.32Å; M691-L706 HydrophobicContact CG-CD1 4.2Å; M691-L706 HydrophobicContact SD-CB 3.65Å; M691-L706 HydrophobicContact SD-CD1 3.81Å; M691-L706 HydrophobicContact SD-CG 4.39Å; F696-L706 HydrophobicContact CB-CD1 4.47Å; R702-L706 PolarHBondContact O-N 3.25Å; R703-L706 WeakPolarHBondContact O-CB 3.06Å; R703-L706 PolarHBondContact O-N 3.26Å; L706-F708 VanDerWaalsContact C-N 3.33Å; L706-F708 PolarHBondContact O-N 2.87Å; L706-F709 PolarHBondContact O-N 3.2Å; L706-F709 VanDerWaalsContact O-N 3.17Å; L706-G710 PolarHBondContact O-N 3.42Å
707	E	89.1	Confident	85.5	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.047	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-37.7	176.8	-69.6	171.2	-176.9	0	0	111.9	M691 R703 K704 E705 L711 M730	M691-E707 HydrophobicContact CE-CG 3.61Å; M691-E707 WeakPolarHBondContact CE-OE1 3.44Å; M691-E707 HydrophobicContact SD-CG 4.34Å; R703-E707 IonicContact CZ-OE1 2.62Å; R703-E707 IonicContact NE-OE1 3.78Å; R703-E707 PolarHBondContact NE-OE1 3.49Å; R703-E707 IonicContact NH2-OE1 3.96Å; R703-E707 PolarHBondContact NH2-OE1 2.65Å; R703-E707 WeakPolarHBondContact O-CG 3.27Å; R703-E707 PolarHBondContact O-N 3.2Å; K704-E707 PolarHBondContact O-N 3.26Å; E705-E707 PolarHBondContact O-N 3.11Å; E707-L711 WeakPolarHBondContact O-CB 3.16Å; E707-L711 PolarHBondContact O-N 2.94Å; E707-M730 HydrophobicContact CB-CE 4.06Å; E707-M730 HydrophobicContact CB-CG 4.42Å; E707-M730 HydrophobicContact CB-SD 4.28Å
708	F	90.4	Very high	86.6	Confident	99 Å²	99	58.7 Å²	58.7	43%	0.434	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-42.5	170.4	-79.3	-69.8	0	0	0	112.8	K704 E705 L706 S712 M730 F740	K704-F708 WeakPolarHBondContact O-CD2 3.3Å; K704-F708 PolarHBondContact O-N 3.3Å; E705-F708 WeakPolarHBondContact O-CB 3.48Å; E705-F708 PolarHBondContact O-N 3.19Å; L706-F708 VanDerWaalsContact C-N 3.33Å; L706-F708 PolarHBondContact O-N 2.87Å; F708-S712 VanDerWaalsContact O-CB 3.31Å; F708-S712 WeakPolarHBondContact O-CB 3.08Å; F708-S712 PolarHBondContact O-N 3.18Å; F708-S712 PolarHBondContact O-OG 3.46Å; F708-M730 HydrophobicContact CD1-CE 3.66Å; F708-M730 HydrophobicContact CD2-CE 4.04Å; F708-M730 HydrophobicContact CE1-CE 3.8Å; F708-M730 HydrophobicContact CE2-CE 4.15Å; F708-M730 HydrophobicContact CG-CE 3.78Å; F708-M730 HydrophobicContact CZ-CE 4.04Å; F708-F740 HydrophobicContact CD1-CE1 4.44Å; F708-F740 AromaticContact CE1-CE1 3.57Å; F708-F740 HydrophobicContact CE1-CE1 3.57Å; F708-F740 AromaticContact CE1-CZ 3.61Å; F708-F740 HydrophobicContact CE1-CZ 3.61Å; F708-F740 HydrophobicContact CZ-CE1 4.07Å; F708-F740 AromaticContact CZ-CZ 3.59Å; F708-F740 HydrophobicContact CZ-CZ 3.59Å
709	F	90.9	Very high	87.3	Confident	49 Å²	49	56.1 Å²	56.1	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-44.9	176.5	-80.3	-68.6	0	0	0	111.7	L668 L671 L672 V687 E705 L706 S712 A713	L668-F709 HydrophobicContact CD2-CD2 4.3Å; L668-F709 HydrophobicContact CD2-CE2 3.49Å; L668-F709 VanDerWaalsContact CD2-CE2 3.49Å; L668-F709 HydrophobicContact CD2-CZ 4.03Å; L671-F709 HydrophobicContact CD1-CD2 4.43Å; L672-F709 HydrophobicContact CD2-CE1 4.27Å; V687-F709 HydrophobicContact CG2-CB 3.99Å; E705-F709 WeakPolarHBondContact O-CD2 3.16Å; E705-F709 PolarHBondContact O-N 2.7Å; L706-F709 PolarHBondContact O-N 3.2Å; L706-F709 VanDerWaalsContact O-N 3.17Å; F709-S712 PolarHBondContact O-N 3.43Å; F709-A713 VanDerWaalsContact O-CB 3.31Å; F709-A713 WeakPolarHBondContact O-CB 3.27Å; F709-A713 PolarHBondContact O-N 3.08Å
710	G	89.3	Confident	87.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-44.6	177.2	0	0	0	0	0	113	L706 S712 T714	L706-G710 PolarHBondContact O-N 3.42Å; G710-S712 PolarHBondContact O-N 3.47Å; G710-T714 WeakPolarHBondContact O-CB 3.45Å; G710-T714 VanDerWaalsContact O-CG2 3.31Å; G710-T714 WeakPolarHBondContact O-CG2 3.18Å; G710-T714 PolarHBondContact O-N 3.34Å; G710-T714 PolarHBondContact O-OG1 3.15Å
711	L	90.6	Very high	87.7	Confident	6 Å²	6	54.1 Å²	54.1	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-44.5	173.3	179.3	60.9	0	0	0	111.7	E707 T714 I715 A723 I727 M730 I743 L747	E707-L711 WeakPolarHBondContact O-CB 3.16Å; E707-L711 PolarHBondContact O-N 2.94Å; L711-T714 PolarHBondContact O-OG1 3.16Å; L711-I715 HydrophobicContact CD1-CD1 3.82Å; L711-I715 HydrophobicContact CD1-CG1 4.29Å; L711-I715 HydrophobicContact CG-CD1 3.92Å; L711-I715 WeakPolarHBondContact O-CB 3.41Å; L711-I715 WeakPolarHBondContact O-CD1 3.38Å; L711-I715 VanDerWaalsContact O-CG1 3.22Å; L711-I715 WeakPolarHBondContact O-CG1 3.45Å; L711-I715 PolarHBondContact O-N 3.35Å; L711-A723 HydrophobicContact CD1-CB 4.21Å; L711-A723 WeakPolarHBondContact CD1-O 3.14Å; L711-I727 HydrophobicContact CD1-CB 4.12Å; L711-I727 HydrophobicContact CD2-CB 4.46Å; L711-I727 HydrophobicContact CD2-CD1 4.01Å; L711-M730 HydrophobicContact CB-SD 4.39Å; L711-M730 HydrophobicContact CD2-SD 3.78Å; L711-I743 HydrophobicContact CD2-CG2 4.46Å; L711-L747 HydrophobicContact CD1-CD1 4.23Å
712	S	90.1	Very high	87.7	Confident	61 Å²	61	52.3 Å²	52.3	43%	0.427	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-46.3	-179.6	-57.8	0	0	0	0	111.9	F708 F709 G710 I715 L716	F708-S712 VanDerWaalsContact O-CB 3.31Å; F708-S712 WeakPolarHBondContact O-CB 3.08Å; F708-S712 PolarHBondContact O-N 3.18Å; F708-S712 PolarHBondContact O-OG 3.46Å; F709-S712 PolarHBondContact O-N 3.43Å; G710-S712 PolarHBondContact O-N 3.47Å; S712-I715 PolarHBondContact O-N 2.97Å; S712-L716 VanDerWaalsContact O-CG 3.31Å; S712-L716 WeakPolarHBondContact O-CG 3.39Å; S712-L716 PolarHBondContact O-N 2.73Å
713	A	90.5	Very high	87.8	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.017	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-44.8	178	0	0	0	0	0	112	V683 D684 F709 I715 L716 N717	V683-A713 HydrophobicContact CB-CB 3.84Å; V683-A713 HydrophobicContact CG1-CB 3.67Å; D684-A713 HydrophobicContact CB-CB 4.41Å; F709-A713 VanDerWaalsContact O-CB 3.31Å; F709-A713 WeakPolarHBondContact O-CB 3.27Å; F709-A713 PolarHBondContact O-N 3.08Å; A713-I715 PolarHBondContact O-N 2.88Å; A713-L716 PolarHBondContact O-N 2.95Å; A713-N717 VanDerWaalsContact O-CB 3.26Å; A713-N717 WeakPolarHBondContact O-CB 3.42Å; A713-N717 PolarHBondContact O-N 3.35Å
714	T	89.3	Confident	87.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69.2	-31.7	179.6	52.3	0	0	0	0	113.1	D684 G710 L711 Q718 N719 K722 A723 Y726	D684-T714 HydrophobicContact CB-CG2 4.07Å; D684-T714 VanDerWaalsContact CG-CG2 3.5Å; D684-T714 WeakPolarHBondContact OD1-CG2 3.29Å; G710-T714 WeakPolarHBondContact O-CB 3.45Å; G710-T714 VanDerWaalsContact O-CG2 3.31Å; G710-T714 WeakPolarHBondContact O-CG2 3.18Å; G710-T714 PolarHBondContact O-N 3.34Å; G710-T714 PolarHBondContact O-OG1 3.15Å; L711-T714 PolarHBondContact O-OG1 3.16Å; T714-Q718 PolarHBondContact O-N 2.66Å; T714-N719 PolarHBondContact O-N 3.29Å; T714-K722 HydrophobicContact CG2-CB 3.67Å; T714-K722 HydrophobicContact CG2-CD 3.99Å; T714-A723 WeakPolarHBondContact OG1-CA 3.46Å; T714-A723 WeakPolarHBondContact OG1-CB 3.16Å; T714-Y726 HydrophobicContact CG2-CD2 4.4Å; T714-Y726 HydrophobicContact CG2-CE2 4.11Å
715	I	88.8	Confident	87.8	Confident	55 Å²	55	48.2 Å²	48.2	28%	0.282	23%	0.232	S	C	.	.	H	α-helix	trans	-65.3	-48.2	169.6	-72.2	168.1	0	0	0	111	L711 S712 A713 Q718 A723 I743 L747	L711-I715 HydrophobicContact CD1-CD1 3.82Å; L711-I715 HydrophobicContact CD1-CG1 4.29Å; L711-I715 HydrophobicContact CG-CD1 3.92Å; L711-I715 WeakPolarHBondContact O-CB 3.41Å; L711-I715 WeakPolarHBondContact O-CD1 3.38Å; L711-I715 VanDerWaalsContact O-CG1 3.22Å; L711-I715 WeakPolarHBondContact O-CG1 3.45Å; L711-I715 PolarHBondContact O-N 3.35Å; S712-I715 PolarHBondContact O-N 2.97Å; A713-I715 PolarHBondContact O-N 2.88Å; I715-Q718 PolarHBondContact O-N 2.84Å; I715-A723 HydrophobicContact CG1-CB 3.95Å; I715-I743 HydrophobicContact CD1-CG2 3.96Å; I715-L747 HydrophobicContact CD1-CD1 4.47Å; I715-L747 HydrophobicContact CG1-CD2 4.22Å
716	L	87.6	Confident	87.8	Confident	98 Å²	98	45.8 Å²	45.8	51%	0.513	22%	0.219	S	C	.	.	H	α-helix	trans	-67.1	-35.9	-178.9	-68.7	169.6	0	0	0	112.3	F680 S712 A713 Q718	F680-L716 HydrophobicContact CD1-CB 4.09Å; F680-L716 HydrophobicContact CD1-CD1 4Å; F680-L716 HydrophobicContact CD2-CB 3.86Å; F680-L716 HydrophobicContact CE1-CB 4.24Å; F680-L716 HydrophobicContact CE1-CD1 3.62Å; F680-L716 HydrophobicContact CE2-CB 4.01Å; F680-L716 HydrophobicContact CG-CB 3.9Å; F680-L716 HydrophobicContact CZ-CB 4.2Å; F680-L716 HydrophobicContact CZ-CD1 3.95Å; S712-L716 VanDerWaalsContact O-CG 3.31Å; S712-L716 WeakPolarHBondContact O-CG 3.39Å; S712-L716 PolarHBondContact O-N 2.73Å; A713-L716 PolarHBondContact O-N 2.95Å; L716-Q718 PolarHBondContact O-N 2.59Å
717	N	87.4	Confident	87.7	Confident	60 Å²	60	45.8 Å²	45.8	32%	0.321	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	5.2	172	-158.7	26.6	0	0	0	113.6	F680 E681 A713 N719	F680-N717 HydrophobicContact CB-CB 4Å; E681-N717 WeakPolarHBondContact CB-ND2 3.5Å; A713-N717 VanDerWaalsContact O-CB 3.26Å; A713-N717 WeakPolarHBondContact O-CB 3.42Å; A713-N717 PolarHBondContact O-N 3.35Å; N717-N719 PolarHBondContact O-N 3.12Å
718	Q	85.6	Confident	87.6	Confident	136 Å²	136	48.5 Å²	48.5	64%	0.636	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	18	179.9	-51.3	-176	29.2	0	0	115.1	T714 I715 L716 Y720	T714-Q718 PolarHBondContact O-N 2.66Å; I715-Q718 PolarHBondContact O-N 2.84Å; L716-Q718 PolarHBondContact O-N 2.59Å; Q718-Y720 VanDerWaalsContact C-N 3.26Å; Q718-Y720 HydrophobicContact CB-CE2 4.13Å; Q718-Y720 VanDerWaalsContact O-CD2 3.25Å; Q718-Y720 WeakPolarHBondContact O-CD2 3.29Å; Q718-Y720 WeakPolarHBondContact O-CE2 3.38Å; Q718-Y720 PolarHBondContact O-N 2.84Å
719	N	86.2	Confident	87.4	Confident	57 Å²	57	47.9 Å²	47.9	31%	0.305	23%	0.23	S	C	.	.			trans	-82.8	72.1	176.6	-169.1	-23.6	0	0	0	110.2	T714 N717 Y721 K722 A723	T714-N719 PolarHBondContact O-N 3.29Å; N717-N719 PolarHBondContact O-N 3.12Å; N719-Y721 PolarHBondContact O-N 3.1Å; N719-Y721 VanDerWaalsContact O-N 3.12Å; N719-K722 PolarHBondContact O-N 2.92Å; N719-K722 PolarHBondContact OD1-N 3.16Å; N719-A723 PolarHBondContact O-N 3.1Å
720	Y	84.1	Confident	87.2	Confident	79 Å²	79	45.8 Å²	45.8	31%	0.31	22%	0.221	S	C	.	.	H	α-helix	trans	-62.1	-20.9	-175.2	-52.2	-61.9	0	0	0	113.8	Q718 Y724 L747 S750	Q718-Y720 VanDerWaalsContact C-N 3.26Å; Q718-Y720 HydrophobicContact CB-CE2 4.13Å; Q718-Y720 VanDerWaalsContact O-CD2 3.25Å; Q718-Y720 WeakPolarHBondContact O-CD2 3.29Å; Q718-Y720 WeakPolarHBondContact O-CE2 3.38Å; Q718-Y720 PolarHBondContact O-N 2.84Å; Y720-Y724 VanDerWaalsContact O-CB 3.27Å; Y720-Y724 WeakPolarHBondContact O-CB 3.46Å; Y720-Y724 PolarHBondContact O-N 3.02Å; Y720-L747 HydrophobicContact CD1-CD2 3.72Å; Y720-S750 WeakPolarHBondContact CD1-OG 3.48Å
721	Y	83.6	Confident	87.1	Confident	111 Å²	111	45.8 Å²	45.8	44%	0.435	22%	0.221	S	C	.	.	H	α-helix	trans	-71.2	-49.6	174.7	-179.5	-101.3	0	0	0	111.9	N719 Y724 N725 H753	N719-Y721 PolarHBondContact O-N 3.1Å; N719-Y721 VanDerWaalsContact O-N 3.12Å; Y721-Y724 PolarHBondContact O-N 3.38Å; Y721-N725 PolarHBondContact O-N 2.82Å; Y721-N725 PolarHBondContact O-ND2 3.42Å; Y721-H753 AromaticContact CD2-NE2 3.57Å
722	K	83.9	Confident	86.8	Confident	39 Å²	39	49.5 Å²	49.5	17%	0.17	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-45.6	173.1	-80.3	-167.5	163.2	-160.8	0	111.5	D684 E688 T714 N719 Y724 N725 Y726	D684-K722 IonicContact OD1-NZ 2.69Å; D684-K722 PolarHBondContact OD1-NZ 3Å; D684-K722 WeakPolarHBondContact OD2-CD 3.38Å; D684-K722 WeakPolarHBondContact OD2-CE 3.35Å; D684-K722 IonicContact OD2-NZ 3.55Å; D684-K722 PolarHBondContact OD2-NZ 3.35Å; E688-K722 VanDerWaalsContact OE1-CE 3.29Å; E688-K722 WeakPolarHBondContact OE1-CE 3.35Å; E688-K722 IonicContact OE1-NZ 2.75Å; E688-K722 PolarHBondContact OE1-NZ 3.36Å; E688-K722 IonicContact OE2-NZ 3.66Å; E688-K722 PolarHBondContact OE2-NZ 3.26Å; T714-K722 HydrophobicContact CG2-CB 3.67Å; T714-K722 HydrophobicContact CG2-CD 3.99Å; N719-K722 PolarHBondContact O-N 2.92Å; N719-K722 PolarHBondContact OD1-N 3.16Å; K722-Y724 VanDerWaalsContact C-N 3.26Å; K722-Y724 PolarHBondContact O-N 2.87Å; K722-N725 PolarHBondContact O-N 2.86Å; K722-Y726 WeakPolarHBondContact O-CD2 3.22Å; K722-Y726 PolarHBondContact O-N 3.15Å; K722-Y726 VanDerWaalsContact O-N 3.1Å
723	A	86.5	Confident	86.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-40	178.5	0	0	0	0	0	112	L711 T714 I715 N719 N725 Y726 I727 L747	L711-A723 HydrophobicContact CD1-CB 4.21Å; L711-A723 WeakPolarHBondContact CD1-O 3.14Å; T714-A723 WeakPolarHBondContact OG1-CA 3.46Å; T714-A723 WeakPolarHBondContact OG1-CB 3.16Å; I715-A723 HydrophobicContact CG1-CB 3.95Å; N719-A723 PolarHBondContact O-N 3.1Å; A723-N725 PolarHBondContact O-N 3.28Å; A723-Y726 PolarHBondContact O-N 2.83Å; A723-I727 WeakPolarHBondContact O-CG2 3.49Å; A723-I727 PolarHBondContact O-N 2.74Å; A723-L747 HydrophobicContact CB-CD1 4.01Å; A723-L747 HydrophobicContact CB-CD2 3.73Å
724	Y	86	Confident	86.1	Confident	13 Å²	13	53.3 Å²	53.3	5%	0.051	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-42.8	173.5	177.4	-98.6	0	0	0	112.7	Y720 Y721 K722 I727 R728 F744 H756	Y720-Y724 VanDerWaalsContact O-CB 3.27Å; Y720-Y724 WeakPolarHBondContact O-CB 3.46Å; Y720-Y724 PolarHBondContact O-N 3.02Å; Y721-Y724 PolarHBondContact O-N 3.38Å; K722-Y724 VanDerWaalsContact C-N 3.26Å; K722-Y724 PolarHBondContact O-N 2.87Å; Y724-I727 HydrophobicContact CD2-CG2 4.5Å; Y724-I727 VanDerWaalsContact O-CG2 3.3Å; Y724-I727 WeakPolarHBondContact O-CG2 3.33Å; Y724-I727 PolarHBondContact O-N 3.22Å; Y724-R728 HydrophobicContact CE1-CB 4.38Å; Y724-R728 VanDerWaalsContact O-CB 3.29Å; Y724-R728 WeakPolarHBondContact O-CB 3.33Å; Y724-R728 PolarHBondContact O-N 3.22Å; Y724-F744 HydrophobicContact CD2-CE2 4.23Å; Y724-F744 HydrophobicContact CE2-CD2 4.19Å; Y724-F744 AromaticContact CE2-CE2 3.42Å; Y724-F744 HydrophobicContact CE2-CE2 3.42Å; Y724-F744 VanDerWaalsContact CE2-CE2 3.42Å; Y724-F744 AromaticContact CE2-CZ 3.93Å; Y724-F744 HydrophobicContact CE2-CZ 3.93Å; Y724-H756 AromaticContact CD1-CE1 3.78Å; Y724-H756 AromaticContact CD2-CE1 3.21Å; Y724-H756 WeakPolarHBondContact CD2-CE1 3.21Å; Y724-H756 AromaticContact CD2-ND1 3.67Å; Y724-H756 AromaticContact CD2-NE2 3.68Å; Y724-H756 AromaticContact CE1-CE1 3.77Å; Y724-H756 AromaticContact CE1-ND1 3.67Å; Y724-H756 HydrophobicContact CE2-CB 4.38Å; Y724-H756 AromaticContact CE2-CE1 3.19Å; Y724-H756 WeakPolarHBondContact CE2-CE1 3.39Å; Y724-H756 AromaticContact CE2-CG 3.63Å; Y724-H756 AromaticContact CE2-ND1 3.09Å; Y724-H756 WeakPolarHBondContact CE2-ND1 3.27Å; Y724-H756 AromaticContact CE2-NE2 3.82Å; Y724-H756 AromaticContact CG-CE1 3.52Å; Y724-H756 AromaticContact CZ-CE1 3.5Å; Y724-H756 VanDerWaalsContact CZ-CE1 3.5Å; Y724-H756 AromaticContact CZ-CG 3.97Å; Y724-H756 AromaticContact CZ-ND1 3.1Å; Y724-H756 PolarHBondContact OH-ND1 2.94Å
725	N	86.1	Confident	85.8	Confident	53 Å²	53	53.8 Å²	53.8	28%	0.283	26%	0.255	S	S	.	.	H	α-helix	trans	-66	-41.1	-179.7	-66.3	-27	0	0	0	111.9	Y721 K722 A723 L729	Y721-N725 PolarHBondContact O-N 2.82Å; Y721-N725 PolarHBondContact O-ND2 3.42Å; K722-N725 PolarHBondContact O-N 2.86Å; A723-N725 PolarHBondContact O-N 3.28Å; N725-L729 WeakPolarHBondContact O-CG 3.37Å; N725-L729 PolarHBondContact O-N 2.99Å
726	Y	87.9	Confident	85.5	Confident	34 Å²	34	57.3 Å²	57.3	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-56.1	172.6	-80.6	-69.8	0	0	0	111.7	T714 K722 A723 R728 L729 M730	T714-Y726 HydrophobicContact CG2-CD2 4.4Å; T714-Y726 HydrophobicContact CG2-CE2 4.11Å; K722-Y726 WeakPolarHBondContact O-CD2 3.22Å; K722-Y726 PolarHBondContact O-N 3.15Å; K722-Y726 VanDerWaalsContact O-N 3.1Å; A723-Y726 PolarHBondContact O-N 2.83Å; Y726-R728 VanDerWaalsContact C-N 3.26Å; Y726-R728 PolarHBondContact O-N 3.16Å; Y726-L729 PolarHBondContact O-N 3.38Å; Y726-L729 VanDerWaalsContact O-N 3.1Å; Y726-M730 WeakPolarHBondContact O-CG 3.33Å; Y726-M730 PolarHBondContact O-N 2.97Å; Y726-M730 VanDerWaalsContact O-N 3.07Å
727	I	88.6	Confident	85.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-30.7	-177.3	-167.8	61	0	0	0	112.5	L711 A723 Y724 L729 L731 F740 I743 F744 L747	L711-I727 HydrophobicContact CD1-CB 4.12Å; L711-I727 HydrophobicContact CD2-CB 4.46Å; L711-I727 HydrophobicContact CD2-CD1 4.01Å; A723-I727 WeakPolarHBondContact O-CG2 3.49Å; A723-I727 PolarHBondContact O-N 2.74Å; Y724-I727 HydrophobicContact CD2-CG2 4.5Å; Y724-I727 VanDerWaalsContact O-CG2 3.3Å; Y724-I727 WeakPolarHBondContact O-CG2 3.33Å; Y724-I727 PolarHBondContact O-N 3.22Å; I727-L729 PolarHBondContact O-N 3.03Å; I727-L731 HydrophobicContact CD1-CG 4.38Å; I727-L731 HydrophobicContact CG1-CD1 4.14Å; I727-L731 HydrophobicContact CG1-CG 4.32Å; I727-L731 VanDerWaalsContact O-CB 3.28Å; I727-L731 WeakPolarHBondContact O-CB 3.38Å; I727-L731 WeakPolarHBondContact O-CG 3.36Å; I727-L731 PolarHBondContact O-N 3.48Å; I727-F740 HydrophobicContact CD1-CB 3.89Å; I727-F740 HydrophobicContact CD1-CD1 3.53Å; I727-F740 HydrophobicContact CD1-CE1 4.38Å; I727-F740 HydrophobicContact CD1-CG 4.05Å; I727-I743 HydrophobicContact CD1-CB 4.49Å; I727-I743 HydrophobicContact CD1-CG2 4.34Å; I727-I743 HydrophobicContact CG1-CG2 4.49Å; I727-F744 HydrophobicContact CG1-CB 3.87Å; I727-F744 HydrophobicContact CG1-CD2 4.3Å; I727-F744 HydrophobicContact CG2-CD2 3.91Å; I727-L747 HydrophobicContact CB-CD1 4.21Å; I727-L747 HydrophobicContact CG2-CD1 3.68Å
728	R	87.1	Confident	85.2	Confident	66 Å²	66	57.1 Å²	57.1	25%	0.249	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-45.5	173.8	-176.8	-174.2	75.1	137.9	-5.3	111.3	D94 Y724 Y726 I732 F759	D94-R728 IonicContact OD2-CZ 2.65Å; D94-R728 IonicContact OD2-NH1 3.47Å; D94-R728 IonicContact OD2-NH2 3.9Å; D94-R728 PolarHBondContact OD2-NH2 3.18Å; D94-R728 VanDerWaalsContact OD2-NH2 3.14Å; Y724-R728 HydrophobicContact CE1-CB 4.38Å; Y724-R728 VanDerWaalsContact O-CB 3.29Å; Y724-R728 WeakPolarHBondContact O-CB 3.33Å; Y724-R728 PolarHBondContact O-N 3.22Å; Y726-R728 VanDerWaalsContact C-N 3.26Å; Y726-R728 PolarHBondContact O-N 3.16Å; R728-I732 WeakPolarHBondContact O-CG1 3.49Å; R728-I732 PolarHBondContact O-N 2.93Å; R728-F759 HydrophobicContact CG-CD2 4.02Å; R728-F759 HydrophobicContact CG-CE1 4.24Å; R728-F759 HydrophobicContact CG-CE2 3.7Å; R728-F759 HydrophobicContact CG-CG 4.43Å; R728-F759 HydrophobicContact CG-CZ 3.81Å
729	L	85.9	Confident	85.2	Confident	86 Å²	86	56.4 Å²	56.4	45%	0.45	27%	0.274	S	S	.	.	H	α-helix	trans	-69.2	-48.9	179.7	-66.1	171	0	0	0	110.9	N725 Y726 I727 L731 I732 E733	N725-L729 WeakPolarHBondContact O-CG 3.37Å; N725-L729 PolarHBondContact O-N 2.99Å; Y726-L729 PolarHBondContact O-N 3.38Å; Y726-L729 VanDerWaalsContact O-N 3.1Å; I727-L729 PolarHBondContact O-N 3.03Å; L729-L731 PolarHBondContact O-N 3.13Å; L729-I732 PolarHBondContact O-N 2.93Å; L729-E733 PolarHBondContact O-N 3.33Å
730	M	86.2	Confident	85.3	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-32.5	179.4	-60.8	176.1	93.3	0	0	112.6	E707 F708 L711 Y726 N734 F740	E707-M730 HydrophobicContact CB-CE 4.06Å; E707-M730 HydrophobicContact CB-CG 4.42Å; E707-M730 HydrophobicContact CB-SD 4.28Å; F708-M730 HydrophobicContact CD1-CE 3.66Å; F708-M730 HydrophobicContact CD2-CE 4.04Å; F708-M730 HydrophobicContact CE1-CE 3.8Å; F708-M730 HydrophobicContact CE2-CE 4.15Å; F708-M730 HydrophobicContact CG-CE 3.78Å; F708-M730 HydrophobicContact CZ-CE 4.04Å; L711-M730 HydrophobicContact CB-SD 4.39Å; L711-M730 HydrophobicContact CD2-SD 3.78Å; Y726-M730 WeakPolarHBondContact O-CG 3.33Å; Y726-M730 PolarHBondContact O-N 2.97Å; Y726-M730 VanDerWaalsContact O-N 3.07Å; M730-N734 WeakPolarHBondContact O-CB 3.3Å; M730-N734 PolarHBondContact O-N 3.42Å; M730-N734 VanDerWaalsContact O-N 3.08Å; M730-N734 PolarHBondContact O-ND2 2.58Å; M730-F740 HydrophobicContact CB-CE1 4.4Å; M730-F740 HydrophobicContact CB-CZ 4.38Å; M730-F740 HydrophobicContact CE-CE1 3.9Å; M730-F740 HydrophobicContact CE-CZ 3.94Å; M730-F740 HydrophobicContact SD-CE1 4.3Å
731	L	87.3	Confident	85.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-74.1	-26	175.2	-84.2	175.4	0	0	0	114.9	I727 L729 E733 V735 F740 W741 F744 F759	I727-L731 HydrophobicContact CD1-CG 4.38Å; I727-L731 HydrophobicContact CG1-CD1 4.14Å; I727-L731 HydrophobicContact CG1-CG 4.32Å; I727-L731 VanDerWaalsContact O-CB 3.28Å; I727-L731 WeakPolarHBondContact O-CB 3.38Å; I727-L731 WeakPolarHBondContact O-CG 3.36Å; I727-L731 PolarHBondContact O-N 3.48Å; L729-L731 PolarHBondContact O-N 3.13Å; L731-E733 VanDerWaalsContact C-N 3.32Å; L731-V735 WeakPolarHBondContact O-CG2 3.35Å; L731-V735 PolarHBondContact O-N 2.97Å; L731-F740 HydrophobicContact CD2-CB 3.44Å; L731-F740 VanDerWaalsContact CD2-CB 3.44Å; L731-F740 HydrophobicContact CD2-CG 4.47Å; L731-F740 HydrophobicContact CG-CB 4.06Å; L731-W741 HydrophobicContact CD1-CD2 4.22Å; L731-W741 HydrophobicContact CD1-CE3 3.81Å; L731-W741 HydrophobicContact CD1-CH2 3.85Å; L731-W741 HydrophobicContact CD1-CZ2 4.27Å; L731-W741 HydrophobicContact CD1-CZ3 3.63Å; L731-W741 HydrophobicContact CD2-CD2 3.74Å; L731-W741 VanDerWaalsContact CD2-CE2 3.49Å; L731-W741 HydrophobicContact CD2-CE3 4.2Å; L731-W741 HydrophobicContact CD2-CG 4.12Å; L731-W741 HydrophobicContact CD2-CH2 4.19Å; L731-W741 HydrophobicContact CD2-CZ2 3.74Å; L731-W741 HydrophobicContact CD2-CZ3 4.42Å; L731-W741 HydrophobicContact CG-CH2 4.45Å; L731-W741 HydrophobicContact CG-CZ2 4.44Å; L731-F744 HydrophobicContact CD1-CB 3.67Å; L731-F744 HydrophobicContact CD1-CD1 4.44Å; L731-F744 HydrophobicContact CD1-CD2 3.35Å; L731-F744 HydrophobicContact CD1-CE2 4.04Å; L731-F744 HydrophobicContact CD1-CG 3.58Å; L731-F759 HydrophobicContact CB-CZ 4.47Å
732	I	84.5	Confident	85.6	Confident	84 Å²	84	50.7 Å²	50.7	43%	0.431	26%	0.256	S	S	.	.	H	α-helix	trans	-68	-37.7	175.2	-69.5	162.5	0	0	0	109.9	R728 L729 F759	R728-I732 WeakPolarHBondContact O-CG1 3.49Å; R728-I732 PolarHBondContact O-N 2.93Å; L729-I732 PolarHBondContact O-N 2.93Å; I732-F759 HydrophobicContact CD1-CE2 4.02Å; I732-F759 HydrophobicContact CG1-CE2 3.82Å; I732-F759 HydrophobicContact CG1-CZ 4.04Å
733	E	82.3	Confident	85.8	Confident	103 Å²	103	51.5 Å²	51.5	48%	0.481	26%	0.261	S	S	.	.	H	α-helix	trans	-79.6	-34.8	176.9	-68.2	-168.8	177.3	0	0	114.1	K704 L729 L731	K704-E733 WeakPolarHBondContact CE-OE2 3.37Å; K704-E733 IonicContact NZ-OE2 3.19Å; K704-E733 PolarHBondContact NZ-OE2 3.33Å; L729-E733 PolarHBondContact O-N 3.33Å; L731-E733 VanDerWaalsContact C-N 3.32Å
734	N	83.4	Confident	85.8	Confident	41 Å²	41	51.6 Å²	51.6	22%	0.219	26%	0.262	C	S	.	.			trans	-123.8	49	-166.6	-46.8	-87.4	0	0	0	111.9	M730 D736 L737 F740	M730-N734 WeakPolarHBondContact O-CB 3.3Å; M730-N734 PolarHBondContact O-N 3.42Å; M730-N734 VanDerWaalsContact O-N 3.08Å; M730-N734 PolarHBondContact O-ND2 2.58Å; N734-D736 PolarHBondContact O-N 3.36Å; N734-D736 VanDerWaalsContact O-N 3.1Å; N734-L737 HydrophobicContact CB-CD1 4.1Å; N734-L737 PolarHBondContact O-N 3.19Å; N734-F740 HydrophobicContact CB-CD2 3.94Å; N734-F740 HydrophobicContact CB-CE2 3.72Å
735	V	83.4	Confident	85.8	Confident	9 Å²	9	53.9 Å²	53.9	6%	0.055	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-33.6	-173.5	173.2	0	0	0	0	113.9	L731 W741 L763 H767 N770 L773	L731-V735 WeakPolarHBondContact O-CG2 3.35Å; L731-V735 PolarHBondContact O-N 2.97Å; V735-W741 PolarHBondContact O-NE1 3.21Å; V735-L763 HydrophobicContact CG2-CD2 4.25Å; V735-H767 HydrophobicContact CG1-CB 4.14Å; V735-N770 WeakPolarHBondContact CG1-ND2 3.32Å; V735-N770 PolarHBondContact O-ND2 3.12Å; V735-L773 HydrophobicContact CG1-CD1 4.35Å
736	D	81.3	Confident	85.7	Confident	130 Å²	130	57.7 Å²	57.7	70%	0.695	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-6.6	-170.8	-58.6	-43.3	0	0	0	114.9	N734 P738	N734-D736 PolarHBondContact O-N 3.36Å; N734-D736 VanDerWaalsContact O-N 3.1Å; D736-P738 VanDerWaalsContact O-CD 3.26Å; D736-P738 WeakPolarHBondContact O-CD 3.47Å
737	L	85.8	Confident	85.6	Confident	80 Å²	80	56.3 Å²	56.3	42%	0.419	28%	0.283	S	S	.	.			trans	-86.1	111	-177.4	-69.1	-180	0	0	0	112.2	N734 Q739 F740	N734-L737 HydrophobicContact CB-CD1 4.1Å; N734-L737 PolarHBondContact O-N 3.19Å; L737-Q739 PolarHBondContact O-N 3.49Å; L737-Q739 VanDerWaalsContact O-N 3.16Å; L737-F740 HydrophobicContact CB-CD2 3.95Å; L737-F740 HydrophobicContact CD1-CD2 4.05Å; L737-F740 HydrophobicContact CD1-CE2 3.81Å; L737-F740 PolarHBondContact O-N 3.49Å
738	P	82.6	Confident	85.2	Confident	74 Å²	74	57.8 Å²	57.8	48%	0.481	29%	0.292	S	S	.	.	H	α-helix	trans	-65.5	-22.8	-176.3	-21.5	35.2	0	0	0	113.9	D736 F740 W741 N742	D736-P738 VanDerWaalsContact O-CD 3.26Å; D736-P738 WeakPolarHBondContact O-CD 3.47Å; P738-F740 PolarHBondContact O-N 2.99Å; P738-W741 PolarHBondContact O-N 3.05Å; P738-N742 VanDerWaalsContact O-CG 3.3Å; P738-N742 PolarHBondContact O-N 2.97Å; P738-N742 PolarHBondContact O-ND2 3.45Å
739	Q	86.6	Confident	84.8	Confident	120 Å²	120	60.3 Å²	60.3	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-61.1	-43.8	178.5	-60.7	83.3	-9.4	0	0	111.3	L737 N742 I743	L737-Q739 PolarHBondContact O-N 3.49Å; L737-Q739 VanDerWaalsContact O-N 3.16Å; Q739-N742 PolarHBondContact O-N 2.95Å; Q739-I743 WeakPolarHBondContact O-CG1 3.45Å; Q739-I743 PolarHBondContact O-N 3.37Å; Q739-I743 VanDerWaalsContact O-N 3.11Å
740	F	87.4	Confident	84.4	Confident	12 Å²	12	58.4 Å²	58.4	5%	0.053	30%	0.304	C	S	.	.	H	α-helix	trans	-66.8	-38.5	176.7	-72.6	-47.5	0	0	0	111.8	F708 I727 M730 L731 N734 L737 P738 N742 I743 F744	F708-F740 HydrophobicContact CD1-CE1 4.44Å; F708-F740 AromaticContact CE1-CE1 3.57Å; F708-F740 HydrophobicContact CE1-CE1 3.57Å; F708-F740 AromaticContact CE1-CZ 3.61Å; F708-F740 HydrophobicContact CE1-CZ 3.61Å; F708-F740 HydrophobicContact CZ-CE1 4.07Å; F708-F740 AromaticContact CZ-CZ 3.59Å; F708-F740 HydrophobicContact CZ-CZ 3.59Å; I727-F740 HydrophobicContact CD1-CB 3.89Å; I727-F740 HydrophobicContact CD1-CD1 3.53Å; I727-F740 HydrophobicContact CD1-CE1 4.38Å; I727-F740 HydrophobicContact CD1-CG 4.05Å; M730-F740 HydrophobicContact CB-CE1 4.4Å; M730-F740 HydrophobicContact CB-CZ 4.38Å; M730-F740 HydrophobicContact CE-CE1 3.9Å; M730-F740 HydrophobicContact CE-CZ 3.94Å; M730-F740 HydrophobicContact SD-CE1 4.3Å; L731-F740 HydrophobicContact CD2-CB 3.44Å; L731-F740 VanDerWaalsContact CD2-CB 3.44Å; L731-F740 HydrophobicContact CD2-CG 4.47Å; L731-F740 HydrophobicContact CG-CB 4.06Å; N734-F740 HydrophobicContact CB-CD2 3.94Å; N734-F740 HydrophobicContact CB-CE2 3.72Å; L737-F740 HydrophobicContact CB-CD2 3.95Å; L737-F740 HydrophobicContact CD1-CD2 4.05Å; L737-F740 HydrophobicContact CD1-CE2 3.81Å; L737-F740 PolarHBondContact O-N 3.49Å; P738-F740 PolarHBondContact O-N 2.99Å; F740-N742 VanDerWaalsContact C-N 3.31Å; F740-N742 PolarHBondContact O-N 2.73Å; F740-I743 PolarHBondContact O-N 2.97Å; F740-F744 WeakPolarHBondContact O-CB 3.43Å; F740-F744 PolarHBondContact O-N 3.19Å
741	W	87.8	Confident	83.6	Confident	5 Å²	5	58.5 Å²	58.5	2%	0.019	31%	0.305	C	S	.	.	H	α-helix	trans	-64.3	-33.9	174.7	-71.2	109.8	0	0	0	113.3	L731 V735 P738 F744 H745 F759 L763 A772 L773 L776	L731-W741 HydrophobicContact CD1-CD2 4.22Å; L731-W741 HydrophobicContact CD1-CE3 3.81Å; L731-W741 HydrophobicContact CD1-CH2 3.85Å; L731-W741 HydrophobicContact CD1-CZ2 4.27Å; L731-W741 HydrophobicContact CD1-CZ3 3.63Å; L731-W741 HydrophobicContact CD2-CD2 3.74Å; L731-W741 VanDerWaalsContact CD2-CE2 3.49Å; L731-W741 HydrophobicContact CD2-CE3 4.2Å; L731-W741 HydrophobicContact CD2-CG 4.12Å; L731-W741 HydrophobicContact CD2-CH2 4.19Å; L731-W741 HydrophobicContact CD2-CZ2 3.74Å; L731-W741 HydrophobicContact CD2-CZ3 4.42Å; L731-W741 HydrophobicContact CG-CH2 4.45Å; L731-W741 HydrophobicContact CG-CZ2 4.44Å; V735-W741 PolarHBondContact O-NE1 3.21Å; P738-W741 PolarHBondContact O-N 3.05Å; W741-F744 HydrophobicContact CE3-CD1 4.01Å; W741-F744 HydrophobicContact CE3-CG 4.34Å; W741-F744 HydrophobicContact CZ3-CD1 4.04Å; W741-F744 HydrophobicContact CZ3-CE1 4.13Å; W741-F744 HydrophobicContact CZ3-CG 4.39Å; W741-H745 VanDerWaalsContact O-CB 3.3Å; W741-H745 WeakPolarHBondContact O-CB 3.47Å; W741-H745 PolarHBondContact O-N 3.19Å; W741-F759 HydrophobicContact CH2-CE1 4.48Å; W741-L763 HydrophobicContact CH2-CD2 3.74Å; W741-L763 HydrophobicContact CZ2-CD2 3.87Å; W741-A772 HydrophobicContact CB-CB 3.77Å; W741-A772 HydrophobicContact CD2-CB 4.21Å; W741-A772 HydrophobicContact CG-CB 3.58Å; W741-L773 HydrophobicContact CH2-CD1 4.35Å; W741-L773 HydrophobicContact CH2-CD2 3.37Å; W741-L773 HydrophobicContact CH2-CG 3.74Å; W741-L773 HydrophobicContact CZ2-CD1 3.99Å; W741-L773 HydrophobicContact CZ2-CD2 3.82Å; W741-L773 HydrophobicContact CZ2-CG 3.62Å; W741-L773 HydrophobicContact CZ3-CD2 3.89Å; W741-L773 HydrophobicContact CZ3-CG 4.39Å; W741-L776 HydrophobicContact CB-CD1 4.5Å; W741-L776 HydrophobicContact CD2-CD1 4.26Å; W741-L776 HydrophobicContact CE3-CD1 3.45Å; W741-L776 VanDerWaalsContact CE3-CD1 3.45Å; W741-L776 HydrophobicContact CZ3-CD1 4.1Å
742	N	87.7	Confident	82.4	Confident	111 Å²	111	67.6 Å²	67.6	59%	0.594	35%	0.347	S	S	*	.	H	α-helix	trans	-67.2	-46	173.5	-68.5	-27.2	0	0	0	111.8	P738 Q739 F740 H745 Q746	P738-N742 VanDerWaalsContact O-CG 3.3Å; P738-N742 PolarHBondContact O-N 2.97Å; P738-N742 PolarHBondContact O-ND2 3.45Å; Q739-N742 PolarHBondContact O-N 2.95Å; F740-N742 VanDerWaalsContact C-N 3.31Å; F740-N742 PolarHBondContact O-N 2.73Å; N742-H745 PolarHBondContact O-N 2.78Å; N742-Q746 PolarHBondContact O-N 3.13Å
743	I	86.6	Confident	81.5	Confident	56 Å²	56	67.4 Å²	67.4	29%	0.287	35%	0.345	S	S	.	.	H	α-helix	trans	-63.3	-45.7	176.7	-65.5	165.9	0	0	0	110.5	L711 I715 I727 Q739 F740 H745 Q746 L747	L711-I743 HydrophobicContact CD2-CG2 4.46Å; I715-I743 HydrophobicContact CD1-CG2 3.96Å; I727-I743 HydrophobicContact CD1-CB 4.49Å; I727-I743 HydrophobicContact CD1-CG2 4.34Å; I727-I743 HydrophobicContact CG1-CG2 4.49Å; Q739-I743 WeakPolarHBondContact O-CG1 3.45Å; Q739-I743 PolarHBondContact O-N 3.37Å; Q739-I743 VanDerWaalsContact O-N 3.11Å; F740-I743 PolarHBondContact O-N 2.97Å; I743-H745 VanDerWaalsContact C-N 3.34Å; I743-H745 PolarHBondContact O-N 2.68Å; I743-Q746 PolarHBondContact O-N 2.78Å; I743-L747 HydrophobicContact CG2-CD1 4.06Å; I743-L747 WeakPolarHBondContact O-CB 3.43Å; I743-L747 WeakPolarHBondContact O-CG 3.37Å; I743-L747 PolarHBondContact O-N 2.98Å
744	F	88.1	Confident	80.6	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.009	36%	0.362	C	S	.	.	H	α-helix	trans	-56.1	-47.4	173.3	179.2	-89.8	0	0	0	111.1	Y724 I727 L731 F740 W741 Q746 L747 T748 H756 F759 L776	Y724-F744 HydrophobicContact CD2-CE2 4.23Å; Y724-F744 HydrophobicContact CE2-CD2 4.19Å; Y724-F744 AromaticContact CE2-CE2 3.42Å; Y724-F744 HydrophobicContact CE2-CE2 3.42Å; Y724-F744 VanDerWaalsContact CE2-CE2 3.42Å; Y724-F744 AromaticContact CE2-CZ 3.93Å; Y724-F744 HydrophobicContact CE2-CZ 3.93Å; I727-F744 HydrophobicContact CG1-CB 3.87Å; I727-F744 HydrophobicContact CG1-CD2 4.3Å; I727-F744 HydrophobicContact CG2-CD2 3.91Å; L731-F744 HydrophobicContact CD1-CB 3.67Å; L731-F744 HydrophobicContact CD1-CD1 4.44Å; L731-F744 HydrophobicContact CD1-CD2 3.35Å; L731-F744 HydrophobicContact CD1-CE2 4.04Å; L731-F744 HydrophobicContact CD1-CG 3.58Å; F740-F744 WeakPolarHBondContact O-CB 3.43Å; F740-F744 PolarHBondContact O-N 3.19Å; W741-F744 HydrophobicContact CE3-CD1 4.01Å; W741-F744 HydrophobicContact CE3-CG 4.34Å; W741-F744 HydrophobicContact CZ3-CD1 4.04Å; W741-F744 HydrophobicContact CZ3-CE1 4.13Å; W741-F744 HydrophobicContact CZ3-CG 4.39Å; F744-Q746 PolarHBondContact O-N 2.86Å; F744-L747 CarbonylContact O-C 3.55Å; F744-L747 WeakPolarHBondContact O-CB 3.45Å; F744-L747 PolarHBondContact O-N 2.92Å; F744-L747 VanDerWaalsContact O-N 3.17Å; F744-T748 HydrophobicContact CD1-CG2 3.76Å; F744-T748 HydrophobicContact CE1-CG2 3.5Å; F744-T748 HydrophobicContact CG-CG2 4.41Å; F744-T748 HydrophobicContact CZ-CG2 3.98Å; F744-T748 WeakPolarHBondContact O-CG2 3.47Å; F744-T748 PolarHBondContact O-N 2.94Å; F744-H756 HydrophobicContact CZ-CB 4.45Å; F744-F759 AromaticContact CE2-CD1 3.93Å; F744-F759 HydrophobicContact CE2-CD1 3.93Å; F744-F759 AromaticContact CE2-CE1 3.86Å; F744-F759 HydrophobicContact CE2-CE1 3.86Å; F744-F759 AromaticContact CZ-CD1 3.86Å; F744-F759 HydrophobicContact CZ-CD1 3.86Å; F744-F759 HydrophobicContact CZ-CE1 4.14Å; F744-L776 HydrophobicContact CD1-CD1 4.28Å
745	H	85.5	Confident	79.9	Confident	61 Å²	61	76.3 Å²	76.3	28%	0.282	38%	0.378	S	S	.	.	H	α-helix	trans	-63	-43.7	179.5	-170.5	29.2	0	0	0	112	W741 N742 I743 L747 T748 I749 L776	W741-H745 VanDerWaalsContact O-CB 3.3Å; W741-H745 WeakPolarHBondContact O-CB 3.47Å; W741-H745 PolarHBondContact O-N 3.19Å; N742-H745 PolarHBondContact O-N 2.78Å; I743-H745 VanDerWaalsContact C-N 3.34Å; I743-H745 PolarHBondContact O-N 2.68Å; H745-L747 VanDerWaalsContact C-N 3.3Å; H745-L747 PolarHBondContact O-N 2.96Å; H745-T748 WeakPolarHBondContact CA-OG1 3.49Å; H745-T748 PolarHBondContact ND1-OG1 3.34Å; H745-T748 PolarHBondContact O-N 2.85Å; H745-T748 VanDerWaalsContact O-N 3.07Å; H745-T748 PolarHBondContact O-OG1 2.9Å; H745-I749 WeakPolarHBondContact O-CG1 3.19Å; H745-I749 PolarHBondContact O-N 3.42Å; H745-L776 HydrophobicContact CB-CD2 3.91Å
746	Q	84.4	Confident	79.7	Confident	132 Å²	132	76.2 Å²	76.2	62%	0.617	38%	0.377	S	S	*	.	H	α-helix	trans	-57.4	-43	173.5	-175.9	174.5	-12.1	0	0	111.6	N742 I743 F744 I749 S750	N742-Q746 PolarHBondContact O-N 3.13Å; I743-Q746 PolarHBondContact O-N 2.78Å; F744-Q746 PolarHBondContact O-N 2.86Å; Q746-I749 PolarHBondContact O-N 3.27Å; Q746-S750 PolarHBondContact O-N 3.06Å; Q746-S750 VanDerWaalsContact O-N 3.12Å
747	L	84.4	Confident	79.5	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.026	36%	0.357	C	S	.	.	H	α-helix	trans	-66.4	-33.3	173.8	-73.2	170.7	0	0	0	113.3	L711 I715 Y720 A723 I727 I743 F744 H745 I749 S750 S751	L711-L747 HydrophobicContact CD1-CD1 4.23Å; I715-L747 HydrophobicContact CD1-CD1 4.47Å; I715-L747 HydrophobicContact CG1-CD2 4.22Å; Y720-L747 HydrophobicContact CD1-CD2 3.72Å; A723-L747 HydrophobicContact CB-CD1 4.01Å; A723-L747 HydrophobicContact CB-CD2 3.73Å; I727-L747 HydrophobicContact CB-CD1 4.21Å; I727-L747 HydrophobicContact CG2-CD1 3.68Å; I743-L747 HydrophobicContact CG2-CD1 4.06Å; I743-L747 WeakPolarHBondContact O-CB 3.43Å; I743-L747 WeakPolarHBondContact O-CG 3.37Å; I743-L747 PolarHBondContact O-N 2.98Å; F744-L747 CarbonylContact O-C 3.55Å; F744-L747 WeakPolarHBondContact O-CB 3.45Å; F744-L747 PolarHBondContact O-N 2.92Å; F744-L747 VanDerWaalsContact O-N 3.17Å; H745-L747 VanDerWaalsContact C-N 3.3Å; H745-L747 PolarHBondContact O-N 2.96Å; L747-I749 VanDerWaalsContact C-N 3.26Å; L747-I749 PolarHBondContact O-N 3.07Å; L747-S750 PolarHBondContact O-OG 3.02Å; L747-S751 VanDerWaalsContact O-CB 3.32Å; L747-S751 WeakPolarHBondContact O-CB 3.34Å; L747-S751 PolarHBondContact O-N 3.49Å; L747-S751 PolarHBondContact O-OG 3.49Å
748	T	81.3	Confident	79.3	Confident	31 Å²	31	73 Å²	73	19%	0.19	35%	0.352	C	S	.	.	H	α-helix	trans	-71.4	-19.5	173.3	66.7	0	0	0	0	113.6	F744 H745 H756	F744-T748 HydrophobicContact CD1-CG2 3.76Å; F744-T748 HydrophobicContact CE1-CG2 3.5Å; F744-T748 HydrophobicContact CG-CG2 4.41Å; F744-T748 HydrophobicContact CZ-CG2 3.98Å; F744-T748 WeakPolarHBondContact O-CG2 3.47Å; F744-T748 PolarHBondContact O-N 2.94Å; H745-T748 WeakPolarHBondContact CA-OG1 3.49Å; H745-T748 PolarHBondContact ND1-OG1 3.34Å; H745-T748 PolarHBondContact O-N 2.85Å; H745-T748 VanDerWaalsContact O-N 3.07Å; H745-T748 PolarHBondContact O-OG1 2.9Å; T748-H756 HydrophobicContact CG2-CB 4.15Å; T748-H756 WeakPolarHBondContact CG2-CD2 3.29Å
749	I	79.1	Confident	79.4	Confident	120 Å²	120	70.6 Å²	70.6	62%	0.615	33%	0.334	S	S	*	.	H	α-helix	trans	-86	-37.9	175.9	-66.8	164	0	0	0	110.5	H745 Q746 L747	H745-I749 WeakPolarHBondContact O-CG1 3.19Å; H745-I749 PolarHBondContact O-N 3.42Å; Q746-I749 PolarHBondContact O-N 3.27Å; L747-I749 VanDerWaalsContact C-N 3.26Å; L747-I749 PolarHBondContact O-N 3.07Å
750	S	76.3	Confident	79.3	Confident	46 Å²	46	64.9 Å²	64.9	32%	0.322	31%	0.308	S	S	.	.	H	α-helix	trans	-79.6	-39.3	176.9	63.6	0	0	0	0	113.3	Y720 Q746 L747	Y720-S750 WeakPolarHBondContact CD1-OG 3.48Å; Q746-S750 PolarHBondContact O-N 3.06Å; Q746-S750 VanDerWaalsContact O-N 3.12Å; L747-S750 PolarHBondContact O-OG 3.02Å
751	S	68.8	Low	79.1	Confident	7 Å²	7	67.8 Å²	67.8	5%	0.049	32%	0.323	C	S	.	.	S	Bend	trans	-89.4	114.9	175.4	70.1	0	0	0	0	111.3	L747 H753 H756	L747-S751 VanDerWaalsContact O-CB 3.32Å; L747-S751 WeakPolarHBondContact O-CB 3.34Å; L747-S751 PolarHBondContact O-N 3.49Å; L747-S751 PolarHBondContact O-OG 3.49Å; S751-H753 PolarHBondContact O-N 2.95Å; S751-H756 PolarHBondContact OG-NE2 3.19Å
752	Q	63.8	Low	79	Confident	191 Å²	191	72.2 Å²	72.2	89%	0.893	34%	0.34	S	S	*	.			trans	-73.9	27.5	-178.4	-58.7	-176.4	2.9	0	0	113.8
753	H	64.2	Low	78.9	Confident	80 Å²	80	67.5 Å²	67.5	37%	0.37	32%	0.315	S	S	.	.			trans	-86.9	126	-173.6	-68	-50	0	0	0	112.3	Y721 S751 R755 H756	Y721-H753 AromaticContact CD2-NE2 3.57Å; S751-H753 PolarHBondContact O-N 2.95Å; H753-R755 VanDerWaalsContact C-N 3.31Å; H753-R755 PolarHBondContact O-N 3.22Å; H753-H756 VanDerWaalsContact CB-CE1 3.48Å; H753-H756 WeakPolarHBondContact CB-CE1 3.33Å; H753-H756 PolarHBondContact O-CD2 3.44Å; H753-H756 VanDerWaalsContact O-CG 3.31Å; H753-H756 PolarHBondContact O-NE2 3.11Å
754	Q	64.6	Low	78.8	Confident	181 Å²	181	65.7 Å²	65.7	85%	0.846	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.7	-178.3	-61.1	175.4	1.2	0	0	113.8	H756 H757	Q754-H756 PolarHBondContact O-N 3.43Å; Q754-H756 VanDerWaalsContact O-N 3.14Å; Q754-H757 PolarHBondContact O-N 3.29Å
755	R	68.3	Low	78.6	Confident	149 Å²	149	72.9 Å²	72.9	56%	0.562	34%	0.343	S	S	*	.	H	α-helix	trans	-55.9	-31.8	-178.4	-67.3	-178.8	173.1	179.3	-5.5	112.6	H753 H757 R758	H753-R755 VanDerWaalsContact C-N 3.31Å; H753-R755 PolarHBondContact O-N 3.22Å; R755-H757 PolarHBondContact O-N 2.98Å; R755-R758 PolarHBondContact O-N 2.68Å
756	H	78.1	Confident	78.5	Confident	7 Å²	7	75.2 Å²	75.2	3%	0.032	35%	0.352	C	S	.	.	H	α-helix	trans	-56.1	-32.8	-176.2	-50.9	-7.9	0	0	0	113.2	Y724 F744 T748 S751 H753 Q754 F759 C760	Y724-H756 AromaticContact CD1-CE1 3.78Å; Y724-H756 AromaticContact CD2-CE1 3.21Å; Y724-H756 WeakPolarHBondContact CD2-CE1 3.21Å; Y724-H756 AromaticContact CD2-ND1 3.67Å; Y724-H756 AromaticContact CD2-NE2 3.68Å; Y724-H756 AromaticContact CE1-CE1 3.77Å; Y724-H756 AromaticContact CE1-ND1 3.67Å; Y724-H756 HydrophobicContact CE2-CB 4.38Å; Y724-H756 AromaticContact CE2-CE1 3.19Å; Y724-H756 WeakPolarHBondContact CE2-CE1 3.39Å; Y724-H756 AromaticContact CE2-CG 3.63Å; Y724-H756 AromaticContact CE2-ND1 3.09Å; Y724-H756 WeakPolarHBondContact CE2-ND1 3.27Å; Y724-H756 AromaticContact CE2-NE2 3.82Å; Y724-H756 AromaticContact CG-CE1 3.52Å; Y724-H756 AromaticContact CZ-CE1 3.5Å; Y724-H756 VanDerWaalsContact CZ-CE1 3.5Å; Y724-H756 AromaticContact CZ-CG 3.97Å; Y724-H756 AromaticContact CZ-ND1 3.1Å; Y724-H756 PolarHBondContact OH-ND1 2.94Å; F744-H756 HydrophobicContact CZ-CB 4.45Å; T748-H756 HydrophobicContact CG2-CB 4.15Å; T748-H756 WeakPolarHBondContact CG2-CD2 3.29Å; S751-H756 PolarHBondContact OG-NE2 3.19Å; H753-H756 VanDerWaalsContact CB-CE1 3.48Å; H753-H756 WeakPolarHBondContact CB-CE1 3.33Å; H753-H756 PolarHBondContact O-CD2 3.44Å; H753-H756 VanDerWaalsContact O-CG 3.31Å; H753-H756 PolarHBondContact O-NE2 3.11Å; Q754-H756 PolarHBondContact O-N 3.43Å; Q754-H756 VanDerWaalsContact O-N 3.14Å; H756-F759 PolarHBondContact O-N 2.93Å; H756-C760 PolarHBondContact O-N 3.01Å; H756-C760 PolarHBondContact O-SG 3.34Å
757	H	77.4	Confident	78.5	Confident	59 Å²	59	72.3 Å²	72.3	27%	0.273	34%	0.339	S	S	.	.	H	α-helix	trans	-68.3	-44.3	-178.4	-176.1	29	0	0	0	112.8	Q754 R755 F759 C760 L761 N780	Q754-H757 PolarHBondContact O-N 3.29Å; R755-H757 PolarHBondContact O-N 2.98Å; H757-F759 VanDerWaalsContact C-N 3.31Å; H757-F759 PolarHBondContact O-N 3.1Å; H757-C760 PolarHBondContact O-N 3.2Å; H757-L761 VanDerWaalsContact CE1-CD1 3.45Å; H757-L761 WeakPolarHBondContact CE1-CD1 3.49Å; H757-L761 WeakPolarHBondContact O-CG 3.4Å; H757-L761 PolarHBondContact O-N 3.08Å; H757-L761 VanDerWaalsContact O-N 3.08Å; H757-N780 HydrophobicContact CB-CB 4.46Å
758	R	82.1	Confident	78.3	Confident	84 Å²	84	76 Å²	76	32%	0.317	36%	0.363	S	S	.	.	H	α-helix	trans	-61.9	-40.8	176.5	-71.6	-172	-177.2	171.9	5.8	110.9	D89 D92 R755 L761 R762	D89-R758 IonicContact OD2-NH2 3.19Å; D92-R758 IonicContact OD2-NH1 2.73Å; D92-R758 PolarHBondContact OD2-NH1 3.17Å; R755-R758 PolarHBondContact O-N 2.68Å; R758-L761 PolarHBondContact O-N 3.36Å; R758-R762 WeakPolarHBondContact O-CG 3.49Å; R758-R762 PolarHBondContact O-N 3.07Å
759	F	84.9	Confident	78.3	Confident	24 Å²	24	81.5 Å²	81.5	11%	0.105	39%	0.391	C	S	.	.	H	α-helix	trans	-60.7	-52.6	176.2	175.2	-109.6	0	0	0	112.1	R728 L731 I732 W741 F744 H756 H757 L761 R762 L763	R728-F759 HydrophobicContact CG-CD2 4.02Å; R728-F759 HydrophobicContact CG-CE1 4.24Å; R728-F759 HydrophobicContact CG-CE2 3.7Å; R728-F759 HydrophobicContact CG-CG 4.43Å; R728-F759 HydrophobicContact CG-CZ 3.81Å; L731-F759 HydrophobicContact CB-CZ 4.47Å; I732-F759 HydrophobicContact CD1-CE2 4.02Å; I732-F759 HydrophobicContact CG1-CE2 3.82Å; I732-F759 HydrophobicContact CG1-CZ 4.04Å; W741-F759 HydrophobicContact CH2-CE1 4.48Å; F744-F759 AromaticContact CE2-CD1 3.93Å; F744-F759 HydrophobicContact CE2-CD1 3.93Å; F744-F759 AromaticContact CE2-CE1 3.86Å; F744-F759 HydrophobicContact CE2-CE1 3.86Å; F744-F759 AromaticContact CZ-CD1 3.86Å; F744-F759 HydrophobicContact CZ-CD1 3.86Å; F744-F759 HydrophobicContact CZ-CE1 4.14Å; H756-F759 PolarHBondContact O-N 2.93Å; H757-F759 VanDerWaalsContact C-N 3.31Å; H757-F759 PolarHBondContact O-N 3.1Å; F759-L761 VanDerWaalsContact C-N 3.31Å; F759-L761 PolarHBondContact O-N 3.34Å; F759-R762 PolarHBondContact O-N 3.49Å; F759-L763 HydrophobicContact CE1-CD2 4.41Å; F759-L763 HydrophobicContact CE2-CD1 4.38Å; F759-L763 HydrophobicContact CZ-CD2 4.02Å; F759-L763 PolarHBondContact O-N 3.45Å
760	C	84.9	Confident	78.6	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-60.6	-38.3	179.8	-61.1	0	0	0	0	112.4	H756 H757 L763 L764 L773	H756-C760 PolarHBondContact O-N 3.01Å; H756-C760 PolarHBondContact O-SG 3.34Å; H757-C760 PolarHBondContact O-N 3.2Å; C760-L763 PolarHBondContact O-N 3.38Å; C760-L764 VanDerWaalsContact O-CB 3.31Å; C760-L764 WeakPolarHBondContact O-CB 3.34Å; C760-L764 PolarHBondContact O-N 2.9Å; C760-L773 HydrophobicContact CB-CD2 4.28Å
761	L	82.6	Confident	78.9	Confident	73 Å²	73	77.4 Å²	77.4	38%	0.382	37%	0.365	S	S	.	.	H	α-helix	trans	-66.4	-45.3	176	-73.1	175.8	0	0	0	112.5	H757 R758 F759 L763 L764 L765	H757-L761 VanDerWaalsContact CE1-CD1 3.45Å; H757-L761 WeakPolarHBondContact CE1-CD1 3.49Å; H757-L761 WeakPolarHBondContact O-CG 3.4Å; H757-L761 PolarHBondContact O-N 3.08Å; H757-L761 VanDerWaalsContact O-N 3.08Å; R758-L761 PolarHBondContact O-N 3.36Å; F759-L761 VanDerWaalsContact C-N 3.31Å; F759-L761 PolarHBondContact O-N 3.34Å; L761-L763 VanDerWaalsContact C-N 3.27Å; L761-L763 PolarHBondContact O-N 3.45Å; L761-L764 PolarHBondContact O-N 3.44Å; L761-L765 WeakPolarHBondContact O-CG 3.32Å; L761-L765 PolarHBondContact O-N 2.78Å; L761-L765 VanDerWaalsContact O-N 3.16Å
762	R	85.9	Confident	79.6	Confident	98 Å²	98	78.3 Å²	78.3	37%	0.37	37%	0.373	S	S	.	.	H	α-helix	trans	-59.2	-38.8	175.9	-73.7	176.9	-174.3	148.7	9.4	111.5	D92 R758 F759	D92-R762 VanDerWaalsContact CG-NH2 3.29Å; D92-R762 IonicContact OD1-CZ 3.19Å; D92-R762 IonicContact OD1-NH1 3.66Å; D92-R762 PolarHBondContact OD1-NH1 3.29Å; D92-R762 IonicContact OD1-NH2 3.63Å; D92-R762 IonicContact OD2-CZ 2.81Å; D92-R762 IonicContact OD2-NH1 3.61Å; D92-R762 IonicContact OD2-NH2 3.91Å; D92-R762 PolarHBondContact OD2-NH2 3.06Å; R758-R762 WeakPolarHBondContact O-CG 3.49Å; R758-R762 PolarHBondContact O-N 3.07Å; F759-R762 PolarHBondContact O-N 3.49Å
763	L	85.3	Confident	80.6	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-76	-38.6	180	-136.3	70	0	0	0	112.7	V735 W741 F759 C760 L761 L765 K766 H767 L773	V735-L763 HydrophobicContact CG2-CD2 4.25Å; W741-L763 HydrophobicContact CH2-CD2 3.74Å; W741-L763 HydrophobicContact CZ2-CD2 3.87Å; F759-L763 HydrophobicContact CE1-CD2 4.41Å; F759-L763 HydrophobicContact CE2-CD1 4.38Å; F759-L763 HydrophobicContact CZ-CD2 4.02Å; F759-L763 PolarHBondContact O-N 3.45Å; C760-L763 PolarHBondContact O-N 3.38Å; L761-L763 VanDerWaalsContact C-N 3.27Å; L761-L763 PolarHBondContact O-N 3.45Å; L763-L765 VanDerWaalsContact C-N 3.26Å; L763-L765 PolarHBondContact O-N 3.31Å; L763-K766 PolarHBondContact O-N 3.49Å; L763-H767 PolarHBondContact O-N 3.37Å; L763-L773 HydrophobicContact CB-CD1 4.06Å; L763-L773 HydrophobicContact CB-CD2 4.01Å; L763-L773 HydrophobicContact CD2-CD1 4.24Å; L763-L773 HydrophobicContact CD2-CD2 4.44Å; L763-L773 HydrophobicContact CG-CD1 4.28Å
764	L	84.2	Confident	81.6	Confident	18 Å²	18	65.7 Å²	65.7	9%	0.094	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-30.1	175.4	-179.1	63.1	0	0	0	112.6	C760 L761 K766 H767 P768 L773 C774 C777	C760-L764 VanDerWaalsContact O-CB 3.31Å; C760-L764 WeakPolarHBondContact O-CB 3.34Å; C760-L764 PolarHBondContact O-N 2.9Å; L761-L764 PolarHBondContact O-N 3.44Å; L764-K766 VanDerWaalsContact C-N 3.31Å; L764-H767 CarbonylContact O-C 3.54Å; L764-P768 WeakPolarHBondContact O-CA 3.42Å; L764-L773 HydrophobicContact CB-CB 4.42Å; L764-L773 HydrophobicContact CD1-CB 4.03Å; L764-C774 HydrophobicContact CD1-CB 4.5Å; L764-C777 HydrophobicContact CD2-CB 3.82Å
765	L	83.9	Confident	82.7	Confident	153 Å²	153	58 Å²	58	80%	0.801	28%	0.28	S	S	*	.	H	α-helix	trans	-68.7	-27	172.5	-71.9	172.1	0	0	0	113.3	L761 L763	L761-L765 WeakPolarHBondContact O-CG 3.32Å; L761-L765 PolarHBondContact O-N 2.78Å; L761-L765 VanDerWaalsContact O-N 3.16Å; L763-L765 VanDerWaalsContact C-N 3.26Å; L763-L765 PolarHBondContact O-N 3.31Å
766	K	84.6	Confident	83.6	Confident	110 Å²	110	51.5 Å²	51.5	48%	0.478	26%	0.256	S	S	.	.	H	α-helix	trans	-85.1	-33.8	172.9	-70.5	-167.5	173.2	-167	0	112.6	L763 L764 P768	L763-K766 PolarHBondContact O-N 3.49Å; L764-K766 VanDerWaalsContact C-N 3.31Å; K766-P768 WeakPolarHBondContact O-CD 3.29Å
767	H	84.2	Confident	83.9	Confident	72 Å²	72	51.3 Å²	51.3	33%	0.333	26%	0.256	S	S	.	.			trans	-127.7	70.8	-174.7	-55.4	-84.8	0	0	0	110.9	V735 L763 L764 D769 N770 L773	V735-H767 HydrophobicContact CG1-CB 4.14Å; L763-H767 PolarHBondContact O-N 3.37Å; L764-H767 CarbonylContact O-C 3.54Å; H767-D769 VanDerWaalsContact C-N 3.28Å; H767-D769 PolarHBondContact O-N 2.93Å; H767-N770 HydrophobicContact CB-CB 4.26Å; H767-N770 PolarHBondContact O-N 3.49Å; H767-L773 HydrophobicContact CB-CD1 4.3Å
768	P	79.9	Confident	84.3	Confident	82 Å²	82	48.5 Å²	48.5	53%	0.532	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.4	-171.7	26.6	-35.8	0	0	0	114	L764 K766	L764-P768 WeakPolarHBondContact O-CA 3.42Å; K766-P768 WeakPolarHBondContact O-CD 3.29Å
769	D	80.7	Confident	84.6	Confident	146 Å²	146	46.3 Å²	46.3	78%	0.781	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-5.1	-177.6	-58.7	-55.7	0	0	0	113.5	H767 H771	H767-D769 VanDerWaalsContact C-N 3.28Å; H767-D769 PolarHBondContact O-N 2.93Å; D769-H771 PolarHBondContact O-N 2.88Å; D769-H771 VanDerWaalsContact O-N 3.16Å
770	N	85.4	Confident	84.5	Confident	19 Å²	19	47 Å²	47	10%	0.102	24%	0.241	C	C	.	.			trans	-71.5	112.8	-179.1	-175.8	-53	0	0	0	111.2	V735 H767 A772 L773 C774	V735-N770 WeakPolarHBondContact CG1-ND2 3.32Å; V735-N770 PolarHBondContact O-ND2 3.12Å; H767-N770 HydrophobicContact CB-CB 4.26Å; H767-N770 PolarHBondContact O-N 3.49Å; N770-A772 PolarHBondContact O-N 3.21Å; N770-A772 PolarHBondContact OD1-N 3.4Å; N770-L773 HydrophobicContact CB-CB 4.14Å; N770-L773 HydrophobicContact CB-CD1 3.98Å; N770-L773 HydrophobicContact CB-CG 4.46Å; N770-L773 PolarHBondContact O-N 3.38Å; N770-L773 PolarHBondContact OD1-N 3.21Å; N770-L773 VanDerWaalsContact OD1-N 3.08Å; N770-C774 PolarHBondContact O-N 3.23Å
771	H	83.3	Confident	84.5	Confident	62 Å²	62	47.4 Å²	47.4	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-58.6	-43.3	-176.8	178.9	32.9	0	0	0	113.7	D769 C774 V775 H801 H807	D769-H771 PolarHBondContact O-N 2.88Å; D769-H771 VanDerWaalsContact O-N 3.16Å; H771-C774 PolarHBondContact O-N 3.24Å; H771-V775 WeakPolarHBondContact CE1-CG2 3.22Å; H771-V775 WeakPolarHBondContact O-CG2 3.38Å; H771-V775 PolarHBondContact O-N 2.89Å; H771-H801 AromaticContact CD2-CD2 3.48Å; H771-H801 PolarHBondContact CD2-CD2 2.78Å; H771-H801 VanDerWaalsContact CD2-CD2 3.48Å; H771-H801 AromaticContact CD2-NE2 3.74Å; H771-H801 AromaticContact CE1-CD2 3.77Å; H771-H801 AromaticContact CG-CD2 3.43Å; H771-H801 VanDerWaalsContact CG-CD2 3.43Å; H771-H801 AromaticContact CG-NE2 3.62Å; H771-H801 AromaticContact ND1-CD2 3.6Å; H771-H801 AromaticContact NE2-CD2 3.7Å; H771-H807 AromaticContact CE1-CE1 3.22Å; H771-H807 PolarHBondContact CE1-CE1 3.45Å; H771-H807 AromaticContact CE1-NE2 3.25Å; H771-H807 PolarHBondContact CE1-NE2 3.26Å; H771-H807 VanDerWaalsContact CE1-NE2 3.25Å; H771-H807 AromaticContact NE2-CE1 3.47Å; H771-H807 PolarHBondContact NE2-CE1 3.41Å; H771-H807 AromaticContact NE2-NE2 3.53Å
772	A	83.1	Confident	84.6	Confident	25 Å²	25	45.7 Å²	45.7	21%	0.207	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-42.9	-176.9	0	0	0	0	0	111.5	W741 N770 V775 L776	W741-A772 HydrophobicContact CB-CB 3.77Å; W741-A772 HydrophobicContact CD2-CB 4.21Å; W741-A772 HydrophobicContact CG-CB 3.58Å; N770-A772 PolarHBondContact O-N 3.21Å; N770-A772 PolarHBondContact OD1-N 3.4Å; A772-V775 PolarHBondContact O-N 3.32Å; A772-L776 WeakPolarHBondContact O-CB 3.42Å; A772-L776 VanDerWaalsContact O-CG 3.31Å; A772-L776 WeakPolarHBondContact O-CG 3.34Å; A772-L776 PolarHBondContact O-N 3.24Å
773	L	84.4	Confident	84.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60	-45	173.3	-86.2	168.9	0	0	0	112.2	V735 W741 C760 L763 L764 H767 N770 V775 L776 C777	V735-L773 HydrophobicContact CG1-CD1 4.35Å; W741-L773 HydrophobicContact CH2-CD1 4.35Å; W741-L773 HydrophobicContact CH2-CD2 3.37Å; W741-L773 HydrophobicContact CH2-CG 3.74Å; W741-L773 HydrophobicContact CZ2-CD1 3.99Å; W741-L773 HydrophobicContact CZ2-CD2 3.82Å; W741-L773 HydrophobicContact CZ2-CG 3.62Å; W741-L773 HydrophobicContact CZ3-CD2 3.89Å; W741-L773 HydrophobicContact CZ3-CG 4.39Å; C760-L773 HydrophobicContact CB-CD2 4.28Å; L763-L773 HydrophobicContact CB-CD1 4.06Å; L763-L773 HydrophobicContact CB-CD2 4.01Å; L763-L773 HydrophobicContact CD2-CD1 4.24Å; L763-L773 HydrophobicContact CD2-CD2 4.44Å; L763-L773 HydrophobicContact CG-CD1 4.28Å; L764-L773 HydrophobicContact CB-CB 4.42Å; L764-L773 HydrophobicContact CD1-CB 4.03Å; H767-L773 HydrophobicContact CB-CD1 4.3Å; N770-L773 HydrophobicContact CB-CB 4.14Å; N770-L773 HydrophobicContact CB-CD1 3.98Å; N770-L773 HydrophobicContact CB-CG 4.46Å; N770-L773 PolarHBondContact O-N 3.38Å; N770-L773 PolarHBondContact OD1-N 3.21Å; N770-L773 VanDerWaalsContact OD1-N 3.08Å; L773-V775 PolarHBondContact O-N 3.34Å; L773-L776 PolarHBondContact O-N 2.99Å; L773-C777 VanDerWaalsContact O-CB 3.3Å; L773-C777 WeakPolarHBondContact O-CB 3.17Å; L773-C777 PolarHBondContact O-N 3.36Å; L773-C777 PolarHBondContact O-SG 3.29Å
774	C	86.2	Confident	84.2	Confident	7 Å²	7	49.9 Å²	49.9	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-48	177.7	-179.4	0	0	0	0	111.7	L764 N770 H771 G778 Q793	L764-C774 HydrophobicContact CD1-CB 4.5Å; N770-C774 PolarHBondContact O-N 3.23Å; H771-C774 PolarHBondContact O-N 3.24Å; C774-G778 PolarHBondContact O-N 3.11Å; C774-Q793 PolarHBondContact SG-O 3.38Å; C774-Q793 VanDerWaalsContact SG-O 3.34Å; C774-Q793 PolarHBondContact SG-OE1 3.4Å
775	V	86.7	Confident	84.1	Confident	19 Å²	19	50.5 Å²	50.5	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-42.8	178.6	172	0	0	0	0	112.1	H771 A772 L773 G778 H779 A797 Y810	H771-V775 WeakPolarHBondContact CE1-CG2 3.22Å; H771-V775 WeakPolarHBondContact O-CG2 3.38Å; H771-V775 PolarHBondContact O-N 2.89Å; A772-V775 PolarHBondContact O-N 3.32Å; L773-V775 PolarHBondContact O-N 3.34Å; V775-G778 CarbonylContact O-C 3.57Å; V775-G778 WeakPolarHBondContact O-CA 3.48Å; V775-G778 PolarHBondContact O-N 3.34Å; V775-G778 VanDerWaalsContact O-N 3.17Å; V775-H779 VanDerWaalsContact CG1-CE1 3.44Å; V775-H779 WeakPolarHBondContact CG1-CE1 3.47Å; V775-H779 PolarHBondContact O-N 3.43Å; V775-H779 PolarHBondContact O-ND1 3.39Å; V775-A797 HydrophobicContact CG2-CB 3.89Å; V775-Y810 HydrophobicContact CG1-CE2 4.44Å
776	L	86.5	Confident	84.3	Confident	13 Å²	13	45.6 Å²	45.6	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-67.5	-37.8	178.3	-71.7	170.1	0	0	0	112.6	W741 F744 H745 A772 L773 G778 H779 N780	W741-L776 HydrophobicContact CB-CD1 4.5Å; W741-L776 HydrophobicContact CD2-CD1 4.26Å; W741-L776 HydrophobicContact CE3-CD1 3.45Å; W741-L776 VanDerWaalsContact CE3-CD1 3.45Å; W741-L776 HydrophobicContact CZ3-CD1 4.1Å; F744-L776 HydrophobicContact CD1-CD1 4.28Å; H745-L776 HydrophobicContact CB-CD2 3.91Å; A772-L776 WeakPolarHBondContact O-CB 3.42Å; A772-L776 VanDerWaalsContact O-CG 3.31Å; A772-L776 WeakPolarHBondContact O-CG 3.34Å; A772-L776 PolarHBondContact O-N 3.24Å; L773-L776 PolarHBondContact O-N 2.99Å; L776-G778 VanDerWaalsContact C-N 3.31Å; L776-H779 PolarHBondContact O-N 3.07Å; L776-N780 WeakPolarHBondContact O-CB 3.35Å; L776-N780 PolarHBondContact O-N 2.84Å; L776-N780 PolarHBondContact O-ND2 3Å
777	C	85.8	Confident	84.3	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.02	25%	0.247	C	C	.	.	H	α-helix	trans	-64.3	-36.5	170.1	-78	0	0	0	0	111.9	L764 L773 A781	L764-C777 HydrophobicContact CD2-CB 3.82Å; L773-C777 VanDerWaalsContact O-CB 3.3Å; L773-C777 WeakPolarHBondContact O-CB 3.17Å; L773-C777 PolarHBondContact O-N 3.36Å; L773-C777 PolarHBondContact O-SG 3.29Å; C777-A781 VanDerWaalsContact O-CB 3.27Å; C777-A781 WeakPolarHBondContact O-CB 3.42Å; C777-A781 PolarHBondContact O-N 3.34Å
778	G	86.5	Confident	84.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-46.5	169.4	0	0	0	0	0	113.2	C774 V775 L776 A781 M782 Y794	C774-G778 PolarHBondContact O-N 3.11Å; V775-G778 CarbonylContact O-C 3.57Å; V775-G778 WeakPolarHBondContact O-CA 3.48Å; V775-G778 PolarHBondContact O-N 3.34Å; V775-G778 VanDerWaalsContact O-N 3.17Å; L776-G778 VanDerWaalsContact C-N 3.31Å; G778-A781 PolarHBondContact O-N 3.2Å; G778-M782 PolarHBondContact O-N 3.06Å; G778-Y794 PolarHBondContact O-OH 3.19Å; G778-Y794 VanDerWaalsContact O-OH 3.06Å
779	H	86.9	Confident	84.6	Confident	37 Å²	37	49.1 Å²	49.1	17%	0.171	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-48.8	176.6	-70.6	139.7	0	0	0	111.6	V775 L776 A781 M782 V783 Y794 Y810	V775-H779 VanDerWaalsContact CG1-CE1 3.44Å; V775-H779 WeakPolarHBondContact CG1-CE1 3.47Å; V775-H779 PolarHBondContact O-N 3.43Å; V775-H779 PolarHBondContact O-ND1 3.39Å; L776-H779 PolarHBondContact O-N 3.07Å; H779-A781 VanDerWaalsContact C-N 3.33Å; H779-A781 PolarHBondContact O-N 3.17Å; H779-M782 WeakPolarHBondContact O-CB 3.47Å; H779-M782 PolarHBondContact O-N 3.45Å; H779-M782 VanDerWaalsContact O-N 3.1Å; H779-V783 WeakPolarHBondContact O-CG2 3.44Å; H779-V783 PolarHBondContact O-N 2.75Å; H779-Y794 VanDerWaalsContact CA-OH 3.22Å; H779-Y794 WeakPolarHBondContact CA-OH 3.48Å; H779-Y794 PolarHBondContact CD2-OH 2.91Å; H779-Y794 PolarHBondContact N-OH 2.85Å; H779-Y794 VanDerWaalsContact N-OH 3.12Å; H779-Y810 AromaticContact NE2-CE1 3.55Å; H779-Y810 AromaticContact NE2-CE2 3.97Å; H779-Y810 AromaticContact NE2-CZ 3.5Å
780	N	83.6	Confident	84.9	Confident	40 Å²	40	42.2 Å²	42.2	21%	0.214	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-42.4	176.7	-73.2	-45.3	0	0	0	112.2	H757 L776 M782 V783 S784	H757-N780 HydrophobicContact CB-CB 4.46Å; L776-N780 WeakPolarHBondContact O-CB 3.35Å; L776-N780 PolarHBondContact O-N 2.84Å; L776-N780 PolarHBondContact O-ND2 3Å; N780-M782 VanDerWaalsContact C-N 3.33Å; N780-M782 PolarHBondContact O-N 2.87Å; N780-V783 PolarHBondContact O-N 3.05Å; N780-S784 PolarHBondContact O-N 3.09Å; N780-S784 PolarHBondContact O-OG 3.34Å
781	A	84.9	Confident	85	Confident	8 Å²	8	42.7 Å²	42.7	7%	0.066	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-25.4	176.6	0	0	0	0	0	113.6	C777 G778 H779 S784 S786 H789 A790	C777-A781 VanDerWaalsContact O-CB 3.27Å; C777-A781 WeakPolarHBondContact O-CB 3.42Å; C777-A781 PolarHBondContact O-N 3.34Å; G778-A781 PolarHBondContact O-N 3.2Å; H779-A781 VanDerWaalsContact C-N 3.33Å; H779-A781 PolarHBondContact O-N 3.17Å; A781-S784 PolarHBondContact O-OG 3.37Å; A781-S786 CarbonylContact O-C 3.59Å; A781-S786 WeakPolarHBondContact O-CA 3.42Å; A781-S786 WeakPolarHBondContact O-CB 3.36Å; A781-S786 PolarHBondContact O-N 3.39Å; A781-H789 HydrophobicContact CB-CB 4.27Å; A781-A790 HydrophobicContact CB-CB 3.81Å
782	M	84.7	Confident	85.2	Confident	37 Å²	37	41.9 Å²	41.9	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-72.4	-45.7	171.5	-172.6	-164.7	-80.8	0	0	110.5	G778 H779 N780 S784 G785 F787 A790 Y794 L813 T814	G778-M782 PolarHBondContact O-N 3.06Å; H779-M782 WeakPolarHBondContact O-CB 3.47Å; H779-M782 PolarHBondContact O-N 3.45Å; H779-M782 VanDerWaalsContact O-N 3.1Å; N780-M782 VanDerWaalsContact C-N 3.33Å; N780-M782 PolarHBondContact O-N 2.87Å; M782-S784 PolarHBondContact O-N 3Å; M782-G785 PolarHBondContact O-N 2.9Å; M782-G785 VanDerWaalsContact O-N 3.14Å; M782-F787 HydrophobicContact CG-CD1 4.4Å; M782-F787 HydrophobicContact CG-CE1 4.34Å; M782-F787 WeakPolarHBondContact O-CE1 3.36Å; M782-A790 HydrophobicContact CB-CB 4.2Å; M782-Y794 HydrophobicContact CE-CE2 3.75Å; M782-L813 HydrophobicContact CE-CB 4.28Å; M782-T814 HydrophobicContact CE-CG2 3.75Å
783	V	82.6	Confident	85.5	Confident	129 Å²	129	43.4 Å²	43.4	78%	0.782	25%	0.248	S	C	*	.	H	α-helix	trans	-65.2	-37.2	179.3	174	0	0	0	0	111.8	H779 N780 G785	H779-V783 WeakPolarHBondContact O-CG2 3.44Å; H779-V783 PolarHBondContact O-N 2.75Å; N780-V783 PolarHBondContact O-N 3.05Å; V783-G785 PolarHBondContact O-N 2.94Å
784	S	79.8	Confident	85.7	Confident	67 Å²	67	43.4 Å²	43.4	47%	0.469	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	5.3	175.1	70.4	0	0	0	0	114.6	N780 A781 M782 S786	N780-S784 PolarHBondContact O-N 3.09Å; N780-S784 PolarHBondContact O-OG 3.34Å; A781-S784 PolarHBondContact O-OG 3.37Å; M782-S784 PolarHBondContact O-N 3Å; S784-S786 PolarHBondContact O-N 3.36Å; S784-S786 PolarHBondContact OG-OG 3.29Å
785	G	82.5	Confident	85.7	Confident	32 Å²	32	45.4 Å²	45.4	33%	0.33	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	3.2	-178.6	0	0	0	0	0	114.8	M782 V783 F787	M782-G785 PolarHBondContact O-N 2.9Å; M782-G785 VanDerWaalsContact O-N 3.14Å; V783-G785 PolarHBondContact O-N 2.94Å; G785-F787 WeakPolarHBondContact O-CD2 3.41Å; G785-F787 PolarHBondContact O-N 2.94Å
786	S	86.9	Confident	85.7	Confident	50 Å²	50	48.4 Å²	48.4	35%	0.35	27%	0.272	S	S	.	.			trans	-79.8	51.4	-178.7	-71.2	0	0	0	0	112.4	A781 S784 K788 H789 A790	A781-S786 CarbonylContact O-C 3.59Å; A781-S786 WeakPolarHBondContact O-CA 3.42Å; A781-S786 WeakPolarHBondContact O-CB 3.36Å; A781-S786 PolarHBondContact O-N 3.39Å; S784-S786 PolarHBondContact O-N 3.36Å; S784-S786 PolarHBondContact OG-OG 3.29Å; S786-K788 PolarHBondContact O-N 3.32Å; S786-H789 PolarHBondContact O-N 2.88Å; S786-A790 PolarHBondContact O-N 2.98Å; S786-A790 VanDerWaalsContact O-N 3.14Å
787	F	86.4	Confident	85.6	Confident	29 Å²	29	47.8 Å²	47.8	13%	0.127	27%	0.269	C	S	.	.	H	α-helix	trans	-57.1	-27.7	-167.4	-52.4	-51.8	0	0	0	115	M782 G785 A790 L791 H817 M818 Q821	M782-F787 HydrophobicContact CG-CD1 4.4Å; M782-F787 HydrophobicContact CG-CE1 4.34Å; M782-F787 WeakPolarHBondContact O-CE1 3.36Å; G785-F787 WeakPolarHBondContact O-CD2 3.41Å; G785-F787 PolarHBondContact O-N 2.94Å; F787-A790 PolarHBondContact O-N 2.83Å; F787-L791 WeakPolarHBondContact O-CB 3.12Å; F787-L791 PolarHBondContact O-N 2.65Å; F787-H817 HydrophobicContact CD1-CB 4.08Å; F787-H817 HydrophobicContact CD2-CB 4.32Å; F787-H817 HydrophobicContact CE1-CB 3.78Å; F787-H817 HydrophobicContact CE2-CB 4.04Å; F787-H817 HydrophobicContact CG-CB 4.36Å; F787-H817 HydrophobicContact CZ-CB 3.77Å; F787-M818 HydrophobicContact CB-CG 3.44Å; F787-M818 VanDerWaalsContact CB-CG 3.44Å; F787-M818 HydrophobicContact CB-SD 4.11Å; F787-M818 HydrophobicContact CD2-CG 4.15Å; F787-M818 HydrophobicContact CG-CG 4.13Å; F787-Q821 HydrophobicContact CD2-CG 4.27Å; F787-Q821 HydrophobicContact CE2-CG 4.08Å
788	K	85	Confident	85.6	Confident	173 Å²	173	49.4 Å²	49.4	75%	0.752	28%	0.277	S	S	*	.	H	α-helix	trans	-61.3	-45.6	172.7	-69.3	-176.4	-179.3	177.9	0	112	S786 G792 M818	S786-K788 PolarHBondContact O-N 3.32Å; K788-G792 PolarHBondContact O-N 2.96Å; K788-M818 HydrophobicContact CG-CE 4.37Å
789	H	84.9	Confident	85.5	Confident	136 Å²	136	56.5 Å²	56.5	63%	0.63	31%	0.308	S	S	*	.	H	α-helix	trans	-70.1	-41.3	178.1	-62.3	120.7	0	0	0	111	A781 S786 L791 G792 Q793	A781-H789 HydrophobicContact CB-CB 4.27Å; S786-H789 PolarHBondContact O-N 2.88Å; H789-L791 PolarHBondContact O-N 2.87Å; H789-G792 PolarHBondContact O-N 3.3Å; H789-Q793 PolarHBondContact O-N 3.33Å; H789-Q793 VanDerWaalsContact O-N 3.14Å
790	A	87.6	Confident	85.3	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58.5	-48	174.9	0	0	0	0	0	111.8	A781 M782 S786 F787 G792 Q793 Y794 T814	A781-A790 HydrophobicContact CB-CB 3.81Å; M782-A790 HydrophobicContact CB-CB 4.2Å; S786-A790 PolarHBondContact O-N 2.98Å; S786-A790 VanDerWaalsContact O-N 3.14Å; F787-A790 PolarHBondContact O-N 2.83Å; A790-G792 VanDerWaalsContact C-N 3.31Å; A790-G792 PolarHBondContact O-N 3.27Å; A790-Q793 PolarHBondContact O-N 3.18Å; A790-Y794 HydrophobicContact CB-CD2 4.34Å; A790-Y794 HydrophobicContact CB-CE2 3.91Å; A790-Y794 WeakPolarHBondContact O-CD2 3.29Å; A790-Y794 PolarHBondContact O-N 3.48Å; A790-T814 HydrophobicContact CB-CG2 4.06Å
791	L	87.3	Confident	85.2	Confident	30 Å²	30	60.1 Å²	60.1	16%	0.157	33%	0.328	C	S	.	.	H	α-helix	trans	-57.2	-42.7	176.1	176.4	63.8	0	0	0	111.9	F787 H789 Q793 V795 V811 F815 M818	F787-L791 WeakPolarHBondContact O-CB 3.12Å; F787-L791 PolarHBondContact O-N 2.65Å; H789-L791 PolarHBondContact O-N 2.87Å; L791-Q793 PolarHBondContact O-N 3.11Å; L791-V795 HydrophobicContact CD1-CG2 3.9Å; L791-V795 HydrophobicContact CG-CG2 4.42Å; L791-V795 VanDerWaalsContact O-CB 3.32Å; L791-V795 WeakPolarHBondContact O-CB 3.28Å; L791-V795 VanDerWaalsContact O-CG2 3.24Å; L791-V795 WeakPolarHBondContact O-CG2 3.47Å; L791-V795 PolarHBondContact O-N 2.99Å; L791-V811 HydrophobicContact CD1-CG1 3.73Å; L791-F815 HydrophobicContact CD1-CD2 4.33Å; L791-F815 HydrophobicContact CD1-CE1 4.24Å; L791-F815 HydrophobicContact CD1-CE2 3.8Å; L791-F815 HydrophobicContact CD1-CZ 3.75Å; L791-F815 HydrophobicContact CD2-CD1 4.44Å; L791-F815 HydrophobicContact CD2-CE1 3.73Å; L791-F815 HydrophobicContact CD2-CZ 3.88Å; L791-F815 HydrophobicContact CG-CZ 4.47Å; L791-M818 HydrophobicContact CD2-SD 4.12Å
792	G	87.2	Confident	84.9	Confident	44 Å²	44	63 Å²	63	45%	0.454	35%	0.347	S	S	.	.	H	α-helix	trans	-57.9	-47	175.5	0	0	0	0	0	112.9	K788 H789 A790 Q796	K788-G792 PolarHBondContact O-N 2.96Å; H789-G792 PolarHBondContact O-N 3.3Å; A790-G792 VanDerWaalsContact C-N 3.31Å; A790-G792 PolarHBondContact O-N 3.27Å; G792-Q796 PolarHBondContact O-N 3.22Å; G792-Q796 VanDerWaalsContact O-N 3.08Å
793	Q	88.2	Confident	84.4	Confident	58 Å²	58	67.9 Å²	67.9	27%	0.271	37%	0.369	S	S	.	.	H	α-helix	trans	-67.1	-46.8	178.5	-63.8	-61.7	-21	0	0	112.3	C774 H789 A790 L791 V795 Q796 A797	C774-Q793 PolarHBondContact SG-O 3.38Å; C774-Q793 VanDerWaalsContact SG-O 3.34Å; C774-Q793 PolarHBondContact SG-OE1 3.4Å; H789-Q793 PolarHBondContact O-N 3.33Å; H789-Q793 VanDerWaalsContact O-N 3.14Å; A790-Q793 PolarHBondContact O-N 3.18Å; L791-Q793 PolarHBondContact O-N 3.11Å; Q793-V795 VanDerWaalsContact C-N 3.32Å; Q793-V795 PolarHBondContact O-N 3.2Å; Q793-Q796 WeakPolarHBondContact O-CB 3.34Å; Q793-Q796 PolarHBondContact O-N 3.16Å; Q793-Q796 VanDerWaalsContact O-N 3.08Å; Q793-A797 PolarHBondContact O-N 3.47Å
794	Y	89	Confident	84.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66	-32.6	178.3	-61.2	-57.6	0	0	0	113.3	G778 H779 M782 A790 Q796 A797 L798 Y810 T814	G778-Y794 PolarHBondContact O-OH 3.19Å; G778-Y794 VanDerWaalsContact O-OH 3.06Å; H779-Y794 VanDerWaalsContact CA-OH 3.22Å; H779-Y794 WeakPolarHBondContact CA-OH 3.48Å; H779-Y794 PolarHBondContact CD2-OH 2.91Å; H779-Y794 PolarHBondContact N-OH 2.85Å; H779-Y794 VanDerWaalsContact N-OH 3.12Å; M782-Y794 HydrophobicContact CE-CE2 3.75Å; A790-Y794 HydrophobicContact CB-CD2 4.34Å; A790-Y794 HydrophobicContact CB-CE2 3.91Å; A790-Y794 WeakPolarHBondContact O-CD2 3.29Å; A790-Y794 PolarHBondContact O-N 3.48Å; Y794-Q796 VanDerWaalsContact C-N 3.32Å; Y794-A797 PolarHBondContact O-N 3.39Å; Y794-L798 VanDerWaalsContact O-CB 3.3Å; Y794-L798 WeakPolarHBondContact O-CB 3.48Å; Y794-L798 PolarHBondContact O-N 3.47Å; Y794-Y810 AromaticContact CD1-CD2 3.96Å; Y794-Y810 HydrophobicContact CD1-CD2 3.96Å; Y794-Y810 HydrophobicContact CD1-CG 4.04Å; Y794-Y810 AromaticContact CE1-CD2 3.95Å; Y794-Y810 HydrophobicContact CE1-CD2 3.95Å; Y794-Y810 AromaticContact CE1-CG 3.87Å; Y794-Y810 HydrophobicContact CE1-CG 3.87Å; Y794-T814 HydrophobicContact CD2-CG2 3.58Å; Y794-T814 HydrophobicContact CE2-CG2 3.5Å; Y794-T814 VanDerWaalsContact CE2-CG2 3.5Å
795	V	86.5	Confident	84.4	Confident	48 Å²	48	61.9 Å²	61.9	29%	0.291	33%	0.328	S	S	.	.	H	α-helix	trans	-68.5	-33.1	172.7	168.2	0	0	0	0	111.1	L791 Q793 K799 V811	L791-V795 HydrophobicContact CD1-CG2 3.9Å; L791-V795 HydrophobicContact CG-CG2 4.42Å; L791-V795 VanDerWaalsContact O-CB 3.32Å; L791-V795 WeakPolarHBondContact O-CB 3.28Å; L791-V795 VanDerWaalsContact O-CG2 3.24Å; L791-V795 WeakPolarHBondContact O-CG2 3.47Å; L791-V795 PolarHBondContact O-N 2.99Å; Q793-V795 VanDerWaalsContact C-N 3.32Å; Q793-V795 PolarHBondContact O-N 3.2Å; V795-K799 VanDerWaalsContact O-CG 3.3Å; V795-K799 WeakPolarHBondContact O-CG 3.47Å; V795-K799 PolarHBondContact O-N 3.06Å; V795-K799 VanDerWaalsContact O-N 3.08Å; V795-V811 HydrophobicContact CG2-CG1 4.05Å; V795-V811 HydrophobicContact CG2-CG2 4.04Å
796	Q	86.6	Confident	84.5	Confident	83 Å²	83	64 Å²	64	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-67.8	-46.1	171.9	-171.1	65.9	2.6	0	0	111.4	G792 Q793 Y794 L798 K799 T800	G792-Q796 PolarHBondContact O-N 3.22Å; G792-Q796 VanDerWaalsContact O-N 3.08Å; Q793-Q796 WeakPolarHBondContact O-CB 3.34Å; Q793-Q796 PolarHBondContact O-N 3.16Å; Q793-Q796 VanDerWaalsContact O-N 3.08Å; Y794-Q796 VanDerWaalsContact C-N 3.32Å; Q796-L798 VanDerWaalsContact C-N 3.3Å; Q796-L798 PolarHBondContact O-N 3Å; Q796-K799 WeakPolarHBondContact O-CB 3.19Å; Q796-K799 PolarHBondContact O-N 3.36Å; Q796-K799 VanDerWaalsContact O-N 3.1Å; Q796-T800 PolarHBondContact O-N 3.3Å; Q796-T800 PolarHBondContact O-OG1 3.14Å
797	A	85.3	Confident	84.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-34.4	174.5	0	0	0	0	0	113.4	V775 Q793 Y794 T800 H801 H807	V775-A797 HydrophobicContact CG2-CB 3.89Å; Q793-A797 PolarHBondContact O-N 3.47Å; Y794-A797 PolarHBondContact O-N 3.39Å; A797-T800 PolarHBondContact O-OG1 3.3Å; A797-H801 PolarHBondContact O-N 3.49Å; A797-H807 PolarHBondContact O-ND1 3.02Å
798	L	84.3	Confident	84.3	Confident	37 Å²	37	60.5 Å²	60.5	19%	0.194	31%	0.31	C	S	.	.	H	α-helix	trans	-71.2	-31.2	174.2	-176.7	62.7	0	0	0	112.5	Y794 Q796 H801 P802 H807 S808 V811	Y794-L798 VanDerWaalsContact O-CB 3.3Å; Y794-L798 WeakPolarHBondContact O-CB 3.48Å; Y794-L798 PolarHBondContact O-N 3.47Å; Q796-L798 VanDerWaalsContact C-N 3.3Å; Q796-L798 PolarHBondContact O-N 3Å; L798-H801 CarbonylContact O-C 3.46Å; L798-P802 VanDerWaalsContact O-CA 3.24Å; L798-P802 WeakPolarHBondContact O-CA 3.34Å; L798-H807 HydrophobicContact CB-CB 4.01Å; L798-H807 HydrophobicContact CD1-CB 3.81Å; L798-S808 WeakPolarHBondContact CD1-OG 3.46Å; L798-V811 HydrophobicContact CD2-CG2 4.19Å
799	K	84.4	Confident	84.3	Confident	148 Å²	148	55.4 Å²	55.4	64%	0.643	29%	0.291	S	S	*	.	H	α-helix	trans	-72.4	-40.6	174	-74.4	168.6	-178.5	176.2	0	112.4	V795 Q796	V795-K799 VanDerWaalsContact O-CG 3.3Å; V795-K799 WeakPolarHBondContact O-CG 3.47Å; V795-K799 PolarHBondContact O-N 3.06Å; V795-K799 VanDerWaalsContact O-N 3.08Å; Q796-K799 WeakPolarHBondContact O-CB 3.19Å; Q796-K799 PolarHBondContact O-N 3.36Å; Q796-K799 VanDerWaalsContact O-N 3.1Å
800	T	83.1	Confident	84.4	Confident	68 Å²	68	51.4 Å²	51.4	42%	0.417	27%	0.271	S	S	.	.	H	α-helix	trans	-75.5	-35.9	179.9	54.1	0	0	0	0	112.1	Q796 A797	Q796-T800 PolarHBondContact O-N 3.3Å; Q796-T800 PolarHBondContact O-OG1 3.14Å; A797-T800 PolarHBondContact O-OG1 3.3Å
801	H	81.2	Confident	84.3	Confident	85 Å²	85	51.5 Å²	51.5	39%	0.394	27%	0.271	S	S	.	.			trans	-132.7	79.2	178.9	-60.1	-65.4	0	0	0	111.4	H771 A797 L798 E803 H807	H771-H801 AromaticContact CD2-CD2 3.48Å; H771-H801 PolarHBondContact CD2-CD2 2.78Å; H771-H801 VanDerWaalsContact CD2-CD2 3.48Å; H771-H801 AromaticContact CD2-NE2 3.74Å; H771-H801 AromaticContact CE1-CD2 3.77Å; H771-H801 AromaticContact CG-CD2 3.43Å; H771-H801 VanDerWaalsContact CG-CD2 3.43Å; H771-H801 AromaticContact CG-NE2 3.62Å; H771-H801 AromaticContact ND1-CD2 3.6Å; H771-H801 AromaticContact NE2-CD2 3.7Å; A797-H801 PolarHBondContact O-N 3.49Å; L798-H801 CarbonylContact O-C 3.46Å; H801-E803 VanDerWaalsContact C-N 3.35Å; H801-E803 PolarHBondContact O-N 3.38Å; H801-H807 PolarHBondContact O-ND1 3.5Å
802	P	78.8	Confident	84.2	Confident	70 Å²	70	50.1 Å²	50.1	46%	0.455	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.8	-177.7	28	-35.4	0	0	0	113.9	L798 N804	L798-P802 VanDerWaalsContact O-CA 3.24Å; L798-P802 WeakPolarHBondContact O-CA 3.34Å; P802-N804 VanDerWaalsContact C-N 3.26Å; P802-N804 PolarHBondContact O-N 3.39Å
803	E	75.4	Confident	84.1	Confident	138 Å²	138	51 Å²	51	65%	0.645	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-14.4	-179.1	-60.6	-57.6	144.5	0	0	113.8	H801 P805	H801-E803 VanDerWaalsContact C-N 3.35Å; H801-E803 PolarHBondContact O-N 3.38Å; E803-P805 VanDerWaalsContact O-CD 3.26Å; E803-P805 WeakPolarHBondContact O-CD 3.13Å
804	N	80.8	Confident	84.1	Confident	52 Å²	52	48.2 Å²	48.2	28%	0.278	25%	0.245	S	C	.	.			trans	-85.7	110.4	-178.7	-175.4	-5	0	0	0	111.1	P802 L806 H807	P802-N804 VanDerWaalsContact C-N 3.26Å; P802-N804 PolarHBondContact O-N 3.39Å; N804-L806 PolarHBondContact O-N 3.25Å; N804-L806 VanDerWaalsContact O-N 3.1Å; N804-L806 WeakPolarHBondContact OD1-CB 3.46Å; N804-L806 PolarHBondContact OD1-N 2.66Å; N804-L806 VanDerWaalsContact OD1-N 3.08Å; N804-H807 PolarHBondContact ND2-CE1 3.19Å; N804-H807 PolarHBondContact ND2-NE2 3.45Å; N804-H807 VanDerWaalsContact ND2-NE2 3.15Å; N804-H807 PolarHBondContact O-N 3.07Å; N804-H807 VanDerWaalsContact O-N 3.14Å
805	P	81.8	Confident	84	Confident	18 Å²	18	49.6 Å²	49.6	12%	0.117	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-19	-177.2	27	-35.6	0	0	0	113.7	E803 H807 L809 G841 L844 L845 I848	E803-P805 VanDerWaalsContact O-CD 3.26Å; E803-P805 WeakPolarHBondContact O-CD 3.13Å; P805-H807 VanDerWaalsContact C-N 3.32Å; P805-H807 PolarHBondContact O-N 2.72Å; P805-L809 PolarHBondContact O-N 3.12Å; P805-L809 VanDerWaalsContact O-N 3.16Å; P805-G841 VanDerWaalsContact CB-O 3.27Å; P805-G841 WeakPolarHBondContact CB-O 3.42Å; P805-L844 HydrophobicContact CB-CB 4.04Å; P805-L845 HydrophobicContact CB-CB 4.21Å; P805-L845 HydrophobicContact CB-CD1 4.48Å; P805-L845 HydrophobicContact CB-CG 4.48Å; P805-L845 HydrophobicContact CG-CB 4.23Å; P805-L845 HydrophobicContact CG-CD1 4.28Å; P805-L845 HydrophobicContact CG-CG 4.08Å; P805-I848 HydrophobicContact CG-CD1 4.34Å
806	L	83.6	Confident	83.9	Confident	77 Å²	77	52 Å²	52	40%	0.403	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-34.9	176.2	-63.4	176.7	0	0	0	112	N804 L809 Y810	N804-L806 PolarHBondContact O-N 3.25Å; N804-L806 VanDerWaalsContact O-N 3.1Å; N804-L806 WeakPolarHBondContact OD1-CB 3.46Å; N804-L806 PolarHBondContact OD1-N 2.66Å; N804-L806 VanDerWaalsContact OD1-N 3.08Å; L806-L809 WeakPolarHBondContact O-CB 3.48Å; L806-L809 PolarHBondContact O-N 2.88Å; L806-Y810 HydrophobicContact CB-CE2 3.88Å; L806-Y810 WeakPolarHBondContact O-CD2 3.49Å; L806-Y810 PolarHBondContact O-N 3.36Å
807	H	85.1	Confident	83.9	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.019	26%	0.257	C	S	.	.	H	α-helix	trans	-67	-44.2	-179.8	-57	157.3	0	0	0	111.2	H771 A797 L798 H801 N804 P805 L809 Y810 V811	H771-H807 AromaticContact CE1-CE1 3.22Å; H771-H807 PolarHBondContact CE1-CE1 3.45Å; H771-H807 AromaticContact CE1-NE2 3.25Å; H771-H807 PolarHBondContact CE1-NE2 3.26Å; H771-H807 VanDerWaalsContact CE1-NE2 3.25Å; H771-H807 AromaticContact NE2-CE1 3.47Å; H771-H807 PolarHBondContact NE2-CE1 3.41Å; H771-H807 AromaticContact NE2-NE2 3.53Å; A797-H807 PolarHBondContact O-ND1 3.02Å; L798-H807 HydrophobicContact CB-CB 4.01Å; L798-H807 HydrophobicContact CD1-CB 3.81Å; H801-H807 PolarHBondContact O-ND1 3.5Å; N804-H807 PolarHBondContact ND2-CE1 3.19Å; N804-H807 PolarHBondContact ND2-NE2 3.45Å; N804-H807 VanDerWaalsContact ND2-NE2 3.15Å; N804-H807 PolarHBondContact O-N 3.07Å; N804-H807 VanDerWaalsContact O-N 3.14Å; P805-H807 VanDerWaalsContact C-N 3.32Å; P805-H807 PolarHBondContact O-N 2.72Å; H807-L809 VanDerWaalsContact C-N 3.26Å; H807-L809 PolarHBondContact O-N 3.01Å; H807-Y810 PolarHBondContact O-N 3.15Å; H807-V811 WeakPolarHBondContact O-CG2 3.47Å; H807-V811 PolarHBondContact O-N 3.04Å
808	S	84.1	Confident	83.8	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-58.1	-38.9	172.4	-61	0	0	0	0	112.1	L798 G812	L798-S808 WeakPolarHBondContact CD1-OG 3.46Å; S808-G812 PolarHBondContact O-N 3.06Å
809	L	84.8	Confident	83.9	Confident	67 Å²	67	51.5 Å²	51.5	35%	0.351	26%	0.255	S	S	.	.	H	α-helix	trans	-67	-45.6	174.7	-179.1	61.8	0	0	0	112.3	P805 L806 H807 G812 L813 V838	P805-L809 PolarHBondContact O-N 3.12Å; P805-L809 VanDerWaalsContact O-N 3.16Å; L806-L809 WeakPolarHBondContact O-CB 3.48Å; L806-L809 PolarHBondContact O-N 2.88Å; H807-L809 VanDerWaalsContact C-N 3.26Å; H807-L809 PolarHBondContact O-N 3.01Å; L809-G812 PolarHBondContact O-N 2.69Å; L809-L813 HydrophobicContact CD1-CD1 4.23Å; L809-L813 HydrophobicContact CD1-CG 4.25Å; L809-L813 HydrophobicContact CG-CD1 4.03Å; L809-L813 HydrophobicContact CG-CG 4.47Å; L809-L813 WeakPolarHBondContact O-CB 3.2Å; L809-L813 VanDerWaalsContact O-CG 3.32Å; L809-L813 WeakPolarHBondContact O-CG 3.12Å; L809-L813 PolarHBondContact O-N 2.88Å; L809-V838 HydrophobicContact CD1-CG2 4.35Å
810	Y	87.1	Confident	83.9	Confident	51 Å²	51	47.5 Å²	47.5	20%	0.2	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-45.7	178.7	-59.7	-42.6	0	0	0	112.3	V775 H779 Y794 L806 H807 G812 L813 T814	V775-Y810 HydrophobicContact CG1-CE2 4.44Å; H779-Y810 AromaticContact NE2-CE1 3.55Å; H779-Y810 AromaticContact NE2-CE2 3.97Å; H779-Y810 AromaticContact NE2-CZ 3.5Å; Y794-Y810 AromaticContact CD1-CD2 3.96Å; Y794-Y810 HydrophobicContact CD1-CD2 3.96Å; Y794-Y810 HydrophobicContact CD1-CG 4.04Å; Y794-Y810 AromaticContact CE1-CD2 3.95Å; Y794-Y810 HydrophobicContact CE1-CD2 3.95Å; Y794-Y810 AromaticContact CE1-CG 3.87Å; Y794-Y810 HydrophobicContact CE1-CG 3.87Å; L806-Y810 HydrophobicContact CB-CE2 3.88Å; L806-Y810 WeakPolarHBondContact O-CD2 3.49Å; L806-Y810 PolarHBondContact O-N 3.36Å; H807-Y810 PolarHBondContact O-N 3.15Å; Y810-G812 VanDerWaalsContact C-N 3.33Å; Y810-G812 PolarHBondContact O-N 2.96Å; Y810-L813 PolarHBondContact O-N 2.78Å; Y810-T814 PolarHBondContact O-N 3.12Å
811	V	85.8	Confident	84	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-47.9	173.6	179.4	0	0	0	0	109.7	L791 V795 L798 H807 L813 T814 F815 L837	L791-V811 HydrophobicContact CD1-CG1 3.73Å; V795-V811 HydrophobicContact CG2-CG1 4.05Å; V795-V811 HydrophobicContact CG2-CG2 4.04Å; L798-V811 HydrophobicContact CD2-CG2 4.19Å; H807-V811 WeakPolarHBondContact O-CG2 3.47Å; H807-V811 PolarHBondContact O-N 3.04Å; V811-L813 PolarHBondContact O-N 3.41Å; V811-T814 PolarHBondContact O-N 3.01Å; V811-T814 PolarHBondContact O-OG1 3.4Å; V811-F815 HydrophobicContact CG1-CD2 4.02Å; V811-F815 HydrophobicContact CG1-CE2 3.66Å; V811-F815 WeakPolarHBondContact O-CD2 3.25Å; V811-F815 PolarHBondContact O-N 3.44Å; V811-L837 HydrophobicContact CB-CD1 4.39Å; V811-L837 HydrophobicContact CG1-CD1 3.6Å
812	G	85.4	Confident	83.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-54.8	-48.5	174.8	0	0	0	0	0	113.2	S808 L809 Y810 T814 F815 F816 N834	S808-G812 PolarHBondContact O-N 3.06Å; L809-G812 PolarHBondContact O-N 2.69Å; Y810-G812 VanDerWaalsContact C-N 3.33Å; Y810-G812 PolarHBondContact O-N 2.96Å; G812-T814 PolarHBondContact O-N 3.28Å; G812-F815 PolarHBondContact O-N 3.43Å; G812-F816 PolarHBondContact O-N 3.08Å; G812-N834 VanDerWaalsContact C-ND2 3.33Å; G812-N834 PolarHBondContact O-ND2 3.09Å
813	L	85.6	Confident	83.4	Confident	62 Å²	62	58.5 Å²	58.5	33%	0.325	28%	0.277	S	S	.	.	H	α-helix	trans	-62.2	-41.7	178.8	-73.6	168.9	0	0	0	112	M782 L809 Y810 V811 F815 F816 H817	M782-L813 HydrophobicContact CE-CB 4.28Å; L809-L813 HydrophobicContact CD1-CD1 4.23Å; L809-L813 HydrophobicContact CD1-CG 4.25Å; L809-L813 HydrophobicContact CG-CD1 4.03Å; L809-L813 HydrophobicContact CG-CG 4.47Å; L809-L813 WeakPolarHBondContact O-CB 3.2Å; L809-L813 VanDerWaalsContact O-CG 3.32Å; L809-L813 WeakPolarHBondContact O-CG 3.12Å; L809-L813 PolarHBondContact O-N 2.88Å; Y810-L813 PolarHBondContact O-N 2.78Å; V811-L813 PolarHBondContact O-N 3.41Å; L813-F815 VanDerWaalsContact C-N 3.33Å; L813-F815 PolarHBondContact O-N 3.13Å; L813-F816 WeakPolarHBondContact O-CB 3.3Å; L813-F816 PolarHBondContact O-N 3.03Å; L813-F816 VanDerWaalsContact O-N 3.1Å; L813-H817 PolarHBondContact O-CD2 3.34Å; L813-H817 PolarHBondContact O-N 3.36Å
814	T	86.5	Confident	83.5	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61	-39.6	175.8	58	0	0	0	0	112.7	M782 A790 Y794 Y810 V811 G812 F816 H817 M818	M782-T814 HydrophobicContact CE-CG2 3.75Å; A790-T814 HydrophobicContact CB-CG2 4.06Å; Y794-T814 HydrophobicContact CD2-CG2 3.58Å; Y794-T814 HydrophobicContact CE2-CG2 3.5Å; Y794-T814 VanDerWaalsContact CE2-CG2 3.5Å; Y810-T814 PolarHBondContact O-N 3.12Å; V811-T814 PolarHBondContact O-N 3.01Å; V811-T814 PolarHBondContact O-OG1 3.4Å; G812-T814 PolarHBondContact O-N 3.28Å; T814-F816 VanDerWaalsContact C-N 3.32Å; T814-F816 PolarHBondContact O-N 2.9Å; T814-H817 PolarHBondContact O-N 2.83Å; T814-M818 WeakPolarHBondContact O-CB 3.45Å; T814-M818 VanDerWaalsContact O-CG 3.29Å; T814-M818 WeakPolarHBondContact O-CG 3.27Å; T814-M818 PolarHBondContact O-N 2.95Å
815	F	87.1	Confident	82.7	Confident	30 Å²	30	56.9 Å²	56.9	13%	0.132	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-35.9	173.5	-77.2	-58.9	0	0	0	113	L791 V811 G812 L813 A819 L830 N834 L837	L791-F815 HydrophobicContact CD1-CD2 4.33Å; L791-F815 HydrophobicContact CD1-CE1 4.24Å; L791-F815 HydrophobicContact CD1-CE2 3.8Å; L791-F815 HydrophobicContact CD1-CZ 3.75Å; L791-F815 HydrophobicContact CD2-CD1 4.44Å; L791-F815 HydrophobicContact CD2-CE1 3.73Å; L791-F815 HydrophobicContact CD2-CZ 3.88Å; L791-F815 HydrophobicContact CG-CZ 4.47Å; V811-F815 HydrophobicContact CG1-CD2 4.02Å; V811-F815 HydrophobicContact CG1-CE2 3.66Å; V811-F815 WeakPolarHBondContact O-CD2 3.25Å; V811-F815 PolarHBondContact O-N 3.44Å; G812-F815 PolarHBondContact O-N 3.43Å; L813-F815 VanDerWaalsContact C-N 3.33Å; L813-F815 PolarHBondContact O-N 3.13Å; F815-A819 VanDerWaalsContact O-CB 3.26Å; F815-A819 WeakPolarHBondContact O-CB 3.35Å; F815-A819 PolarHBondContact O-N 3.09Å; F815-L830 HydrophobicContact CD1-CD2 3.79Å; F815-L830 HydrophobicContact CE1-CD2 4.11Å; F815-N834 HydrophobicContact CB-CB 4.05Å; F815-L837 HydrophobicContact CD2-CD1 3.86Å; F815-L837 HydrophobicContact CE2-CD1 3.71Å
816	F	86.1	Confident	82.6	Confident	99 Å²	99	63.9 Å²	63.9	43%	0.434	32%	0.318	S	S	.	.	H	α-helix	trans	-68.6	-43.2	175.2	-175.6	-94.6	0	0	0	112.6	G812 L813 T814 A819 S820	G812-F816 PolarHBondContact O-N 3.08Å; L813-F816 WeakPolarHBondContact O-CB 3.3Å; L813-F816 PolarHBondContact O-N 3.03Å; L813-F816 VanDerWaalsContact O-N 3.1Å; T814-F816 VanDerWaalsContact C-N 3.32Å; T814-F816 PolarHBondContact O-N 2.9Å; F816-A819 CarbonylContact O-C 3.55Å; F816-A819 PolarHBondContact O-N 3.26Å; F816-S820 PolarHBondContact O-N 2.95Å; F816-S820 PolarHBondContact O-OG 3.12Å; F816-S820 VanDerWaalsContact O-OG 3.04Å
817	H	85.1	Confident	82.5	Confident	77 Å²	77	66.3 Å²	66.3	36%	0.356	32%	0.322	S	S	.	.	H	α-helix	trans	-65.5	-41.6	175.5	-76	-70.8	0	0	0	112.1	F787 L813 T814 S820 Q821	F787-H817 HydrophobicContact CD1-CB 4.08Å; F787-H817 HydrophobicContact CD2-CB 4.32Å; F787-H817 HydrophobicContact CE1-CB 3.78Å; F787-H817 HydrophobicContact CE2-CB 4.04Å; F787-H817 HydrophobicContact CG-CB 4.36Å; F787-H817 HydrophobicContact CZ-CB 3.77Å; L813-H817 PolarHBondContact O-CD2 3.34Å; L813-H817 PolarHBondContact O-N 3.36Å; T814-H817 PolarHBondContact O-N 2.83Å; H817-S820 PolarHBondContact O-N 2.89Å; H817-Q821 PolarHBondContact O-N 3.34Å
818	M	84.6	Confident	82.3	Confident	30 Å²	30	73.8 Å²	73.8	15%	0.148	36%	0.356	C	S	.	.	H	α-helix	trans	-58.7	-48.1	170.2	-72.7	177.8	70.8	0	0	111.2	F787 K788 L791 T814 S820 Q821 V824	F787-M818 HydrophobicContact CB-CG 3.44Å; F787-M818 VanDerWaalsContact CB-CG 3.44Å; F787-M818 HydrophobicContact CB-SD 4.11Å; F787-M818 HydrophobicContact CD2-CG 4.15Å; F787-M818 HydrophobicContact CG-CG 4.13Å; K788-M818 HydrophobicContact CG-CE 4.37Å; L791-M818 HydrophobicContact CD2-SD 4.12Å; T814-M818 WeakPolarHBondContact O-CB 3.45Å; T814-M818 VanDerWaalsContact O-CG 3.29Å; T814-M818 WeakPolarHBondContact O-CG 3.27Å; T814-M818 PolarHBondContact O-N 2.95Å; M818-S820 PolarHBondContact O-N 3.49Å; M818-S820 VanDerWaalsContact O-N 3.09Å; M818-Q821 WeakPolarHBondContact O-CB 3.48Å; M818-Q821 PolarHBondContact O-N 2.65Å; M818-Q821 VanDerWaalsContact O-N 3.08Å; M818-V824 WeakPolarHBondContact O-CG2 3.43Å
819	A	85.1	Confident	82.2	Confident	2 Å²	2	76 Å²	76	2%	0.017	38%	0.375	C	S	.	.	H	α-helix	trans	-64.8	-10.6	176	0	0	0	0	0	114	F815 F816 R827 L830 V831	F815-A819 VanDerWaalsContact O-CB 3.26Å; F815-A819 WeakPolarHBondContact O-CB 3.35Å; F815-A819 PolarHBondContact O-N 3.09Å; F816-A819 CarbonylContact O-C 3.55Å; F816-A819 PolarHBondContact O-N 3.26Å; A819-R827 HydrophobicContact CB-CG 4.35Å; A819-R827 WeakPolarHBondContact O-CG 3.45Å; A819-R827 PolarHBondContact O-NE 3.17Å; A819-R827 PolarHBondContact O-NH2 3.01Å; A819-L830 HydrophobicContact CB-CB 3.95Å; A819-V831 HydrophobicContact CB-CG2 3.77Å
820	S	84.4	Confident	81.9	Confident	63 Å²	63	74.1 Å²	74.1	44%	0.441	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-4.3	174.9	-64.1	0	0	0	0	113.9	F816 H817 M818	F816-S820 PolarHBondContact O-N 2.95Å; F816-S820 PolarHBondContact O-OG 3.12Å; F816-S820 VanDerWaalsContact O-OG 3.04Å; H817-S820 PolarHBondContact O-N 2.89Å; M818-S820 PolarHBondContact O-N 3.49Å; M818-S820 VanDerWaalsContact O-N 3.09Å
821	Q	84.7	Confident	81.6	Confident	90 Å²	90	73.7 Å²	73.7	42%	0.421	37%	0.368	S	S	.	.	S	Bend	trans	-68.3	150.9	173.9	-66.8	-175.8	-43.3	0	0	112.2	F787 H817 M818 Y823 V824	F787-Q821 HydrophobicContact CD2-CG 4.27Å; F787-Q821 HydrophobicContact CE2-CG 4.08Å; H817-Q821 PolarHBondContact O-N 3.34Å; M818-Q821 WeakPolarHBondContact O-CB 3.48Å; M818-Q821 PolarHBondContact O-N 2.65Å; M818-Q821 VanDerWaalsContact O-N 3.08Å; Q821-Y823 VanDerWaalsContact C-N 3.3Å; Q821-Y823 PolarHBondContact O-N 3.16Å; Q821-V824 HydrophobicContact CB-CG2 3.81Å
822	K	76.4	Confident	81.3	Confident	173 Å²	173	79.1 Å²	79.1	75%	0.752	40%	0.396	S	S	*	.	S	Bend	trans	-64.7	-24.8	-169.3	-168.9	178.1	176.7	-159.7	0	115
823	Y	71.8	Confident	81	Confident	192 Å²	192	83.7 Å²	83.7	75%	0.753	42%	0.417	S	S	*	.	S	Bend	trans	-133.5	78.1	-171.2	-59.5	-71.5	0	0	0	111.6	Q821	Q821-Y823 VanDerWaalsContact C-N 3.3Å; Q821-Y823 PolarHBondContact O-N 3.16Å
824	V	76.6	Confident	80.9	Confident	43 Å²	43	81.3 Å²	81.3	26%	0.261	41%	0.405	S	S	.	.			trans	-132.2	105.4	-174	-178.6	0	0	0	0	112.1	M818 Q821 K826 L830	M818-V824 WeakPolarHBondContact O-CG2 3.43Å; Q821-V824 HydrophobicContact CB-CG2 3.81Å; V824-K826 VanDerWaalsContact C-N 3.29Å; V824-K826 PolarHBondContact O-N 2.97Å; V824-L830 HydrophobicContact CG1-CD1 3.55Å
825	A	64.7	Low	80.5	Confident	112 Å²	112	86.6 Å²	86.6	93%	0.926	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.3	-173.6	0	0	0	0	0	115.4
826	K	79.8	Confident	80.1	Confident	165 Å²	165	90 Å²	90	72%	0.717	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	34.2	-177	-65.8	-172.8	178.7	179.3	0	113.4	V824 H828 A829 L830	V824-K826 VanDerWaalsContact C-N 3.29Å; V824-K826 PolarHBondContact O-N 2.97Å; K826-H828 VanDerWaalsContact C-N 3.34Å; K826-H828 PolarHBondContact O-N 2.77Å; K826-A829 PolarHBondContact O-N 3.17Å; K826-L830 PolarHBondContact O-N 3.48Å
827	R	81.4	Confident	79.7	Confident	129 Å²	129	86.9 Å²	86.9	49%	0.487	44%	0.439	S	S	.	.	H	α-helix	trans	-46.2	-49.2	-172.6	-164.1	175.9	-167.7	177.9	5.6	114.4	A819 A829 L830 V831	A819-R827 HydrophobicContact CB-CG 4.35Å; A819-R827 WeakPolarHBondContact O-CG 3.45Å; A819-R827 PolarHBondContact O-NE 3.17Å; A819-R827 PolarHBondContact O-NH2 3.01Å; R827-A829 PolarHBondContact O-N 3.42Å; R827-L830 PolarHBondContact O-N 2.93Å; R827-V831 WeakPolarHBondContact O-CG2 3.04Å; R827-V831 PolarHBondContact O-N 3.26Å
828	H	81.1	Confident	79.2	Confident	160 Å²	160	84.7 Å²	84.7	74%	0.741	43%	0.431	S	S	*	.	H	α-helix	trans	-65.8	-33.1	-177.5	-60.8	-76.4	0	0	0	113.9	K826 V831 L832	K826-H828 VanDerWaalsContact C-N 3.34Å; K826-H828 PolarHBondContact O-N 2.77Å; H828-V831 PolarHBondContact O-N 3.02Å; H828-L832 WeakPolarHBondContact O-CG 3.09Å; H828-L832 PolarHBondContact O-N 3.33Å; H828-L832 VanDerWaalsContact O-N 3.08Å
829	A	81.6	Confident	78.7	Confident	48 Å²	48	89.7 Å²	89.7	40%	0.397	45%	0.452	S	S	.	.	H	α-helix	trans	-69.2	-40.8	178.8	0	0	0	0	0	111.7	K826 R827 V831 L832 Q833	K826-A829 PolarHBondContact O-N 3.17Å; R827-A829 PolarHBondContact O-N 3.42Å; A829-V831 VanDerWaalsContact C-N 3.33Å; A829-V831 PolarHBondContact O-N 3.49Å; A829-L832 PolarHBondContact O-N 3.35Å; A829-Q833 WeakPolarHBondContact O-CG 3.33Å; A829-Q833 PolarHBondContact O-N 2.86Å
830	L	79.7	Confident	78.2	Confident	27 Å²	27	93.4 Å²	93.4	14%	0.141	47%	0.471	C	S	.	.	H	α-helix	trans	-64.8	-37.2	176.4	-61.6	166.8	0	0	0	111.6	F815 A819 V824 K826 R827 Q833 N834	F815-L830 HydrophobicContact CD1-CD2 3.79Å; F815-L830 HydrophobicContact CE1-CD2 4.11Å; A819-L830 HydrophobicContact CB-CB 3.95Å; V824-L830 HydrophobicContact CG1-CD1 3.55Å; K826-L830 PolarHBondContact O-N 3.48Å; R827-L830 PolarHBondContact O-N 2.93Å; L830-Q833 PolarHBondContact O-N 3.26Å; L830-N834 WeakPolarHBondContact O-CB 3.48Å; L830-N834 PolarHBondContact O-N 3.48Å
831	V	80.1	Confident	77.6	Confident	42 Å²	42	90.6 Å²	90.6	26%	0.255	45%	0.453	S	S	.	.	H	α-helix	trans	-65.9	-41.9	174.2	173.1	0	0	0	0	111.5	A819 R827 H828 A829 N834 F835	A819-V831 HydrophobicContact CB-CG2 3.77Å; R827-V831 WeakPolarHBondContact O-CG2 3.04Å; R827-V831 PolarHBondContact O-N 3.26Å; H828-V831 PolarHBondContact O-N 3.02Å; A829-V831 VanDerWaalsContact C-N 3.33Å; A829-V831 PolarHBondContact O-N 3.49Å; V831-N834 WeakPolarHBondContact O-CB 3.45Å; V831-N834 PolarHBondContact O-N 3.17Å; V831-F835 HydrophobicContact CG1-CD2 3.84Å; V831-F835 HydrophobicContact CG1-CE2 3.65Å; V831-F835 VanDerWaalsContact O-CD2 3.28Å; V831-F835 WeakPolarHBondContact O-CD2 3.35Å; V831-F835 PolarHBondContact O-N 3.45Å
832	L	80.3	Confident	77	Confident	118 Å²	118	90.8 Å²	90.8	62%	0.618	46%	0.455	S	S	*	.	H	α-helix	trans	-63.6	-40.7	174.5	-71.8	167.3	0	0	0	112	H828 A829 F835 V836	H828-L832 WeakPolarHBondContact O-CG 3.09Å; H828-L832 PolarHBondContact O-N 3.33Å; H828-L832 VanDerWaalsContact O-N 3.08Å; A829-L832 PolarHBondContact O-N 3.35Å; L832-F835 PolarHBondContact O-N 3.29Å; L832-V836 WeakPolarHBondContact O-CG2 3.5Å; L832-V836 PolarHBondContact O-N 2.91Å; L832-V836 VanDerWaalsContact O-N 3.12Å
833	Q	79.3	Confident	76.8	Confident	95 Å²	95	89.5 Å²	89.5	44%	0.444	45%	0.45	S	S	.	.	H	α-helix	trans	-64.3	-40.5	174.9	-72.8	172.7	-38.2	0	0	112.4	A829 L830 L837	A829-Q833 WeakPolarHBondContact O-CG 3.33Å; A829-Q833 PolarHBondContact O-N 2.86Å; L830-Q833 PolarHBondContact O-N 3.26Å; Q833-L837 WeakPolarHBondContact O-CG 3.31Å; Q833-L837 PolarHBondContact O-N 2.9Å
834	N	81.9	Confident	76.8	Confident	12 Å²	12	81.9 Å²	81.9	6%	0.064	42%	0.422	C	S	.	.	H	α-helix	trans	-55.4	-53.8	170.5	156.6	-97.2	0	0	0	111.4	G812 F815 L830 V831 V836 L837 V838	G812-N834 VanDerWaalsContact C-ND2 3.33Å; G812-N834 PolarHBondContact O-ND2 3.09Å; F815-N834 HydrophobicContact CB-CB 4.05Å; L830-N834 WeakPolarHBondContact O-CB 3.48Å; L830-N834 PolarHBondContact O-N 3.48Å; V831-N834 WeakPolarHBondContact O-CB 3.45Å; V831-N834 PolarHBondContact O-N 3.17Å; N834-V836 PolarHBondContact O-N 3.43Å; N834-L837 PolarHBondContact O-N 3.02Å; N834-V838 WeakPolarHBondContact O-CG2 3.29Å; N834-V838 PolarHBondContact O-N 2.85Å
835	F	78.1	Confident	76.6	Confident	111 Å²	111	83.9 Å²	83.9	49%	0.487	43%	0.431	S	S	.	.	H	α-helix	trans	-58.9	-45.7	-177.9	-84.4	-66.3	0	0	0	112.3	V831 L832 L837 V838 F839	V831-F835 HydrophobicContact CG1-CD2 3.84Å; V831-F835 HydrophobicContact CG1-CE2 3.65Å; V831-F835 VanDerWaalsContact O-CD2 3.28Å; V831-F835 WeakPolarHBondContact O-CD2 3.35Å; V831-F835 PolarHBondContact O-N 3.45Å; L832-F835 PolarHBondContact O-N 3.29Å; F835-L837 VanDerWaalsContact C-N 3.31Å; F835-L837 PolarHBondContact O-N 2.71Å; F835-V838 PolarHBondContact O-N 2.75Å; F835-F839 HydrophobicContact CB-CD2 4.45Å; F835-F839 HydrophobicContact CD1-CE2 4.12Å; F835-F839 WeakPolarHBondContact O-CB 3.49Å; F835-F839 VanDerWaalsContact O-CD2 3.25Å; F835-F839 WeakPolarHBondContact O-CD2 3.31Å; F835-F839 PolarHBondContact O-N 3.07Å
836	V	78.9	Confident	77	Confident	102 Å²	102	83.2 Å²	83.2	62%	0.618	42%	0.415	S	S	*	.	H	α-helix	trans	-57.2	-44.2	178.9	170.7	0	0	0	0	111.7	L832 N834 L840	L832-V836 WeakPolarHBondContact O-CG2 3.5Å; L832-V836 PolarHBondContact O-N 2.91Å; L832-V836 VanDerWaalsContact O-N 3.12Å; N834-V836 PolarHBondContact O-N 3.43Å; V836-L840 WeakPolarHBondContact O-CB 3.47Å; V836-L840 PolarHBondContact O-N 2.89Å
837	L	77.6	Confident	76.3	Confident	33 Å²	33	77.8 Å²	77.8	17%	0.173	40%	0.401	C	S	.	.	H	α-helix	trans	-75.6	-34	-178.2	-67.5	169.6	0	0	0	113.2	V811 F815 Q833 N834 F835 L840 G841	V811-L837 HydrophobicContact CB-CD1 4.39Å; V811-L837 HydrophobicContact CG1-CD1 3.6Å; F815-L837 HydrophobicContact CD2-CD1 3.86Å; F815-L837 HydrophobicContact CE2-CD1 3.71Å; Q833-L837 WeakPolarHBondContact O-CG 3.31Å; Q833-L837 PolarHBondContact O-N 2.9Å; N834-L837 PolarHBondContact O-N 3.02Å; F835-L837 VanDerWaalsContact C-N 3.31Å; F835-L837 PolarHBondContact O-N 2.71Å; L837-L840 HydrophobicContact CD2-CD2 4.38Å; L837-L840 PolarHBondContact O-N 3.29Å; L837-G841 PolarHBondContact O-N 2.96Å
838	V	75.1	Confident	75.5	Confident	32 Å²	32	75.7 Å²	75.7	19%	0.194	40%	0.399	C	S	.	.	H	α-helix	trans	-67.4	-43.2	172.6	172.8	0	0	0	0	110.9	L809 N834 F835 L840 G841 I842	L809-V838 HydrophobicContact CD1-CG2 4.35Å; N834-V838 WeakPolarHBondContact O-CG2 3.29Å; N834-V838 PolarHBondContact O-N 2.85Å; F835-V838 PolarHBondContact O-N 2.75Å; V838-L840 VanDerWaalsContact C-N 3.35Å; V838-L840 PolarHBondContact O-N 3Å; V838-G841 PolarHBondContact O-N 3.42Å; V838-I842 HydrophobicContact CG1-CD1 3.92Å; V838-I842 VanDerWaalsContact O-CG1 3.31Å; V838-I842 WeakPolarHBondContact O-CG1 3.4Å; V838-I842 PolarHBondContact O-N 3.06Å
839	F	73.9	Confident	74.5	Confident	135 Å²	135	76.8 Å²	76.8	59%	0.592	40%	0.396	S	S	*	.	H	α-helix	trans	-63.8	-37.9	173.8	-85.5	-67.8	0	0	0	112.3	F835 I842 F843	F835-F839 HydrophobicContact CB-CD2 4.45Å; F835-F839 HydrophobicContact CD1-CE2 4.12Å; F835-F839 WeakPolarHBondContact O-CB 3.49Å; F835-F839 VanDerWaalsContact O-CD2 3.25Å; F835-F839 WeakPolarHBondContact O-CD2 3.31Å; F835-F839 PolarHBondContact O-N 3.07Å; F839-I842 PolarHBondContact O-N 3.07Å; F839-F843 VanDerWaalsContact O-CB 3.32Å; F839-F843 WeakPolarHBondContact O-CB 3.23Å; F839-F843 PolarHBondContact O-N 3.31Å
840	L	74.5	Confident	73.4	Confident	79 Å²	79	76.3 Å²	76.3	41%	0.414	40%	0.396	S	S	.	.	H	α-helix	trans	-61.8	-45.5	173.2	-178.3	65	0	0	0	111.8	V836 L837 V838 F843 L844	V836-L840 WeakPolarHBondContact O-CB 3.47Å; V836-L840 PolarHBondContact O-N 2.89Å; L837-L840 HydrophobicContact CD2-CD2 4.38Å; L837-L840 PolarHBondContact O-N 3.29Å; V838-L840 VanDerWaalsContact C-N 3.35Å; V838-L840 PolarHBondContact O-N 3Å; L840-F843 PolarHBondContact O-N 3.03Å; L840-L844 HydrophobicContact CG-CD1 4.31Å; L840-L844 PolarHBondContact O-N 2.96Å
841	G	71.5	Confident	72.3	Confident	5 Å²	5	77.8 Å²	77.8	5%	0.052	41%	0.412	C	S	.	.	H	α-helix	trans	-60.6	-43.8	175.1	0	0	0	0	0	112.8	P805 L837 V838 L845	P805-G841 VanDerWaalsContact CB-O 3.27Å; P805-G841 WeakPolarHBondContact CB-O 3.42Å; L837-G841 PolarHBondContact O-N 2.96Å; V838-G841 PolarHBondContact O-N 3.42Å; G841-L845 WeakPolarHBondContact O-CB 3.47Å; G841-L845 PolarHBondContact O-N 3.3Å
842	I	73.2	Confident	71	Confident	93 Å²	93	78.6 Å²	78.6	48%	0.477	42%	0.423	S	S	.	.	H	α-helix	trans	-62.9	-42.9	175	-67.8	164.9	0	0	0	111	V838 F839 L845 V846	V838-I842 HydrophobicContact CG1-CD1 3.92Å; V838-I842 VanDerWaalsContact O-CG1 3.31Å; V838-I842 WeakPolarHBondContact O-CG1 3.4Å; V838-I842 PolarHBondContact O-N 3.06Å; F839-I842 PolarHBondContact O-N 3.07Å; I842-L845 PolarHBondContact O-N 3.33Å; I842-V846 WeakPolarHBondContact O-CG2 3.09Å; I842-V846 PolarHBondContact O-N 3.25Å
843	F	72.2	Confident	69.5	Low	146 Å²	146	83 Å²	83	64%	0.64	43%	0.432	S	S	*	.	H	α-helix	trans	-62.6	-45.6	179.3	-178.1	-95.5	0	0	0	112.1	F839 L840 L845 V846 A847	F839-F843 VanDerWaalsContact O-CB 3.32Å; F839-F843 WeakPolarHBondContact O-CB 3.23Å; F839-F843 PolarHBondContact O-N 3.31Å; L840-F843 PolarHBondContact O-N 3.03Å; F843-L845 VanDerWaalsContact C-N 3.35Å; F843-L845 PolarHBondContact O-N 3.12Å; F843-V846 PolarHBondContact O-N 3.42Å; F843-A847 WeakPolarHBondContact O-CB 3.42Å; F843-A847 PolarHBondContact O-N 3.27Å
844	L	71.6	Confident	67.9	Low	33 Å²	33	87.9 Å²	87.9	17%	0.173	45%	0.446	C	S	.	.	H	α-helix	trans	-57.3	-46.1	172.4	-77.6	162.2	0	0	0	111.6	P805 L840 V846 A847 I848	P805-L844 HydrophobicContact CB-CB 4.04Å; L840-L844 HydrophobicContact CG-CD1 4.31Å; L840-L844 PolarHBondContact O-N 2.96Å; L844-V846 VanDerWaalsContact C-N 3.32Å; L844-V846 PolarHBondContact O-N 3.46Å; L844-A847 PolarHBondContact O-N 3.45Å; L844-A847 VanDerWaalsContact O-N 3.17Å; L844-I848 WeakPolarHBondContact O-CD1 3.16Å; L844-I848 VanDerWaalsContact O-CG1 3.28Å; L844-I848 WeakPolarHBondContact O-CG1 2.98Å; L844-I848 PolarHBondContact O-N 2.88Å
845	L	71.3	Confident	66.4	Low	85 Å²	85	92.3 Å²	92.3	45%	0.445	47%	0.474	S	S	.	.	H	α-helix	trans	-64.4	-35.6	-179.6	-144.8	163.7	0	0	0	112.3	P805 G841 I842 F843 R849	P805-L845 HydrophobicContact CB-CB 4.21Å; P805-L845 HydrophobicContact CB-CD1 4.48Å; P805-L845 HydrophobicContact CB-CG 4.48Å; P805-L845 HydrophobicContact CG-CB 4.23Å; P805-L845 HydrophobicContact CG-CD1 4.28Å; P805-L845 HydrophobicContact CG-CG 4.08Å; G841-L845 WeakPolarHBondContact O-CB 3.47Å; G841-L845 PolarHBondContact O-N 3.3Å; I842-L845 PolarHBondContact O-N 3.33Å; F843-L845 VanDerWaalsContact C-N 3.35Å; F843-L845 PolarHBondContact O-N 3.12Å; L845-R849 PolarHBondContact O-N 2.97Å
846	V	73.1	Confident	64.8	Low	97 Å²	97	90.9 Å²	90.9	59%	0.588	48%	0.477	S	S	*	.	H	α-helix	trans	-70	-42.2	171.8	171.5	0	0	0	0	111.6	I842 F843 L844 R849 G850	I842-V846 WeakPolarHBondContact O-CG2 3.09Å; I842-V846 PolarHBondContact O-N 3.25Å; F843-V846 PolarHBondContact O-N 3.42Å; L844-V846 VanDerWaalsContact C-N 3.32Å; L844-V846 PolarHBondContact O-N 3.46Å; V846-R849 PolarHBondContact O-N 2.93Å; V846-G850 PolarHBondContact O-N 3.02Å
847	A	65.8	Low	63	Low	51 Å²	51	88.2 Å²	88.2	42%	0.421	47%	0.47	S	S	.	.	H	α-helix	trans	-62.8	-45	178.1	0	0	0	0	0	112.1	F843 L844 R849 G850 A851	F843-A847 WeakPolarHBondContact O-CB 3.42Å; F843-A847 PolarHBondContact O-N 3.27Å; L844-A847 PolarHBondContact O-N 3.45Å; L844-A847 VanDerWaalsContact O-N 3.17Å; A847-R849 PolarHBondContact O-N 3.18Å; A847-G850 PolarHBondContact O-N 3.46Å; A847-G850 VanDerWaalsContact O-N 3.14Å; A847-A851 PolarHBondContact O-N 3.26Å
848	I	65	Low	61.4	Low	85 Å²	85	94.6 Å²	94.6	44%	0.436	50%	0.499	S	S	.	.	H	α-helix	trans	-60.3	-44.5	176	-67.8	162.3	0	0	0	110.8	P805 L844 G850 A851 A852	P805-I848 HydrophobicContact CG-CD1 4.34Å; L844-I848 WeakPolarHBondContact O-CD1 3.16Å; L844-I848 VanDerWaalsContact O-CG1 3.28Å; L844-I848 WeakPolarHBondContact O-CG1 2.98Å; L844-I848 PolarHBondContact O-N 2.88Å; I848-G850 VanDerWaalsContact C-N 3.34Å; I848-G850 PolarHBondContact O-N 2.82Å; I848-A851 PolarHBondContact O-N 3.24Å; I848-A852 PolarHBondContact O-N 3.13Å
849	R	59.9	Low	59.7	Low	183 Å²	183	101.8 Å²	101.8	69%	0.691	53%	0.53	S	S	*	.	H	α-helix	trans	-61.6	-39.6	173.7	-87	-177.8	160.4	179.2	-5.1	112.7	L845 V846 A847 W853	L845-R849 PolarHBondContact O-N 2.97Å; V846-R849 PolarHBondContact O-N 2.93Å; A847-R849 PolarHBondContact O-N 3.18Å; R849-W853 PolarHBondContact O-N 3.02Å; R849-W853 VanDerWaalsContact O-N 3.14Å
850	G	58.4	Low	58.1	Low	39 Å²	39	100.6 Å²	100.6	40%	0.402	53%	0.534	S	S	.	.	H	α-helix	trans	-67	-33.5	176	0	0	0	0	0	113.7	V846 A847 I848	V846-G850 PolarHBondContact O-N 3.02Å; A847-G850 PolarHBondContact O-N 3.46Å; A847-G850 VanDerWaalsContact O-N 3.14Å; I848-G850 VanDerWaalsContact C-N 3.34Å; I848-G850 PolarHBondContact O-N 2.82Å
851	A	57.6	Low	56.2	Low	57 Å²	57	106.3 Å²	106.3	47%	0.471	56%	0.558	S	S	.	*	H	α-helix	trans	-70.5	-47.8	174.1	0	0	0	0	0	111.7	A847 I848 W853 R854 V855	A847-A851 PolarHBondContact O-N 3.26Å; I848-A851 PolarHBondContact O-N 3.24Å; A851-W853 VanDerWaalsContact C-N 3.27Å; A851-W853 PolarHBondContact O-N 3.2Å; A851-R854 PolarHBondContact O-N 3.43Å; A851-V855 PolarHBondContact O-N 3.37Å
852	A	51.6	Low	54.3	Low	59 Å²	59	112.1 Å²	112.1	49%	0.488	60%	0.598	S	S	.	*	H	α-helix	trans	-57.1	-40.6	177.4	0	0	0	0	0	112.3	I848 R854 V855 S856	I848-A852 PolarHBondContact O-N 3.13Å; A852-R854 VanDerWaalsContact C-N 3.26Å; A852-R854 PolarHBondContact O-N 3.46Å; A852-V855 PolarHBondContact O-N 2.75Å; A852-S856 PolarHBondContact O-N 2.7Å; A852-S856 VanDerWaalsContact O-N 3.14Å; A852-S856 PolarHBondContact O-OG 3.25Å; A852-S856 VanDerWaalsContact O-OG 3.11Å
853	W	48.2	Very low	52.3	Low	211 Å²	211	111.2 Å²	111.2	80%	0.799	61%	0.612	S	S	*	*	H	α-helix	trans	-64.2	-22.6	175.8	-100	78.2	0	0	0	114.9	R849 A851 S856	R849-W853 PolarHBondContact O-N 3.02Å; R849-W853 VanDerWaalsContact O-N 3.14Å; A851-W853 VanDerWaalsContact C-N 3.27Å; A851-W853 PolarHBondContact O-N 3.2Å; W853-S856 PolarHBondContact O-OG 3.04Å
854	R	47.1	Very low	50.5	Low	197 Å²	197	110 Å²	110	74%	0.743	62%	0.619	S	S	*	*	H	α-helix	trans	-79.6	-47.8	173.8	-70.9	-178.8	-177	171.7	2	111.3	A851 A852 S856 G857 E858	A851-R854 PolarHBondContact O-N 3.43Å; A852-R854 VanDerWaalsContact C-N 3.26Å; A852-R854 PolarHBondContact O-N 3.46Å; R854-S856 VanDerWaalsContact C-N 3.3Å; R854-S856 PolarHBondContact O-N 2.73Å; R854-G857 WeakPolarHBondContact O-CA 3.5Å; R854-G857 PolarHBondContact O-N 3.03Å; R854-E858 PolarHBondContact O-N 3.13Å
855	V	50.5	Low	48.7	Very low	106 Å²	106	113.8 Å²	113.8	64%	0.642	65%	0.648	S	S	*	*	H	α-helix	trans	-61	-39.2	-179	-179.4	0	0	0	0	111.2	A851 A852 G857	A851-V855 PolarHBondContact O-N 3.37Å; A852-V855 PolarHBondContact O-N 2.75Å; V855-G857 PolarHBondContact O-N 2.88Å
856	S	43.7	Very low	46.7	Very low	80 Å²	80	116.8 Å²	116.8	56%	0.559	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-14.8	173.7	57	0	0	0	0	114.5	A852 W853 R854	A852-S856 PolarHBondContact O-N 2.7Å; A852-S856 VanDerWaalsContact O-N 3.14Å; A852-S856 PolarHBondContact O-OG 3.25Å; A852-S856 VanDerWaalsContact O-OG 3.11Å; W853-S856 PolarHBondContact O-OG 3.04Å; R854-S856 VanDerWaalsContact C-N 3.3Å; R854-S856 PolarHBondContact O-N 2.73Å
857	G	42.1	Very low	44.5	Very low	46 Å²	46	116.6 Å²	116.6	47%	0.474	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	-25.3	179.4	0	0	0	0	0	114.5	R854 V855 H859 V860	R854-G857 WeakPolarHBondContact O-CA 3.5Å; R854-G857 PolarHBondContact O-N 3.03Å; V855-G857 PolarHBondContact O-N 2.88Å; G857-H859 VanDerWaalsContact C-N 3.3Å; G857-H859 PolarHBondContact O-N 3.45Å; G857-V860 PolarHBondContact O-N 2.96Å
858	E	42.6	Very low	43.4	Very low	167 Å²	167	119 Å²	119	78%	0.78	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-11.7	-172.1	-68.7	-177.6	154.9	0	0	114.1	R854	R854-E858 PolarHBondContact O-N 3.13Å
859	H	40.8	Very low	41.5	Very low	184 Å²	184	122.5 Å²	122.5	85%	0.852	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	5	175.7	-87.4	-40	0	0	0	115.3	G857	G857-H859 VanDerWaalsContact C-N 3.3Å; G857-H859 PolarHBondContact O-N 3.45Å
860	V	39.8	Very low	39.8	Very low	110 Å²	110	117.2 Å²	117.2	67%	0.667	71%	0.712	S	S	*	*	S	Bend	trans	-126.8	63.5	-177	-165	0	0	0	0	112.8	G857	G857-V860 PolarHBondContact O-N 2.96Å
861	Q	34.4	Very low	39.3	Very low	198 Å²	198	120.7 Å²	120.7	93%	0.925	73%	0.728	S	S	*	*			trans	-162.9	89.3	158.3	-122.1	159.2	84.6	0	0	115.7
862	S	32.2	Very low	37.7	Very low	127 Å²	127	127.9 Å²	127.9	89%	0.888	74%	0.744	S	S	*	*			trans	-164.5	147.2	144.1	58.1	0	0	0	0	110.8
863	G	29.5	Very low	36.4	Very low	75 Å²	75	130.2 Å²	130.2	77%	0.773	75%	0.752	S	S	*	*			trans	95.6	116	177.9	0	0	0	0	0	115
864	P	36.1	Very low	35.2	Very low	121 Å²	121	129.7 Å²	129.7	79%	0.786	76%	0.756	S	S	*	*			trans	-94.1	145.7	-178.8	35.9	-33.9	0	0	0	114.2
865	S	33.7	Very low	34.1	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	76%	0.758	S	S	*	*			trans	23.4	106.4	150.9	62.4	0	0	0	0	120.2
866	T	28.5	Very low	32.8	Very low	148 Å²	148	127.5 Å²	127.5	91%	0.908	77%	0.767	S	S	*	*				-156.6	138.9	122.9	20.7	0	0	0	0	110.7
867	A	26.8	Very low	31.9	Very low	92 Å²	92	128.2 Å²	128.2	76%	0.76	77%	0.772	S	S	*	*			trans	-112.8	161.5	159.1	0	0	0	0	0	106.2
868	P	42.5	Very low	31.1	Very low	103 Å²	103	134 Å²	134	67%	0.669	79%	0.791	S	S	*	*			cis	-140.3	-170.8	36	43.1	-24.1	0	0	0	116.1
869	D	26.4	Very low	30.3	Very low	158 Å²	158	132.7 Å²	132.7	85%	0.845	79%	0.789	S	S	*	*			trans	67.2	133.1	159	-53.8	-30.9	0	0	0	119.6
870	G	24.4	Very low	29.7	Very low	71 Å²	71	130 Å²	130	73%	0.732	79%	0.788	S	S	*	*			trans	-111.9	-150.9	164.4	0	0	0	0	0	110.1
871	P	45.9	Very low	29	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	80%	0.795	S	S	*	*			cis	-125.2	-158.8	-2.7	30.2	-7.9	0	0	0	112.4
872	Y	24.9	Very low	28.6	Very low	207 Å²	207	128 Å²	128	81%	0.812	79%	0.788	S	S	*	*			trans	96.2	139.4	160.7	-72.2	-71.5	0	0	0	122.3
873	T	24.2	Very low	28.3	Very low	109 Å²	109	128.3 Å²	128.3	67%	0.669	79%	0.785	S	S	*	*			trans	75.9	114.7	140.2	49.7	0	0	0	0	123.4
874	F	24.1	Very low	28.2	Very low	200 Å²	200	130.5 Å²	130.5	88%	0.877	78%	0.783	S	S	*	*			trans	64.6	142.4	135.4	-80.1	-106.2	0	0	0	121.8
875	G	23.7	Very low	27.7	Very low	75 Å²	75	130.1 Å²	130.1	77%	0.773	78%	0.78	S	S	*	*			trans	169.6	86.1	165.5	0	0	0	0	0	116.2
876	H	23.5	Very low	27.4	Very low	181 Å²	181	131 Å²	131	84%	0.838	78%	0.781	S	S	*	*			trans	-58.1	156.4	157.1	-71.5	-95.5	0	0	0	110.1
877	S	23.3	Very low	27.3	Very low	96 Å²	96	130 Å²	130	67%	0.671	78%	0.778	S	S	*	*			cis	-161.8	166.2	7.7	39.2	0	0	0	0	108.3
878	L	26.2	Very low	27.2	Very low	166 Å²	166	134.4 Å²	134.4	87%	0.869	79%	0.786	S	S	*	*				-171	154.8	80.1	-88.7	163.9	0	0	0	111.5
879	L	25.3	Very low	26.3	Very low	140 Å²	140	138.4 Å²	138.4	73%	0.733	80%	0.796	S	S	*	*			trans	-81.3	159.9	174.8	-73.2	159.8	0	0	0	111.5
880	P	27.5	Very low	26.3	Very low	129 Å²	129	135.7 Å²	135.7	84%	0.838	79%	0.786	S	S	*	*				-112.1	167.2	92.8	-11.7	30	0	0	0	114.6
881	K	26.5	Very low	26.3	Very low	189 Å²	189	135.8 Å²	135.8	82%	0.822	79%	0.788	S	S	*	*			trans	-90.4	144.6	-175.6	-61.2	173.1	179.7	177.1	0	112
882	G	25.9	Very low	25.4	Very low	75 Å²	75	139.9 Å²	139.9	77%	0.773	79%	0.789	S	S	*	*			trans	-170.3	88.6	167.7	0	0	0	0	0	109.1
883	V	25.8	Very low	25.3	Very low	134 Å²	134	137.5 Å²	137.5	81%	0.812	79%	0.79	S	S	*	*			trans	-88.8	116.8	-166.5	179.6	0	0	0	0	111.2
884	V	26.1	Very low	25.4	Very low	122 Å²	122	140.4 Å²	140.4	74%	0.739	79%	0.793	S	S	*	*			trans	-131.3	119.9	156.2	-179.7	0	0	0	0	106.6	T886	V884-T886 PolarHBondContact O-N 3.37Å; V884-T886 VanDerWaalsContact O-N 3.16Å
885	P	27.6	Very low	25.4	Very low	112 Å²	112	142.1 Å²	142.1	73%	0.727	79%	0.794	S	S	*	*			trans	-74.7	104.9	177.4	29.5	-31.9	0	0	0	109.7	C887	P885-C887 PolarHBondContact O-N 2.92Å
886	T	26.4	Very low	25.5	Very low	132 Å²	132	150 Å²	150	81%	0.81	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-64.3	127	169.9	47.8	0	0	0	0	110	V884	V884-T886 PolarHBondContact O-N 3.37Å; V884-T886 VanDerWaalsContact O-N 3.16Å
887	C	26.6	Very low	25.7	Very low	125 Å²	125	147.3 Å²	147.3	85%	0.845	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-53.8	146	178	-58.4	0	0	0	0	112.2	P885	P885-C887 PolarHBondContact O-N 2.92Å
888	M	24.6	Very low	26.1	Very low	185 Å²	185	150 Å²	150	91%	0.911	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-59.3	143	174.5	-64.4	-174.5	-178.5	0	0	111.5	P890	M888-P890 VanDerWaalsContact O-CD 3.31Å; M888-P890 WeakPolarHBondContact O-CD 3.04Å
889	E	23.6	Very low	26.1	Very low	188 Å²	188	149.2 Å²	149.2	88%	0.879	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-67.1	121.1	168.8	-62.8	-174.7	133.9	0	0	110.3	G891	E889-G891 PolarHBondContact O-N 2.84Å
890	P	27.1	Very low	26.2	Very low	100 Å²	100	149.7 Å²	149.7	65%	0.649	85%	0.85	S	S	*	*			trans	-74	110.8	167.5	30	-31.7	0	0	0	108.9	M888 W892	M888-P890 VanDerWaalsContact O-CD 3.31Å; M888-P890 WeakPolarHBondContact O-CD 3.04Å; P890-W892 PolarHBondContact O-N 3.42Å
891	G	24.1	Very low	26.1	Very low	74 Å²	74	150.8 Å²	150.8	76%	0.763	85%	0.851	S	S	*	*			trans	-71.8	81.7	179.5	0	0	0	0	0	113.4	E889 N893	E889-G891 PolarHBondContact O-N 2.84Å; G891-N893 PolarHBondContact O-N 2.78Å
892	W	26	Very low	26.1	Very low	199 Å²	199	148.6 Å²	148.6	75%	0.754	85%	0.852	S	S	*	*			trans	-70.8	72.6	178.3	-81.3	76	0	0	0	112.8	P890 F894	P890-W892 PolarHBondContact O-N 3.42Å; W892-F894 HydrophobicContact CE3-CD2 4.08Å; W892-F894 HydrophobicContact CE3-CE2 4.08Å; W892-F894 HydrophobicContact CZ3-CE2 4.09Å; W892-F894 PolarHBondContact O-N 3Å
893	N	23.9	Very low	26.1	Very low	156 Å²	156	153.2 Å²	153.2	83%	0.834	86%	0.857	S	S	*	*			trans	-80.6	62.6	-174	-136.7	-20.5	0	0	0	112.4	G891 R895	G891-N893 PolarHBondContact O-N 2.78Å; N893-R895 PolarHBondContact O-N 2.71Å
894	F	25.4	Very low	26.1	Very low	170 Å²	170	154.5 Å²	154.5	75%	0.746	86%	0.86	S	S	*	*			trans	-70.4	96.5	177.5	-113.8	-83.6	0	0	0	111.1	W892 R896	W892-F894 HydrophobicContact CE3-CD2 4.08Å; W892-F894 HydrophobicContact CE3-CE2 4.08Å; W892-F894 HydrophobicContact CZ3-CE2 4.09Å; W892-F894 PolarHBondContact O-N 3Å; F894-R896 PolarHBondContact O-N 2.75Å
895	R	24.5	Very low	26.1	Very low	237 Å²	237	156.8 Å²	156.8	89%	0.894	87%	0.869	S	S	*	*			trans	-58.8	102.4	165.5	-77.2	-173.5	174.9	-171.4	-0.2	109.6	N893 S897	N893-R895 PolarHBondContact O-N 2.71Å; R895-S897 PolarHBondContact O-N 3.04Å
896	R	25	Very low	26	Very low	239 Å²	239	160.2 Å²	160.2	90%	0.902	88%	0.88	S	S	*	*			trans	-71.5	118.5	161	-77.1	-173.7	172.8	-177	-1.4	108.7	F894	F894-R896 PolarHBondContact O-N 2.75Å
897	S	28.9	Very low	26	Very low	125 Å²	125	162.6 Å²	162.6	87%	0.874	89%	0.886	S	S	*	*			trans	-69.2	124.7	157.8	52.3	0	0	0	0	109.2	R895	R895-S897 PolarHBondContact O-N 3.04Å
898	G	31.8	Very low	25.9	Very low	153 Å²	153	166 Å²	166	100%	1.577	89%	0.889	S	S	*	*			trans	-157.4	0	173.2	0	0	0	0	0	109

Retrieved 898 of 898 residues in 822.5 ms (Link to these results)

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