A0A5K4F2D0_SCHMA Loading...

DNA polymerase

AlphaFold DB , UniProt , Accession A0A5K4F2D0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,644 aa.

						>A0A5K4F2D0_SCHMA|A0A5K4F2D0
MQLISFQEKDEQPVYETVDEAEYAELVRKRLEDDWIVDDEGGDYAEDGREIFDDNDEDEESYDSKPKAKSKMSSTSIPKKKRLNPDIRASDSAPLRPPVGRDIRSLFAASSGSNSSKKRKEMKDLSVDPNLDDLLAELESSVTEPKPHHHNPDNLSRKSFVASKRNSGVHGNVVNTPTPLKRRSPERPEQPIHTPSGSRLRLPLVSEKKHSSQTPLDQRSRNPFSCRELTGTEPKMKHSKPQVTGAISLPTEEATSMVSEVDETNFSEDFEMEMIPKNIQPAVQPPKSTSGSNMQSTTSVTANWLTEENLAKADETTWIDETSPVSFPPSSNKGNILYFYWFDAHEDFKQLPGIVYLFGKLYDHSKSGTYASCCLRIKDLERRIFLLPRTSSPENGDIPTVKDVYMEFRDLTSQYKIGKFRCKTTEKRYAFEYADVPETSDYLEVRYAASYSALPADLQGKTFSHIFGTNTSFLENLLLDLQLRGPCWLEIKDASQVQPQISWCQIDYEVIWRSGTGCPITKLSTVIESQKSSDNTSDLMKVPPAPPLCLAAINIKSVTQKHSSHSEIISIGLLIDNAYLLDRPIEKSLFQTHYLVLAPPKDAALPYDLRTKLPSYGAQYSPPSSTWLSLNPGVSSTPSTVEKYKNHSNGDSSGAGGVDVEPNERALLGRFLTRLHKLDPDIIIGHDLWGHQIELLIQRLNANKVPHWHRVGRLRRSVNFPMNLNSRSWIIRHSMPGRLVCDTKVSARELVRSRTYNLSDLASQVLGEVTSKKDDKSSQIGVLPKRQIPPILISRLNGNTKFVCDNDLSIMGVGAELADIEIDSADLRCLFSNSDLVRQLIDFCLSDAHLVLRLCHQLQVLPLAMQITSICGNVLSRTLSGGRAERNEALLLHAFTQHGYIVPDPPVSHRGPHSNRHDEWDGIQEQAVEDAGTGRRKPAYTGGLVLEPKKGFYDKYILLLDFNSLYPSIIQEFNICFTTVDRDLVATTSSDKEPLDLDTIVTTLIATVHGDSNSISVSKSDNDKKIRLPVDQEPGLLPAEIRRLVESRKEVKKLLANTSSGDAAQRAQWNTRQAALKLTANSVYGCLGFAASRFCARGLAALVTGLGRAVLMNTRDLVENMNMEVIYGDTDSIMVNTNTTDLLAALAIGEKIRQEVNKHYRLLELDTDGVYAAMLLLAKKKYAALSVINPVQWATAAKISINQGLTPQVVCTKQEMKGLDIVRRDWSALAISVGRRCVAALLSGEPKDIILDRIHADLTETAEKVRQGKLPISEFIITKMLTKNPEDYSDAKSQPHVQVALRLNGSAADDKKTGTRRLRAGDTVEYVICEDGSGQLATHRGYSPTELTSCLYKVSDDSEPSTKGNLSIDVNYYLAHQIHPVVSRLVAPIEGTSPARIADCLGLDPSGYRRSNVTTVVDEDDENNPDIGFSSGFSSFTNCGDVESLYINCPRNCGGPPIAIKTSAFSVVGKTWFCPTCSHNLLLSQDSARLVTNRLVFEARRLIVHYQLGWMTCEDPACAVVTRSLHCPPSSGHHTIGESDGLWARGGRPLCGVCGGQAALKSNYSEAKLYRQLCFFRYLVTPPNNKNAGSNADMEITLPPVVSSILSQCRNHFDRLLSHSAFAMVDLGKLFSGLRTTCTGPGFR
					

Structure Viewer

Loading PAE data...

(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	30.2	Very low	26.8	Very low	241 Å²	241	174.3 Å²	174.3	100%	1.187	86%	0.857	S	S	*	*				0	142.9	0	-63.1	172.2	-177.6	0	0	107.2	L3	M1-L3 PolarHBondContact O-N 3.2Å
2	Q	27.3	Very low	27.3	Very low	197 Å²	197	173.1 Å²	173.1	92%	0.921	85%	0.848	S	S	*	*			trans	-83.4	106.5	174.9	-73.2	168.4	-63.3	0	0	108.4
3	L	25	Very low	27.6	Very low	172 Å²	172	167.9 Å²	167.9	90%	0.901	84%	0.836	S	S	*	*			trans	-86	118.2	166.4	-85.3	162.5	0	0	0	107.9	M1 S5	M1-L3 PolarHBondContact O-N 3.2Å; L3-S5 PolarHBondContact O-N 3.48Å
4	I	27.1	Very low	28.8	Very low	144 Å²	144	162.7 Å²	162.7	74%	0.738	82%	0.817	S	S	*	*			trans	-76.7	118.7	173.4	-64	169.5	0	0	0	106.6	F6	I4-F6 PolarHBondContact O-N 2.83Å; I4-F6 VanDerWaalsContact O-N 3.12Å
5	S	26.2	Very low	28.9	Very low	108 Å²	108	163.1 Å²	163.1	76%	0.755	81%	0.807	S	S	*	*			trans	-72.5	100.9	172.7	53.1	0	0	0	0	109.3	L3 Q7	L3-S5 PolarHBondContact O-N 3.48Å; S5-Q7 PolarHBondContact O-N 3.26Å
6	F	23	Very low	29.6	Very low	179 Å²	179	162.3 Å²	162.3	79%	0.785	80%	0.8	S	S	*	*			trans	-62.3	126.7	157	-92.2	-108.2	0	0	0	107.9	I4	I4-F6 PolarHBondContact O-N 2.83Å; I4-F6 VanDerWaalsContact O-N 3.12Å
7	Q	26	Very low	30.1	Very low	185 Å²	185	158.5 Å²	158.5	86%	0.864	79%	0.789	S	S	*	*			trans	-88.3	101.7	152.1	-67.3	-176.2	-84.7	0	0	105.1	S5	S5-Q7 PolarHBondContact O-N 3.26Å
8	E	24.1	Very low	30.7	Very low	167 Å²	167	151.8 Å²	151.8	78%	0.78	76%	0.757	S	S	*	*			trans	-58.3	137.8	154.4	-76.3	168.5	128.5	0	0	106.9
9	K	25.2	Very low	32.1	Very low	187 Å²	187	147.7 Å²	147.7	81%	0.813	74%	0.738	S	S	*	*			trans	-77.1	128.4	159	-73.5	-179.3	175.6	-177.9	0	105.3	E11	K9-E11 VanDerWaalsContact C-N 3.3Å; K9-E11 PolarHBondContact O-N 3.17Å
10	D	30.2	Very low	32.5	Very low	160 Å²	160	149.5 Å²	149.5	86%	0.856	74%	0.744	S	S	*	*			trans	-64.9	95.7	166.1	-58.5	-72.3	0	0	0	108	Q12	D10-Q12 PolarHBondContact O-N 2.93Å
11	E	30.3	Very low	33	Very low	177 Å²	177	145.4 Å²	145.4	83%	0.827	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-67.9	117.4	168.4	-67.8	-173.9	160.9	0	0	107.1	K9	K9-E11 VanDerWaalsContact C-N 3.3Å; K9-E11 PolarHBondContact O-N 3.17Å
12	Q	32.4	Very low	33.9	Very low	160 Å²	160	138.8 Å²	138.8	75%	0.748	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-56.8	131.3	179.6	-72.9	-176.2	-25.6	0	0	109.2	D10 V14	D10-Q12 PolarHBondContact O-N 2.93Å; Q12-V14 PolarHBondContact O-N 3.34Å; Q12-V14 VanDerWaalsContact O-N 3.09Å
13	P	31.2	Very low	34.9	Very low	106 Å²	106	134.6 Å²	134.6	69%	0.688	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-61.9	119.5	-176.7	25.1	-33.7	0	0	0	109.5	Y15	P13-Y15 PolarHBondContact O-N 3.04Å
14	V	44.7	Very low	35.7	Very low	95 Å²	95	128.2 Å²	128.2	58%	0.576	65%	0.649	S	S	*	*	S	Bend	trans	-60.1	-17.6	-177.2	-178.6	0	0	0	0	112.4	Q12	Q12-V14 PolarHBondContact O-N 3.34Å; Q12-V14 VanDerWaalsContact O-N 3.09Å
15	Y	31	Very low	36.5	Very low	169 Å²	169	122.9 Å²	122.9	66%	0.663	62%	0.621	S	S	*	*	S	Bend	trans	-124.5	124.1	174.3	-54.1	-80.5	0	0	0	109.7	P13 T17	P13-Y15 PolarHBondContact O-N 3.04Å; Y15-T17 PolarHBondContact O-N 3.32Å
16	E	39.2	Very low	37.6	Very low	149 Å²	149	120.3 Å²	120.3	70%	0.696	60%	0.598	S	S	*	*			trans	-70.1	115.1	166.4	-172.5	175.5	-135.2	0	0	108.5	V18	E16-V18 HydrophobicContact CG-CG1 3.99Å; E16-V18 PolarHBondContact O-N 3.09Å
17	T	38.2	Very low	38.5	Very low	99 Å²	99	113.2 Å²	113.2	61%	0.607	57%	0.57	S	S	*	*			trans	-80.7	62.4	-174.7	-29.4	0	0	0	0	111.5	Y15 L1634	Y15-T17 PolarHBondContact O-N 3.32Å; T17-L1634 HydrophobicContact CG2-CD1 4.31Å
18	V	40.5	Very low	39.1	Very low	37 Å²	37	107.4 Å²	107.4	22%	0.224	54%	0.54	C	S	.	.			trans	-58	139.5	177.9	-74.1	0	0	0	0	112.3	E16 E22 Y23 L26	E16-V18 HydrophobicContact CG-CG1 3.99Å; E16-V18 PolarHBondContact O-N 3.09Å; V18-E22 WeakPolarHBondContact CA-OE2 3.26Å; V18-E22 HydrophobicContact CB-CB 3.65Å; V18-E22 HydrophobicContact CG1-CB 3.84Å; V18-Y23 HydrophobicContact CG2-CD2 4.38Å; V18-L26 HydrophobicContact CB-CD1 4.48Å; V18-L26 HydrophobicContact CG1-CD1 3.96Å; V18-L26 HydrophobicContact CG2-CD1 4.11Å
19	D	57.6	Low	39.8	Very low	74 Å²	74	104.6 Å²	104.6	40%	0.396	53%	0.525	S	S	.	.			trans	-74	174	173.8	81.1	17.4	0	0	0	112.4	A21 E22 Y23	D19-A21 PolarHBondContact O-N 3.01Å; D19-A21 WeakPolarHBondContact OD1-CA 3.44Å; D19-A21 WeakPolarHBondContact OD1-CB 3.33Å; D19-A21 PolarHBondContact OD1-N 2.9Å; D19-E22 PolarHBondContact N-OE2 3.43Å; D19-E22 PolarHBondContact O-N 2.96Å; D19-E22 PolarHBondContact OD1-N 3.29Å; D19-Y23 WeakPolarHBondContact O-CB 3.37Å; D19-Y23 PolarHBondContact O-N 3.24Å
20	E	41.4	Very low	40.6	Very low	183 Å²	183	102.6 Å²	102.6	86%	0.855	51%	0.512	S	S	*	.	H	α-helix	trans	-59.9	-28.1	-179.2	-80.4	-176.2	117.2	0	0	113.3	A24	E20-A24 WeakPolarHBondContact O-CB 3.23Å; E20-A24 PolarHBondContact O-N 3.2Å
21	A	43	Very low	40.7	Very low	65 Å²	65	98.2 Å²	98.2	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-80.2	-38.1	177.6	0	0	0	0	0	111.7	D19 A24 E25	D19-A21 PolarHBondContact O-N 3.01Å; D19-A21 WeakPolarHBondContact OD1-CA 3.44Å; D19-A21 WeakPolarHBondContact OD1-CB 3.33Å; D19-A21 PolarHBondContact OD1-N 2.9Å; A21-A24 PolarHBondContact O-N 3.01Å; A21-E25 VanDerWaalsContact O-CB 3.32Å; A21-E25 WeakPolarHBondContact O-CB 3.41Å; A21-E25 PolarHBondContact O-N 3.08Å
22	E	48.6	Very low	40.8	Very low	102 Å²	102	93.1 Å²	93.1	48%	0.477	47%	0.465	S	S	.	.	H	α-helix	trans	-68.5	-37.7	171.8	-72.3	-176.7	137.8	0	0	112.2	V18 D19 E25 L26	V18-E22 WeakPolarHBondContact CA-OE2 3.26Å; V18-E22 HydrophobicContact CB-CB 3.65Å; V18-E22 HydrophobicContact CG1-CB 3.84Å; D19-E22 PolarHBondContact N-OE2 3.43Å; D19-E22 PolarHBondContact O-N 2.96Å; D19-E22 PolarHBondContact OD1-N 3.29Å; E22-E25 PolarHBondContact O-N 2.85Å; E22-L26 WeakPolarHBondContact O-CB 3.43Å; E22-L26 WeakPolarHBondContact O-CG 3.09Å; E22-L26 PolarHBondContact O-N 3.19Å
23	Y	47.1	Very low	40.8	Very low	108 Å²	108	88.9 Å²	88.9	42%	0.424	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-43	171.1	-174.2	-99.6	0	0	0	111.3	V18 D19 L26 V27 T941	V18-Y23 HydrophobicContact CG2-CD2 4.38Å; D19-Y23 WeakPolarHBondContact O-CB 3.37Å; D19-Y23 PolarHBondContact O-N 3.24Å; Y23-L26 WeakPolarHBondContact O-CB 3.28Å; Y23-L26 PolarHBondContact O-N 2.9Å; Y23-V27 HydrophobicContact CD1-CG2 4.29Å; Y23-V27 HydrophobicContact CE1-CG2 3.95Å; Y23-V27 WeakPolarHBondContact O-CG2 3.45Å; Y23-V27 PolarHBondContact O-N 3.23Å; Y23-T941 PolarHBondContact OH-OG1 3.47Å
24	A	42.8	Very low	41	Very low	38 Å²	38	87.5 Å²	87.5	31%	0.314	43%	0.434	S	S	.	.	H	α-helix	trans	-63	-39.8	172.5	0	0	0	0	0	112.2	E20 A21 V27 R28	E20-A24 WeakPolarHBondContact O-CB 3.23Å; E20-A24 PolarHBondContact O-N 3.2Å; A21-A24 PolarHBondContact O-N 3.01Å; A24-V27 PolarHBondContact O-N 3.01Å; A24-R28 VanDerWaalsContact O-CB 3.25Å; A24-R28 WeakPolarHBondContact O-CB 3.36Å; A24-R28 PolarHBondContact O-N 3.32Å
25	E	44.8	Very low	40.5	Very low	33 Å²	33	87.4 Å²	87.4	15%	0.154	42%	0.424	C	S	.	.	H	α-helix	trans	-64.4	-39.1	174.1	178.7	64.2	-144	0	0	111.7	A21 E22 R28 K29 R1545 G1546	A21-E25 VanDerWaalsContact O-CB 3.32Å; A21-E25 WeakPolarHBondContact O-CB 3.41Å; A21-E25 PolarHBondContact O-N 3.08Å; E22-E25 PolarHBondContact O-N 2.85Å; E25-R28 PolarHBondContact O-N 2.73Å; E25-R28 IonicContact OE1-NH2 2.79Å; E25-R28 PolarHBondContact OE1-NH2 3.49Å; E25-R28 IonicContact OE2-CZ 2.9Å; E25-R28 IonicContact OE2-NE 2.85Å; E25-R28 IonicContact OE2-NH2 3.86Å; E25-R28 PolarHBondContact OE2-NH2 3.04Å; E25-K29 WeakPolarHBondContact O-CB 3.44Å; E25-K29 WeakPolarHBondContact O-CG 3.4Å; E25-K29 PolarHBondContact O-N 3.42Å; E25-R1545 WeakPolarHBondContact OE1-CA 3.49Å; E25-G1546 VanDerWaalsContact CD-N 3.3Å; E25-G1546 PolarHBondContact OE1-N 3.04Å
26	L	48.6	Very low	40.8	Very low	54 Å²	54	80.2 Å²	80.2	28%	0.283	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-44.9	172.2	-84.1	164.4	0	0	0	112.3	V18 E22 Y23 R28 K29 R30	V18-L26 HydrophobicContact CB-CD1 4.48Å; V18-L26 HydrophobicContact CG1-CD1 3.96Å; V18-L26 HydrophobicContact CG2-CD1 4.11Å; E22-L26 WeakPolarHBondContact O-CB 3.43Å; E22-L26 WeakPolarHBondContact O-CG 3.09Å; E22-L26 PolarHBondContact O-N 3.19Å; Y23-L26 WeakPolarHBondContact O-CB 3.28Å; Y23-L26 PolarHBondContact O-N 2.9Å; L26-R28 VanDerWaalsContact C-N 3.31Å; L26-R28 PolarHBondContact O-N 3.02Å; L26-K29 PolarHBondContact O-N 3.06Å; L26-R30 WeakPolarHBondContact O-CG 3.42Å; L26-R30 PolarHBondContact O-N 3.33Å; L26-R30 VanDerWaalsContact O-N 3.12Å
27	V	40.7	Very low	40.6	Very low	30 Å²	30	74.3 Å²	74.3	18%	0.182	37%	0.37	C	S	.	.	H	α-helix	trans	-64.3	-36.7	174.5	171.2	0	0	0	0	111	Y23 A24 R30 L31 P938	Y23-V27 HydrophobicContact CD1-CG2 4.29Å; Y23-V27 HydrophobicContact CE1-CG2 3.95Å; Y23-V27 WeakPolarHBondContact O-CG2 3.45Å; Y23-V27 PolarHBondContact O-N 3.23Å; A24-V27 PolarHBondContact O-N 3.01Å; V27-R30 WeakPolarHBondContact O-CB 3.5Å; V27-R30 PolarHBondContact O-N 3.48Å; V27-L31 HydrophobicContact CG1-CD1 4.4Å; V27-L31 PolarHBondContact O-N 2.87Å; V27-P938 HydrophobicContact CG1-CG 4.33Å
28	R	39.8	Very low	40.2	Very low	63 Å²	63	71.8 Å²	71.8	24%	0.238	35%	0.353	C	S	.	.	H	α-helix	trans	-75.9	-33.1	178.4	-153.8	-176.5	54.1	52.7	18.9	112.8	A24 E25 L26 R30 L31 E32	A24-R28 VanDerWaalsContact O-CB 3.25Å; A24-R28 WeakPolarHBondContact O-CB 3.36Å; A24-R28 PolarHBondContact O-N 3.32Å; E25-R28 PolarHBondContact O-N 2.73Å; E25-R28 IonicContact OE1-NH2 2.79Å; E25-R28 PolarHBondContact OE1-NH2 3.49Å; E25-R28 IonicContact OE2-CZ 2.9Å; E25-R28 IonicContact OE2-NE 2.85Å; E25-R28 IonicContact OE2-NH2 3.86Å; E25-R28 PolarHBondContact OE2-NH2 3.04Å; L26-R28 VanDerWaalsContact C-N 3.31Å; L26-R28 PolarHBondContact O-N 3.02Å; R28-R30 VanDerWaalsContact C-N 3.32Å; R28-R30 PolarHBondContact O-N 3.48Å; R28-L31 PolarHBondContact O-N 2.65Å; R28-L31 VanDerWaalsContact O-N 3.11Å; R28-E32 IonicContact CZ-OE1 2.64Å; R28-E32 IonicContact NH1-OE1 2.78Å; R28-E32 PolarHBondContact NH1-OE1 2.96Å; R28-E32 PolarHBondContact O-N 3.34Å; R28-E32 VanDerWaalsContact O-N 3.15Å
29	K	39.4	Very low	39.8	Very low	108 Å²	108	73.4 Å²	73.4	47%	0.47	36%	0.36	S	S	.	.	H	α-helix	trans	-56.5	-44.9	165.5	-83.4	175.9	177.3	172.6	0	110.9	E25 L26 L31 E32 D33	E25-K29 WeakPolarHBondContact O-CB 3.44Å; E25-K29 WeakPolarHBondContact O-CG 3.4Å; E25-K29 PolarHBondContact O-N 3.42Å; L26-K29 PolarHBondContact O-N 3.06Å; K29-L31 PolarHBondContact O-N 2.81Å; K29-E32 PolarHBondContact O-N 3.01Å; K29-D33 PolarHBondContact O-N 2.84Å
30	R	40.5	Very low	38.6	Very low	144 Å²	144	74.4 Å²	74.4	54%	0.543	36%	0.363	S	S	.	.	H	α-helix	trans	-65.7	-18.7	175.6	-66.1	169.2	-172.8	156.5	3.3	114.1	L26 V27 R28	L26-R30 WeakPolarHBondContact O-CG 3.42Å; L26-R30 PolarHBondContact O-N 3.33Å; L26-R30 VanDerWaalsContact O-N 3.12Å; V27-R30 WeakPolarHBondContact O-CB 3.5Å; V27-R30 PolarHBondContact O-N 3.48Å; R28-R30 VanDerWaalsContact C-N 3.32Å; R28-R30 PolarHBondContact O-N 3.48Å
31	L	32.1	Very low	38.1	Very low	69 Å²	69	70.1 Å²	70.1	36%	0.361	37%	0.368	S	S	.	.	H	α-helix	trans	-89.4	-20.5	174.6	-76	163.3	0	0	0	113.3	V27 R28 K29	V27-L31 HydrophobicContact CG1-CD1 4.4Å; V27-L31 PolarHBondContact O-N 2.87Å; R28-L31 PolarHBondContact O-N 2.65Å; R28-L31 VanDerWaalsContact O-N 3.11Å; K29-L31 PolarHBondContact O-N 2.81Å
32	E	33.6	Very low	37.5	Very low	69 Å²	69	68.3 Å²	68.3	32%	0.322	36%	0.355	S	S	.	.	H	α-helix	trans	-91.8	-29.8	174.4	-73.8	-176.8	-159.4	0	0	114	R28 K29 D34 R1545	R28-E32 IonicContact CZ-OE1 2.64Å; R28-E32 IonicContact NH1-OE1 2.78Å; R28-E32 PolarHBondContact NH1-OE1 2.96Å; R28-E32 PolarHBondContact O-N 3.34Å; R28-E32 VanDerWaalsContact O-N 3.15Å; K29-E32 PolarHBondContact O-N 3.01Å; E32-D34 PolarHBondContact O-N 3.4Å; E32-R1545 WeakPolarHBondContact OE2-CG 3.33Å; E32-R1545 IonicContact OE2-CZ 3.25Å; E32-R1545 VanDerWaalsContact OE2-CZ 3.23Å; E32-R1545 IonicContact OE2-NE 3.18Å; E32-R1545 PolarHBondContact OE2-NE 2.85Å; E32-R1545 IonicContact OE2-NH2 2.67Å; E32-R1545 PolarHBondContact OE2-NH2 3.13Å
33	D	33.1	Very low	36.6	Very low	71 Å²	71	66.4 Å²	66.4	38%	0.38	35%	0.348	S	S	.	.	S	Bend	trans	-72.5	86.3	166	-102.5	-45.4	0	0	0	108.9	K29 W35 K1181	K29-D33 PolarHBondContact O-N 2.84Å; D33-W35 WeakPolarHBondContact O-CA 3.33Å; D33-W35 PolarHBondContact O-N 2.96Å; D33-K1181 IonicContact OD1-NZ 3.32Å; D33-K1181 PolarHBondContact OD1-NZ 2.92Å
34	D	34.9	Very low	35.9	Very low	77 Å²	77	64.7 Å²	64.7	41%	0.412	34%	0.341	S	S	.	.			trans	-42.6	103.9	174.1	-154.6	24.4	0	0	0	110.3	E32 I36 R1223	E32-D34 PolarHBondContact O-N 3.4Å; D34-I36 PolarHBondContact O-N 3.4Å; D34-R1223 IonicContact OD2-CZ 3.56Å; D34-R1223 IonicContact OD2-NH1 3.8Å; D34-R1223 PolarHBondContact OD2-NH1 2.79Å; D34-R1223 VanDerWaalsContact OD2-NH1 3.07Å; D34-R1223 IonicContact OD2-NH2 2.88Å; D34-R1223 PolarHBondContact OD2-NH2 3.45Å
35	W	34.2	Very low	35.5	Very low	94 Å²	94	65.2 Å²	65.2	36%	0.356	35%	0.346	S	S	.	.			trans	-49	119.8	-155.6	-164.3	88.8	0	0	0	112.7	D33 Y44 E46	D33-W35 WeakPolarHBondContact O-CA 3.33Å; D33-W35 PolarHBondContact O-N 2.96Å; W35-Y44 WeakPolarHBondContact CH2-O 3.38Å; W35-Y44 WeakPolarHBondContact CZ3-O 3.5Å; W35-E46 HydrophobicContact CE3-CB 3.91Å; W35-E46 HydrophobicContact CH2-CB 3.92Å; W35-E46 HydrophobicContact CZ3-CB 3.57Å
36	I	36	Very low	34.9	Very low	17 Å²	17	67 Å²	67	9%	0.087	35%	0.354	C	S	.	.			trans	-82.1	145.8	-166.1	-63.8	151	0	0	0	110.2	D34 K1179 K1180 K1181	D34-I36 PolarHBondContact O-N 3.4Å; I36-K1179 VanDerWaalsContact CD1-O 3.29Å; I36-K1179 WeakPolarHBondContact CD1-O 3.44Å; I36-K1180 HydrophobicContact CB-CB 3.57Å; I36-K1180 HydrophobicContact CB-CD 3.68Å; I36-K1180 HydrophobicContact CB-CG 4.22Å; I36-K1180 HydrophobicContact CD1-CB 3.78Å; I36-K1180 HydrophobicContact CG1-CB 4.29Å; I36-K1180 HydrophobicContact CG2-CB 3.35Å; I36-K1180 HydrophobicContact CG2-CD 4.21Å; I36-K1180 HydrophobicContact CG2-CG 4.39Å; I36-K1180 WeakPolarHBondContact CG2-O 3.5Å; I36-K1181 HydrophobicContact CD1-CD 4.25Å; I36-K1181 HydrophobicContact CD1-CG 3.89Å
37	V	35.2	Very low	34.2	Very low	25 Å²	25	66.4 Å²	66.4	15%	0.152	35%	0.351	C	S	.	.			trans	-129.9	126.1	-145.2	79.6	0	0	0	0	108.3	R752	V37-R752 VanDerWaalsContact CG1-CZ 3.49Å
38	D	31.3	Very low	33.7	Very low	46 Å²	46	66.4 Å²	66.4	25%	0.246	36%	0.357	C	S	.	.			trans	-80	140.6	-171.1	-84.1	-82.2	0	0	0	113.1	K1217	D38-K1217 WeakPolarHBondContact OD1-CD 3.37Å; D38-K1217 VanDerWaalsContact OD1-CE 3.3Å; D38-K1217 WeakPolarHBondContact OD1-CE 3.46Å; D38-K1217 IonicContact OD1-NZ 2.77Å; D38-K1217 PolarHBondContact OD1-NZ 3.08Å
39	D	31.1	Very low	33.3	Very low	71 Å²	71	67 Å²	67	38%	0.38	36%	0.359	S	S	.	.	S	Bend	trans	-87.6	-10.2	179.8	-62.6	-79.9	0	0	0	113.2	M1216 V1222	D39-M1216 VanDerWaalsContact OD2-O 3.12Å; D39-V1222 WeakPolarHBondContact OD1-CG1 3.46Å
40	E	31.7	Very low	33.1	Very low	96 Å²	96	66.1 Å²	66.1	45%	0.449	36%	0.357	S	S	.	.	S	Bend	trans	-89.5	110.6	172.9	-68.7	-69.7	138.6	0	0	108.8	G42 K1213	E40-G42 PolarHBondContact O-N 3.01Å; E40-K1213 IonicContact OE1-NZ 3.8Å; E40-K1213 PolarHBondContact OE1-NZ 2.92Å
41	G	32.2	Very low	32.7	Very low	93 Å²	93	64.4 Å²	64.4	96%	0.959	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	47.4	-173.1	0	0	0	0	0	115.3
42	G	29.2	Very low	32.9	Very low	26 Å²	26	63.3 Å²	63.3	27%	0.268	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-36.2	-171.3	0	0	0	0	0	115.6	E40 K1077 N1081	E40-G42 PolarHBondContact O-N 3.01Å; G42-K1077 VanDerWaalsContact C-NZ 3.3Å; G42-K1077 VanDerWaalsContact O-CE 3.31Å; G42-K1077 WeakPolarHBondContact O-CE 3.43Å; G42-K1077 PolarHBondContact O-NZ 3.35Å; G42-N1081 PolarHBondContact O-ND2 3.31Å
43	D	31.5	Very low	32.7	Very low	62 Å²	62	63.1 Å²	63.1	33%	0.332	35%	0.351	S	S	.	.	S	Bend	trans	-131.3	-157.9	-171.5	-63.7	-71.1	0	0	0	111.4	A45 K1077 N1081	D43-A45 PolarHBondContact O-N 3.15Å; D43-K1077 VanDerWaalsContact OD1-CE 3.27Å; D43-K1077 WeakPolarHBondContact OD1-CE 3.35Å; D43-K1077 IonicContact OD1-NZ 2.66Å; D43-K1077 PolarHBondContact OD1-NZ 3.12Å; D43-K1077 IonicContact OD2-NZ 3.52Å; D43-K1077 PolarHBondContact OD2-NZ 3.33Å; D43-N1081 PolarHBondContact OD1-ND2 2.77Å
44	Y	32.5	Very low	32.7	Very low	72 Å²	72	63.7 Å²	63.7	28%	0.282	35%	0.354	S	S	.	.			trans	-64.2	89.1	-157.7	-80.7	-99.7	0	0	0	114.9	W35 E46 Y966 N1081 Y1084	W35-Y44 WeakPolarHBondContact CH2-O 3.38Å; W35-Y44 WeakPolarHBondContact CZ3-O 3.5Å; Y44-E46 PolarHBondContact O-N 2.93Å; Y44-Y966 HydrophobicContact CE2-CD2 4.25Å; Y44-N1081 PolarHBondContact OH-O 3.45Å; Y44-Y1084 AromaticContact CE1-CD1 3.94Å; Y44-Y1084 HydrophobicContact CE1-CD1 3.94Å; Y44-Y1084 HydrophobicContact CE1-CE1 4.25Å; Y44-Y1084 AromaticContact CZ-CD1 3.88Å; Y44-Y1084 WeakPolarHBondContact OH-CD1 3.18Å
45	A	33.1	Very low	32.4	Very low	49 Å²	49	61 Å²	61	41%	0.405	34%	0.339	S	S	.	.			trans	-94.4	89	171.9	0	0	0	0	0	111.7	D43	D43-A45 PolarHBondContact O-N 3.15Å
46	E	32.6	Very low	32.2	Very low	70 Å²	70	58.8 Å²	58.8	33%	0.327	34%	0.335	S	S	.	.			trans	-93.9	103.1	171.6	-165.1	171.4	-86.7	0	0	109.2	W35 Y44 G48	W35-E46 HydrophobicContact CE3-CB 3.91Å; W35-E46 HydrophobicContact CH2-CB 3.92Å; W35-E46 HydrophobicContact CZ3-CB 3.57Å; Y44-E46 PolarHBondContact O-N 2.93Å; E46-G48 PolarHBondContact O-N 2.84Å
47	D	32.7	Very low	32.1	Very low	43 Å²	43	62 Å²	62	23%	0.23	35%	0.349	C	S	.	.			trans	-79.7	38.2	-166	-152.6	58.3	0	0	0	113.7	R49 R752 R1224	D47-R49 PolarHBondContact O-N 3.42Å; D47-R49 VanDerWaalsContact O-N 3.12Å; D47-R752 IonicContact OD1-CZ 3.21Å; D47-R752 VanDerWaalsContact OD1-CZ 3.23Å; D47-R752 IonicContact OD1-NH1 3.42Å; D47-R752 PolarHBondContact OD1-NH1 3.4Å; D47-R752 IonicContact OD1-NH2 3.4Å; D47-R752 PolarHBondContact OD1-NH2 2.93Å; D47-R1224 IonicContact OD2-NH2 3.54Å; D47-R1224 PolarHBondContact OD2-NH2 3.07Å
48	G	31.8	Very low	31.7	Very low	29 Å²	29	67.7 Å²	67.7	30%	0.299	38%	0.379	S	S	.	.	S	Bend	trans	65.1	3.4	-164.1	0	0	0	0	0	113.8	E46	E46-G48 PolarHBondContact O-N 2.84Å
49	R	31.7	Very low	31.6	Very low	75 Å²	75	73.6 Å²	73.6	28%	0.283	41%	0.405	S	S	.	.			trans	-116.2	107.5	178.5	-65.9	176.1	-178.7	-94.1	-15.8	108.8	D47 I51 M1280 L1281	D47-R49 PolarHBondContact O-N 3.42Å; D47-R49 VanDerWaalsContact O-N 3.12Å; R49-I51 PolarHBondContact O-N 3.29Å; R49-M1280 PolarHBondContact NH2-SD 2.76Å; R49-L1281 PolarHBondContact NH2-O 3Å
50	E	33.2	Very low	31.2	Very low	91 Å²	91	78.7 Å²	78.7	43%	0.425	43%	0.427	S	S	.	.			trans	-63.1	116.2	150.1	-94.1	-166.2	-114.5	0	0	107.2	F52 D53	E50-F52 HydrophobicContact CB-CB 4.02Å; E50-F52 HydrophobicContact CB-CD2 4.5Å; E50-F52 HydrophobicContact CG-CD2 4.45Å; E50-F52 PolarHBondContact O-N 3.43Å; E50-D53 HydrophobicContact CB-CB 4.02Å; E50-D53 PolarHBondContact O-N 3.34Å
51	I	34.1	Very low	30.9	Very low	107 Å²	107	77.9 Å²	77.9	55%	0.549	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	41.2	178.2	-37.9	178	0	0	0	109.8	R49	R49-I51 PolarHBondContact O-N 3.29Å
52	F	34.7	Very low	30.6	Very low	46 Å²	46	83.7 Å²	83.7	20%	0.202	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-161.6	-25.6	-145.8	-65.8	-38.1	0	0	0	110	E50 D54 R883 A884 F1089	E50-F52 HydrophobicContact CB-CB 4.02Å; E50-F52 HydrophobicContact CB-CD2 4.5Å; E50-F52 HydrophobicContact CG-CD2 4.45Å; E50-F52 PolarHBondContact O-N 3.43Å; F52-D54 PolarHBondContact O-N 2.98Å; F52-D54 VanDerWaalsContact O-N 3.1Å; F52-R883 HydrophobicContact CZ-CB 4.23Å; F52-A884 HydrophobicContact CD1-CB 4.41Å; F52-A884 HydrophobicContact CE1-CB 3.79Å; F52-F1089 HydrophobicContact CB-CD2 3.55Å; F52-F1089 HydrophobicContact CB-CE1 4.4Å; F52-F1089 HydrophobicContact CB-CE2 3.46Å; F52-F1089 VanDerWaalsContact CB-CE2 3.46Å; F52-F1089 HydrophobicContact CB-CG 4.12Å; F52-F1089 HydrophobicContact CB-CZ 3.88Å; F52-F1089 AromaticContact CD1-CD1 3.67Å; F52-F1089 HydrophobicContact CD1-CD1 3.67Å; F52-F1089 HydrophobicContact CD1-CD2 4.25Å; F52-F1089 AromaticContact CD1-CE1 3.59Å; F52-F1089 HydrophobicContact CD1-CE1 3.59Å; F52-F1089 HydrophobicContact CD1-CE2 4.23Å; F52-F1089 HydrophobicContact CD1-CG 4.01Å; F52-F1089 AromaticContact CD1-CZ 3.88Å; F52-F1089 HydrophobicContact CD1-CZ 3.88Å; F52-F1089 HydrophobicContact CD2-CG 4.47Å; F52-F1089 HydrophobicContact CE1-CD1 4.09Å; F52-F1089 HydrophobicContact CE1-CE1 4.24Å; F52-F1089 HydrophobicContact CG-CD1 4.12Å; F52-F1089 AromaticContact CG-CD2 3.92Å; F52-F1089 HydrophobicContact CG-CD2 3.92Å; F52-F1089 HydrophobicContact CG-CE1 4.24Å; F52-F1089 HydrophobicContact CG-CE2 4.1Å; F52-F1089 AromaticContact CG-CG 3.96Å; F52-F1089 HydrophobicContact CG-CG 3.96Å; F52-F1089 HydrophobicContact CG-CZ 4.21Å; F52-F1089 WeakPolarHBondContact O-CE2 3.48Å
53	D	29.6	Very low	30.5	Very low	65 Å²	65	88.6 Å²	88.6	35%	0.348	45%	0.446	S	S	.	.			trans	-74.7	6.5	-177.9	-136.3	0.1	0	0	0	113.5	E50 N55	E50-D53 HydrophobicContact CB-CB 4.02Å; E50-D53 PolarHBondContact O-N 3.34Å; D53-N55 PolarHBondContact O-N 2.93Å
54	D	32.6	Very low	30.1	Very low	83 Å²	83	90.7 Å²	90.7	44%	0.444	47%	0.466	S	S	.	.	S	Bend	trans	-86.9	95.2	171.2	-68.8	-46.9	0	0	0	109.7	F52	F52-D54 PolarHBondContact O-N 2.98Å; F52-D54 VanDerWaalsContact O-N 3.1Å
55	N	29.8	Very low	29.8	Very low	20 Å²	20	95.6 Å²	95.6	11%	0.107	49%	0.489	C	S	.	.			trans	67.5	173.2	-177.2	-11.1	-21.4	0	0	0	116.1	D53 A927	D53-N55 PolarHBondContact O-N 2.93Å; N55-A927 HydrophobicContact CB-CB 4.02Å; N55-A927 VanDerWaalsContact OD1-CB 3.28Å; N55-A927 WeakPolarHBondContact OD1-CB 3.3Å
56	D	30	Very low	29.5	Very low	49 Å²	49	99.1 Å²	99.1	26%	0.262	51%	0.507	S	S	.	.			cis	-122.3	-174.4	-16.4	-98.8	-56.5	0	0	0	105.8	R936	D56-R936 PolarHBondContact O-NH1 2.98Å; D56-R936 PolarHBondContact O-NH2 2.8Å; D56-R936 VanDerWaalsContact O-NH2 3.08Å
57	E	33.3	Very low	29	Very low	84 Å²	84	105.7 Å²	105.7	39%	0.393	54%	0.535	S	S	.	.			cis	-124.9	-161	-27	-140	154.1	-157	0	0	105.3	S908 H909 R936	E57-S908 WeakPolarHBondContact OE1-CB 3.42Å; E57-S908 PolarHBondContact OE1-OG 2.99Å; E57-H909 PolarHBondContact OE1-N 2.77Å; E57-H909 PolarHBondContact OE2-N 2.84Å; E57-H909 VanDerWaalsContact OE2-N 3.07Å; E57-R936 PolarHBondContact O-NH2 3.04Å; E57-R936 VanDerWaalsContact O-NH2 3.12Å
58	D	27.3	Very low	28.7	Very low	145 Å²	145	108.6 Å²	108.6	78%	0.775	57%	0.565	S	S	*	*			trans	-150	119.2	171.2	-145.8	2	0	0	0	108.7
59	E	29.3	Very low	28.4	Very low	169 Å²	169	116.9 Å²	116.9	79%	0.79	59%	0.593	S	S	*	*			trans	176.7	122.3	140.8	-106.8	-164.7	-163.1	0	0	113.3
60	E	21.7	Very low	28.3	Very low	178 Å²	178	119.2 Å²	119.2	83%	0.832	62%	0.621	S	S	*	*			trans	-119.6	97.5	144.7	-82.2	-164.6	165.5	0	0	109.4
61	S	25.5	Very low	28	Very low	80 Å²	80	124.3 Å²	124.3	56%	0.559	64%	0.641	S	S	*	*				179.5	138.3	126.6	55.8	0	0	0	0	112.4
62	Y	26.5	Very low	27.7	Very low	215 Å²	215	127.6 Å²	127.6	84%	0.843	66%	0.656	S	S	*	*				-162.3	87.6	119.7	-106.4	-65	0	0	0	110.9	S64	Y62-S64 PolarHBondContact O-N 3.42Å
63	D	26.2	Very low	27.3	Very low	128 Å²	128	130 Å²	130	68%	0.684	68%	0.679	S	S	*	*			trans	-60.4	128.7	173.6	174	36.1	0	0	0	111.5	K65	D63-K65 PolarHBondContact O-N 3.24Å
64	S	24.7	Very low	27.1	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	70%	0.697	S	S	*	*			trans	-90.7	67.1	-159.4	60	0	0	0	0	113.5	Y62 P66	Y62-S64 PolarHBondContact O-N 3.42Å; S64-P66 WeakPolarHBondContact O-CD 3.43Å
65	K	25.8	Very low	26.9	Very low	175 Å²	175	133.2 Å²	133.2	76%	0.761	71%	0.708	S	S	*	*			trans	-57.9	121.6	-179.5	-75.3	173.7	-179.6	162.7	0	113.1	D63	D63-K65 PolarHBondContact O-N 3.24Å
66	P	26.2	Very low	26.8	Very low	122 Å²	122	137 Å²	137	79%	0.792	74%	0.736	S	S	*	*			trans	-75.4	144.4	-174.8	29.2	-35.2	0	0	0	113.3	S64 A68	S64-P66 WeakPolarHBondContact O-CD 3.43Å; P66-A68 PolarHBondContact O-N 2.94Å
67	K	22.2	Very low	26.7	Very low	209 Å²	209	142.1 Å²	142.1	91%	0.909	76%	0.762	S	S	*	*			trans	-79.1	84.8	-177.7	-70.1	171.9	-179.3	163.6	0	112.7
68	A	27.2	Very low	26.5	Very low	104 Å²	104	143.4 Å²	143.4	86%	0.86	78%	0.778	S	S	*	*			trans	-79.4	118.3	166.4	0	0	0	0	0	111.4	P66	P66-A68 PolarHBondContact O-N 2.94Å
69	K	25.7	Very low	26.5	Very low	203 Å²	203	145.6 Å²	145.6	88%	0.883	78%	0.78	S	S	*	*			trans	-102.5	125.8	172.4	-71.7	177.4	179.5	172.3	0	110.7
70	S	29.1	Very low	26.3	Very low	124 Å²	124	146.1 Å²	146.1	87%	0.867	78%	0.78	S	S	*	*			trans	-145.8	161.3	150.3	73.2	0	0	0	0	110.3
71	K	25.7	Very low	26.6	Very low	197 Å²	197	145.7 Å²	145.7	86%	0.857	78%	0.776	S	S	*	*			trans	-116.8	146.9	179.9	-66.5	175.2	175.6	177.2	0	108.8
72	M	28.1	Very low	26.5	Very low	176 Å²	176	152 Å²	152	87%	0.867	79%	0.787	S	S	*	*				-173.6	155.5	115.3	-99	177.2	83.7	0	0	113.9
73	S	26.1	Very low	26.4	Very low	97 Å²	97	147.8 Å²	147.8	68%	0.678	78%	0.778	S	S	*	*			trans	-46.8	161	167.8	43.1	0	0	0	0	115.7
74	S	25.5	Very low	26.3	Very low	103 Å²	103	148.9 Å²	148.9	72%	0.72	78%	0.784	S	S	*	*			cis	-161	174.3	1.2	44.4	0	0	0	0	108.2
75	T	29.4	Very low	26.9	Very low	112 Å²	112	148.9 Å²	148.9	69%	0.687	78%	0.782	S	S	*	*				179	149.7	52.6	-42.3	0	0	0	0	109.4
76	S	27.4	Very low	27.1	Very low	100 Å²	100	148 Å²	148	70%	0.699	79%	0.786	S	S	*	*			trans	53.2	147	157	53.1	0	0	0	0	121.4
77	I	28.4	Very low	27.1	Very low	157 Å²	157	149.1 Å²	149.1	81%	0.805	78%	0.783	S	S	*	*			cis	-156.6	144.8	-9.1	-98.4	157.8	0	0	0	107.1
78	P	28.9	Very low	27.5	Very low	111 Å²	111	151 Å²	151	72%	0.721	79%	0.785	S	S	*	*			trans	-121.6	154.9	-175.8	40.5	-31.6	0	0	0	117.6
79	K	27.5	Very low	27.4	Very low	190 Å²	190	150.5 Å²	150.5	83%	0.826	78%	0.78	S	S	*	*			trans	-171.5	126.8	150.9	-98	141.4	-173.1	177.6	0	109.7
80	K	25.6	Very low	27.4	Very low	181 Å²	181	145.6 Å²	145.6	79%	0.787	77%	0.772	S	S	*	*				67	138.1	78.5	-66.8	-179.3	-177.6	177.5	0	113.2
81	K	26.2	Very low	27.3	Very low	169 Å²	169	146.1 Å²	146.1	74%	0.735	77%	0.765	S	S	*	*			cis	-163.6	153.1	-1.7	-115.4	-175.2	178.3	-170	0	108.6
82	R	23.9	Very low	27.4	Very low	212 Å²	212	142.6 Å²	142.6	80%	0.8	77%	0.765	S	S	*	*				42.9	140.3	101.3	-73.5	-168.5	168.9	-156.9	1.4	116.1
83	L	25	Very low	27.3	Very low	126 Å²	126	138.6 Å²	138.6	66%	0.66	76%	0.76	S	S	*	*			cis	-168	144.8	11.1	-111.5	162.5	0	0	0	112
84	N	24.4	Very low	27.7	Very low	152 Å²	152	139.4 Å²	139.4	81%	0.813	76%	0.763	S	S	*	*			trans	53.9	174.9	136.3	-103.1	24	0	0	0	123
85	P	37.4	Very low	27.8	Very low	107 Å²	107	141.7 Å²	141.7	70%	0.695	77%	0.766	S	S	*	*			trans	-125.9	-172.7	-136.6	46.8	-32.4	0	0	0	114.9
86	D	29.4	Very low	27.6	Very low	157 Å²	157	147 Å²	147	84%	0.84	77%	0.773	S	S	*	*			trans	-158.4	174	145.3	-134	-33.5	0	0	0	114.1
87	I	27.1	Very low	27.7	Very low	144 Å²	144	148.2 Å²	148.2	74%	0.738	78%	0.779	S	S	*	*			trans	-107.7	145.1	-162.1	-64.5	159.2	0	0	0	113.9
88	R	30	Very low	27.8	Very low	250 Å²	250	146.3 Å²	146.3	94%	0.943	78%	0.777	S	S	*	*			trans	-169.8	168.2	140.8	-103.9	155.7	-158.7	-150.8	2.3	112.8
89	A	25.5	Very low	27.7	Very low	93 Å²	93	148.2 Å²	148.2	77%	0.769	79%	0.786	S	S	*	*			trans	-140.9	178.8	-159.4	0	0	0	0	0	114.4
90	S	24.5	Very low	27.8	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	78%	0.778	S	S	*	*			trans	100.8	143.4	153.9	96.8	0	0	0	0	121.3
91	D	27.4	Very low	28.1	Very low	134 Å²	134	145.5 Å²	145.5	72%	0.717	79%	0.786	S	S	*	*			trans	75.3	102	148.4	-49.8	-37	0	0	0	123.9
92	S	27.4	Very low	28.2	Very low	123 Å²	123	144.1 Å²	144.1	86%	0.86	79%	0.786	S	S	*	*			trans	78	152.1	131.1	76.7	0	0	0	0	120.2
93	A	26.8	Very low	28.6	Very low	93 Å²	93	141.5 Å²	141.5	77%	0.769	79%	0.787	S	S	*	*			trans	-137	-173.2	-178.6	0	0	0	0	0	108.5
94	P	33.5	Very low	28.6	Very low	114 Å²	114	146.3 Å²	146.3	74%	0.74	80%	0.796	S	S	*	*			cis	-128.6	178.2	-14.4	36.8	-20.1	0	0	0	113.1
95	L	27.4	Very low	28.8	Very low	150 Å²	150	144.5 Å²	144.5	79%	0.785	80%	0.795	S	S	*	*				167.8	133.5	127	-90.2	162.5	0	0	0	114.3
96	R	26.3	Very low	28.5	Very low	223 Å²	223	147.8 Å²	147.8	84%	0.842	81%	0.806	S	S	*	*			trans	38	115.1	153.3	-64.1	-178.3	-178.9	-167.3	0.5	120.7
97	P	29.9	Very low	28.5	Very low	127 Å²	127	149.9 Å²	149.9	83%	0.825	81%	0.808	S	S	*	*			trans	-84.1	158.7	160.7	36.2	-34.3	0	0	0	112.5
98	P	30.7	Very low	28.7	Very low	116 Å²	116	148.2 Å²	148.2	75%	0.753	82%	0.816	S	S	*	*			trans	-137.5	127.3	141.1	34.5	-20.4	0	0	0	114.7
99	V	26.6	Very low	28.7	Very low	151 Å²	151	140.9 Å²	140.9	92%	0.915	81%	0.809	S	S	*	*			trans	45.7	116.5	138.1	-172	0	0	0	0	119.4
100	G	30.1	Very low	28.7	Very low	64 Å²	64	141.5 Å²	141.5	66%	0.66	81%	0.807	S	S	*	*			trans	164.2	71.8	148.5	0	0	0	0	0	121.7
101	R	30.1	Very low	28.9	Very low	250 Å²	250	142.6 Å²	142.6	94%	0.943	82%	0.815	S	S	*	*			trans	63.7	159.8	149.2	-67.5	178.2	-175.5	162.1	1.8	118.4
102	D	29.6	Very low	28.9	Very low	140 Å²	140	139.4 Å²	139.4	75%	0.749	81%	0.814	S	S	*	*			cis	-158.1	159.9	-33.4	-167	5.8	0	0	0	107.6	R104	D102-R104 PolarHBondContact O-N 3.4Å
103	I	31.7	Very low	28.9	Very low	158 Å²	158	138.7 Å²	138.7	81%	0.81	81%	0.809	S	S	*	*			trans	-80.6	102.4	-173.1	-64.9	176.5	0	0	0	111.3
104	R	25.9	Very low	28.9	Very low	227 Å²	227	140.5 Å²	140.5	86%	0.857	81%	0.805	S	S	*	*			trans	-163	158.7	158.4	-101.9	138.9	-175.8	177.4	2.2	111.3	D102	D102-R104 PolarHBondContact O-N 3.4Å
105	S	28.2	Very low	28.7	Very low	113 Å²	113	141 Å²	141	79%	0.79	81%	0.812	S	S	*	*			trans	63.4	79.5	178.3	59	0	0	0	0	118.7
106	L	30.8	Very low	28.9	Very low	176 Å²	176	137.3 Å²	137.3	92%	0.921	80%	0.799	S	S	*	*			trans	-132.7	50.2	150.3	-91	178	0	0	0	111.3
107	F	29.8	Very low	29.1	Very low	202 Å²	202	135.1 Å²	135.1	89%	0.886	80%	0.795	S	S	*	*	S	Bend	trans	-140.5	125.1	169.1	-82.9	-78	0	0	0	109.1
108	A	30.7	Very low	28.9	Very low	108 Å²	108	138.2 Å²	138.2	89%	0.893	80%	0.795	S	S	*	*			trans	62	145.4	-180	0	0	0	0	0	115.9
109	A	29.5	Very low	28.7	Very low	97 Å²	97	142.8 Å²	142.8	80%	0.802	80%	0.798	S	S	*	*			cis	-148.8	153.9	-15.5	0	0	0	0	0	111.7
110	S	26.6	Very low	28.7	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	78%	0.783	S	S	*	*			trans	-59.6	154.4	168.6	43.9	0	0	0	0	114.7
111	S	27.8	Very low	28.6	Very low	123 Å²	123	144.9 Å²	144.9	86%	0.86	78%	0.778	S	S	*	*				167.6	155.7	122.5	-77.5	0	0	0	0	114.8
112	G	28.3	Very low	28.5	Very low	67 Å²	67	140.5 Å²	140.5	69%	0.691	77%	0.77	S	S	*	*			trans	98.9	101.8	168.3	0	0	0	0	0	113.9
113	S	27.8	Very low	28.4	Very low	107 Å²	107	141 Å²	141	75%	0.748	77%	0.766	S	S	*	*				73.5	144.3	50.9	97.8	0	0	0	0	113
114	N	26.6	Very low	28.2	Very low	131 Å²	131	138.4 Å²	138.4	70%	0.701	75%	0.754	S	S	*	*			cis	-165.3	140.9	29.4	-140.5	-41.5	0	0	0	112.8
115	S	29.5	Very low	28.3	Very low	125 Å²	125	134.7 Å²	134.7	87%	0.874	75%	0.75	S	S	*	*			trans	-152.6	104.4	154.4	53.8	0	0	0	0	112.3
116	S	30	Very low	28.1	Very low	73 Å²	73	133.7 Å²	133.7	51%	0.51	74%	0.743	S	S	.	*			trans	-101.5	176.4	177.9	43.6	0	0	0	0	110.5
117	K	30.9	Very low	28	Very low	177 Å²	177	131.4 Å²	131.4	77%	0.77	74%	0.736	S	S	*	*			cis	-120.2	-148.3	9.6	-64.6	75	-170.7	140.1	0	107.8
118	K	26.5	Very low	28.1	Very low	191 Å²	191	128.4 Å²	128.4	83%	0.83	73%	0.729	S	S	*	*			cis	-166.5	172.9	4.9	-122.5	165.3	-176.7	177	0	102.9
119	R	26.6	Very low	28.4	Very low	212 Å²	212	128.8 Å²	128.8	80%	0.8	72%	0.722	S	S	*	*			cis	-177	159.8	-17.9	-127.1	-162.1	68.1	159	0.2	102.4
120	K	27	Very low	28.3	Very low	140 Å²	140	131 Å²	131	61%	0.609	72%	0.721	S	S	*	*			cis	-178.6	147.9	-21.4	-120.3	-157.4	-178.6	-127.3	0	103
121	E	26.2	Very low	28.6	Very low	119 Å²	119	132.2 Å²	132.2	56%	0.556	72%	0.718	S	S	*	*			cis	-173.1	177.5	-2.4	-151.6	160.1	-117.1	0	0	108.3
122	M	27.9	Very low	28.4	Very low	158 Å²	158	133.1 Å²	133.1	78%	0.778	71%	0.714	S	S	*	*			trans	67.7	158.6	157.2	-80.6	172.5	-179.3	0	0	118.4
123	K	28.1	Very low	28.5	Very low	152 Å²	152	137.2 Å²	137.2	66%	0.661	72%	0.72	S	S	*	*			cis	-164	167.1	-29.5	-132.7	-172	150.2	-133.8	0	109.4
124	D	27.3	Very low	28.4	Very low	103 Å²	103	138.6 Å²	138.6	55%	0.551	72%	0.718	S	S	*	*			trans	54.7	134.9	148.5	-62.1	-8.9	0	0	0	123.1
125	L	29.1	Very low	28.3	Very low	148 Å²	148	140.1 Å²	140.1	78%	0.775	73%	0.725	S	S	*	*			trans	46.4	126.5	133.4	-50.1	170.5	0	0	0	119.9
126	S	24	Very low	28.2	Very low	92 Å²	92	138.7 Å²	138.7	64%	0.643	72%	0.721	S	S	*	*			cis	79.9	135.1	28.6	89.4	0	0	0	0	117.3
127	V	29.1	Very low	28	Very low	129 Å²	129	143.7 Å²	143.7	78%	0.782	74%	0.736	S	S	*	*			trans	83.3	136.4	168.3	-166.1	0	0	0	0	116
128	D	30.7	Very low	27.8	Very low	139 Å²	139	142.3 Å²	142.3	74%	0.743	74%	0.736	S	S	*	*			trans	-53	-174.6	165.3	-50.2	-97.1	0	0	0	113.4
129	P	37.4	Very low	27.7	Very low	115 Å²	115	141 Å²	141	75%	0.747	73%	0.733	S	S	*	*				-143.3	137.5	96.6	36.6	-23	0	0	0	114.7
130	N	28.3	Very low	27.5	Very low	145 Å²	145	136.3 Å²	136.3	78%	0.775	73%	0.733	S	S	*	*			trans	63.2	147.8	139.9	-84.1	18.7	0	0	0	119.1
131	L	31.9	Very low	27.5	Very low	130 Å²	130	135.2 Å²	135.2	68%	0.681	74%	0.743	S	S	*	*			cis	-154.1	161.3	0.6	-179.4	58.4	0	0	0	107.9	D133	L131-D133 PolarHBondContact O-N 3.45Å
132	D	24.4	Very low	28.1	Very low	142 Å²	142	136.2 Å²	136.2	76%	0.759	76%	0.757	S	S	*	*			trans	-41.5	128	165.6	-49.3	-74.6	0	0	0	112.6
133	D	28.8	Very low	28.1	Very low	153 Å²	153	134.4 Å²	134.4	82%	0.818	76%	0.755	S	S	*	*				-146.2	149.7	125	-127.4	-27.6	0	0	0	113.2	L131	L131-D133 PolarHBondContact O-N 3.45Å
134	L	26.5	Very low	28	Very low	137 Å²	137	135.5 Å²	135.5	72%	0.717	76%	0.763	S	S	*	*			trans	-70.4	153.6	-163.1	-74.4	151	0	0	0	116.3
135	L	25.3	Very low	28	Very low	163 Å²	163	136.2 Å²	136.2	85%	0.853	77%	0.773	S	S	*	*			trans	72.9	156.9	142.5	-71.2	162.8	0	0	0	120.9
136	A	26.4	Very low	27.8	Very low	95 Å²	95	137.8 Å²	137.8	79%	0.785	77%	0.773	S	S	*	*			trans	76.4	135.3	158.8	0	0	0	0	0	119.9
137	E	25	Very low	28	Very low	178 Å²	178	138.3 Å²	138.3	83%	0.832	77%	0.774	S	S	*	*			trans	-56	139.7	169.5	-53.4	152.1	127.2	0	0	111.9
138	L	26.7	Very low	28	Very low	147 Å²	147	139.8 Å²	139.8	77%	0.77	77%	0.772	S	S	*	*				171.7	127.1	110.4	-90.3	155.4	0	0	0	114
139	E	24.3	Very low	27.8	Very low	163 Å²	163	140.9 Å²	140.9	76%	0.762	77%	0.773	S	S	*	*			trans	38	115.6	138.6	-69.5	-178.5	168.8	0	0	123.2
140	S	23.9	Very low	27.4	Very low	114 Å²	114	144.7 Å²	144.7	80%	0.797	78%	0.78	S	S	*	*				84.5	145.7	124	83.3	0	0	0	0	121
141	S	26.7	Very low	27.4	Very low	118 Å²	118	144.8 Å²	144.8	83%	0.825	78%	0.781	S	S	*	*			trans	-155.7	83.5	154.5	43.9	0	0	0	0	110.6
142	V	38.1	Very low	27.5	Very low	139 Å²	139	142.7 Å²	142.7	84%	0.842	78%	0.775	S	S	*	*			trans	-137.4	113.4	168.7	-175.4	0	0	0	0	110.2
143	T	27.7	Very low	27.5	Very low	120 Å²	120	142.7 Å²	142.7	74%	0.736	78%	0.775	S	S	*	*			trans	-155.2	157.9	162.8	20.2	0	0	0	0	106.2
144	E	26.3	Very low	27.4	Very low	176 Å²	176	141.5 Å²	141.5	82%	0.822	77%	0.769	S	S	*	*			cis	-126.9	173.8	25.1	-72.4	-170.1	141.6	0	0	112
145	P	28.1	Very low	27.4	Very low	117 Å²	117	142.6 Å²	142.6	76%	0.76	77%	0.774	S	S	*	*			cis	-126.7	178.3	8.7	40.4	-24.1	0	0	0	116.3
146	K	23.2	Very low	27.4	Very low	182 Å²	182	139.7 Å²	139.7	79%	0.791	77%	0.768	S	S	*	*			trans	-96	179.4	176.4	-50.3	176.9	-178.9	173	0	110.1
147	P	29.9	Very low	27.3	Very low	102 Å²	102	145.7 Å²	145.7	66%	0.662	77%	0.77	S	S	*	*			cis	-140.9	178.3	1.7	44.1	-26.5	0	0	0	117.9
148	H	27.9	Very low	27.3	Very low	160 Å²	160	145.9 Å²	145.9	74%	0.741	77%	0.768	S	S	*	*			trans	73.2	121.5	154.3	-65.7	-55.8	0	0	0	123.7
149	H	26.8	Very low	27.2	Very low	162 Å²	162	143.5 Å²	143.5	75%	0.75	76%	0.764	S	S	*	*			trans	17.2	126.3	148.8	-53.3	-72.5	0	0	0	122.2
150	H	29.2	Very low	27.3	Very low	196 Å²	196	145.4 Å²	145.4	91%	0.907	77%	0.77	S	S	*	*				-158.5	-172.4	103.6	-116.1	-77.8	0	0	0	112.7
151	N	27.7	Very low	27.4	Very low	146 Å²	146	145.6 Å²	145.6	78%	0.781	77%	0.766	S	S	*	*			trans	-115.9	-167.5	-159.4	-148.7	29.6	0	0	0	111.6
152	P	34.4	Very low	27.4	Very low	87 Å²	87	144.8 Å²	144.8	57%	0.565	77%	0.767	S	S	*	*				-128.9	-166.6	-100.1	44	-27.6	0	0	0	116.5
153	D	25.1	Very low	26.8	Very low	141 Å²	141	142.8 Å²	142.8	75%	0.754	76%	0.759	S	S	*	*			trans	88.7	135.9	146.6	-71.4	-19.2	0	0	0	124.9
154	N	27	Very low	26.9	Very low	129 Å²	129	146.9 Å²	146.9	69%	0.69	77%	0.766	S	S	*	*			trans	70.6	113.6	145.8	-84.4	-49.7	0	0	0	124.7
155	L	26.2	Very low	26.8	Very low	159 Å²	159	149.9 Å²	149.9	83%	0.832	77%	0.77	S	S	*	*				38.5	139.8	126	-68.6	173.6	0	0	0	123
156	S	24.7	Very low	27	Very low	103 Å²	103	151.9 Å²	151.9	72%	0.72	77%	0.774	S	S	*	*			trans	96.5	117.8	147.3	-158.4	0	0	0	0	120.4
157	R	25.1	Very low	27.2	Very low	221 Å²	221	148 Å²	148	83%	0.834	77%	0.77	S	S	*	*			trans	50	125.3	144	-72.9	179.5	170.4	169.5	-0.2	121.9
158	K	23.9	Very low	27.2	Very low	182 Å²	182	146.7 Å²	146.7	79%	0.791	78%	0.775	S	S	*	*			trans	72.5	95.4	136.2	-69.2	-174.4	175.5	-172.7	0	119.8
159	S	24.2	Very low	27.3	Very low	97 Å²	97	146 Å²	146	68%	0.678	78%	0.782	S	S	*	*				51.2	114.6	120	66.1	0	0	0	0	121.4
160	F	26.2	Very low	27.4	Very low	203 Å²	203	147.2 Å²	147.2	89%	0.89	79%	0.787	S	S	*	*			trans	81.3	156.8	132.5	-101.8	-88.3	0	0	0	121.8
161	V	27.2	Very low	27.4	Very low	118 Å²	118	141.1 Å²	141.1	72%	0.715	78%	0.778	S	S	*	*			trans	81.1	115.8	162.2	-153.9	0	0	0	0	119.6	S163	V161-S163 WeakPolarHBondContact CG1-OG 3.43Å
162	A	26.6	Very low	27.2	Very low	101 Å²	101	142 Å²	142	84%	0.835	78%	0.782	S	S	*	*			trans	-141.8	148.6	132.6	0	0	0	0	0	109.4
163	S	25.3	Very low	26.9	Very low	97 Å²	97	144 Å²	144	68%	0.678	79%	0.793	S	S	*	*			cis	152.2	99.8	-29.7	-92.1	0	0	0	0	108.8	V161	V161-S163 WeakPolarHBondContact CG1-OG 3.43Å
164	K	30.5	Very low	26.8	Very low	206 Å²	206	143 Å²	143	90%	0.896	79%	0.792	S	S	*	*			trans	-165.6	104.7	163.8	-99.1	164.1	-175.1	178.2	0	105.5
165	R	24.3	Very low	26.7	Very low	238 Å²	238	144.2 Å²	144.2	90%	0.898	80%	0.798	S	S	*	*				78.3	129.6	58.6	-76.8	-167.8	166	178.7	-3.1	114.3
166	N	30.9	Very low	26.7	Very low	159 Å²	159	142.8 Å²	142.8	85%	0.85	80%	0.796	S	S	*	*			trans	92.3	148	-175.3	-72.1	10.7	0	0	0	116.3
167	S	28.7	Very low	26.8	Very low	101 Å²	101	143.6 Å²	143.6	71%	0.706	80%	0.799	S	S	*	*			cis	-179	135.6	-30.5	49.1	0	0	0	0	109.7
168	G	29.2	Very low	27.2	Very low	74 Å²	74	139.4 Å²	139.4	76%	0.763	80%	0.798	S	S	*	*			trans	87.2	149.7	-178.9	0	0	0	0	0	113.4
169	V	29.4	Very low	27.3	Very low	145 Å²	145	136 Å²	136	88%	0.879	80%	0.795	S	S	*	*			cis	-137	166	3.5	176.6	0	0	0	0	109.6
170	H	29.6	Very low	27.3	Very low	188 Å²	188	138.4 Å²	138.4	87%	0.87	80%	0.799	S	S	*	*			trans	-66.6	174.5	173.9	-48.1	-24.8	0	0	0	112.4
171	G	28.9	Very low	27.2	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	79%	0.794	S	S	*	*			cis	-176	-167.3	8.6	0	0	0	0	0	113.2
172	N	24.4	Very low	27.2	Very low	163 Å²	163	142.1 Å²	142.1	87%	0.872	80%	0.799	S	S	*	*			trans	-77.4	167.9	-171.1	-66.3	-25	0	0	0	115.2
173	V	26.6	Very low	27.2	Very low	131 Å²	131	147.5 Å²	147.5	79%	0.794	80%	0.798	S	S	*	*			trans	133.8	100.8	136.2	175	0	0	0	0	115
174	V	23.9	Very low	27.2	Very low	120 Å²	120	147.8 Å²	147.8	73%	0.727	80%	0.8	S	S	*	*			trans	64.9	146.1	135.6	175.8	0	0	0	0	121.3
175	N	24.9	Very low	27.3	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	79%	0.794	S	S	*	*			trans	82.8	147.7	167.2	-73.5	-18	0	0	0	120.9
176	T	25.2	Very low	27.5	Very low	129 Å²	129	139.2 Å²	139.2	79%	0.791	78%	0.784	S	S	*	*			trans	-74.4	173.6	168.7	45	0	0	0	0	111.2
177	P	26.8	Very low	27.4	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	78%	0.775	S	S	*	*			cis	-133.1	-173.7	12.1	41.4	-22.9	0	0	0	116.1
178	T	34.8	Very low	27.5	Very low	132 Å²	132	140 Å²	140	81%	0.81	77%	0.771	S	S	*	*			trans	-73.1	153.7	170.6	38.9	0	0	0	0	112.9
179	P	25.8	Very low	27.5	Very low	112 Å²	112	142.3 Å²	142.3	73%	0.727	76%	0.763	S	S	*	*				-154.7	143.8	105.9	37.5	-18.4	0	0	0	119.2
180	L	23	Very low	27.5	Very low	146 Å²	146	143.2 Å²	143.2	76%	0.764	76%	0.757	S	S	*	*			trans	55.9	113	132	-61.2	170.4	0	0	0	124.9
181	K	25.2	Very low	27.7	Very low	181 Å²	181	139.7 Å²	139.7	79%	0.787	75%	0.751	S	S	*	*				47.4	133.8	118.4	-65.4	-173.3	-179.9	-179.6	0	122.9
182	R	26.8	Very low	27.5	Very low	218 Å²	218	143.2 Å²	143.2	82%	0.823	75%	0.752	S	S	*	*			trans	-131.6	145.7	131.7	-74.8	-175	174.6	-175.8	-0.5	107.7
183	R	27.4	Very low	27.7	Very low	214 Å²	214	144 Å²	144	81%	0.808	75%	0.75	S	S	*	*			cis	-150.3	152.9	-2.4	-116.8	172.4	-179.7	-177.2	-3.2	109.5
184	S	24	Very low	27.5	Very low	103 Å²	103	143.9 Å²	143.9	72%	0.72	75%	0.75	S	S	*	*			trans	-104.8	-161.8	166.8	-46	0	0	0	0	109.2
185	P	34.5	Very low	27.7	Very low	117 Å²	117	143.5 Å²	143.5	76%	0.76	75%	0.75	S	S	*	*			cis	-139.3	-165.8	40.3	45.2	-25.6	0	0	0	113.8
186	E	28.1	Very low	27.6	Very low	147 Å²	147	142.1 Å²	142.1	69%	0.687	75%	0.752	S	S	*	*			cis	-115.9	-153.2	-14.5	-66.2	-173.2	43.9	0	0	108.5
187	R	28	Very low	27.6	Very low	180 Å²	180	139.4 Å²	139.4	68%	0.679	75%	0.75	S	S	*	*			cis	-145.4	155	-13	-164.2	168.1	177.5	88.8	13.4	111.3	E189	R187-E189 IonicContact CZ-OE1 3.55Å; R187-E189 IonicContact NE-OE1 3.65Å; R187-E189 IonicContact NH2-OE1 2.73Å; R187-E189 PolarHBondContact NH2-OE1 2.9Å
188	P	30.6	Very low	27.4	Very low	96 Å²	96	139 Å²	139	62%	0.623	75%	0.75	S	S	*	*			trans	-103.5	-162.8	176.9	21.2	1.9	0	0	0	112.6
189	E	29.7	Very low	26.9	Very low	124 Å²	124	143.6 Å²	143.6	58%	0.579	75%	0.752	S	S	*	*			cis	-169.6	161.4	43.8	-65.8	157.9	-117.4	0	0	110.7	R187	R187-E189 IonicContact CZ-OE1 3.55Å; R187-E189 IonicContact NE-OE1 3.65Å; R187-E189 IonicContact NH2-OE1 2.73Å; R187-E189 PolarHBondContact NH2-OE1 2.9Å
190	Q	28.4	Very low	26.8	Very low	163 Å²	163	145.9 Å²	145.9	76%	0.762	76%	0.758	S	S	*	*			cis	-165.9	148.5	-22.1	-97.3	-177.1	109.4	0	0	109.6
191	P	34.7	Very low	26.8	Very low	115 Å²	115	150.3 Å²	150.3	75%	0.747	76%	0.764	S	S	*	*			trans	-107.8	-177.7	174.3	40.7	-33.7	0	0	0	114.2
192	I	24.2	Very low	27.4	Very low	142 Å²	142	149.3 Å²	149.3	73%	0.728	77%	0.767	S	S	*	*			trans	154.6	124.8	142.7	-80.5	153.7	0	0	0	113.3
193	H	29.1	Very low	27.5	Very low	181 Å²	181	144.7 Å²	144.7	84%	0.838	77%	0.765	S	S	*	*				172.6	150.6	127.2	-101.2	-69.3	0	0	0	113.6
194	T	22.2	Very low	27.4	Very low	127 Å²	127	141.9 Å²	141.9	78%	0.779	77%	0.765	S	S	*	*			trans	-128.1	173.7	175.7	55.6	0	0	0	0	108.8
195	P	29	Very low	27.5	Very low	112 Å²	112	143.2 Å²	143.2	73%	0.727	77%	0.769	S	S	*	*			cis	-143.1	-170.4	15.7	44.8	-24.4	0	0	0	117.6
196	S	22.7	Very low	27.1	Very low	125 Å²	125	142.4 Å²	142.4	87%	0.874	77%	0.766	S	S	*	*			trans	-2.7	136.7	158	-48.2	0	0	0	0	122
197	G	24.3	Very low	26.9	Very low	72 Å²	72	141.9 Å²	141.9	74%	0.742	76%	0.763	S	S	*	*			trans	164.1	75.5	158.6	0	0	0	0	0	119.9
198	S	23.4	Very low	26.7	Very low	112 Å²	112	140.9 Å²	140.9	78%	0.783	76%	0.764	S	S	*	*			trans	26.9	127.3	152.9	62.1	0	0	0	0	123.7
199	R	23.5	Very low	26.3	Very low	228 Å²	228	143.5 Å²	143.5	86%	0.86	77%	0.766	S	S	*	*			trans	74.9	103.2	146.4	-68.2	-177.2	175.2	-175.3	-0.5	121.5
200	L	24.4	Very low	26.1	Very low	160 Å²	160	146.3 Å²	146.3	84%	0.838	78%	0.778	S	S	*	*				48.1	121.2	118.4	-64	166.2	0	0	0	120.8
201	R	21.8	Very low	25.8	Very low	239 Å²	239	142.9 Å²	142.9	90%	0.902	77%	0.772	S	S	*	*				-175.3	156.8	105.4	-104.6	176.8	178.8	-175.3	-0.4	115
202	L	39.4	Very low	25.1	Very low	161 Å²	161	142.3 Å²	142.3	84%	0.843	77%	0.771	S	S	*	*			trans	-81.9	149.6	163.6	-54.4	105.4	0	0	0	111.4
203	P	28.5	Very low	25	Very low	120 Å²	120	144 Å²	144	78%	0.779	78%	0.775	S	S	*	*			trans	-136.5	155.5	154.2	27.2	-7.8	0	0	0	114
204	L	24.1	Very low	24.7	Very low	155 Å²	155	141.2 Å²	141.2	81%	0.812	77%	0.772	S	S	*	*			cis	-164.1	-168.6	-18.7	-148.5	78.3	0	0	0	109.9
205	V	26.9	Very low	25.1	Very low	132 Å²	132	140.1 Å²	140.1	80%	0.8	77%	0.767	S	S	*	*			trans	81.2	124.4	-176.2	-176.8	0	0	0	0	111.9
206	S	25.8	Very low	24.8	Very low	100 Å²	100	142.1 Å²	142.1	70%	0.699	77%	0.771	S	S	*	*			cis	-170.2	150.8	-11	49.2	0	0	0	0	109.3
207	E	24.5	Very low	24.7	Very low	136 Å²	136	142 Å²	142	64%	0.636	76%	0.76	S	S	*	*			cis	-169.6	165.4	-15.9	-122.2	-153	110.1	0	0	109.1
208	K	24	Very low	24.6	Very low	159 Å²	159	144.1 Å²	144.1	69%	0.691	75%	0.75	S	S	*	*			trans	63.5	149.5	153.3	-72.8	160.2	177	138.8	0	119.1
209	K	21.3	Very low	24.5	Very low	151 Å²	151	149.3 Å²	149.3	66%	0.657	75%	0.753	S	S	*	*			cis	-173.5	153.9	-27	-136.2	-179.1	173.9	-167.3	0	109.8
210	H	25.7	Very low	24.5	Very low	183 Å²	183	143 Å²	143	85%	0.847	74%	0.744	S	S	*	*			trans	62.6	178.9	159	-64.6	-44.5	0	0	0	118.6
211	S	21.3	Very low	24.6	Very low	90 Å²	90	145.6 Å²	145.6	63%	0.629	74%	0.742	S	S	*	*				-168	138.2	-70.6	56.6	0	0	0	0	112.9
212	S	21.7	Very low	25.2	Very low	103 Å²	103	141.4 Å²	141.4	72%	0.72	74%	0.738	S	S	*	*			trans	55.1	142.6	149.9	62.9	0	0	0	0	123
213	Q	21.7	Very low	24.7	Very low	177 Å²	177	138.8 Å²	138.8	83%	0.827	73%	0.731	S	S	*	*			trans	78.6	109.1	159.2	-70.7	179.7	0.7	0	0	119.9
214	T	23.2	Very low	24.6	Very low	124 Å²	124	142 Å²	142	76%	0.761	73%	0.733	S	S	*	*				21.9	155.6	117.9	51.3	0	0	0	0	121.4
215	P	31	Very low	24.6	Very low	103 Å²	103	138.5 Å²	138.5	67%	0.669	72%	0.721	S	S	*	*			cis	-136.1	-165.6	0.2	31.1	-7.3	0	0	0	114.1
216	L	20.7	Very low	24.6	Very low	155 Å²	155	137.5 Å²	137.5	81%	0.812	72%	0.719	S	S	*	*			trans	72.9	122.5	140.5	-94.8	170.2	0	0	0	120.7
217	D	21.2	Very low	24.5	Very low	123 Å²	123	142.3 Å²	142.3	66%	0.658	72%	0.722	S	S	*	*				97.6	154.6	125.9	-149.3	18.7	0	0	0	120.1
218	Q	22.4	Very low	24.4	Very low	115 Å²	115	143.7 Å²	143.7	54%	0.537	73%	0.728	S	S	.	*			trans	61.2	99.5	158.4	-80.4	173.2	75.6	0	0	121
219	R	21.3	Very low	24.4	Very low	221 Å²	221	141.8 Å²	141.8	83%	0.834	73%	0.725	S	S	*	*				79.4	165.3	118.5	-70.1	167.5	171.3	166	-11.6	118.5
220	S	23.9	Very low	24.6	Very low	95 Å²	95	141 Å²	141	66%	0.664	73%	0.733	S	S	*	*			trans	107.4	79.1	141.5	-160.8	0	0	0	0	118
221	R	25.2	Very low	24.5	Very low	216 Å²	216	135.5 Å²	135.5	82%	0.815	73%	0.726	S	S	*	*				73.9	105.7	127.1	-69.7	171.8	174.4	164.6	-2.8	118.2	P223	R221-P223 WeakPolarHBondContact O-CD 3.39Å
222	N	34.9	Very low	24.7	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	73%	0.734	S	S	*	*				-46.8	134.6	118.9	-61.5	-0.8	0	0	0	110.3
223	P	28.4	Very low	24.6	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	74%	0.737	S	S	*	*			trans	-95.2	110.2	153.8	-2.7	23.4	0	0	0	109.5	R221	R221-P223 WeakPolarHBondContact O-CD 3.39Å
224	F	26.5	Very low	24.9	Very low	187 Å²	187	136.4 Å²	136.4	82%	0.82	73%	0.725	S	S	*	*			trans	70.2	129.3	169.3	-62.1	-91.1	0	0	0	116.9
225	S	24.4	Very low	24.9	Very low	82 Å²	82	138.8 Å²	138.8	57%	0.573	73%	0.725	S	S	*	*			cis	79	135	29.7	-161.5	0	0	0	0	112.2
226	C	26.3	Very low	24.5	Very low	111 Å²	111	141.1 Å²	141.1	75%	0.75	73%	0.729	S	S	*	*			cis	-116.6	150.5	23.9	-68.7	0	0	0	0	114.2
227	R	23.7	Very low	24.6	Very low	201 Å²	201	142.4 Å²	142.4	76%	0.758	73%	0.728	S	S	*	*			cis	73.3	112.1	49.4	-142.2	-174.6	-174.9	170.9	-0.1	110.6
228	E	22.9	Very low	24.7	Very low	164 Å²	164	144 Å²	144	77%	0.766	73%	0.731	S	S	*	*			cis	79.4	155.1	21.4	-149	-165.1	-135	0	0	115.9
229	L	24.4	Very low	24.7	Very low	120 Å²	120	144.1 Å²	144.1	63%	0.628	75%	0.745	S	S	*	*			trans	80.7	150.3	167.5	-49.5	176.9	0	0	0	116.4
230	T	24.6	Very low	24.8	Very low	135 Å²	135	143.1 Å²	143.1	83%	0.828	75%	0.746	S	S	*	*			cis	-157.8	164.8	7.6	-11.8	0	0	0	0	112.3
231	G	24.8	Very low	25	Very low	67 Å²	67	144 Å²	144	69%	0.691	75%	0.749	S	S	*	*			trans	-178	40.4	170.8	0	0	0	0	0	121.2
232	T	24.5	Very low	24.9	Very low	131 Å²	131	142 Å²	142	80%	0.804	75%	0.749	S	S	*	*			trans	32.4	116.5	157.2	53.9	0	0	0	0	120.6
233	E	21.4	Very low	24.4	Very low	169 Å²	169	140.9 Å²	140.9	79%	0.79	75%	0.748	S	S	*	*				54.8	149.1	62.8	-107.3	-145.2	-116.1	0	0	115.8
234	P	27.3	Very low	24	Very low	88 Å²	88	142.2 Å²	142.2	57%	0.571	75%	0.754	S	S	*	*			cis	-155.2	174.3	41	44.5	-23.2	0	0	0	122
235	K	23.4	Very low	23.8	Very low	174 Å²	174	136.5 Å²	136.5	76%	0.757	75%	0.748	S	S	*	*			trans	66	133	155.3	-65.8	145.7	-168.1	169.3	0	119.7
236	M	21.7	Very low	23.7	Very low	152 Å²	152	137.5 Å²	137.5	75%	0.749	76%	0.761	S	S	*	*			cis	81	135.3	39.1	-62.5	-169.5	84.8	0	0	115.1
237	K	23.8	Very low	23.6	Very low	183 Å²	183	140.1 Å²	140.1	80%	0.796	77%	0.766	S	S	*	*			cis	-151.6	155.6	38.5	-65.8	174.8	178.2	178.5	0	115.5
238	H	23.3	Very low	23.5	Very low	157 Å²	157	135.4 Å²	135.4	73%	0.727	76%	0.764	S	S	*	*			trans	27.2	152.5	140.7	-54	-55.3	0	0	0	123.4
239	S	22	Very low	23.9	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	77%	0.767	S	S	*	*			cis	-156.5	168.3	16.8	32.2	0	0	0	0	115.4
240	K	22.5	Very low	24.1	Very low	199 Å²	199	134.2 Å²	134.2	87%	0.865	77%	0.768	S	S	*	*			trans	-42.7	168.7	172.3	-63.4	-177.8	174	-177	0	117.2
241	P	28.9	Very low	23.9	Very low	113 Å²	113	133.2 Å²	133.2	73%	0.734	76%	0.762	S	S	*	*			cis	-137.8	-152.9	13.5	43.3	-22.5	0	0	0	116.7
242	Q	23.9	Very low	23.9	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	76%	0.763	S	S	*	*			trans	-40.1	161.9	178.3	-62.2	159	-77.4	0	0	119.4
243	V	23	Very low	23.8	Very low	127 Å²	127	139.8 Å²	139.8	77%	0.77	77%	0.765	S	S	*	*			trans	165.6	104.7	135.7	149.3	0	0	0	0	110.2
244	T	21.3	Very low	23.9	Very low	135 Å²	135	134.9 Å²	134.9	83%	0.828	75%	0.754	S	S	*	*				59.9	146.1	106.9	77.4	0	0	0	0	119.7
245	G	21.8	Very low	23.6	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	77%	0.769	S	S	*	*			trans	96.9	136.6	170.6	0	0	0	0	0	112.9
246	A	23	Very low	23.7	Very low	102 Å²	102	133.8 Å²	133.8	84%	0.843	76%	0.764	S	S	*	*			cis	58	97.1	7	0	0	0	0	0	115.4
247	I	24	Very low	23.8	Very low	167 Å²	167	134.9 Å²	134.9	86%	0.856	77%	0.769	S	S	*	*			trans	-124.3	141.8	161.6	-67.8	176.5	0	0	0	106.7
248	S	21.4	Very low	23.9	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	77%	0.768	S	S	*	*			trans	-129.1	125.2	178.2	-55.8	0	0	0	0	110.1
249	L	30.9	Very low	24	Very low	162 Å²	162	129.8 Å²	129.8	85%	0.848	77%	0.769	S	S	*	*			trans	62.3	-175	156.1	-63	170.5	0	0	0	113.7
250	P	28	Very low	23.9	Very low	98 Å²	98	132.7 Å²	132.7	64%	0.636	77%	0.77	S	S	*	*			cis	-130.6	172.4	-3.9	41.3	-25.3	0	0	0	116.1
251	T	21.9	Very low	23.9	Very low	114 Å²	114	129.4 Å²	129.4	70%	0.699	77%	0.766	S	S	*	*			trans	56.8	151.3	149.1	45.3	0	0	0	0	119.5
252	E	23.1	Very low	23.6	Very low	154 Å²	154	130.7 Å²	130.7	72%	0.72	77%	0.767	S	S	*	*			cis	-155.9	160.5	11.5	-134.7	145.4	-128.8	0	0	110.1
253	E	22.5	Very low	23.5	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	76%	0.761	S	S	*	*			trans	48.3	148	149.8	-75.8	-178.4	-170.2	0	0	122.7
254	A	23.7	Very low	23.5	Very low	67 Å²	67	128 Å²	128	55%	0.554	75%	0.753	S	S	*	*			cis	-165.5	159.4	-8.6	0	0	0	0	0	111.8
255	T	22.1	Very low	23.6	Very low	146 Å²	146	128.1 Å²	128.1	90%	0.896	75%	0.748	S	S	*	*			trans	63.8	156.3	160.5	59.1	0	0	0	0	118.6
256	S	24.4	Very low	23.8	Very low	92 Å²	92	135.2 Å²	135.2	64%	0.643	76%	0.76	S	S	*	*			cis	-146.7	159.4	9.5	64.7	0	0	0	0	114
257	M	24	Very low	23.8	Very low	175 Å²	175	134.5 Å²	134.5	86%	0.862	75%	0.749	S	S	*	*			trans	66.9	144.2	157.8	-68.3	171.3	174	0	0	118.4
258	V	25.4	Very low	24	Very low	125 Å²	125	134.8 Å²	134.8	76%	0.758	75%	0.746	S	S	*	*			cis	-134.9	137.2	19.9	-136.5	0	0	0	0	113.9
259	S	25.2	Very low	24	Very low	108 Å²	108	137 Å²	137	76%	0.755	75%	0.75	S	S	*	*			trans	40.3	131.3	148	57	0	0	0	0	123.7
260	E	21.2	Very low	23.7	Very low	178 Å²	178	138.6 Å²	138.6	83%	0.832	75%	0.751	S	S	*	*			trans	-83.2	-167.3	155.2	-57.4	171.8	124.5	0	0	111.8
261	V	22.6	Very low	23.4	Very low	130 Å²	130	143.5 Å²	143.5	79%	0.788	77%	0.765	S	S	*	*			trans	63.9	138.6	176.9	-55.5	0	0	0	0	116.1
262	D	22.1	Very low	23.4	Very low	140 Å²	140	144.6 Å²	144.6	75%	0.749	76%	0.764	S	S	*	*			cis	-161.4	-168.7	-9.8	-119.8	-49.4	0	0	0	107.8
263	E	22.7	Very low	23.4	Very low	152 Å²	152	146.5 Å²	146.5	71%	0.71	77%	0.773	S	S	*	*			cis	-156.3	161.1	9.1	-141.1	-167.5	137.1	0	0	111
264	T	22.7	Very low	23.6	Very low	95 Å²	95	145.9 Å²	145.9	58%	0.583	77%	0.772	S	S	*	*			trans	64	136.3	151.5	54.5	0	0	0	0	125.1
265	N	23.2	Very low	23.6	Very low	137 Å²	137	149.3 Å²	149.3	73%	0.733	78%	0.78	S	S	*	*			trans	54.5	108.8	133.4	-56	-8.6	0	0	0	122.2
266	F	24.9	Very low	23.8	Very low	216 Å²	216	148.2 Å²	148.2	95%	0.947	78%	0.775	S	S	*	*				-139.5	143.1	106.3	-131.2	-89.7	0	0	0	109.6
267	S	23.8	Very low	23.9	Very low	86 Å²	86	152.9 Å²	152.9	60%	0.601	78%	0.784	S	S	*	*			trans	-132.3	-168.5	-172.1	57.2	0	0	0	0	111.3
268	E	27.6	Very low	24	Very low	173 Å²	173	149.7 Å²	149.7	81%	0.808	77%	0.77	S	S	*	*			trans	77	99.7	-174.1	-54	178.7	-174.1	0	0	111.9
269	D	22.9	Very low	24.1	Very low	147 Å²	147	151.1 Å²	151.1	79%	0.786	77%	0.772	S	S	*	*			cis	84.4	108.4	48.3	-64.3	-44.4	0	0	0	113.7
270	F	23.4	Very low	24.2	Very low	197 Å²	197	153.1 Å²	153.1	86%	0.864	77%	0.77	S	S	*	*			trans	-164.6	105.2	134.5	-135.3	-94.6	0	0	0	113.4
271	E	21	Very low	24.6	Very low	200 Å²	200	149.8 Å²	149.8	94%	0.935	76%	0.763	S	S	*	*			trans	-157.7	122.8	149.7	-133.8	173.9	-134.7	0	0	108.9
272	M	23.8	Very low	24.5	Very low	138 Å²	138	148 Å²	148	68%	0.68	76%	0.762	S	S	*	*			trans	-150.7	96	-175.5	-176.9	178.8	63	0	0	112
273	E	22.9	Very low	24.7	Very low	193 Å²	193	148.3 Å²	148.3	90%	0.902	77%	0.769	S	S	*	*			trans	-93.3	149.1	155.7	-73.1	-156.7	130.4	0	0	110.8
274	M	26.1	Very low	24.8	Very low	169 Å²	169	149.9 Å²	149.9	83%	0.833	78%	0.776	S	S	*	*			trans	-90	134	-169.2	-72	-164.2	171.1	0	0	114.2
275	I	22.6	Very low	25.5	Very low	139 Å²	139	150.9 Å²	150.9	71%	0.713	78%	0.784	S	S	*	*			trans	-106.6	123.8	176.6	-58.1	168.3	0	0	0	111	K277	I275-K277 HydrophobicContact CG2-CG 4.49Å; I275-K277 PolarHBondContact O-N 3.08Å
276	P	28.3	Very low	25.6	Very low	122 Å²	122	150.5 Å²	150.5	79%	0.792	79%	0.789	S	S	*	*			trans	-79.3	112.1	159.2	-8.9	26.6	0	0	0	110.4	N278	P276-N278 PolarHBondContact O-N 2.72Å
277	K	26	Very low	25.4	Very low	190 Å²	190	149.5 Å²	149.5	83%	0.826	78%	0.784	S	S	*	*			trans	-70.9	119.1	176.6	-69.3	175.6	-178	175.3	0	109.6	I275	I275-K277 HydrophobicContact CG2-CG 4.49Å; I275-K277 PolarHBondContact O-N 3.08Å
278	N	25.9	Very low	25.4	Very low	109 Å²	109	150.5 Å²	150.5	58%	0.583	79%	0.792	S	S	*	*				69.4	125.2	89.9	-175	29.3	0	0	0	115.1	P276	P276-N278 PolarHBondContact O-N 2.72Å
279	I	27.9	Very low	25.2	Very low	155 Å²	155	148 Å²	148	80%	0.795	79%	0.788	S	S	*	*				-178.6	96.9	128.1	-87.9	151.2	0	0	0	110.5
280	Q	26.1	Very low	25.1	Very low	150 Å²	150	146.5 Å²	146.5	70%	0.701	79%	0.789	S	S	*	*				19.5	164.7	118.8	-66.1	-173.7	19.1	0	0	121.8
281	P	29.2	Very low	25.2	Very low	108 Å²	108	141.2 Å²	141.2	70%	0.701	79%	0.79	S	S	*	*			cis	-147.3	-178	-39	42.5	-25.2	0	0	0	115.7
282	A	21.2	Very low	25.2	Very low	93 Å²	93	137.1 Å²	137.1	77%	0.769	78%	0.784	S	S	*	*			trans	66.7	130	143.3	0	0	0	0	0	123
283	V	27	Very low	25.3	Very low	146 Å²	146	137.8 Å²	137.8	89%	0.885	79%	0.79	S	S	*	*				-162.4	155.3	105.7	145.1	0	0	0	0	109
284	Q	23.9	Very low	25.4	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	78%	0.78	S	S	*	*			trans	-101.8	163.5	-171.6	-77.8	-171.5	7.2	0	0	114.8
285	P	38.2	Very low	25.2	Very low	116 Å²	116	134.9 Å²	134.9	75%	0.753	78%	0.776	S	S	*	*			trans	-102.8	172.2	-171.9	40.6	-36.8	0	0	0	114.8
286	P	24.5	Very low	25.3	Very low	129 Å²	129	133 Å²	133	84%	0.838	78%	0.776	S	S	*	*			trans	-117.6	176.4	157.8	34.1	-20.3	0	0	0	113.8
287	K	22	Very low	25	Very low	194 Å²	194	133.2 Å²	133.2	84%	0.843	78%	0.775	S	S	*	*			trans	-118.6	150.2	-168.5	-54.1	171.1	-178.3	175.2	0	112.9
288	S	23.3	Very low	25	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	77%	0.773	S	S	*	*			trans	61.5	155.7	148.1	59.4	0	0	0	0	118.3
289	T	22.3	Very low	24.9	Very low	119 Å²	119	129.6 Å²	129.6	73%	0.73	78%	0.777	S	S	*	*			cis	-155.6	155.2	14.7	-25.1	0	0	0	0	111.8
290	S	22.5	Very low	24.8	Very low	116 Å²	116	129.2 Å²	129.2	81%	0.811	78%	0.781	S	S	*	*			trans	47.7	122.7	149	60.9	0	0	0	0	122.3
291	G	24.4	Very low	24.7	Very low	86 Å²	86	127.8 Å²	127.8	89%	0.887	78%	0.783	S	S	*	*			trans	-178.9	128.3	158.5	0	0	0	0	0	111.7
292	S	22	Very low	24.5	Very low	115 Å²	115	127.1 Å²	127.1	80%	0.804	79%	0.786	S	S	*	*			trans	-127	144.1	-168.1	53	0	0	0	0	114.1
293	N	24.7	Very low	24.6	Very low	152 Å²	152	130.1 Å²	130.1	81%	0.813	79%	0.79	S	S	*	*			trans	-166.7	155.1	135.9	-122.4	-24.1	0	0	0	116.5
294	M	24.9	Very low	24.4	Very low	137 Å²	137	135.5 Å²	135.5	68%	0.675	79%	0.794	S	S	*	*			trans	31.8	114.9	157.8	-49.3	-147	77.3	0	0	120.2
295	Q	22.7	Very low	24.4	Very low	163 Å²	163	134.4 Å²	134.4	76%	0.762	79%	0.794	S	S	*	*				67.3	120	74.8	-68.8	-175.5	-5.7	0	0	114.5
296	S	23.4	Very low	23.7	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	80%	0.796	S	S	*	*				179.2	148.9	78.7	39.4	0	0	0	0	114.1
297	T	22.7	Very low	23.7	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	80%	0.799	S	S	*	*			trans	57.8	145.6	151.4	51.5	0	0	0	0	121
298	T	26.4	Very low	23.8	Very low	129 Å²	129	136.8 Å²	136.8	79%	0.791	80%	0.795	S	S	*	*			cis	-155.3	138	6.7	-5.9	0	0	0	0	114
299	S	23.1	Very low	23.8	Very low	94 Å²	94	138.9 Å²	138.9	66%	0.657	80%	0.798	S	S	*	*			trans	5.8	132.5	143.2	168.8	0	0	0	0	122.2
300	V	26.6	Very low	24	Very low	146 Å²	146	141.5 Å²	141.5	89%	0.885	81%	0.807	S	S	*	*				-138.1	152.9	121.2	179.4	0	0	0	0	109
301	T	23.5	Very low	24.1	Very low	120 Å²	120	140.2 Å²	140.2	74%	0.736	80%	0.803	S	S	*	*			trans	-111.5	156	-166.1	51.5	0	0	0	0	115.3
302	A	26	Very low	23.9	Very low	94 Å²	94	146.3 Å²	146.3	78%	0.777	81%	0.805	S	S	*	*			trans	-162.4	106.6	142.2	0	0	0	0	0	112.2
303	N	22.3	Very low	24	Very low	157 Å²	157	145.4 Å²	145.4	84%	0.84	81%	0.805	S	S	*	*			trans	-98.8	143.1	164.8	-81	-3	0	0	0	109.6
304	W	23	Very low	23.9	Very low	259 Å²	259	145.6 Å²	145.6	98%	0.981	81%	0.806	S	S	*	*			trans	-142.4	97.1	154.7	-84.8	93	0	0	0	110.1
305	L	23	Very low	23.8	Very low	162 Å²	162	147.7 Å²	147.7	85%	0.848	81%	0.814	S	S	*	*			trans	-161.8	114.6	170.3	-124.6	177.1	0	0	0	109
306	T	25	Very low	23.8	Very low	130 Å²	130	145.1 Å²	145.1	80%	0.798	81%	0.81	S	S	*	*			trans	173.1	127.2	152.6	18.8	0	0	0	0	109
307	E	24	Very low	23.7	Very low	193 Å²	193	146.2 Å²	146.2	90%	0.902	81%	0.812	S	S	*	*				-153.5	145.1	95.2	-122.8	-178.5	-170	0	0	109.7
308	E	23.4	Very low	23.8	Very low	165 Å²	165	151.2 Å²	151.2	77%	0.771	82%	0.817	S	S	*	*			trans	-93.7	149.7	173.7	-59.1	173.6	110	0	0	109.2
309	N	23.3	Very low	23.6	Very low	152 Å²	152	152 Å²	152	81%	0.813	82%	0.815	S	S	*	*				169.5	114.9	124.1	-96.6	-70.1	0	0	0	112.4
310	L	26.2	Very low	23.7	Very low	174 Å²	174	153.5 Å²	153.5	91%	0.911	82%	0.815	S	S	*	*			trans	165.7	141.1	139.9	-112.9	71.1	0	0	0	107.4
311	A	24.5	Very low	23.6	Very low	90 Å²	90	155.2 Å²	155.2	74%	0.744	81%	0.814	S	S	*	*			cis	-163.5	164.6	-27.7	0	0	0	0	0	106.8
312	K	21	Very low	23.8	Very low	213 Å²	213	154.9 Å²	154.9	93%	0.926	81%	0.812	S	S	*	*			trans	-66.1	137.4	179.4	-62.6	175.6	180	179.7	0	111.7
313	A	23.1	Very low	23.9	Very low	96 Å²	96	155.3 Å²	155.3	79%	0.793	81%	0.809	S	S	*	*			trans	-140.2	118.3	161.6	0	0	0	0	0	108.9
314	D	23.9	Very low	24.5	Very low	156 Å²	156	153.5 Å²	153.5	83%	0.834	81%	0.806	S	S	*	*			trans	-20	138	-172.7	-53.1	-30.4	0	0	0	120.5	T316	D314-T316 PolarHBondContact O-N 3.39Å
315	E	21.8	Very low	25.4	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	79%	0.787	S	S	*	*			trans	-61	126.8	164.6	-65.4	171.3	105.8	0	0	110.8
316	T	23.8	Very low	26.3	Very low	109 Å²	109	142.3 Å²	142.3	67%	0.669	78%	0.776	S	S	*	*			trans	-131.7	88.6	158.4	-60.3	0	0	0	0	107.7	D314 W318	D314-T316 PolarHBondContact O-N 3.39Å; T316-W318 PolarHBondContact O-N 3.43Å
317	T	20.6	Very low	27.4	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	74%	0.744	S	S	*	*			trans	-66.6	99.8	-179.4	49.3	0	0	0	0	110.9
318	W	25.5	Very low	28.4	Very low	232 Å²	232	132.6 Å²	132.6	88%	0.879	73%	0.73	S	S	*	*			trans	-85	112.3	156.9	-71.8	89.6	0	0	0	108	T316 D320	T316-W318 PolarHBondContact O-N 3.43Å; W318-D320 PolarHBondContact O-N 2.9Å
319	I	22	Very low	29.5	Very low	145 Å²	145	127.7 Å²	127.7	74%	0.744	71%	0.712	S	S	*	*			trans	-77.3	116.2	174.2	-56.8	172.8	0	0	0	107.2	E321	I319-E321 HydrophobicContact CG2-CG 3.87Å
320	D	26.1	Very low	30.4	Very low	126 Å²	126	122.7 Å²	122.7	67%	0.674	69%	0.689	S	S	*	*			trans	-112.2	96.6	171.6	-145.7	-10.8	0	0	0	107.5	W318 T322	W318-D320 PolarHBondContact O-N 2.9Å; D320-T322 VanDerWaalsContact C-N 3.3Å; D320-T322 PolarHBondContact O-N 2.92Å
321	E	23.4	Very low	30.9	Very low	182 Å²	182	119.6 Å²	119.6	85%	0.85	68%	0.682	S	S	*	*			trans	-76	79.8	-179	-72.2	-167.1	138.9	0	0	111.2	I319	I319-E321 HydrophobicContact CG2-CG 3.87Å
322	T	27.6	Very low	31.6	Very low	113 Å²	113	123.1 Å²	123.1	69%	0.693	69%	0.689	S	S	*	*			trans	-120.1	101	159.5	54.6	0	0	0	0	109.5	D320	D320-T322 VanDerWaalsContact C-N 3.3Å; D320-T322 PolarHBondContact O-N 2.92Å
323	S	29	Very low	32.8	Very low	104 Å²	104	121.2 Å²	121.2	73%	0.727	68%	0.68	S	S	*	*			trans	-51.9	132.3	173.2	-55	0	0	0	0	110.5	V325	S323-V325 PolarHBondContact O-N 3.04Å
324	P	33.7	Very low	34.2	Very low	119 Å²	119	119.1 Å²	119.1	77%	0.773	67%	0.668	S	S	*	*			trans	-64.7	110.9	-178.8	25.8	-33.5	0	0	0	109.8	S326	P324-S326 VanDerWaalsContact C-N 3.27Å; P324-S326 PolarHBondContact O-N 3.06Å
325	V	42.3	Very low	36.5	Very low	96 Å²	96	114.4 Å²	114.4	58%	0.582	64%	0.643	S	S	*	*			trans	-75.6	85	176	-169	0	0	0	0	108.2	S323 F327 I506	S323-V325 PolarHBondContact O-N 3.04Å; V325-F327 HydrophobicContact CG1-CD2 3.88Å; V325-F327 HydrophobicContact CG1-CE2 3.61Å; V325-F327 PolarHBondContact O-N 3.4Å; V325-I506 WeakPolarHBondContact O-CD1 3.47Å
326	S	41.9	Very low	39.4	Very low	89 Å²	89	107.7 Å²	107.7	62%	0.622	61%	0.612	S	S	*	*			trans	-67	110.9	171.9	57.6	0	0	0	0	109.3	P324 P328	P324-S326 VanDerWaalsContact C-N 3.27Å; P324-S326 PolarHBondContact O-N 3.06Å; S326-P328 WeakPolarHBondContact O-CD 3.41Å
327	F	47.6	Very low	42.5	Very low	25 Å²	25	103 Å²	103	11%	0.11	58%	0.583	C	S	.	*			trans	-84.9	102.1	162.4	-81.4	-124	0	0	0	107.2	V325 L361 D363 A371 I506	V325-F327 HydrophobicContact CG1-CD2 3.88Å; V325-F327 HydrophobicContact CG1-CE2 3.61Å; V325-F327 PolarHBondContact O-N 3.4Å; F327-L361 HydrophobicContact CB-CD2 4.27Å; F327-L361 HydrophobicContact CD1-CD2 3.62Å; F327-L361 HydrophobicContact CE1-CD2 4.13Å; F327-L361 HydrophobicContact CG-CD2 4.09Å; F327-D363 HydrophobicContact CD1-CB 4.29Å; F327-D363 HydrophobicContact CE1-CB 3.58Å; F327-D363 HydrophobicContact CZ-CB 4.25Å; F327-A371 HydrophobicContact CE1-CB 4.23Å; F327-A371 HydrophobicContact CE2-CB 3.84Å; F327-A371 HydrophobicContact CZ-CB 3.51Å; F327-I506 HydrophobicContact CB-CD1 4.01Å; F327-I506 HydrophobicContact CD2-CD1 3.28Å; F327-I506 HydrophobicContact CE2-CD1 3.86Å; F327-I506 HydrophobicContact CG-CD1 3.81Å
328	P	45.7	Very low	45.8	Very low	94 Å²	94	98.2 Å²	98.2	61%	0.61	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-66.7	135.9	174.2	29.2	-34.3	0	0	0	109.2	S326	S326-P328 WeakPolarHBondContact O-CD 3.41Å
329	P	45.6	Very low	49	Very low	63 Å²	63	87.2 Å²	87.2	41%	0.409	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-61.1	146.8	169.4	28.4	-34.5	0	0	0	109.7	S331 N335	P329-S331 PolarHBondContact O-N 2.84Å; P329-N335 WeakPolarHBondContact CB-OD1 3.29Å
330	S	43.5	Very low	52.5	Low	47 Å²	47	81.1 Å²	81.1	33%	0.329	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-57.1	117.2	-162.5	81.8	0	0	0	0	112.4	N332	S330-N332 PolarHBondContact O-N 3.23Å
331	S	37.3	Very low	55.8	Low	109 Å²	109	75.1 Å²	75.1	76%	0.762	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	64.9	-170.4	62.9	0	0	0	0	112.1	P329	P329-S331 PolarHBondContact O-N 2.84Å
332	N	38.9	Very low	59.2	Low	164 Å²	164	66.5 Å²	66.5	88%	0.877	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-173	-14.4	152	-97.4	-35	0	0	0	116.3	S330	S330-N332 PolarHBondContact O-N 3.23Å
333	K	44.9	Very low	62.4	Low	172 Å²	172	61.4 Å²	61.4	75%	0.748	37%	0.374	S	S	*	.	S	Bend	trans	-139.3	72	-178.8	-73.9	-173.3	-179.6	174.1	0	113.6
334	G	52.8	Low	65.5	Low	53 Å²	53	57 Å²	57	55%	0.546	34%	0.344	S	S	.	.			trans	77.1	163.9	171.5	0	0	0	0	0	115	I336	G334-I336 PolarHBondContact O-N 3.18Å
335	N	73.8	Confident	68.3	Low	56 Å²	56	52.3 Å²	52.3	30%	0.299	31%	0.312	S	S	.	.	S	Bend	trans	-82.8	70.6	176.8	-174.2	22.2	0	0	0	110	P329 K492 D493 A494	P329-N335 WeakPolarHBondContact CB-OD1 3.29Å; N335-K492 WeakPolarHBondContact O-CA 3.4Å; N335-D493 PolarHBondContact O-N 2.77Å; N335-A494 PolarHBondContact ND2-O 3.15Å
336	I	82.7	Confident	70.6	Confident	41 Å²	41	49.3 Å²	49.3	21%	0.21	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.3	-176.5	-53.1	-177.6	0	0	0	109.8	G334 Y338 E490 I491 K492	G334-I336 PolarHBondContact O-N 3.18Å; I336-Y338 HydrophobicContact CG2-CE1 4.26Å; I336-E490 HydrophobicContact CG2-CG 3.57Å; I336-I491 CarbonylContact C-O 3.59Å; I336-I491 WeakPolarHBondContact CA-O 3.28Å; I336-K492 HydrophobicContact CG1-CG 4.48Å
337	L	87.5	Confident	72.5	Confident	11 Å²	11	46 Å²	46	6%	0.058	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.6	175.9	-58.8	177.9	0	0	0	110.4	L361 E490 I491 A494 Y508	L337-L361 HydrophobicContact CB-CD1 4.08Å; L337-L361 HydrophobicContact CD1-CD1 4.3Å; L337-L361 HydrophobicContact CD2-CD1 4.43Å; L337-E490 WeakPolarHBondContact O-CA 3.37Å; L337-I491 HydrophobicContact CB-CB 4.41Å; L337-I491 PolarHBondContact N-O 2.78Å; L337-I491 PolarHBondContact O-N 2.91Å; L337-A494 HydrophobicContact CD1-CB 3.59Å; L337-A494 HydrophobicContact CG-CB 4.41Å; L337-Y508 HydrophobicContact CD1-CD1 3.68Å; L337-Y508 HydrophobicContact CD1-CD2 3.93Å; L337-Y508 HydrophobicContact CD1-CE1 3.61Å; L337-Y508 HydrophobicContact CD1-CE2 3.85Å; L337-Y508 HydrophobicContact CD1-CG 3.85Å
338	Y	90.4	Very high	73.9	Confident	22 Å²	22	47.5 Å²	47.5	9%	0.086	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.3	166.7	-60.5	-53.9	0	0	0	110.6	I336 Y362 H364 L489 E490 L523 M540	I336-Y338 HydrophobicContact CG2-CE1 4.26Å; Y338-Y362 PolarHBondContact O-N 3.14Å; Y338-H364 AromaticContact CD2-CE1 3.41Å; Y338-H364 VanDerWaalsContact CD2-CE1 3.41Å; Y338-H364 WeakPolarHBondContact CD2-CE1 3.22Å; Y338-H364 AromaticContact CD2-NE2 3.26Å; Y338-H364 VanDerWaalsContact CD2-NE2 3.26Å; Y338-H364 WeakPolarHBondContact CD2-NE2 3.38Å; Y338-H364 AromaticContact CE2-CE1 3.93Å; Y338-H364 AromaticContact CE2-NE2 3.33Å; Y338-H364 VanDerWaalsContact CE2-NE2 3.33Å; Y338-H364 WeakPolarHBondContact CE2-NE2 3.49Å; Y338-L489 WeakPolarHBondContact CA-O 3.4Å; Y338-E490 HydrophobicContact CD1-CB 4.05Å; Y338-E490 HydrophobicContact CD1-CG 4.25Å; Y338-E490 HydrophobicContact CE1-CB 3.8Å; Y338-E490 HydrophobicContact CE1-CG 3.66Å; Y338-E490 WeakPolarHBondContact CE1-OE2 3.46Å; Y338-E490 PolarHBondContact OH-OE2 3.05Å; Y338-L523 HydrophobicContact CD1-CD1 4.02Å; Y338-L523 HydrophobicContact CD1-CD2 4.07Å; Y338-L523 HydrophobicContact CE1-CD1 3.59Å; Y338-L523 HydrophobicContact CE1-CD2 4.4Å; Y338-M540 HydrophobicContact CE2-CE 3.55Å; Y338-M540 HydrophobicContact CE2-SD 4.28Å
339	F	93.6	Very high	75.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	121.4	-172.7	171.4	-105.1	0	0	0	109.9	W341 L357 G359 K360 C373 L375 W488 L489 I491	F339-W341 HydrophobicContact CD1-CB 4.1Å; F339-W341 HydrophobicContact CE1-CB 3.55Å; F339-W341 HydrophobicContact CZ-CB 4.29Å; F339-L357 HydrophobicContact CE1-CB 3.8Å; F339-L357 HydrophobicContact CE1-CD1 4.41Å; F339-L357 HydrophobicContact CZ-CB 4.03Å; F339-G359 VanDerWaalsContact CE2-CA 3.46Å; F339-K360 CarbonylContact C-O 3.59Å; F339-K360 WeakPolarHBondContact CA-O 3.41Å; F339-C373 HydrophobicContact CD2-CB 3.95Å; F339-C373 HydrophobicContact CE2-CB 3.77Å; F339-L375 HydrophobicContact CE1-CB 4.38Å; F339-L375 HydrophobicContact CZ-CB 4.29Å; F339-W488 VanDerWaalsContact C-CE3 3.49Å; F339-L489 HydrophobicContact CD1-CD1 4.22Å; F339-L489 PolarHBondContact N-O 2.89Å; F339-L489 PolarHBondContact O-N 3.47Å; F339-I491 HydrophobicContact CB-CD1 3.57Å; F339-I491 HydrophobicContact CB-CG1 4.49Å; F339-I491 HydrophobicContact CD1-CD1 4.11Å; F339-I491 HydrophobicContact CG-CD1 4.02Å
340	Y	94.3	Very high	76.6	Confident	17 Å²	17	49.5 Å²	49.5	7%	0.067	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	105.9	174.4	-175.1	-91.9	0	0	0	108.9	F342 G359 K360 P486 C487 W488 P546	Y340-F342 HydrophobicContact CD1-CD1 4.38Å; Y340-G359 CarbonylContact O-C 3.55Å; Y340-G359 WeakPolarHBondContact O-CA 3.41Å; Y340-K360 PolarHBondContact N-O 3.16Å; Y340-K360 PolarHBondContact O-N 3.05Å; Y340-P486 HydrophobicContact CE1-CB 4.07Å; Y340-P486 WeakPolarHBondContact OH-CB 3.14Å; Y340-C487 WeakPolarHBondContact CA-O 3.44Å; Y340-W488 AromaticContact CD2-CD1 3.93Å; Y340-W488 AromaticContact CD2-CD2 3.98Å; Y340-W488 HydrophobicContact CD2-CD2 3.98Å; Y340-W488 AromaticContact CD2-CE2 3.86Å; Y340-W488 AromaticContact CD2-CG 3.99Å; Y340-W488 HydrophobicContact CD2-CG 3.99Å; Y340-W488 HydrophobicContact CD2-CZ2 4.43Å; Y340-W488 AromaticContact CD2-NE1 3.86Å; Y340-W488 HydrophobicContact CG-CD2 4.42Å; Y340-P546 HydrophobicContact CD1-CG 3.47Å; Y340-P546 VanDerWaalsContact CD1-CG 3.47Å; Y340-P546 HydrophobicContact CD2-CG 4.48Å; Y340-P546 HydrophobicContact CE1-CG 4.12Å; Y340-P546 VanDerWaalsContact CG-CD 3.46Å; Y340-P546 HydrophobicContact CG-CG 3.68Å
341	W	95.2	Very high	78.5	Confident	1 Å²	1	50.6 Å²	50.6	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	148	179.3	89.1	-74.3	0	0	0	110.8	F339 A344 L357 L478 L483 G485 P486 C487 L489 V874	F339-W341 HydrophobicContact CD1-CB 4.1Å; F339-W341 HydrophobicContact CE1-CB 3.55Å; F339-W341 HydrophobicContact CZ-CB 4.29Å; W341-A344 HydrophobicContact CE3-CB 4.35Å; W341-A344 HydrophobicContact CZ3-CB 3.9Å; W341-L357 HydrophobicContact CE3-CD2 4.32Å; W341-L478 HydrophobicContact CH2-CD2 3.62Å; W341-L478 HydrophobicContact CZ2-CD2 4Å; W341-L478 HydrophobicContact CZ3-CD2 4.35Å; W341-L483 HydrophobicContact CZ2-CB 3.99Å; W341-L483 HydrophobicContact CZ2-CD1 4.44Å; W341-G485 WeakPolarHBondContact CZ2-O 3.49Å; W341-G485 PolarHBondContact NE1-O 3.12Å; W341-P486 VanDerWaalsContact O-CA 3.23Å; W341-P486 WeakPolarHBondContact O-CA 3.49Å; W341-P486 WeakPolarHBondContact O-CB 3.39Å; W341-C487 PolarHBondContact N-O 3.19Å; W341-C487 VanDerWaalsContact N-O 3.13Å; W341-C487 PolarHBondContact NE1-SG 3.33Å; W341-C487 PolarHBondContact O-N 3.43Å; W341-L489 HydrophobicContact CB-CD1 4.31Å; W341-L489 HydrophobicContact CG-CD1 4.29Å; W341-V874 HydrophobicContact CH2-CG2 4.35Å; W341-V874 HydrophobicContact CZ3-CG1 4.15Å; W341-V874 HydrophobicContact CZ3-CG2 4.36Å
342	F	94.3	Very high	80.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	-17.9	173.1	55.3	-108.4	0	0	0	114.8	Y340 F358 K360 P486 L548 D681 L739	Y340-F342 HydrophobicContact CD1-CD1 4.38Å; F342-F358 PolarHBondContact N-O 2.94Å; F342-K360 HydrophobicContact CE1-CG 4.41Å; F342-P486 HydrophobicContact CB-CB 4.16Å; F342-P486 HydrophobicContact CB-CG 4.26Å; F342-L548 HydrophobicContact CD1-CD2 4.08Å; F342-L548 HydrophobicContact CE1-CD2 3.82Å; F342-D681 HydrophobicContact CE1-CB 4.41Å; F342-D681 HydrophobicContact CE2-CB 4.24Å; F342-D681 HydrophobicContact CZ-CB 3.81Å; F342-D681 WeakPolarHBondContact CZ-OD1 3.38Å; F342-L739 HydrophobicContact CB-CD1 4.42Å; F342-L739 HydrophobicContact CD2-CD1 3.76Å; F342-L739 HydrophobicContact CD2-CD2 4.46Å; F342-L739 HydrophobicContact CD2-CG 3.98Å; F342-L739 HydrophobicContact CE2-CD1 4.46Å; F342-L739 HydrophobicContact CE2-CG 4.44Å; F342-L739 HydrophobicContact CG-CD1 4.33Å
343	D	95.4	Very high	83.2	Confident	7 Å²	7	40 Å²	40	4%	0.037	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.4	175.8	-173.1	40.9	0	0	0	110.7	F358 G737 L739 S876	D343-F358 HydrophobicContact CB-CB 4.39Å; D343-F358 PolarHBondContact N-O 2.98Å; D343-F358 PolarHBondContact O-N 3.35Å; D343-G737 WeakPolarHBondContact OD2-CA 3.29Å; D343-G737 PolarHBondContact OD2-N 3.19Å; D343-L739 HydrophobicContact CB-CD2 3.96Å; D343-S876 VanDerWaalsContact OD1-CB 3.23Å; D343-S876 WeakPolarHBondContact OD1-CB 3.41Å; D343-S876 PolarHBondContact OD1-OG 3.46Å
344	A	94.1	Very high	85.5	Confident	11 Å²	11	33.1 Å²	33.1	9%	0.091	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	143.7	-178.2	0	0	0	0	0	111.5	W341 Y356 L357 L474 V874	W341-A344 HydrophobicContact CE3-CB 4.35Å; W341-A344 HydrophobicContact CZ3-CB 3.9Å; A344-Y356 CarbonylContact C-O 3.53Å; A344-Y356 WeakPolarHBondContact CA-O 3.44Å; A344-L357 HydrophobicContact CB-CD2 3.59Å; A344-L474 HydrophobicContact CB-CD1 3.65Å; A344-L474 HydrophobicContact CB-CD2 4.27Å; A344-V874 HydrophobicContact CB-CG1 4.32Å; A344-V874 HydrophobicContact CB-CG2 4.34Å
345	H	92.5	Very high	87.5	Confident	21 Å²	21	30.6 Å²	30.6	10%	0.097	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.1	-179	-171.9	69.7	0	0	0	111	D347 Y356 F358 H733 P736	H345-D347 WeakPolarHBondContact NE2-CB 3.45Å; H345-D347 IonicContact NE2-OD2 2.78Å; H345-Y356 PolarHBondContact N-O 3.18Å; H345-Y356 PolarHBondContact O-N 3.46Å; H345-F358 HydrophobicContact CB-CE2 3.96Å; H345-H733 AromaticContact CE1-CE1 3.44Å; H345-H733 PolarHBondContact CE1-CE1 2.87Å; H345-H733 VanDerWaalsContact CE1-CE1 3.44Å; H345-H733 AromaticContact CE1-CG 3.58Å; H345-H733 AromaticContact CE1-ND1 2.92Å; H345-H733 PolarHBondContact CE1-ND1 3.39Å; H345-P736 HydrophobicContact CB-CB 3.9Å
346	E	90	Very high	88.5	Confident	33 Å²	33	28.4 Å²	28.4	15%	0.154	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	157.7	166.5	57.2	165	-132.7	0	0	110.4	V355 S472 F473 L474	E346-V355 HydrophobicContact CB-CG2 4.26Å; E346-S472 WeakPolarHBondContact OE1-CB 3.26Å; E346-F473 PolarHBondContact OE2-N 3.03Å; E346-F473 VanDerWaalsContact OE2-N 3.12Å; E346-L474 HydrophobicContact CG-CB 4.13Å; E346-L474 WeakPolarHBondContact OE2-CB 3.25Å; E346-L474 PolarHBondContact OE2-N 2.92Å
347	D	83.2	Confident	89.1	Confident	18 Å²	18	26.5 Å²	26.5	10%	0.096	13%	0.13	C	C	.	.			trans	-132.3	81.3	173	-170.3	-35.5	0	0	0	107.7	H345 K349 Q350 L351	H345-D347 WeakPolarHBondContact NE2-CB 3.45Å; H345-D347 IonicContact NE2-OD2 2.78Å; D347-K349 PolarHBondContact O-N 2.91Å; D347-K349 PolarHBondContact OD1-N 3.25Å; D347-Q350 PolarHBondContact O-N 3.37Å; D347-Q350 WeakPolarHBondContact OD1-CB 3.09Å; D347-Q350 WeakPolarHBondContact OD1-CG 3.42Å; D347-Q350 PolarHBondContact OD1-N 2.88Å; D347-Q350 PolarHBondContact OD2-NE2 3.38Å; D347-Q350 VanDerWaalsContact OD2-NE2 3.15Å; D347-L351 CarbonylContact O-C 3.3Å; D347-L351 VanDerWaalsContact O-C 3.25Å; D347-L351 WeakPolarHBondContact O-CA 3.41Å; D347-L351 PolarHBondContact O-N 2.81Å
348	F	75.5	Confident	89.6	Confident	58 Å²	58	26 Å²	26	25%	0.254	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.8	-175.1	68.8	-89	0	0	0	113.2	W920 D921	F348-W920 HydrophobicContact CE2-CB 3.92Å; F348-W920 HydrophobicContact CE2-CD2 4.35Å; F348-W920 HydrophobicContact CE2-CG 4.16Å; F348-W920 HydrophobicContact CZ-CB 3.89Å; F348-W920 HydrophobicContact CZ-CG 4.27Å; F348-D921 WeakPolarHBondContact CE1-OD1 3.19Å; F348-D921 WeakPolarHBondContact CZ-OD2 3.43Å
349	K	70.9	Confident	89.8	Confident	86 Å²	86	25 Å²	25	37%	0.374	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-47.1	177.3	-68.5	-173.1	178	179.3	0	112	D347 D918 D921	D347-K349 PolarHBondContact O-N 2.91Å; D347-K349 PolarHBondContact OD1-N 3.25Å; K349-D918 IonicContact NZ-OD1 2.8Å; K349-D918 PolarHBondContact NZ-OD1 2.88Å; K349-D921 WeakPolarHBondContact CE-OD2 3.35Å; K349-D921 IonicContact NZ-OD2 3.39Å
350	Q	77.5	Confident	89.8	Confident	112 Å²	112	26 Å²	26	52%	0.523	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-33.8	-174.1	-61.3	-178.9	57.3	0	0	113.4	D347	D347-Q350 PolarHBondContact O-N 3.37Å; D347-Q350 WeakPolarHBondContact OD1-CB 3.09Å; D347-Q350 WeakPolarHBondContact OD1-CG 3.42Å; D347-Q350 PolarHBondContact OD1-N 2.88Å; D347-Q350 PolarHBondContact OD2-NE2 3.38Å; D347-Q350 VanDerWaalsContact OD2-NE2 3.15Å
351	L	83.6	Confident	89.7	Confident	71 Å²	71	25.3 Å²	25.3	37%	0.372	13%	0.126	S	C	.	.	S	Bend	trans	-140.7	60.1	-170.3	-65	175.4	0	0	0	111.9	D347 I354 Y356	D347-L351 CarbonylContact O-C 3.3Å; D347-L351 VanDerWaalsContact O-C 3.25Å; D347-L351 WeakPolarHBondContact O-CA 3.41Å; D347-L351 PolarHBondContact O-N 2.81Å; L351-I354 HydrophobicContact CB-CB 4.32Å; L351-I354 HydrophobicContact CB-CD1 4.29Å; L351-I354 HydrophobicContact CD2-CD1 4.38Å; L351-I354 PolarHBondContact O-N 3.2Å; L351-Y356 VanDerWaalsContact CD1-OH 3.29Å; L351-Y356 WeakPolarHBondContact CD1-OH 3.48Å
352	P	85.6	Confident	89.3	Confident	49 Å²	49	27.4 Å²	27.4	32%	0.318	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	140	177.5	26.5	-35.5	0	0	0	111.7	I354 A449 F473	P352-I354 VanDerWaalsContact C-N 3.34Å; P352-A449 HydrophobicContact CB-CB 4.32Å; P352-F473 HydrophobicContact CB-CE2 4.06Å
353	G	88.6	Confident	88.5	Confident	2 Å²	2	28 Å²	28	2%	0.021	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	12.1	-175.9	0	0	0	0	0	115.2	D379 L380 F473	G353-D379 PolarHBondContact O-N 2.86Å; G353-L380 WeakPolarHBondContact O-CB 3.36Å; G353-L380 PolarHBondContact O-N 3.21Å; G353-F473 VanDerWaalsContact N-CE2 3.33Å
354	I	93.4	Very high	87.3	Confident	26 Å²	26	31.9 Å²	31.9	13%	0.133	16%	0.155	C	C	.	.			trans	-120.9	125.5	173.8	-55.5	-171.7	0	0	0	110.2	L351 P352 Y356 R376 I377 K378	L351-I354 HydrophobicContact CB-CB 4.32Å; L351-I354 HydrophobicContact CB-CD1 4.29Å; L351-I354 HydrophobicContact CD2-CD1 4.38Å; L351-I354 PolarHBondContact O-N 3.2Å; P352-I354 VanDerWaalsContact C-N 3.34Å; I354-Y356 HydrophobicContact CG2-CD2 4.3Å; I354-Y356 HydrophobicContact CG2-CE2 3.72Å; I354-R376 HydrophobicContact CG2-CG 3.54Å; I354-I377 WeakPolarHBondContact CA-O 3.35Å; I354-K378 HydrophobicContact CD1-CG 4.24Å; I354-K378 HydrophobicContact CG1-CG 4.34Å
355	V	94.8	Very high	86.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.7	172.5	173.9	0	0	0	0	109.2	E346 L357 I377 L380 F473 L474 L477	E346-V355 HydrophobicContact CB-CG2 4.26Å; V355-L357 HydrophobicContact CG1-CD2 4.01Å; V355-I377 PolarHBondContact N-O 3.04Å; V355-I377 VanDerWaalsContact N-O 3.11Å; V355-I377 PolarHBondContact O-N 2.96Å; V355-L380 HydrophobicContact CB-CD1 3.82Å; V355-L380 HydrophobicContact CG2-CD1 3.46Å; V355-L380 VanDerWaalsContact CG2-CD1 3.46Å; V355-F473 HydrophobicContact CG2-CB 4.06Å; V355-L474 HydrophobicContact CG1-CD1 3.98Å; V355-L474 HydrophobicContact CG2-CB 4.35Å; V355-L477 HydrophobicContact CB-CD2 4.15Å; V355-L477 HydrophobicContact CG1-CD2 3.76Å; V355-L477 HydrophobicContact CG2-CD2 4.49Å
356	Y	95.5	Very high	85	Confident	11 Å²	11	40.5 Å²	40.5	4%	0.043	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.4	176.2	-61.1	-97.3	0	0	0	109.2	A344 H345 L351 I354 L375 R376 I501 L714	A344-Y356 CarbonylContact C-O 3.53Å; A344-Y356 WeakPolarHBondContact CA-O 3.44Å; H345-Y356 PolarHBondContact N-O 3.18Å; H345-Y356 PolarHBondContact O-N 3.46Å; L351-Y356 VanDerWaalsContact CD1-OH 3.29Å; L351-Y356 WeakPolarHBondContact CD1-OH 3.48Å; I354-Y356 HydrophobicContact CG2-CD2 4.3Å; I354-Y356 HydrophobicContact CG2-CE2 3.72Å; Y356-L375 WeakPolarHBondContact CA-O 3.22Å; Y356-R376 HydrophobicContact CD1-CB 4.29Å; Y356-R376 HydrophobicContact CD1-CG 4.32Å; Y356-R376 HydrophobicContact CE1-CB 4.3Å; Y356-R376 HydrophobicContact CE1-CG 4Å; Y356-I501 HydrophobicContact CE1-CD1 4.18Å; Y356-L714 HydrophobicContact CD1-CD1 3.73Å; Y356-L714 HydrophobicContact CE1-CD1 3.5Å; Y356-L714 VanDerWaalsContact CE1-CD1 3.5Å; Y356-L714 HydrophobicContact CE2-CD2 4.39Å; Y356-L714 HydrophobicContact CG-CD1 4.34Å
357	L	96	Very high	83.9	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	139.3	168.9	-54	-175.1	0	0	0	109.7	F339 W341 A344 V355 C374 L375 I377 L477 L489	F339-L357 HydrophobicContact CE1-CB 3.8Å; F339-L357 HydrophobicContact CE1-CD1 4.41Å; F339-L357 HydrophobicContact CZ-CB 4.03Å; W341-L357 HydrophobicContact CE3-CD2 4.32Å; A344-L357 HydrophobicContact CB-CD2 3.59Å; V355-L357 HydrophobicContact CG1-CD2 4.01Å; L357-C374 WeakPolarHBondContact O-CA 3.47Å; L357-L375 HydrophobicContact CB-CB 4.37Å; L357-L375 HydrophobicContact CD1-CD2 4.35Å; L357-L375 PolarHBondContact N-O 3.41Å; L357-L375 PolarHBondContact O-N 3.37Å; L357-I377 HydrophobicContact CD1-CD1 3.84Å; L357-I377 HydrophobicContact CG-CD1 3.98Å; L357-L477 HydrophobicContact CD2-CD2 4.33Å; L357-L489 HydrophobicContact CD1-CD1 3.95Å
358	F	96.6	Very high	83.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.6	176.8	-60.5	-87.3	0	0	0	110.4	F342 D343 H345 C374 R713 L714 P736	F342-F358 PolarHBondContact N-O 2.94Å; D343-F358 HydrophobicContact CB-CB 4.39Å; D343-F358 PolarHBondContact N-O 2.98Å; D343-F358 PolarHBondContact O-N 3.35Å; H345-F358 HydrophobicContact CB-CE2 3.96Å; F358-C374 HydrophobicContact CD1-CB 4.08Å; F358-C374 HydrophobicContact CE1-CB 3.98Å; F358-C374 WeakPolarHBondContact CE1-SG 3.39Å; F358-R713 HydrophobicContact CD1-CB 4.05Å; F358-R713 HydrophobicContact CE1-CB 3.76Å; F358-L714 HydrophobicContact CZ-CB 4.41Å; F358-P736 HydrophobicContact CE2-CB 4.42Å
359	G	95.4	Very high	83.5	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	-168.6	-167.6	0	0	0	0	0	114.8	F339 Y340 C373	F339-G359 VanDerWaalsContact CE2-CA 3.46Å; Y340-G359 CarbonylContact O-C 3.55Å; Y340-G359 WeakPolarHBondContact O-CA 3.41Å; G359-C373 PolarHBondContact N-O 2.89Å; G359-C373 VanDerWaalsContact N-O 3.15Å; G359-C373 PolarHBondContact O-N 3.41Å
360	K	93.9	Very high	84.3	Confident	21 Å²	21	43.5 Å²	43.5	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.9	174	-60.7	-58.8	-164.7	-166.6	0	111.3	F339 Y340 F342 Y370 A371 P546 L548 D681	F339-K360 CarbonylContact C-O 3.59Å; F339-K360 WeakPolarHBondContact CA-O 3.41Å; Y340-K360 PolarHBondContact N-O 3.16Å; Y340-K360 PolarHBondContact O-N 3.05Å; F342-K360 HydrophobicContact CE1-CG 4.41Å; K360-Y370 HydrophobicContact CB-CD1 4.43Å; K360-A371 CarbonylContact C-O 3.6Å; K360-A371 VanDerWaalsContact CA-O 3.3Å; K360-A371 WeakPolarHBondContact CA-O 3.49Å; K360-P546 HydrophobicContact CB-CB 3.99Å; K360-P546 HydrophobicContact CB-CG 3.97Å; K360-P546 HydrophobicContact CG-CB 3.86Å; K360-P546 HydrophobicContact CG-CG 3.85Å; K360-L548 HydrophobicContact CG-CD2 4.08Å; K360-D681 WeakPolarHBondContact CE-OD1 3.35Å; K360-D681 WeakPolarHBondContact CE-OD2 3.2Å; K360-D681 IonicContact NZ-OD1 2.9Å; K360-D681 PolarHBondContact NZ-OD1 3.47Å; K360-D681 IonicContact NZ-OD2 3.3Å; K360-D681 PolarHBondContact NZ-OD2 3.21Å
361	L	91.6	Very high	84.9	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	141.6	168.5	-163	80.7	0	0	0	109.9	F327 L337 Y370 A371 C373 Y508	F327-L361 HydrophobicContact CB-CD2 4.27Å; F327-L361 HydrophobicContact CD1-CD2 3.62Å; F327-L361 HydrophobicContact CE1-CD2 4.13Å; F327-L361 HydrophobicContact CG-CD2 4.09Å; L337-L361 HydrophobicContact CB-CD1 4.08Å; L337-L361 HydrophobicContact CD1-CD1 4.3Å; L337-L361 HydrophobicContact CD2-CD1 4.43Å; L361-Y370 VanDerWaalsContact O-CA 3.28Å; L361-Y370 WeakPolarHBondContact O-CA 3.48Å; L361-A371 PolarHBondContact N-O 3Å; L361-A371 PolarHBondContact O-N 2.92Å; L361-C373 HydrophobicContact CB-CB 4.15Å; L361-Y508 HydrophobicContact CD1-CE2 4.39Å; L361-Y508 HydrophobicContact CD2-CE2 3.98Å
362	Y	85.9	Confident	85.4	Confident	44 Å²	44	34.9 Å²	34.9	17%	0.173	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.8	175.9	-177.4	-112.9	0	0	0	112.8	Y338 H364 Y370	Y338-Y362 PolarHBondContact O-N 3.14Å; Y362-H364 AromaticContact CD1-CE1 3.97Å; Y362-H364 AromaticContact CD1-ND1 3.9Å; Y362-H364 PolarHBondContact O-N 3.01Å; Y362-H364 PolarHBondContact O-ND1 2.82Å; Y362-Y370 HydrophobicContact CD2-CD1 4.08Å; Y362-Y370 AromaticContact CD2-CE1 3.57Å; Y362-Y370 HydrophobicContact CD2-CE1 3.57Å; Y362-Y370 HydrophobicContact CE2-CE1 4.28Å
363	D	78.3	Confident	85.8	Confident	14 Å²	14	32.6 Å²	32.6	8%	0.075	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-77.6	116.4	172.9	-165.3	-13.9	0	0	0	110.9	F327 S365 K366 T369	F327-D363 HydrophobicContact CD1-CB 4.29Å; F327-D363 HydrophobicContact CE1-CB 3.58Å; F327-D363 HydrophobicContact CZ-CB 4.25Å; D363-S365 VanDerWaalsContact CG-OG 3.24Å; D363-S365 WeakPolarHBondContact OD1-CA 3.37Å; D363-S365 VanDerWaalsContact OD1-CB 3.3Å; D363-S365 WeakPolarHBondContact OD1-CB 3.28Å; D363-S365 PolarHBondContact OD1-N 2.91Å; D363-S365 PolarHBondContact OD1-OG 3.1Å; D363-S365 PolarHBondContact OD2-OG 3.48Å; D363-S365 VanDerWaalsContact OD2-OG 3.1Å; D363-K366 HydrophobicContact CB-CB 4.4Å; D363-K366 CarbonylContact O-C 3.54Å; D363-K366 PolarHBondContact OD1-N 3.32Å; D363-T369 VanDerWaalsContact CB-OG1 3.27Å; D363-T369 WeakPolarHBondContact CB-OG1 3.45Å; D363-T369 PolarHBondContact N-O 2.99Å; D363-T369 VanDerWaalsContact N-O 3.15Å
364	H	71	Confident	86.1	Confident	87 Å²	87	32.5 Å²	32.5	40%	0.403	19%	0.186	S	C	.	.	S	Bend	trans	-78.2	-21.8	175.6	-67.4	63.9	0	0	0	112.7	Y338 Y362	Y338-H364 AromaticContact CD2-CE1 3.41Å; Y338-H364 VanDerWaalsContact CD2-CE1 3.41Å; Y338-H364 WeakPolarHBondContact CD2-CE1 3.22Å; Y338-H364 AromaticContact CD2-NE2 3.26Å; Y338-H364 VanDerWaalsContact CD2-NE2 3.26Å; Y338-H364 WeakPolarHBondContact CD2-NE2 3.38Å; Y338-H364 AromaticContact CE2-CE1 3.93Å; Y338-H364 AromaticContact CE2-NE2 3.33Å; Y338-H364 VanDerWaalsContact CE2-NE2 3.33Å; Y338-H364 WeakPolarHBondContact CE2-NE2 3.49Å; Y362-H364 AromaticContact CD1-CE1 3.97Å; Y362-H364 AromaticContact CD1-ND1 3.9Å; Y362-H364 PolarHBondContact O-N 3.01Å; Y362-H364 PolarHBondContact O-ND1 2.82Å
365	S	69.6	Low	86.2	Confident	90 Å²	90	31.3 Å²	31.3	63%	0.629	18%	0.18	S	C	*	.	S	Bend	trans	-80.1	-20.9	177.2	77.4	0	0	0	0	112.7	D363	D363-S365 VanDerWaalsContact CG-OG 3.24Å; D363-S365 WeakPolarHBondContact OD1-CA 3.37Å; D363-S365 VanDerWaalsContact OD1-CB 3.3Å; D363-S365 WeakPolarHBondContact OD1-CB 3.28Å; D363-S365 PolarHBondContact OD1-N 2.91Å; D363-S365 PolarHBondContact OD1-OG 3.1Å; D363-S365 PolarHBondContact OD2-OG 3.48Å; D363-S365 VanDerWaalsContact OD2-OG 3.1Å
366	K	67.8	Low	86.3	Confident	123 Å²	123	33.2 Å²	33.2	54%	0.535	19%	0.187	S	C	.	.	S	Bend	trans	-141.7	89.3	-176	-67.6	171	-166.4	155.3	0	111	D363 G368 T369	D363-K366 HydrophobicContact CB-CB 4.4Å; D363-K366 CarbonylContact O-C 3.54Å; D363-K366 PolarHBondContact OD1-N 3.32Å; K366-G368 PolarHBondContact O-N 3.34Å; K366-T369 HydrophobicContact CB-CG2 4.07Å; K366-T369 VanDerWaalsContact CB-OG1 3.27Å; K366-T369 WeakPolarHBondContact CB-OG1 3.46Å; K366-T369 PolarHBondContact O-N 3.47Å; K366-T369 PolarHBondContact O-OG1 3.19Å
367	S	66.9	Low	86.2	Confident	106 Å²	106	32.7 Å²	32.7	74%	0.741	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.3	128.2	176.3	-175.6	0	0	0	0	112.1
368	G	69.7	Low	86.1	Confident	46 Å²	46	35.4 Å²	35.4	47%	0.474	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	3.5	179.4	0	0	0	0	0	116	K366 Y370	K366-G368 PolarHBondContact O-N 3.34Å; G368-Y370 WeakPolarHBondContact O-CD2 3.43Å; G368-Y370 WeakPolarHBondContact O-CE2 3.47Å
369	T	81	Confident	85.7	Confident	59 Å²	59	40.1 Å²	40.1	36%	0.362	22%	0.222	S	C	.	.			trans	-101.6	143.3	172.7	68.2	0	0	0	0	112.3	D363 K366	D363-T369 VanDerWaalsContact CB-OG1 3.27Å; D363-T369 WeakPolarHBondContact CB-OG1 3.45Å; D363-T369 PolarHBondContact N-O 2.99Å; D363-T369 VanDerWaalsContact N-O 3.15Å; K366-T369 HydrophobicContact CB-CG2 4.07Å; K366-T369 VanDerWaalsContact CB-OG1 3.27Å; K366-T369 WeakPolarHBondContact CB-OG1 3.46Å; K366-T369 PolarHBondContact O-N 3.47Å; K366-T369 PolarHBondContact O-OG1 3.19Å
370	Y	88.2	Confident	85.6	Confident	47 Å²	47	40.4 Å²	40.4	18%	0.184	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.4	-172.6	-56.6	-90.9	0	0	0	110.4	K360 L361 Y362 G368 W488 P546 P547	K360-Y370 HydrophobicContact CB-CD1 4.43Å; L361-Y370 VanDerWaalsContact O-CA 3.28Å; L361-Y370 WeakPolarHBondContact O-CA 3.48Å; Y362-Y370 HydrophobicContact CD2-CD1 4.08Å; Y362-Y370 AromaticContact CD2-CE1 3.57Å; Y362-Y370 HydrophobicContact CD2-CE1 3.57Å; Y362-Y370 HydrophobicContact CE2-CE1 4.28Å; G368-Y370 WeakPolarHBondContact O-CD2 3.43Å; G368-Y370 WeakPolarHBondContact O-CE2 3.47Å; Y370-W488 HydrophobicContact CD1-CH2 4.35Å; Y370-W488 AromaticContact CE1-CH2 3.95Å; Y370-W488 HydrophobicContact CE1-CH2 3.95Å; Y370-W488 HydrophobicContact CE1-CZ2 4.14Å; Y370-P546 HydrophobicContact CD1-CB 3.73Å; Y370-P546 HydrophobicContact CD2-CB 4.45Å; Y370-P546 HydrophobicContact CE1-CB 3.7Å; Y370-P546 HydrophobicContact CE2-CB 4.45Å; Y370-P546 HydrophobicContact CG-CB 4.1Å; Y370-P547 HydrophobicContact CD2-CG 4.27Å; Y370-P547 HydrophobicContact CE2-CG 4.25Å
371	A	89.3	Confident	85.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	147.2	172.3	0	0	0	0	0	111.1	F327 K360 L361 Q505	F327-A371 HydrophobicContact CE1-CB 4.23Å; F327-A371 HydrophobicContact CE2-CB 3.84Å; F327-A371 HydrophobicContact CZ-CB 3.51Å; K360-A371 CarbonylContact C-O 3.6Å; K360-A371 VanDerWaalsContact CA-O 3.3Å; K360-A371 WeakPolarHBondContact CA-O 3.49Å; L361-A371 PolarHBondContact N-O 3Å; L361-A371 PolarHBondContact O-N 2.92Å; A371-Q505 VanDerWaalsContact CA-OE1 3.27Å; A371-Q505 HydrophobicContact CB-CB 4.38Å; A371-Q505 VanDerWaalsContact CB-OE1 3.28Å
372	S	93.3	Very high	85.5	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.014	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	135	167.4	57.1	0	0	0	0	110	Q505 I506 D679	S372-Q505 PolarHBondContact O-N 3.47Å; S372-Q505 PolarHBondContact OG-N 2.98Å; S372-Q505 VanDerWaalsContact OG-N 3.09Å; S372-I506 PolarHBondContact O-N 3.17Å; S372-D679 WeakPolarHBondContact CB-OD2 3.48Å; S372-D679 PolarHBondContact OG-OD2 3.06Å
373	C	94.8	Very high	85.9	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.007	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	137.5	-172.8	178.3	0	0	0	0	111	F339 G359 L361 I506	F339-C373 HydrophobicContact CD2-CB 3.95Å; F339-C373 HydrophobicContact CE2-CB 3.77Å; G359-C373 PolarHBondContact N-O 2.89Å; G359-C373 VanDerWaalsContact N-O 3.15Å; G359-C373 PolarHBondContact O-N 3.41Å; L361-C373 HydrophobicContact CB-CB 4.15Å; C373-I506 VanDerWaalsContact CA-O 3.31Å; C373-I506 WeakPolarHBondContact CA-O 3.37Å
374	C	95.9	Very high	86.7	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.1	163.5	-171.9	0	0	0	0	109.2	L357 F358 S502 C504 I506 D507 Y508	L357-C374 WeakPolarHBondContact O-CA 3.47Å; F358-C374 HydrophobicContact CD1-CB 4.08Å; F358-C374 HydrophobicContact CE1-CB 3.98Å; F358-C374 WeakPolarHBondContact CE1-SG 3.39Å; C374-S502 WeakPolarHBondContact CB-OG 3.48Å; C374-C504 HydrophobicContact CB-CB 4.46Å; C374-I506 PolarHBondContact N-O 2.97Å; C374-I506 VanDerWaalsContact N-O 3.14Å; C374-D507 WeakPolarHBondContact CB-OD1 3.29Å; C374-D507 WeakPolarHBondContact O-CA 3.28Å; C374-Y508 PolarHBondContact O-N 3.11Å
375	L	95.5	Very high	87.8	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.2	172.1	-178.5	72	0	0	0	109.1	F339 Y356 L357 I377 I491 Y508 V510 I520	F339-L375 HydrophobicContact CE1-CB 4.38Å; F339-L375 HydrophobicContact CZ-CB 4.29Å; Y356-L375 WeakPolarHBondContact CA-O 3.22Å; L357-L375 HydrophobicContact CB-CB 4.37Å; L357-L375 HydrophobicContact CD1-CD2 4.35Å; L357-L375 PolarHBondContact N-O 3.41Å; L357-L375 PolarHBondContact O-N 3.37Å; L375-I377 HydrophobicContact CD2-CD1 4.23Å; L375-I377 HydrophobicContact CD2-CG1 4.03Å; L375-I377 HydrophobicContact CG-CG1 4.19Å; L375-I491 HydrophobicContact CD1-CD1 4.06Å; L375-I491 HydrophobicContact CD1-CG2 4.47Å; L375-I491 HydrophobicContact CD2-CD1 3.63Å; L375-I491 HydrophobicContact CD2-CG1 4.34Å; L375-I491 HydrophobicContact CG-CD1 4.38Å; L375-Y508 WeakPolarHBondContact CA-O 3.17Å; L375-V510 HydrophobicContact CD1-CB 4.45Å; L375-V510 HydrophobicContact CD1-CG1 3.97Å; L375-V510 HydrophobicContact CD2-CG1 4.31Å; L375-V510 HydrophobicContact CG-CG1 4.26Å; L375-I520 HydrophobicContact CD2-CD1 4.21Å
376	R	95.3	Very high	89.1	Confident	40 Å²	40	33.9 Å²	33.9	15%	0.151	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	116.3	169.8	-174.7	169.2	64.7	-167	-7.8	109.9	I354 Y356 K378 I501 Y508 E509 V510	I354-R376 HydrophobicContact CG2-CG 3.54Å; Y356-R376 HydrophobicContact CD1-CB 4.29Å; Y356-R376 HydrophobicContact CD1-CG 4.32Å; Y356-R376 HydrophobicContact CE1-CB 4.3Å; Y356-R376 HydrophobicContact CE1-CG 4Å; R376-K378 HydrophobicContact CG-CG 4.49Å; R376-I501 HydrophobicContact CB-CD1 3.72Å; R376-I501 HydrophobicContact CG-CD1 4.43Å; R376-Y508 PolarHBondContact N-O 2.99Å; R376-E509 IonicContact CZ-OE2 2.81Å; R376-E509 IonicContact NE-OE2 3.23Å; R376-E509 PolarHBondContact NE-OE2 2.89Å; R376-E509 IonicContact NH2-OE1 3.1Å; R376-E509 IonicContact NH2-OE2 3.43Å; R376-E509 PolarHBondContact NH2-OE2 2.94Å; R376-E509 WeakPolarHBondContact O-CA 3.35Å; R376-V510 PolarHBondContact O-N 3.02Å
377	I	94.7	Very high	90.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.2	173.7	-56.8	170.2	0	0	0	107.2	I354 V355 L357 L375 L380 L477 V510 W512 I520	I354-I377 WeakPolarHBondContact CA-O 3.35Å; V355-I377 PolarHBondContact N-O 3.04Å; V355-I377 VanDerWaalsContact N-O 3.11Å; V355-I377 PolarHBondContact O-N 2.96Å; L357-I377 HydrophobicContact CD1-CD1 3.84Å; L357-I377 HydrophobicContact CG-CD1 3.98Å; L375-I377 HydrophobicContact CD2-CD1 4.23Å; L375-I377 HydrophobicContact CD2-CG1 4.03Å; L375-I377 HydrophobicContact CG-CG1 4.19Å; I377-L380 HydrophobicContact CB-CD1 4.45Å; I377-L380 HydrophobicContact CG2-CD1 4.01Å; I377-L380 HydrophobicContact CG2-CD2 4.22Å; I377-L380 HydrophobicContact CG2-CG 4.08Å; I377-L477 HydrophobicContact CD1-CD1 4.11Å; I377-L477 HydrophobicContact CD1-CD2 3.55Å; I377-L477 HydrophobicContact CD1-CG 4.48Å; I377-V510 WeakPolarHBondContact CA-O 3.45Å; I377-V510 HydrophobicContact CB-CG1 4.46Å; I377-V510 HydrophobicContact CG1-CG1 3.91Å; I377-W512 HydrophobicContact CG2-CB 4.07Å; I377-W512 HydrophobicContact CG2-CE3 4.36Å; I377-I520 HydrophobicContact CD1-CD1 3.53Å; I377-I520 HydrophobicContact CG1-CD1 3.93Å
378	K	92.7	Very high	91.5	Very high	56 Å²	56	24 Å²	24	24%	0.243	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	166.6	179.8	-87.1	-174.8	176.9	163.7	0	112.5	I354 R376 L380 E509 V510 W512	I354-K378 HydrophobicContact CD1-CG 4.24Å; I354-K378 HydrophobicContact CG1-CG 4.34Å; R376-K378 HydrophobicContact CG-CG 4.49Å; K378-L380 PolarHBondContact O-N 2.74Å; K378-E509 HydrophobicContact CD-CG 4.43Å; K378-E509 WeakPolarHBondContact CD-OE2 3.35Å; K378-E509 WeakPolarHBondContact CE-OE2 3.49Å; K378-E509 IonicContact NZ-OE1 2.71Å; K378-E509 PolarHBondContact NZ-OE1 3.33Å; K378-E509 IonicContact NZ-OE2 2.77Å; K378-E509 PolarHBondContact NZ-OE2 3.18Å; K378-V510 PolarHBondContact N-O 2.76Å; K378-W512 WeakPolarHBondContact O-CB 3.44Å; K378-W512 PolarHBondContact O-N 2.87Å
379	D	89.9	Confident	92.4	Very high	100 Å²	100	24.5 Å²	24.5	54%	0.535	11%	0.114	S	C	.	.			trans	58.6	35	170.4	-53.9	-27.2	0	0	0	113.3	G353 E381 I511	G353-D379 PolarHBondContact O-N 2.86Å; D379-E381 PolarHBondContact O-N 3.48Å; D379-I511 HydrophobicContact CB-CG2 4.22Å
380	L	92.1	Very high	92.4	Very high	6 Å²	6	27.3 Å²	27.3	3%	0.031	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-64.9	129.9	168.6	-70.3	153.4	0	0	0	109.1	G353 V355 I377 K378 A449 F473 L477 W512	G353-L380 WeakPolarHBondContact O-CB 3.36Å; G353-L380 PolarHBondContact O-N 3.21Å; V355-L380 HydrophobicContact CB-CD1 3.82Å; V355-L380 HydrophobicContact CG2-CD1 3.46Å; V355-L380 VanDerWaalsContact CG2-CD1 3.46Å; I377-L380 HydrophobicContact CB-CD1 4.45Å; I377-L380 HydrophobicContact CG2-CD1 4.01Å; I377-L380 HydrophobicContact CG2-CD2 4.22Å; I377-L380 HydrophobicContact CG2-CG 4.08Å; K378-L380 PolarHBondContact O-N 2.74Å; L380-A449 WeakPolarHBondContact O-CB 3.41Å; L380-F473 HydrophobicContact CB-CB 4.37Å; L380-F473 HydrophobicContact CB-CD1 3.9Å; L380-F473 HydrophobicContact CB-CG 4.44Å; L380-F473 HydrophobicContact CD1-CB 4.26Å; L380-L477 HydrophobicContact CD2-CB 4.49Å; L380-L477 HydrophobicContact CD2-CD1 4.28Å; L380-W512 HydrophobicContact CD2-CB 4.09Å; L380-W512 HydrophobicContact CD2-CD2 3.79Å; L380-W512 HydrophobicContact CD2-CE3 4.45Å; L380-W512 HydrophobicContact CD2-CG 3.59Å; L380-W512 HydrophobicContact CG-CB 4.22Å; L380-W512 HydrophobicContact CG-CG 4.22Å
381	E	92	Very high	91.8	Very high	31 Å²	31	28 Å²	28	15%	0.145	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	143	-179.9	-66.8	171.2	144.1	0	0	110.3	D379 R421 R446 Y447	D379-E381 PolarHBondContact O-N 3.48Å; E381-R421 IonicContact OE1-CZ 3.49Å; E381-R421 VanDerWaalsContact OE1-CZ 3.3Å; E381-R421 IonicContact OE1-NE 3.63Å; E381-R421 PolarHBondContact OE1-NE 2.62Å; E381-R421 IonicContact OE1-NH2 3.56Å; E381-R421 PolarHBondContact OE1-NH2 3.41Å; E381-R421 IonicContact OE2-CZ 3.5Å; E381-R421 IonicContact OE2-NE 3.58Å; E381-R421 IonicContact OE2-NH2 2.78Å; E381-R421 PolarHBondContact OE2-NH2 3.32Å; E381-R446 HydrophobicContact CB-CB 4.09Å; E381-R446 WeakPolarHBondContact OE2-CD 3.49Å; E381-Y447 CarbonylContact C-O 3.54Å; E381-Y447 VanDerWaalsContact CA-O 3.27Å; E381-Y447 WeakPolarHBondContact CA-O 3.3Å; E381-Y447 WeakPolarHBondContact CB-O 3.48Å
382	R	92.2	Very high	90.8	Very high	42 Å²	42	29 Å²	29	16%	0.158	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	143.1	161.2	-65	-177.5	-175.9	-77.1	-5.4	108.3	R446 Y447 F473	R382-R446 VanDerWaalsContact O-CA 3.22Å; R382-R446 WeakPolarHBondContact O-CA 3.26Å; R382-Y447 HydrophobicContact CB-CD1 4.33Å; R382-Y447 HydrophobicContact CB-CE1 3.97Å; R382-Y447 HydrophobicContact CB-CE2 4.23Å; R382-Y447 WeakPolarHBondContact CD-OH 3.32Å; R382-Y447 HydrophobicContact CG-CE2 4.39Å; R382-Y447 PolarHBondContact N-O 3.07Å; R382-Y447 PolarHBondContact O-N 2.71Å; R382-Y447 VanDerWaalsContact O-N 3.15Å; R382-F473 HydrophobicContact CG-CE1 3.76Å; R382-F473 HydrophobicContact CG-CZ 3.79Å
383	R	93.5	Very high	89.5	Confident	32 Å²	32	33.6 Å²	33.6	12%	0.121	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	112.2	-179.2	-179.7	-167	-167.6	159.4	9.9	108.9	F385 E444 R446 G468 D480	R383-F385 HydrophobicContact CG-CE2 4.29Å; R383-F385 HydrophobicContact CG-CZ 4.37Å; R383-F385 VanDerWaalsContact NE-CZ 3.33Å; R383-E444 HydrophobicContact CG-CG 4.16Å; R383-E444 IonicContact CZ-OE1 3.93Å; R383-E444 IonicContact CZ-OE2 3.54Å; R383-E444 IonicContact NE-OE1 3.73Å; R383-E444 PolarHBondContact NE-OE1 2.88Å; R383-E444 IonicContact NE-OE2 2.77Å; R383-E444 PolarHBondContact NE-OE2 3.42Å; R383-E444 IonicContact NH2-OE1 2.61Å; R383-E444 PolarHBondContact NH2-OE1 2.97Å; R383-E444 IonicContact NH2-OE2 2.81Å; R383-E444 PolarHBondContact NH2-OE2 3.16Å; R383-R446 HydrophobicContact CB-CG 4.31Å; R383-R446 HydrophobicContact CG-CG 4.27Å; R383-G468 WeakPolarHBondContact O-CA 3.1Å; R383-D480 IonicContact CZ-OD1 2.77Å; R383-D480 IonicContact NH1-OD1 3.33Å; R383-D480 PolarHBondContact NH1-OD1 2.81Å
384	I	95.1	Very high	88.2	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	157	177.8	62.6	173.2	0	0	0	111	F408 E444 V445 Y447 L454 I466 F467 T469	I384-F408 HydrophobicContact CD1-CE2 3.8Å; I384-F408 HydrophobicContact CD1-CZ 4.12Å; I384-E444 WeakPolarHBondContact O-CA 3.49Å; I384-V445 HydrophobicContact CD1-CB 4.06Å; I384-V445 HydrophobicContact CG1-CB 3.71Å; I384-V445 HydrophobicContact CG1-CG1 4.49Å; I384-V445 HydrophobicContact CG1-CG2 4.5Å; I384-V445 PolarHBondContact N-O 3.36Å; I384-V445 PolarHBondContact O-N 2.78Å; I384-Y447 HydrophobicContact CD1-CE1 4.03Å; I384-Y447 HydrophobicContact CG1-CE1 4.32Å; I384-Y447 HydrophobicContact CG2-CE1 4.31Å; I384-L454 HydrophobicContact CD1-CD1 3.81Å; I384-I466 HydrophobicContact CB-CD1 4.47Å; I384-I466 HydrophobicContact CB-CG1 4.37Å; I384-I466 HydrophobicContact CD1-CD1 3.94Å; I384-F467 CarbonylContact C-O 3.46Å; I384-F467 WeakPolarHBondContact CA-O 3.32Å; I384-F467 WeakPolarHBondContact CB-O 3.32Å; I384-T469 HydrophobicContact CG2-CG2 4.45Å
385	F	95.6	Very high	86.6	Confident	16 Å²	16	45.4 Å²	45.4	7%	0.07	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.8	172.2	-57.3	-90.8	0	0	0	109.4	R383 K427 Y442 E444 I466 F467 I901	R383-F385 HydrophobicContact CG-CE2 4.29Å; R383-F385 HydrophobicContact CG-CZ 4.37Å; R383-F385 VanDerWaalsContact NE-CZ 3.33Å; F385-K427 HydrophobicContact CD1-CG 4.32Å; F385-K427 HydrophobicContact CE1-CG 4.15Å; F385-Y442 HydrophobicContact CB-CD1 3.95Å; F385-Y442 HydrophobicContact CB-CG 4.42Å; F385-E444 HydrophobicContact CD1-CB 3.78Å; F385-E444 HydrophobicContact CD1-CG 4Å; F385-E444 HydrophobicContact CE1-CB 3.73Å; F385-E444 HydrophobicContact CE1-CG 3.6Å; F385-E444 WeakPolarHBondContact CE1-OE2 3.32Å; F385-E444 HydrophobicContact CZ-CG 4.15Å; F385-I466 WeakPolarHBondContact O-CA 3.45Å; F385-F467 HydrophobicContact CB-CB 4.43Å; F385-F467 PolarHBondContact N-O 3.27Å; F385-F467 PolarHBondContact O-N 3.38Å; F385-I901 HydrophobicContact CB-CD1 3.74Å; F385-I901 HydrophobicContact CD1-CD1 4.13Å; F385-I901 HydrophobicContact CD1-CG1 4.4Å; F385-I901 HydrophobicContact CD2-CD1 4.2Å; F385-I901 HydrophobicContact CD2-CG1 4.07Å; F385-I901 HydrophobicContact CE2-CG1 4.32Å; F385-I901 HydrophobicContact CG-CD1 3.78Å; F385-I901 HydrophobicContact CG-CG1 4.1Å
386	L	94.9	Very high	85.3	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.7	177	-61.5	154	0	0	0	109.3	V404 F408 Y442 L443 V445 F463 I466	L386-V404 HydrophobicContact CB-CG1 3.93Å; L386-V404 HydrophobicContact CD1-CG1 4.29Å; L386-F408 HydrophobicContact CD1-CB 4.14Å; L386-F408 HydrophobicContact CD1-CD2 3.46Å; L386-F408 VanDerWaalsContact CD1-CD2 3.46Å; L386-F408 HydrophobicContact CD1-CE2 4.1Å; L386-F408 HydrophobicContact CD1-CG 3.91Å; L386-Y442 WeakPolarHBondContact O-CA 3.41Å; L386-L443 HydrophobicContact CB-CB 4.31Å; L386-L443 HydrophobicContact CD1-CB 4.5Å; L386-L443 HydrophobicContact CD1-CD2 4.17Å; L386-L443 PolarHBondContact N-O 3.44Å; L386-L443 VanDerWaalsContact N-O 3.14Å; L386-L443 PolarHBondContact O-N 3.3Å; L386-L443 VanDerWaalsContact O-N 3.08Å; L386-V445 HydrophobicContact CD1-CG2 3.94Å; L386-F463 HydrophobicContact CB-CB 4.43Å; L386-F463 HydrophobicContact CD2-CD1 4.4Å; L386-F463 HydrophobicContact CD2-CD2 3.66Å; L386-F463 HydrophobicContact CD2-CE1 4.39Å; L386-F463 HydrophobicContact CD2-CE2 3.64Å; L386-F463 HydrophobicContact CD2-CG 4.06Å; L386-F463 HydrophobicContact CD2-CZ 4.03Å; L386-I466 HydrophobicContact CD2-CB 4.05Å; L386-I466 HydrophobicContact CD2-CD1 3.92Å; L386-I466 HydrophobicContact CD2-CG1 3.81Å
387	L	94.4	Very high	84.2	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	117	179.9	174.9	64.6	0	0	0	110.8	V436 P437 Y442 F463 S464 H465	L387-V436 HydrophobicContact CD2-CB 4.21Å; L387-V436 HydrophobicContact CD2-CG1 3.91Å; L387-V436 HydrophobicContact CD2-CG2 3.79Å; L387-P437 HydrophobicContact CD1-CG 4.2Å; L387-Y442 HydrophobicContact CB-CD1 3.98Å; L387-Y442 HydrophobicContact CB-CE1 3.69Å; L387-Y442 HydrophobicContact CD1-CD1 4.34Å; L387-Y442 HydrophobicContact CD1-CE1 3.78Å; L387-Y442 HydrophobicContact CD1-CE2 4.24Å; L387-Y442 HydrophobicContact CG-CE1 4.21Å; L387-F463 CarbonylContact O-C 3.43Å; L387-F463 WeakPolarHBondContact O-CA 3.35Å; L387-F463 WeakPolarHBondContact O-CB 3.49Å; L387-S464 WeakPolarHBondContact CD2-OG 3.31Å; L387-S464 PolarHBondContact O-N 3.03Å; L387-S464 PolarHBondContact O-OG 2.9Å; L387-H465 HydrophobicContact CB-CB 4.44Å; L387-H465 HydrophobicContact CD2-CB 4.39Å; L387-H465 PolarHBondContact N-O 3.33Å; L387-H465 VanDerWaalsContact N-O 3.08Å
388	P	92.4	Very high	83.4	Confident	20 Å²	20	56.9 Å²	56.9	13%	0.13	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	141.5	174.1	-20.5	31.7	0	0	0	112.3	V401 V404 D441 T462	P388-V401 HydrophobicContact CG-CG2 4.16Å; P388-V404 HydrophobicContact CB-CG2 4.03Å; P388-V404 HydrophobicContact CG-CG2 4.11Å; P388-D441 WeakPolarHBondContact CD-O 3.28Å; P388-D441 WeakPolarHBondContact CG-O 3.31Å; P388-T462 CarbonylContact C-O 3.58Å; P388-T462 WeakPolarHBondContact CA-O 3.27Å
389	R	88.9	Confident	82.7	Confident	56 Å²	56	54.9 Å²	54.9	21%	0.211	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-68.3	148.9	173	-65.4	-168.7	-179.7	-87.7	-1.3	110.7	S391 P399 G460 K461 T462 F463	R389-S391 VanDerWaalsContact C-N 3.26Å; R389-S391 VanDerWaalsContact CB-O 3.32Å; R389-S391 WeakPolarHBondContact CB-O 3.36Å; R389-S391 PolarHBondContact O-N 2.87Å; R389-P399 HydrophobicContact CB-CG 4.06Å; R389-P399 VanDerWaalsContact O-CD 3.29Å; R389-P399 WeakPolarHBondContact O-CD 3.39Å; R389-P399 WeakPolarHBondContact O-CG 3.38Å; R389-G460 PolarHBondContact NE-O 3.03Å; R389-G460 PolarHBondContact NH2-O 3.29Å; R389-K461 WeakPolarHBondContact CD-O 3.47Å; R389-T462 PolarHBondContact N-O 3.37Å; R389-F463 VanDerWaalsContact CG-C 3.5Å; R389-F463 PolarHBondContact NE-O 2.76Å; R389-F463 PolarHBondContact NH2-O 2.78Å
390	T	79.9	Confident	82.5	Confident	117 Å²	117	53.7 Å²	53.7	72%	0.718	30%	0.303	S	S	*	.	S	Bend	trans	-72.8	-16.8	171	47.2	0	0	0	0	113.5
391	S	76.3	Confident	82.1	Confident	63 Å²	63	54.6 Å²	54.6	44%	0.441	31%	0.309	S	S	.	.	S	Bend	trans	-154.1	148.9	166.6	57	0	0	0	0	111.3	R389	R389-S391 VanDerWaalsContact C-N 3.26Å; R389-S391 VanDerWaalsContact CB-O 3.32Å; R389-S391 WeakPolarHBondContact CB-O 3.36Å; R389-S391 PolarHBondContact O-N 2.87Å
392	S	66.9	Low	81.9	Confident	22 Å²	22	60 Å²	60	15%	0.154	33%	0.331	C	S	.	.			trans	-77.1	130.7	173.3	171.7	0	0	0	0	110.9	E394 G396 D397	S392-E394 PolarHBondContact O-N 3.47Å; S392-E394 PolarHBondContact OG-N 2.77Å; S392-G396 WeakPolarHBondContact O-CA 3.44Å; S392-G396 PolarHBondContact O-N 3.4Å; S392-D397 WeakPolarHBondContact CB-O 3.21Å; S392-D397 PolarHBondContact N-O 2.87Å
393	P	67.7	Low	81.8	Confident	97 Å²	97	61.2 Å²	61.2	63%	0.63	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.7	179	30	-35.5	0	0	0	113.9	K461	P393-K461 VanDerWaalsContact CD-O 3.28Å; P393-K461 WeakPolarHBondContact CD-O 3.32Å
394	E	66.2	Low	81.7	Confident	128 Å²	128	59.7 Å²	59.7	60%	0.598	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-32.7	179.9	-67.6	-176	148.8	0	0	113.1	S392 K461	S392-E394 PolarHBondContact O-N 3.47Å; S392-E394 PolarHBondContact OG-N 2.77Å; E394-K461 WeakPolarHBondContact OE1-CE 3.45Å; E394-K461 IonicContact OE1-NZ 2.84Å; E394-K461 PolarHBondContact OE1-NZ 3.13Å; E394-K461 WeakPolarHBondContact OE2-CE 3.34Å; E394-K461 IonicContact OE2-NZ 3.46Å; E394-K461 PolarHBondContact OE2-NZ 3.3Å
395	N	63	Low	81.6	Confident	121 Å²	121	63.3 Å²	63.3	65%	0.647	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	-17.4	-174.1	-74.1	9	0	0	0	115.3	D397	N395-D397 HydrophobicContact CB-CB 4.35Å; N395-D397 WeakPolarHBondContact CB-OD2 3.24Å; N395-D397 PolarHBondContact ND2-OD2 3.29Å; N395-D397 PolarHBondContact O-N 3.37Å
396	G	68.5	Low	81.4	Confident	49 Å²	49	65.7 Å²	65.7	51%	0.505	36%	0.362	S	S	.	.			trans	77.7	-20.1	-168.8	0	0	0	0	0	115.2	S392	S392-G396 WeakPolarHBondContact O-CA 3.44Å; S392-G396 PolarHBondContact O-N 3.4Å
397	D	71.9	Confident	81.3	Confident	106 Å²	106	67.4 Å²	67.4	57%	0.567	37%	0.37	S	S	*	.			trans	-54.5	147.2	173.2	-65.7	-49.9	0	0	0	112.3	S392 N395 P399	S392-D397 WeakPolarHBondContact CB-O 3.21Å; S392-D397 PolarHBondContact N-O 2.87Å; N395-D397 HydrophobicContact CB-CB 4.35Å; N395-D397 WeakPolarHBondContact CB-OD2 3.24Å; N395-D397 PolarHBondContact ND2-OD2 3.29Å; N395-D397 PolarHBondContact O-N 3.37Å; D397-P399 VanDerWaalsContact O-CD 3.3Å; D397-P399 WeakPolarHBondContact O-CD 3.35Å
398	I	78.5	Confident	81.2	Confident	128 Å²	128	67.4 Å²	67.4	66%	0.656	37%	0.37	S	S	*	.			trans	-80.2	113.3	175	-49	-179.8	0	0	0	108.7	T400	I398-T400 PolarHBondContact O-N 3.08Å
399	P	77.7	Confident	81.2	Confident	14 Å²	14	71.3 Å²	71.3	9%	0.091	38%	0.382	C	S	.	.			trans	-65.8	133.8	179.8	26.7	-34.7	0	0	0	111.6	R389 D397 D403 T462	R389-P399 HydrophobicContact CB-CG 4.06Å; R389-P399 VanDerWaalsContact O-CD 3.29Å; R389-P399 WeakPolarHBondContact O-CD 3.39Å; R389-P399 WeakPolarHBondContact O-CG 3.38Å; D397-P399 VanDerWaalsContact O-CD 3.3Å; D397-P399 WeakPolarHBondContact O-CD 3.35Å; P399-D403 HydrophobicContact CB-CB 4.48Å; P399-T462 HydrophobicContact CB-CG2 4.15Å; P399-T462 VanDerWaalsContact CG-O 3.31Å; P399-T462 WeakPolarHBondContact CG-O 3.41Å
400	T	83.9	Confident	81.2	Confident	74 Å²	74	72.9 Å²	72.9	45%	0.454	39%	0.394	S	S	.	.			trans	-82.8	161.8	175.4	74.6	0	0	0	0	111	I398 K402 D403 V404	I398-T400 PolarHBondContact O-N 3.08Å; T400-K402 PolarHBondContact O-N 3.08Å; T400-K402 WeakPolarHBondContact OG1-CB 3.45Å; T400-K402 PolarHBondContact OG1-N 3.03Å; T400-D403 WeakPolarHBondContact CA-OD2 3.4Å; T400-D403 VanDerWaalsContact CB-OD2 3.31Å; T400-D403 WeakPolarHBondContact CB-OD2 3.36Å; T400-D403 PolarHBondContact N-OD2 3.18Å; T400-D403 WeakPolarHBondContact O-CA 3.24Å; T400-D403 WeakPolarHBondContact O-CB 3.35Å; T400-D403 PolarHBondContact O-N 2.92Å; T400-D403 PolarHBondContact OG1-N 3.01Å; T400-D403 PolarHBondContact OG1-OD2 3.07Å; T400-V404 PolarHBondContact O-N 3.38Å; T400-V404 VanDerWaalsContact O-N 3.1Å
401	V	85.4	Confident	81.6	Confident	26 Å²	26	68.6 Å²	68.6	16%	0.158	37%	0.367	C	S	.	.	H	α-helix	trans	-55.9	-26.1	173	-175.5	0	0	0	0	112.2	P388 Y405 T424 D441 L443	P388-V401 HydrophobicContact CG-CG2 4.16Å; V401-Y405 PolarHBondContact O-N 2.89Å; V401-T424 HydrophobicContact CG1-CG2 4.17Å; V401-T424 HydrophobicContact CG2-CG2 4.26Å; V401-D441 HydrophobicContact CG2-CB 3.95Å; V401-L443 HydrophobicContact CG1-CB 4.19Å; V401-L443 HydrophobicContact CG1-CD1 3.99Å
402	K	87.5	Confident	82.2	Confident	144 Å²	144	66.4 Å²	66.4	63%	0.626	35%	0.351	S	S	*	.	H	α-helix	trans	-70	-34.8	174.1	-173.1	-174.9	176.3	-170.5	0	112.1	T400 Y405 M406	T400-K402 PolarHBondContact O-N 3.08Å; T400-K402 WeakPolarHBondContact OG1-CB 3.45Å; T400-K402 PolarHBondContact OG1-N 3.03Å; K402-Y405 WeakPolarHBondContact O-CB 3.36Å; K402-Y405 PolarHBondContact O-N 2.79Å; K402-M406 HydrophobicContact CG-CE 4.46Å; K402-M406 WeakPolarHBondContact O-CG 3.23Å; K402-M406 PolarHBondContact O-N 2.9Å
403	D	89.5	Confident	83.1	Confident	68 Å²	68	70 Å²	70	36%	0.364	38%	0.376	S	S	.	.	H	α-helix	trans	-74.3	-38.8	177.9	-51.1	-54.2	0	0	0	110.2	P399 T400 Y405 M406 E407 T462	P399-D403 HydrophobicContact CB-CB 4.48Å; T400-D403 WeakPolarHBondContact CA-OD2 3.4Å; T400-D403 VanDerWaalsContact CB-OD2 3.31Å; T400-D403 WeakPolarHBondContact CB-OD2 3.36Å; T400-D403 PolarHBondContact N-OD2 3.18Å; T400-D403 WeakPolarHBondContact O-CA 3.24Å; T400-D403 WeakPolarHBondContact O-CB 3.35Å; T400-D403 PolarHBondContact O-N 2.92Å; T400-D403 PolarHBondContact OG1-N 3.01Å; T400-D403 PolarHBondContact OG1-OD2 3.07Å; D403-Y405 VanDerWaalsContact C-N 3.3Å; D403-Y405 PolarHBondContact O-N 2.65Å; D403-M406 PolarHBondContact O-N 3.04Å; D403-M406 VanDerWaalsContact O-N 3.08Å; D403-E407 PolarHBondContact O-N 3.42Å; D403-T462 HydrophobicContact CB-CG2 4.18Å
404	V	91.4	Very high	84.1	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-58	-41	167.9	-178.9	0	0	0	0	111.7	L386 P388 T400 F408 L443 T462 F463	L386-V404 HydrophobicContact CB-CG1 3.93Å; L386-V404 HydrophobicContact CD1-CG1 4.29Å; P388-V404 HydrophobicContact CB-CG2 4.03Å; P388-V404 HydrophobicContact CG-CG2 4.11Å; T400-V404 PolarHBondContact O-N 3.38Å; T400-V404 VanDerWaalsContact O-N 3.1Å; V404-F408 VanDerWaalsContact O-CB 3.25Å; V404-F408 WeakPolarHBondContact O-CB 3.19Å; V404-F408 PolarHBondContact O-N 3.42Å; V404-L443 HydrophobicContact CG1-CB 4.36Å; V404-L443 HydrophobicContact CG1-CD2 4.11Å; V404-T462 VanDerWaalsContact CA-OG1 3.31Å; V404-T462 WeakPolarHBondContact CA-OG1 3.22Å; V404-F463 HydrophobicContact CG1-CB 4.16Å; V404-F463 HydrophobicContact CG1-CD1 4.37Å; V404-F463 HydrophobicContact CG2-CB 4.47Å
405	Y	93.4	Very high	85.2	Confident	77 Å²	77	67.7 Å²	67.7	30%	0.302	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-39.5	172.9	167.2	-92.3	0	0	0	112.8	V401 K402 D403 R409 F420 C422	V401-Y405 PolarHBondContact O-N 2.89Å; K402-Y405 WeakPolarHBondContact O-CB 3.36Å; K402-Y405 PolarHBondContact O-N 2.79Å; D403-Y405 VanDerWaalsContact C-N 3.3Å; D403-Y405 PolarHBondContact O-N 2.65Å; Y405-R409 VanDerWaalsContact O-CB 3.26Å; Y405-R409 WeakPolarHBondContact O-CB 3.18Å; Y405-R409 PolarHBondContact O-N 2.87Å; Y405-F420 HydrophobicContact CD2-CE2 4.34Å; Y405-F420 AromaticContact CE2-CE2 3.85Å; Y405-F420 HydrophobicContact CE2-CE2 3.85Å; Y405-F420 AromaticContact CE2-CZ 3.97Å; Y405-F420 HydrophobicContact CE2-CZ 3.97Å; Y405-C422 VanDerWaalsContact CD2-SG 3.53Å; Y405-C422 VanDerWaalsContact CE2-SG 3.56Å
406	M	92.2	Very high	86.4	Confident	66 Å²	66	70.2 Å²	70.2	33%	0.325	36%	0.36	S	S	.	.	H	α-helix	trans	-68.6	-45.2	178.3	-65.7	-63.6	168.2	0	0	111.5	K402 D403 R409 D410	K402-M406 HydrophobicContact CG-CE 4.46Å; K402-M406 WeakPolarHBondContact O-CG 3.23Å; K402-M406 PolarHBondContact O-N 2.9Å; D403-M406 PolarHBondContact O-N 3.04Å; D403-M406 VanDerWaalsContact O-N 3.08Å; M406-R409 PolarHBondContact O-N 3.11Å; M406-R409 PolarHBondContact SD-NH1 3.22Å; M406-D410 VanDerWaalsContact O-CG 3.3Å; M406-D410 PolarHBondContact O-N 3.35Å; M406-D410 VanDerWaalsContact O-N 3.09Å
407	E	92.4	Very high	87.4	Confident	37 Å²	37	68 Å²	68	17%	0.173	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-46.2	173.9	179.9	169.7	-146.4	0	0	111.2	D403 R409 D410 L411 G460 K461 T462 F463	D403-E407 PolarHBondContact O-N 3.42Å; E407-R409 VanDerWaalsContact C-N 3.34Å; E407-R409 PolarHBondContact O-N 3.36Å; E407-D410 PolarHBondContact O-N 3.09Å; E407-D410 VanDerWaalsContact O-N 3.11Å; E407-L411 HydrophobicContact CG-CD1 4.1Å; E407-L411 HydrophobicContact CG-CG 4.36Å; E407-L411 WeakPolarHBondContact O-CG 3.4Å; E407-L411 PolarHBondContact O-N 2.88Å; E407-G460 WeakPolarHBondContact OE1-CA 3.21Å; E407-K461 VanDerWaalsContact CD-N 3.35Å; E407-K461 WeakPolarHBondContact OE1-CB 3.29Å; E407-K461 PolarHBondContact OE1-N 3.4Å; E407-K461 PolarHBondContact OE2-N 3.47Å; E407-K461 VanDerWaalsContact OE2-N 3.12Å; E407-T462 HydrophobicContact CB-CG2 4.36Å; E407-T462 WeakPolarHBondContact OE2-CB 3.41Å; E407-T462 PolarHBondContact OE2-N 3.49Å; E407-T462 PolarHBondContact OE2-OG1 2.94Å; E407-F463 HydrophobicContact CG-CE1 4.23Å
408	F	92.1	Very high	88.1	Confident	3 Å²	3	65.8 Å²	65.8	1%	0.013	34%	0.34	C	S	.	.	H	α-helix	trans	-61.3	-42.4	177.9	-174.5	-92.8	0	0	0	112.2	I384 L386 V404 D410 L411 T412 I417 F420 V445 L454	I384-F408 HydrophobicContact CD1-CE2 3.8Å; I384-F408 HydrophobicContact CD1-CZ 4.12Å; L386-F408 HydrophobicContact CD1-CB 4.14Å; L386-F408 HydrophobicContact CD1-CD2 3.46Å; L386-F408 VanDerWaalsContact CD1-CD2 3.46Å; L386-F408 HydrophobicContact CD1-CE2 4.1Å; L386-F408 HydrophobicContact CD1-CG 3.91Å; V404-F408 VanDerWaalsContact O-CB 3.25Å; V404-F408 WeakPolarHBondContact O-CB 3.19Å; V404-F408 PolarHBondContact O-N 3.42Å; F408-D410 PolarHBondContact O-N 2.94Å; F408-L411 CarbonylContact O-C 3.49Å; F408-L411 WeakPolarHBondContact O-CB 3.42Å; F408-L411 PolarHBondContact O-N 2.95Å; F408-T412 HydrophobicContact CD1-CG2 3.86Å; F408-T412 HydrophobicContact CE1-CG2 3.46Å; F408-T412 VanDerWaalsContact CE1-CG2 3.46Å; F408-T412 HydrophobicContact CZ-CG2 4.1Å; F408-T412 VanDerWaalsContact O-CG2 3.23Å; F408-T412 WeakPolarHBondContact O-CG2 3.29Å; F408-T412 PolarHBondContact O-N 3.3Å; F408-I417 HydrophobicContact CZ-CD1 4.36Å; F408-F420 HydrophobicContact CD1-CD2 4.26Å; F408-F420 AromaticContact CD1-CE2 3.92Å; F408-F420 HydrophobicContact CD1-CE2 3.92Å; F408-F420 HydrophobicContact CD1-CZ 4.09Å; F408-F420 HydrophobicContact CE1-CD1 4.35Å; F408-F420 AromaticContact CE1-CD2 3.95Å; F408-F420 HydrophobicContact CE1-CD2 3.95Å; F408-F420 HydrophobicContact CE1-CE1 4.47Å; F408-F420 HydrophobicContact CE1-CE2 4.07Å; F408-F420 HydrophobicContact CE1-CG 4.08Å; F408-F420 HydrophobicContact CE1-CZ 4.33Å; F408-V445 HydrophobicContact CD1-CG1 4.43Å; F408-V445 HydrophobicContact CD1-CG2 4.34Å; F408-V445 HydrophobicContact CE1-CG1 3.67Å; F408-V445 HydrophobicContact CE1-CG2 4.31Å; F408-V445 HydrophobicContact CZ-CB 4.5Å; F408-V445 HydrophobicContact CZ-CG1 3.83Å; F408-V445 HydrophobicContact CZ-CG2 4.49Å; F408-L454 HydrophobicContact CE2-CD1 3.79Å; F408-L454 HydrophobicContact CZ-CD1 4.42Å
409	R	91.2	Very high	88.6	Confident	101 Å²	101	67.7 Å²	67.7	38%	0.381	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-40.9	175.4	-175.4	-156.9	67	-158.8	-8.7	110.6	Y405 M406 E407 T412 F420	Y405-R409 VanDerWaalsContact O-CB 3.26Å; Y405-R409 WeakPolarHBondContact O-CB 3.18Å; Y405-R409 PolarHBondContact O-N 2.87Å; M406-R409 PolarHBondContact O-N 3.11Å; M406-R409 PolarHBondContact SD-NH1 3.22Å; E407-R409 VanDerWaalsContact C-N 3.34Å; E407-R409 PolarHBondContact O-N 3.36Å; R409-T412 PolarHBondContact O-N 2.99Å; R409-T412 PolarHBondContact O-OG1 3.45Å; R409-F420 HydrophobicContact CB-CZ 4.36Å
410	D	89.8	Confident	89.3	Confident	89 Å²	89	69.4 Å²	69.4	48%	0.476	35%	0.349	S	S	.	.	H	α-helix	trans	-75.3	-37.2	-178.6	-63.4	-5.8	0	0	0	110.9	M406 E407 F408 T412 S413	M406-D410 VanDerWaalsContact O-CG 3.3Å; M406-D410 PolarHBondContact O-N 3.35Å; M406-D410 VanDerWaalsContact O-N 3.09Å; E407-D410 PolarHBondContact O-N 3.09Å; E407-D410 VanDerWaalsContact O-N 3.11Å; F408-D410 PolarHBondContact O-N 2.94Å; D410-T412 VanDerWaalsContact C-N 3.25Å; D410-T412 PolarHBondContact O-N 3.42Å; D410-S413 WeakPolarHBondContact O-CB 3.03Å; D410-S413 PolarHBondContact O-N 3.33Å; D410-S413 VanDerWaalsContact O-N 3.12Å
411	L	88.2	Confident	89.7	Confident	27 Å²	27	72.1 Å²	72.1	14%	0.141	35%	0.351	C	S	.	.	H	α-helix	trans	-59.2	-29.7	167.8	-72.3	172	0	0	0	113.2	E407 F408 S413 Q414 Y415 F463	E407-L411 HydrophobicContact CG-CD1 4.1Å; E407-L411 HydrophobicContact CG-CG 4.36Å; E407-L411 WeakPolarHBondContact O-CG 3.4Å; E407-L411 PolarHBondContact O-N 2.88Å; F408-L411 CarbonylContact O-C 3.49Å; F408-L411 WeakPolarHBondContact O-CB 3.42Å; F408-L411 PolarHBondContact O-N 2.95Å; L411-S413 PolarHBondContact O-N 3.32Å; L411-S413 VanDerWaalsContact O-N 3.16Å; L411-Q414 WeakPolarHBondContact O-CB 3.29Å; L411-Q414 PolarHBondContact O-N 2.99Å; L411-Y415 HydrophobicContact CD2-CE2 4.39Å; L411-Y415 PolarHBondContact O-N 2.88Å; L411-F463 HydrophobicContact CD1-CE1 3.69Å; L411-F463 HydrophobicContact CD1-CZ 3.77Å
412	T	89	Confident	90	Very high	17 Å²	17	73.3 Å²	73.3	10%	0.104	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-24.2	176.3	69.3	0	0	0	0	113.1	F408 R409 D410 K416 I417 F420	F408-T412 HydrophobicContact CD1-CG2 3.86Å; F408-T412 HydrophobicContact CE1-CG2 3.46Å; F408-T412 VanDerWaalsContact CE1-CG2 3.46Å; F408-T412 HydrophobicContact CZ-CG2 4.1Å; F408-T412 VanDerWaalsContact O-CG2 3.23Å; F408-T412 WeakPolarHBondContact O-CG2 3.29Å; F408-T412 PolarHBondContact O-N 3.3Å; R409-T412 PolarHBondContact O-N 2.99Å; R409-T412 PolarHBondContact O-OG1 3.45Å; D410-T412 VanDerWaalsContact C-N 3.25Å; D410-T412 PolarHBondContact O-N 3.42Å; T412-K416 CarbonylContact O-C 3.58Å; T412-K416 VanDerWaalsContact O-CA 3.3Å; T412-K416 WeakPolarHBondContact O-CA 3.38Å; T412-K416 PolarHBondContact O-N 3.29Å; T412-I417 WeakPolarHBondContact CB-O 3.34Å; T412-I417 HydrophobicContact CG2-CB 4.07Å; T412-I417 HydrophobicContact CG2-CG2 4.46Å; T412-I417 PolarHBondContact O-N 2.9Å; T412-F420 HydrophobicContact CG2-CD1 3.7Å; T412-F420 HydrophobicContact CG2-CE1 3.56Å; T412-F420 HydrophobicContact CG2-CZ 4.3Å
413	S	86	Confident	90.3	Very high	99 Å²	99	71.2 Å²	71.2	69%	0.692	35%	0.351	S	S	*	.	H	α-helix	trans	-71.6	-37.4	172.8	-60.5	0	0	0	0	112.3	D410 L411	D410-S413 WeakPolarHBondContact O-CB 3.03Å; D410-S413 PolarHBondContact O-N 3.33Å; D410-S413 VanDerWaalsContact O-N 3.12Å; L411-S413 PolarHBondContact O-N 3.32Å; L411-S413 VanDerWaalsContact O-N 3.16Å
414	Q	88.3	Confident	90.5	Very high	129 Å²	129	71.7 Å²	71.7	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-68.9	-47.5	176.7	177.4	176.5	-17.7	0	0	111.6	L411 K416	L411-Q414 WeakPolarHBondContact O-CB 3.29Å; L411-Q414 PolarHBondContact O-N 2.99Å; Q414-K416 VanDerWaalsContact C-N 3.35Å
415	Y	88.6	Confident	90.6	Very high	47 Å²	47	72.6 Å²	72.6	18%	0.184	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	7.6	-179	-68	-87	0	0	0	114.1	L411 I417 S452 L454 P455 L458	L411-Y415 HydrophobicContact CD2-CE2 4.39Å; L411-Y415 PolarHBondContact O-N 2.88Å; Y415-I417 VanDerWaalsContact C-N 3.27Å; Y415-I417 PolarHBondContact O-N 2.85Å; Y415-S452 PolarHBondContact O-OG 3.08Å; Y415-L454 HydrophobicContact CD1-CD2 3.54Å; Y415-L454 HydrophobicContact CD2-CD2 3.68Å; Y415-L454 HydrophobicContact CE1-CD2 4.02Å; Y415-L454 HydrophobicContact CE2-CD2 4.15Å; Y415-L454 HydrophobicContact CG-CD2 3.35Å; Y415-P455 HydrophobicContact CE1-CG 4.34Å; Y415-L458 HydrophobicContact CE2-CD2 4.12Å
416	K	89.4	Confident	90.7	Very high	173 Å²	173	75.7 Å²	75.7	75%	0.752	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	30.1	175	-54.9	174.9	-176.4	171.9	0	114.7	T412 Q414 G418 Y451	T412-K416 CarbonylContact O-C 3.58Å; T412-K416 VanDerWaalsContact O-CA 3.3Å; T412-K416 WeakPolarHBondContact O-CA 3.38Å; T412-K416 PolarHBondContact O-N 3.29Å; Q414-K416 VanDerWaalsContact C-N 3.35Å; K416-G418 PolarHBondContact O-N 3.27Å; K416-Y451 VanDerWaalsContact O-CD1 3.27Å; K416-Y451 WeakPolarHBondContact O-CD1 3.41Å
417	I	89.8	Confident	90.8	Very high	3 Å²	3	73.5 Å²	73.5	2%	0.015	37%	0.368	C	S	.	.			trans	-80.7	86.1	-179.7	-55.1	175	0	0	0	109.3	F408 T412 Y415 K419 F420 Y447 Y451 L454	F408-I417 HydrophobicContact CZ-CD1 4.36Å; T412-I417 WeakPolarHBondContact CB-O 3.34Å; T412-I417 HydrophobicContact CG2-CB 4.07Å; T412-I417 HydrophobicContact CG2-CG2 4.46Å; T412-I417 PolarHBondContact O-N 2.9Å; Y415-I417 VanDerWaalsContact C-N 3.27Å; Y415-I417 PolarHBondContact O-N 2.85Å; I417-K419 VanDerWaalsContact C-N 3.33Å; I417-K419 PolarHBondContact O-N 3.2Å; I417-F420 HydrophobicContact CG2-CB 4.3Å; I417-Y447 HydrophobicContact CD1-CD2 4.25Å; I417-Y447 HydrophobicContact CD1-CE2 4.06Å; I417-Y447 HydrophobicContact CG1-CD2 4.48Å; I417-Y447 HydrophobicContact CG2-CD2 4.01Å; I417-Y447 HydrophobicContact CG2-CG 4.02Å; I417-Y451 HydrophobicContact CG2-CD2 4.06Å; I417-Y451 HydrophobicContact CG2-CE2 4.48Å; I417-Y451 HydrophobicContact CG2-CG 4.29Å; I417-L454 HydrophobicContact CD1-CD2 4.13Å; I417-L454 HydrophobicContact CD1-CG 4.44Å
418	G	85.6	Confident	91	Very high	60 Å²	60	77.5 Å²	77.5	62%	0.619	38%	0.381	S	S	*	.			trans	-68	-22	-170.7	0	0	0	0	0	116.2	K416	K416-G418 PolarHBondContact O-N 3.27Å
419	K	89.1	Confident	91	Very high	168 Å²	168	77.4 Å²	77.4	73%	0.73	38%	0.381	S	S	*	.			trans	-147.3	132.4	173.7	-69.9	-173.8	-179.4	177.4	0	110.6	I417 Y451	I417-K419 VanDerWaalsContact C-N 3.33Å; I417-K419 PolarHBondContact O-N 3.2Å; K419-Y451 PolarHBondContact N-OH 3.46Å; K419-Y451 WeakPolarHBondContact O-CE2 3.5Å
420	F	92.5	Very high	91	Very high	50 Å²	50	72.9 Å²	72.9	22%	0.219	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	163.5	173.6	66.6	-84.2	0	0	0	110.6	Y405 F408 R409 T412 I417 C422 V445 R446	Y405-F420 HydrophobicContact CD2-CE2 4.34Å; Y405-F420 AromaticContact CE2-CE2 3.85Å; Y405-F420 HydrophobicContact CE2-CE2 3.85Å; Y405-F420 AromaticContact CE2-CZ 3.97Å; Y405-F420 HydrophobicContact CE2-CZ 3.97Å; F408-F420 HydrophobicContact CD1-CD2 4.26Å; F408-F420 AromaticContact CD1-CE2 3.92Å; F408-F420 HydrophobicContact CD1-CE2 3.92Å; F408-F420 HydrophobicContact CD1-CZ 4.09Å; F408-F420 HydrophobicContact CE1-CD1 4.35Å; F408-F420 AromaticContact CE1-CD2 3.95Å; F408-F420 HydrophobicContact CE1-CD2 3.95Å; F408-F420 HydrophobicContact CE1-CE1 4.47Å; F408-F420 HydrophobicContact CE1-CE2 4.07Å; F408-F420 HydrophobicContact CE1-CG 4.08Å; F408-F420 HydrophobicContact CE1-CZ 4.33Å; R409-F420 HydrophobicContact CB-CZ 4.36Å; T412-F420 HydrophobicContact CG2-CD1 3.7Å; T412-F420 HydrophobicContact CG2-CE1 3.56Å; T412-F420 HydrophobicContact CG2-CZ 4.3Å; I417-F420 HydrophobicContact CG2-CB 4.3Å; F420-C422 HydrophobicContact CD2-CB 4.33Å; F420-C422 HydrophobicContact CE2-CB 4.35Å; F420-V445 HydrophobicContact CB-CG1 4.1Å; F420-V445 HydrophobicContact CD2-CG1 3.88Å; F420-V445 HydrophobicContact CG-CG1 4.35Å; F420-R446 CarbonylContact C-O 3.53Å; F420-R446 WeakPolarHBondContact CA-O 3.28Å
421	R	91.6	Very high	91	Very high	130 Å²	130	68.8 Å²	68.8	49%	0.491	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	146	169.4	-59.1	-167.2	-76.5	160.8	-6.8	107.8	E381 V445 R446	E381-R421 IonicContact OE1-CZ 3.49Å; E381-R421 VanDerWaalsContact OE1-CZ 3.3Å; E381-R421 IonicContact OE1-NE 3.63Å; E381-R421 PolarHBondContact OE1-NE 2.62Å; E381-R421 IonicContact OE1-NH2 3.56Å; E381-R421 PolarHBondContact OE1-NH2 3.41Å; E381-R421 IonicContact OE2-CZ 3.5Å; E381-R421 IonicContact OE2-NE 3.58Å; E381-R421 IonicContact OE2-NH2 2.78Å; E381-R421 PolarHBondContact OE2-NH2 3.32Å; R421-V445 CarbonylContact O-C 3.57Å; R421-V445 WeakPolarHBondContact O-CA 3.23Å; R421-V445 WeakPolarHBondContact O-CG1 3.28Å; R421-R446 PolarHBondContact N-O 3.37Å; R421-R446 PolarHBondContact O-N 3.07Å
422	C	92.7	Very high	90.7	Very high	51 Å²	51	69.9 Å²	69.9	35%	0.345	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	152.3	177.7	60.6	0	0	0	0	111.7	Y405 F420 L443 E444 V445	Y405-C422 VanDerWaalsContact CD2-SG 3.53Å; Y405-C422 VanDerWaalsContact CE2-SG 3.56Å; F420-C422 HydrophobicContact CD2-CB 4.33Å; F420-C422 HydrophobicContact CE2-CB 4.35Å; C422-L443 HydrophobicContact CB-CD1 3.98Å; C422-L443 HydrophobicContact CB-CG 4.34Å; C422-E444 VanDerWaalsContact CA-O 3.27Å; C422-E444 WeakPolarHBondContact CA-O 3.32Å; C422-V445 HydrophobicContact CB-CG2 4.05Å
423	K	93	Very high	90.4	Very high	101 Å²	101	73.8 Å²	73.8	44%	0.439	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	149.5	171.8	48.1	158.8	-176.9	150.1	0	109.4	T425 E444	K423-T425 HydrophobicContact CD-CG2 3.69Å; K423-T425 HydrophobicContact CG-CG2 4.17Å; K423-E444 VanDerWaalsContact CE-OE1 3.26Å; K423-E444 WeakPolarHBondContact CE-OE1 3.45Å; K423-E444 WeakPolarHBondContact CE-OE2 3.4Å; K423-E444 HydrophobicContact CG-CB 4.24Å; K423-E444 PolarHBondContact N-O 3.47Å; K423-E444 VanDerWaalsContact NZ-CD 3.29Å; K423-E444 IonicContact NZ-OE1 2.8Å; K423-E444 PolarHBondContact NZ-OE1 2.85Å; K423-E444 IonicContact NZ-OE2 3.15Å; K423-E444 PolarHBondContact NZ-OE2 2.9Å; K423-E444 PolarHBondContact O-N 3.24Å
424	T	94.4	Very high	90	Very high	77 Å²	77	72 Å²	72	47%	0.472	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	139.2	163.3	-47.4	0	0	0	0	108.9	V401 D441 Y442	V401-T424 HydrophobicContact CG1-CG2 4.17Å; V401-T424 HydrophobicContact CG2-CG2 4.26Å; T424-D441 HydrophobicContact CG2-CB 3.95Å; T424-Y442 WeakPolarHBondContact CA-O 3.4Å
425	T	93.1	Very high	89.7	Confident	20 Å²	20	70.8 Å²	70.8	12%	0.123	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	121.9	171.7	51.5	0	0	0	0	110.2	K423 K427 Y442 E444	K423-T425 HydrophobicContact CD-CG2 3.69Å; K423-T425 HydrophobicContact CG-CG2 4.17Å; T425-K427 PolarHBondContact O-N 3.49Å; T425-Y442 PolarHBondContact N-O 3.27Å; T425-Y442 PolarHBondContact O-N 3.1Å; T425-Y442 PolarHBondContact OG1-O 2.88Å; T425-E444 HydrophobicContact CG2-CB 3.96Å
426	E	95.7	Very high	89.6	Confident	141 Å²	141	68.7 Å²	68.7	66%	0.659	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.7	132.3	160.2	-173.2	-178	-131.7	0	0	109	T439 S440	E426-T439 HydrophobicContact CG-CG2 3.71Å; E426-T439 WeakPolarHBondContact OE1-CG2 3.29Å; E426-S440 WeakPolarHBondContact CA-O 3.45Å
427	K	95.2	Very high	89.6	Confident	21 Å²	21	62.7 Å²	62.7	9%	0.091	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	149.3	179.1	-83.4	-63.3	-157.6	167.4	0	110.5	F385 T425 T439 S440 Y442 G899 Y900 I901	F385-K427 HydrophobicContact CD1-CG 4.32Å; F385-K427 HydrophobicContact CE1-CG 4.15Å; T425-K427 PolarHBondContact O-N 3.49Å; K427-T439 WeakPolarHBondContact O-CA 3.49Å; K427-S440 PolarHBondContact N-O 3.21Å; K427-S440 PolarHBondContact O-N 2.96Å; K427-Y442 HydrophobicContact CB-CD2 3.57Å; K427-Y442 HydrophobicContact CB-CE2 3.76Å; K427-Y442 HydrophobicContact CB-CG 4.33Å; K427-Y442 HydrophobicContact CG-CD2 4.44Å; K427-G899 WeakPolarHBondContact CD-O 3.35Å; K427-Y900 PolarHBondContact NZ-O 2.84Å; K427-I901 HydrophobicContact CB-CD1 3.71Å; K427-I901 HydrophobicContact CB-CG1 3.92Å; K427-I901 HydrophobicContact CD-CG1 4.03Å; K427-I901 HydrophobicContact CG-CD1 3.91Å; K427-I901 HydrophobicContact CG-CG1 3.85Å
428	R	94.9	Very high	89.5	Confident	120 Å²	120	69.4 Å²	69.4	45%	0.453	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	153.4	175.5	-58.2	-171.9	-177.4	174	3.6	112.1	E438 T439 G899 Y900 I901	R428-E438 CarbonylContact C-O 3.6Å; R428-E438 WeakPolarHBondContact CA-O 3.45Å; R428-E438 WeakPolarHBondContact CB-O 2.84Å; R428-T439 HydrophobicContact CG-CG2 4.41Å; R428-G899 PolarHBondContact N-O 2.8Å; R428-Y900 HydrophobicContact CB-CD1 3.5Å; R428-Y900 VanDerWaalsContact CB-CD1 3.5Å; R428-Y900 HydrophobicContact CB-CD2 4.25Å; R428-Y900 HydrophobicContact CB-CE1 3.49Å; R428-Y900 VanDerWaalsContact CB-CE1 3.49Å; R428-Y900 HydrophobicContact CB-CE2 4.25Å; R428-Y900 HydrophobicContact CB-CG 3.88Å; R428-Y900 CarbonylContact O-C 3.56Å; R428-Y900 WeakPolarHBondContact O-CA 3.47Å; R428-I901 PolarHBondContact O-N 2.84Å
429	Y	93.5	Very high	89.8	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.008	34%	0.34	C	S	.	.			trans	-149.2	145.2	176.7	-179.9	-91.8	0	0	0	110.6	F431 E432 Y433 V436 E438 F467 I901 R982	Y429-F431 AromaticContact CD2-CD2 3.88Å; Y429-F431 HydrophobicContact CD2-CD2 3.88Å; Y429-F431 HydrophobicContact CE1-CB 4.38Å; Y429-F431 HydrophobicContact CE2-CB 4.02Å; Y429-F431 AromaticContact CE2-CD2 3.75Å; Y429-F431 HydrophobicContact CE2-CD2 3.75Å; Y429-F431 HydrophobicContact CE2-CG 4.38Å; Y429-E432 PolarHBondContact OH-N 2.99Å; Y429-E432 PolarHBondContact OH-OE1 3.28Å; Y429-Y433 AromaticContact CZ-CD2 3.97Å; Y429-Y433 WeakPolarHBondContact OH-CD2 3.44Å; Y429-Y433 PolarHBondContact OH-N 2.92Å; Y429-Y433 VanDerWaalsContact OH-N 3.13Å; Y429-V436 HydrophobicContact CD1-CB 3.76Å; Y429-V436 HydrophobicContact CD1-CG1 3.39Å; Y429-V436 HydrophobicContact CE1-CB 3.95Å; Y429-V436 HydrophobicContact CE1-CG1 4.03Å; Y429-V436 HydrophobicContact CE1-CG2 4.41Å; Y429-V436 HydrophobicContact CG-CG1 3.76Å; Y429-E438 PolarHBondContact N-O 2.86Å; Y429-F467 HydrophobicContact CD2-CE1 4.43Å; Y429-F467 HydrophobicContact CD2-CZ 4.45Å; Y429-F467 AromaticContact CE2-CE1 3.88Å; Y429-F467 HydrophobicContact CE2-CE1 3.88Å; Y429-F467 HydrophobicContact CE2-CZ 4.17Å; Y429-I901 HydrophobicContact CD2-CG2 4.41Å; Y429-R982 PolarHBondContact O-NH2 3.09Å
430	A	90.3	Very high	90	Very high	5 Å²	5	63 Å²	63	4%	0.041	32%	0.316	C	S	.	.			trans	-154.8	24	-169.8	0	0	0	0	0	114.4	Y900 F977 T978	A430-Y900 HydrophobicContact CB-CD1 4.5Å; A430-Y900 HydrophobicContact CB-CE1 4.13Å; A430-F977 HydrophobicContact CB-CB 4.31Å; A430-T978 HydrophobicContact CB-CG2 3.86Å
431	F	90.3	Very high	90.1	Very high	3 Å²	3	64.5 Å²	64.5	1%	0.013	33%	0.326	C	S	.	.	S	Bend	trans	-115.4	-144.6	-169.8	-50.4	-82.3	0	0	0	112.1	Y429 Y433 F895 I901 P903 F977 F1094	Y429-F431 AromaticContact CD2-CD2 3.88Å; Y429-F431 HydrophobicContact CD2-CD2 3.88Å; Y429-F431 HydrophobicContact CE1-CB 4.38Å; Y429-F431 HydrophobicContact CE2-CB 4.02Å; Y429-F431 AromaticContact CE2-CD2 3.75Å; Y429-F431 HydrophobicContact CE2-CD2 3.75Å; Y429-F431 HydrophobicContact CE2-CG 4.38Å; F431-Y433 VanDerWaalsContact C-N 3.28Å; F431-Y433 PolarHBondContact O-N 2.64Å; F431-Y433 VanDerWaalsContact O-N 3.11Å; F431-F895 HydrophobicContact CE1-CD2 4.23Å; F431-F895 HydrophobicContact CE1-CE1 4.09Å; F431-F895 AromaticContact CE1-CE2 3.78Å; F431-F895 HydrophobicContact CE1-CE2 3.78Å; F431-F895 AromaticContact CE1-CZ 3.71Å; F431-F895 HydrophobicContact CE1-CZ 3.71Å; F431-F895 HydrophobicContact CE2-CD1 4.47Å; F431-F895 AromaticContact CZ-CD1 3.65Å; F431-F895 HydrophobicContact CZ-CD1 3.65Å; F431-F895 AromaticContact CZ-CD2 3.82Å; F431-F895 HydrophobicContact CZ-CD2 3.82Å; F431-F895 AromaticContact CZ-CE1 3.61Å; F431-F895 HydrophobicContact CZ-CE1 3.61Å; F431-F895 AromaticContact CZ-CE2 3.77Å; F431-F895 HydrophobicContact CZ-CE2 3.77Å; F431-F895 AromaticContact CZ-CG 3.78Å; F431-F895 HydrophobicContact CZ-CG 3.78Å; F431-F895 AromaticContact CZ-CZ 3.67Å; F431-F895 HydrophobicContact CZ-CZ 3.67Å; F431-I901 VanDerWaalsContact CE2-O 3.28Å; F431-I901 WeakPolarHBondContact CE2-O 3.33Å; F431-P903 HydrophobicContact CB-CG 3.88Å; F431-P903 HydrophobicContact CD1-CG 3.89Å; F431-P903 HydrophobicContact CD2-CG 3.99Å; F431-P903 HydrophobicContact CE1-CG 4.43Å; F431-P903 HydrophobicContact CG-CG 3.64Å; F431-F977 HydrophobicContact CD1-CB 4.46Å; F431-F977 AromaticContact CD1-CD1 3.52Å; F431-F977 HydrophobicContact CD1-CD1 3.52Å; F431-F977 AromaticContact CD1-CE1 3.87Å; F431-F977 HydrophobicContact CD1-CE1 3.87Å; F431-F977 HydrophobicContact CD1-CG 4.06Å; F431-F977 HydrophobicContact CE1-CB 4.32Å; F431-F977 AromaticContact CE1-CD1 3.85Å; F431-F977 HydrophobicContact CE1-CD1 3.85Å; F431-F977 HydrophobicContact CE1-CD2 4.38Å; F431-F977 HydrophobicContact CE1-CE1 4.2Å; F431-F977 AromaticContact CE1-CG 3.94Å; F431-F977 HydrophobicContact CE1-CG 3.94Å; F431-F1094 HydrophobicContact CD1-CD1 4.26Å; F431-F1094 HydrophobicContact CD1-CE1 4.48Å; F431-F1094 AromaticContact CE1-CD1 3.76Å; F431-F1094 HydrophobicContact CE1-CD1 3.76Å; F431-F1094 AromaticContact CE1-CE1 3.72Å; F431-F1094 HydrophobicContact CE1-CE1 3.72Å; F431-F1094 HydrophobicContact CZ-CD1 4.49Å; F431-F1094 AromaticContact CZ-CE1 4Å; F431-F1094 HydrophobicContact CZ-CE1 4Å
432	E	81.5	Confident	90.2	Very high	50 Å²	50	58.3 Å²	58.3	23%	0.234	30%	0.303	C	S	.	.	S	Bend	trans	-56.6	-28.1	-165.6	60.6	-76.5	168.7	0	0	116.5	Y429 A434	Y429-E432 PolarHBondContact OH-N 2.99Å; Y429-E432 PolarHBondContact OH-OE1 3.28Å; E432-A434 PolarHBondContact O-N 2.6Å
433	Y	83.5	Confident	90.3	Very high	100 Å²	100	56.1 Å²	56.1	39%	0.392	29%	0.288	S	S	.	.			trans	-90.5	107.6	-174.4	-64.1	-60.1	0	0	0	111.5	Y429 F431 D435 V436 F467 R982	Y429-Y433 AromaticContact CZ-CD2 3.97Å; Y429-Y433 WeakPolarHBondContact OH-CD2 3.44Å; Y429-Y433 PolarHBondContact OH-N 2.92Å; Y429-Y433 VanDerWaalsContact OH-N 3.13Å; F431-Y433 VanDerWaalsContact C-N 3.28Å; F431-Y433 PolarHBondContact O-N 2.64Å; F431-Y433 VanDerWaalsContact O-N 3.11Å; Y433-D435 VanDerWaalsContact C-N 3.34Å; Y433-V436 HydrophobicContact CG-CG2 4.36Å; Y433-F467 AromaticContact CD2-CE1 3.89Å; Y433-F467 HydrophobicContact CD2-CE1 3.89Å; Y433-F467 HydrophobicContact CD2-CZ 4.07Å; Y433-F467 HydrophobicContact CE2-CE1 4.02Å; Y433-R982 PolarHBondContact O-NH1 2.85Å
434	A	76.2	Confident	90.5	Very high	60 Å²	60	51.6 Å²	51.6	50%	0.496	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-19.4	-180	0	0	0	0	0	114.2	E432	E432-A434 PolarHBondContact O-N 2.6Å
435	D	82.4	Confident	90.5	Very high	104 Å²	104	47.9 Å²	47.9	56%	0.556	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-13.3	178.4	66.1	-50.7	0	0	0	113.7	Y433 H465	Y433-D435 VanDerWaalsContact C-N 3.34Å; D435-H465 IonicContact OD1-NE2 3.95Å; D435-H465 PolarHBondContact OD1-NE2 3.29Å; D435-H465 IonicContact OD2-CD2 3.26Å; D435-H465 IonicContact OD2-CE1 2.71Å; D435-H465 IonicContact OD2-NE2 3.45Å; D435-H465 PolarHBondContact OD2-NE2 2.86Å
436	V	87.9	Confident	90.5	Very high	3 Å²	3	48 Å²	48	2%	0.018	24%	0.244	C	C	.	.	S	Bend	trans	-82.4	126.7	178.5	174.8	0	0	0	0	110.2	L387 Y429 Y433 Y442 F467 R982	L387-V436 HydrophobicContact CD2-CB 4.21Å; L387-V436 HydrophobicContact CD2-CG1 3.91Å; L387-V436 HydrophobicContact CD2-CG2 3.79Å; Y429-V436 HydrophobicContact CD1-CB 3.76Å; Y429-V436 HydrophobicContact CD1-CG1 3.39Å; Y429-V436 HydrophobicContact CE1-CB 3.95Å; Y429-V436 HydrophobicContact CE1-CG1 4.03Å; Y429-V436 HydrophobicContact CE1-CG2 4.41Å; Y429-V436 HydrophobicContact CG-CG1 3.76Å; Y433-V436 HydrophobicContact CG-CG2 4.36Å; V436-Y442 WeakPolarHBondContact CG1-OH 3.37Å; V436-F467 HydrophobicContact CG2-CZ 4.17Å; V436-R982 VanDerWaalsContact O-CZ 3.25Å; V436-R982 PolarHBondContact O-NH1 3.35Å; V436-R982 PolarHBondContact O-NH2 3.34Å; V436-R982 VanDerWaalsContact O-NH2 3.12Å
437	P	89.1	Confident	90.3	Very high	48 Å²	48	41.3 Å²	41.3	31%	0.312	21%	0.213	S	C	.	.			trans	-62.9	156.6	177.4	26.8	-36.7	0	0	0	113.5	L387	L387-P437 HydrophobicContact CD1-CG 4.2Å
438	E	87	Confident	90.1	Very high	143 Å²	143	42.1 Å²	42.1	67%	0.668	22%	0.223	S	C	*	.	S	Bend	trans	-65.7	-35.6	179.5	-71	175.7	-174.4	0	0	113.9	R428 Y429 R982	R428-E438 CarbonylContact C-O 3.6Å; R428-E438 WeakPolarHBondContact CA-O 3.45Å; R428-E438 WeakPolarHBondContact CB-O 2.84Å; Y429-E438 PolarHBondContact N-O 2.86Å; E438-R982 VanDerWaalsContact CA-NH2 3.34Å
439	T	92.8	Very high	89.7	Confident	62 Å²	62	36.9 Å²	36.9	38%	0.38	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	136.3	174.7	-57.5	0	0	0	0	108.2	E426 K427 R428	E426-T439 HydrophobicContact CG-CG2 3.71Å; E426-T439 WeakPolarHBondContact OE1-CG2 3.29Å; K427-T439 WeakPolarHBondContact O-CA 3.49Å; R428-T439 HydrophobicContact CG-CG2 4.41Å
440	S	93.1	Very high	89.4	Confident	33 Å²	33	41.6 Å²	41.6	23%	0.231	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	164.9	177.6	-156.2	0	0	0	0	112.3	E426 K427 Y442	E426-S440 WeakPolarHBondContact CA-O 3.45Å; K427-S440 PolarHBondContact N-O 3.21Å; K427-S440 PolarHBondContact O-N 2.96Å; S440-Y442 VanDerWaalsContact O-CD2 3.32Å; S440-Y442 WeakPolarHBondContact O-CD2 3.06Å
441	D	93.5	Very high	89.3	Confident	81 Å²	81	44.3 Å²	44.3	43%	0.433	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	109.7	170.5	-88.9	-38.3	0	0	0	110.3	P388 V401 T424	P388-D441 WeakPolarHBondContact CD-O 3.28Å; P388-D441 WeakPolarHBondContact CG-O 3.31Å; V401-D441 HydrophobicContact CG2-CB 3.95Å; T424-D441 HydrophobicContact CG2-CB 3.95Å
442	Y	94.6	Very high	89	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	152.2	175.8	-65.8	-112.1	0	0	0	110.3	F385 L386 L387 T424 T425 K427 V436 S440 E444 F467 I901	F385-Y442 HydrophobicContact CB-CD1 3.95Å; F385-Y442 HydrophobicContact CB-CG 4.42Å; L386-Y442 WeakPolarHBondContact O-CA 3.41Å; L387-Y442 HydrophobicContact CB-CD1 3.98Å; L387-Y442 HydrophobicContact CB-CE1 3.69Å; L387-Y442 HydrophobicContact CD1-CD1 4.34Å; L387-Y442 HydrophobicContact CD1-CE1 3.78Å; L387-Y442 HydrophobicContact CD1-CE2 4.24Å; L387-Y442 HydrophobicContact CG-CE1 4.21Å; T424-Y442 WeakPolarHBondContact CA-O 3.4Å; T425-Y442 PolarHBondContact N-O 3.27Å; T425-Y442 PolarHBondContact O-N 3.1Å; T425-Y442 PolarHBondContact OG1-O 2.88Å; K427-Y442 HydrophobicContact CB-CD2 3.57Å; K427-Y442 HydrophobicContact CB-CE2 3.76Å; K427-Y442 HydrophobicContact CB-CG 4.33Å; K427-Y442 HydrophobicContact CG-CD2 4.44Å; V436-Y442 WeakPolarHBondContact CG1-OH 3.37Å; S440-Y442 VanDerWaalsContact O-CD2 3.32Å; S440-Y442 WeakPolarHBondContact O-CD2 3.06Å; Y442-E444 PolarHBondContact O-N 2.81Å; Y442-F467 HydrophobicContact CE1-CD2 4.06Å; Y442-F467 HydrophobicContact CE1-CE2 4.02Å; Y442-I901 HydrophobicContact CD1-CD1 3.5Å; Y442-I901 VanDerWaalsContact CD1-CD1 3.5Å; Y442-I901 HydrophobicContact CD2-CD1 4.02Å; Y442-I901 HydrophobicContact CE1-CD1 3.38Å; Y442-I901 HydrophobicContact CE2-CD1 3.93Å; Y442-I901 HydrophobicContact CG-CD1 3.81Å
443	L	95.5	Very high	89.3	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.026	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	98.7	165.2	-170.9	65.4	0	0	0	108.6	L386 V401 V404 C422 V445	L386-L443 HydrophobicContact CB-CB 4.31Å; L386-L443 HydrophobicContact CD1-CB 4.5Å; L386-L443 HydrophobicContact CD1-CD2 4.17Å; L386-L443 PolarHBondContact N-O 3.44Å; L386-L443 VanDerWaalsContact N-O 3.14Å; L386-L443 PolarHBondContact O-N 3.3Å; L386-L443 VanDerWaalsContact O-N 3.08Å; V401-L443 HydrophobicContact CG1-CB 4.19Å; V401-L443 HydrophobicContact CG1-CD1 3.99Å; V404-L443 HydrophobicContact CG1-CB 4.36Å; V404-L443 HydrophobicContact CG1-CD2 4.11Å; C422-L443 HydrophobicContact CB-CD1 3.98Å; C422-L443 HydrophobicContact CB-CG 4.34Å; L443-V445 HydrophobicContact CD2-CG2 4.05Å; L443-V445 HydrophobicContact CG-CG2 3.86Å; L443-V445 PolarHBondContact O-N 3.11Å
444	E	95.3	Very high	89.6	Confident	5 Å²	5	42.4 Å²	42.4	2%	0.023	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	113.3	169	-175.1	-173.9	134.6	0	0	107.8	R383 I384 F385 C422 K423 T425 Y442 R446	R383-E444 HydrophobicContact CG-CG 4.16Å; R383-E444 IonicContact CZ-OE1 3.93Å; R383-E444 IonicContact CZ-OE2 3.54Å; R383-E444 IonicContact NE-OE1 3.73Å; R383-E444 PolarHBondContact NE-OE1 2.88Å; R383-E444 IonicContact NE-OE2 2.77Å; R383-E444 PolarHBondContact NE-OE2 3.42Å; R383-E444 IonicContact NH2-OE1 2.61Å; R383-E444 PolarHBondContact NH2-OE1 2.97Å; R383-E444 IonicContact NH2-OE2 2.81Å; R383-E444 PolarHBondContact NH2-OE2 3.16Å; I384-E444 WeakPolarHBondContact O-CA 3.49Å; F385-E444 HydrophobicContact CD1-CB 3.78Å; F385-E444 HydrophobicContact CD1-CG 4Å; F385-E444 HydrophobicContact CE1-CB 3.73Å; F385-E444 HydrophobicContact CE1-CG 3.6Å; F385-E444 WeakPolarHBondContact CE1-OE2 3.32Å; F385-E444 HydrophobicContact CZ-CG 4.15Å; C422-E444 VanDerWaalsContact CA-O 3.27Å; C422-E444 WeakPolarHBondContact CA-O 3.32Å; K423-E444 VanDerWaalsContact CE-OE1 3.26Å; K423-E444 WeakPolarHBondContact CE-OE1 3.45Å; K423-E444 WeakPolarHBondContact CE-OE2 3.4Å; K423-E444 HydrophobicContact CG-CB 4.24Å; K423-E444 PolarHBondContact N-O 3.47Å; K423-E444 VanDerWaalsContact NZ-CD 3.29Å; K423-E444 IonicContact NZ-OE1 2.8Å; K423-E444 PolarHBondContact NZ-OE1 2.85Å; K423-E444 IonicContact NZ-OE2 3.15Å; K423-E444 PolarHBondContact NZ-OE2 2.9Å; K423-E444 PolarHBondContact O-N 3.24Å; T425-E444 HydrophobicContact CG2-CB 3.96Å; Y442-E444 PolarHBondContact O-N 2.81Å; E444-R446 IonicContact OE1-CZ 3.98Å; E444-R446 IonicContact OE1-NE 2.67Å; E444-R446 PolarHBondContact OE1-NE 3.22Å; E444-R446 IonicContact OE1-NH2 3.14Å; E444-R446 PolarHBondContact OE1-NH2 3.37Å; E444-R446 VanDerWaalsContact OE1-NH2 3.1Å
445	V	94.7	Very high	90.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.5	175.1	-175.9	0	0	0	0	109.5	I384 L386 F408 F420 R421 C422 L443 Y447	I384-V445 HydrophobicContact CD1-CB 4.06Å; I384-V445 HydrophobicContact CG1-CB 3.71Å; I384-V445 HydrophobicContact CG1-CG1 4.49Å; I384-V445 HydrophobicContact CG1-CG2 4.5Å; I384-V445 PolarHBondContact N-O 3.36Å; I384-V445 PolarHBondContact O-N 2.78Å; L386-V445 HydrophobicContact CD1-CG2 3.94Å; F408-V445 HydrophobicContact CD1-CG1 4.43Å; F408-V445 HydrophobicContact CD1-CG2 4.34Å; F408-V445 HydrophobicContact CE1-CG1 3.67Å; F408-V445 HydrophobicContact CE1-CG2 4.31Å; F408-V445 HydrophobicContact CZ-CB 4.5Å; F408-V445 HydrophobicContact CZ-CG1 3.83Å; F408-V445 HydrophobicContact CZ-CG2 4.49Å; F420-V445 HydrophobicContact CB-CG1 4.1Å; F420-V445 HydrophobicContact CD2-CG1 3.88Å; F420-V445 HydrophobicContact CG-CG1 4.35Å; R421-V445 CarbonylContact O-C 3.57Å; R421-V445 WeakPolarHBondContact O-CA 3.23Å; R421-V445 WeakPolarHBondContact O-CG1 3.28Å; C422-V445 HydrophobicContact CB-CG2 4.05Å; L443-V445 HydrophobicContact CD2-CG2 4.05Å; L443-V445 HydrophobicContact CG-CG2 3.86Å; L443-V445 PolarHBondContact O-N 3.11Å; V445-Y447 HydrophobicContact CG1-CD1 4.43Å
446	R	93.2	Very high	90.4	Very high	22 Å²	22	39.3 Å²	39.3	8%	0.083	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.2	170.5	-63.2	-166.8	-173.8	-144.4	8.2	111.5	E381 R382 R383 F420 R421 E444 D480 S514	E381-R446 HydrophobicContact CB-CB 4.09Å; E381-R446 WeakPolarHBondContact OE2-CD 3.49Å; R382-R446 VanDerWaalsContact O-CA 3.22Å; R382-R446 WeakPolarHBondContact O-CA 3.26Å; R383-R446 HydrophobicContact CB-CG 4.31Å; R383-R446 HydrophobicContact CG-CG 4.27Å; F420-R446 CarbonylContact C-O 3.53Å; F420-R446 WeakPolarHBondContact CA-O 3.28Å; R421-R446 PolarHBondContact N-O 3.37Å; R421-R446 PolarHBondContact O-N 3.07Å; E444-R446 IonicContact OE1-CZ 3.98Å; E444-R446 IonicContact OE1-NE 2.67Å; E444-R446 PolarHBondContact OE1-NE 3.22Å; E444-R446 IonicContact OE1-NH2 3.14Å; E444-R446 PolarHBondContact OE1-NH2 3.37Å; E444-R446 VanDerWaalsContact OE1-NH2 3.1Å; R446-D480 IonicContact CZ-OD2 3.89Å; R446-D480 IonicContact NH1-OD2 2.65Å; R446-D480 PolarHBondContact NH1-OD2 3Å; R446-D480 IonicContact NH2-OD1 2.85Å; R446-D480 IonicContact NH2-OD2 3.66Å; R446-D480 PolarHBondContact NH2-OD2 2.77Å; R446-D480 VanDerWaalsContact NH2-OD2 3.15Å; R446-S514 PolarHBondContact NH1-OG 2.87Å
447	Y	93	Very high	90.4	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	155.4	178.6	63.6	-83	0	0	0	111.7	E381 R382 I384 I417 V445 Y451	E381-Y447 CarbonylContact C-O 3.54Å; E381-Y447 VanDerWaalsContact CA-O 3.27Å; E381-Y447 WeakPolarHBondContact CA-O 3.3Å; E381-Y447 WeakPolarHBondContact CB-O 3.48Å; R382-Y447 HydrophobicContact CB-CD1 4.33Å; R382-Y447 HydrophobicContact CB-CE1 3.97Å; R382-Y447 HydrophobicContact CB-CE2 4.23Å; R382-Y447 WeakPolarHBondContact CD-OH 3.32Å; R382-Y447 HydrophobicContact CG-CE2 4.39Å; R382-Y447 PolarHBondContact N-O 3.07Å; R382-Y447 PolarHBondContact O-N 2.71Å; R382-Y447 VanDerWaalsContact O-N 3.15Å; I384-Y447 HydrophobicContact CD1-CE1 4.03Å; I384-Y447 HydrophobicContact CG1-CE1 4.32Å; I384-Y447 HydrophobicContact CG2-CE1 4.31Å; I417-Y447 HydrophobicContact CD1-CD2 4.25Å; I417-Y447 HydrophobicContact CD1-CE2 4.06Å; I417-Y447 HydrophobicContact CG1-CD2 4.48Å; I417-Y447 HydrophobicContact CG2-CD2 4.01Å; I417-Y447 HydrophobicContact CG2-CG 4.02Å; V445-Y447 HydrophobicContact CG1-CD1 4.43Å; Y447-Y451 HydrophobicContact CD2-CD2 4.22Å
448	A	90.3	Very high	90.4	Very high	37 Å²	37	44.5 Å²	44.5	31%	0.306	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	141.1	-173.4	0	0	0	0	0	112.4	S450 Y451	A448-S450 PolarHBondContact O-N 2.66Å; A448-Y451 HydrophobicContact CB-CD2 4.08Å; A448-Y451 HydrophobicContact CB-CE2 4.04Å; A448-Y451 WeakPolarHBondContact O-CD2 3.48Å; A448-Y451 PolarHBondContact O-N 2.88Å
449	A	86.9	Confident	90.5	Very high	10 Å²	10	42.7 Å²	42.7	8%	0.083	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-15.3	179.7	0	0	0	0	0	115.5	P352 L380 Y451 F473	P352-A449 HydrophobicContact CB-CB 4.32Å; L380-A449 WeakPolarHBondContact O-CB 3.41Å; A449-Y451 PolarHBondContact O-N 2.61Å; A449-F473 HydrophobicContact CB-CE1 3.59Å; A449-F473 HydrophobicContact CB-CE2 4.2Å; A449-F473 HydrophobicContact CB-CZ 3.35Å
450	S	86.1	Confident	90.3	Very high	102 Å²	102	40.3 Å²	40.3	71%	0.713	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-13.6	174.8	51.9	0	0	0	0	114	A448	A448-S450 PolarHBondContact O-N 2.66Å
451	Y	88.7	Confident	90	Very high	61 Å²	61	43.5 Å²	43.5	24%	0.239	26%	0.255	C	S	.	.	S	Bend	trans	-89.5	151	167.1	-54.5	-67.5	0	0	0	110.7	K416 I417 K419 Y447 A448 A449	K416-Y451 VanDerWaalsContact O-CD1 3.27Å; K416-Y451 WeakPolarHBondContact O-CD1 3.41Å; I417-Y451 HydrophobicContact CG2-CD2 4.06Å; I417-Y451 HydrophobicContact CG2-CE2 4.48Å; I417-Y451 HydrophobicContact CG2-CG 4.29Å; K419-Y451 PolarHBondContact N-OH 3.46Å; K419-Y451 WeakPolarHBondContact O-CE2 3.5Å; Y447-Y451 HydrophobicContact CD2-CD2 4.22Å; A448-Y451 HydrophobicContact CB-CD2 4.08Å; A448-Y451 HydrophobicContact CB-CE2 4.04Å; A448-Y451 WeakPolarHBondContact O-CD2 3.48Å; A448-Y451 PolarHBondContact O-N 2.88Å; A449-Y451 PolarHBondContact O-N 2.61Å
452	S	84.5	Confident	89.8	Confident	66 Å²	66	40.6 Å²	40.6	46%	0.462	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-57	141.6	175.4	39.1	0	0	0	0	111.8	Y415	Y415-S452 PolarHBondContact O-OG 3.08Å
453	A	86.5	Confident	89.7	Confident	37 Å²	37	40.7 Å²	40.7	31%	0.306	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-61.5	154.6	167	0	0	0	0	0	110.7
454	L	90.8	Very high	89.5	Confident	11 Å²	11	41.1 Å²	41.1	6%	0.058	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-87.5	152.5	170	-62.1	176.6	0	0	0	109.7	I384 F408 Y415 I417 L458 I466	I384-L454 HydrophobicContact CD1-CD1 3.81Å; F408-L454 HydrophobicContact CE2-CD1 3.79Å; F408-L454 HydrophobicContact CZ-CD1 4.42Å; Y415-L454 HydrophobicContact CD1-CD2 3.54Å; Y415-L454 HydrophobicContact CD2-CD2 3.68Å; Y415-L454 HydrophobicContact CE1-CD2 4.02Å; Y415-L454 HydrophobicContact CE2-CD2 4.15Å; Y415-L454 HydrophobicContact CG-CD2 3.35Å; I417-L454 HydrophobicContact CD1-CD2 4.13Å; I417-L454 HydrophobicContact CD1-CG 4.44Å; L454-L458 HydrophobicContact CB-CD2 4.27Å; L454-L458 HydrophobicContact CD1-CD2 4.4Å; L454-L458 HydrophobicContact CD2-CD2 4.3Å; L454-I466 HydrophobicContact CB-CD1 4.06Å; L454-I466 HydrophobicContact CD1-CD1 3.75Å
455	P	90.2	Very high	89.3	Confident	47 Å²	47	42.2 Å²	42.2	31%	0.305	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-62.8	145.1	171.2	-15.9	29.5	0	0	0	111.3	Y415 D457 L458	Y415-P455 HydrophobicContact CE1-CG 4.34Å; P455-D457 VanDerWaalsContact C-N 3.32Å; P455-D457 WeakPolarHBondContact CB-OD1 3.22Å; P455-L458 HydrophobicContact CB-CB 4.2Å; P455-L458 HydrophobicContact CG-CB 4.41Å; P455-L458 VanDerWaalsContact O-CB 3.29Å; P455-L458 WeakPolarHBondContact O-CB 3.3Å; P455-L458 PolarHBondContact O-N 3.22Å
456	A	85.6	Confident	89.3	Confident	51 Å²	51	42.5 Å²	42.5	42%	0.421	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-29.5	177	0	0	0	0	0	112.4	L458 I466 T469	A456-L458 VanDerWaalsContact C-N 3.28Å; A456-L458 PolarHBondContact O-N 3.21Å; A456-I466 WeakPolarHBondContact O-CG2 3.21Å; A456-T469 WeakPolarHBondContact CB-OG1 3.04Å
457	D	86.7	Confident	89.3	Confident	134 Å²	134	41.8 Å²	41.8	72%	0.717	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	1.5	176.2	62.2	-47.8	0	0	0	113.7	P455 Q459	P455-D457 VanDerWaalsContact C-N 3.32Å; P455-D457 WeakPolarHBondContact CB-OD1 3.22Å; D457-Q459 PolarHBondContact O-N 2.91Å; D457-Q459 VanDerWaalsContact O-N 3.13Å
458	L	89.7	Confident	89.3	Confident	26 Å²	26	42 Å²	42	14%	0.136	25%	0.252	C	S	.	.			trans	-68.6	111.2	-177.9	178.5	63.9	0	0	0	111.1	Y415 L454 P455 A456 F463 I466	Y415-L458 HydrophobicContact CE2-CD2 4.12Å; L454-L458 HydrophobicContact CB-CD2 4.27Å; L454-L458 HydrophobicContact CD1-CD2 4.4Å; L454-L458 HydrophobicContact CD2-CD2 4.3Å; P455-L458 HydrophobicContact CB-CB 4.2Å; P455-L458 HydrophobicContact CG-CB 4.41Å; P455-L458 VanDerWaalsContact O-CB 3.29Å; P455-L458 WeakPolarHBondContact O-CB 3.3Å; P455-L458 PolarHBondContact O-N 3.22Å; A456-L458 VanDerWaalsContact C-N 3.28Å; A456-L458 PolarHBondContact O-N 3.21Å; L458-F463 HydrophobicContact CG-CE2 4.49Å; L458-F463 HydrophobicContact CG-CZ 4.39Å; L458-F463 WeakPolarHBondContact O-CE2 3.29Å; L458-I466 HydrophobicContact CB-CG2 4.3Å; L458-I466 WeakPolarHBondContact O-CG2 3.45Å
459	Q	89.6	Confident	89.3	Confident	106 Å²	106	40.5 Å²	40.5	50%	0.495	24%	0.239	S	C	.	.			trans	-105.8	151	168.4	-47.7	-160	-4.8	0	0	112	D457 S464	D457-Q459 PolarHBondContact O-N 2.91Å; D457-Q459 VanDerWaalsContact O-N 3.13Å; Q459-S464 WeakPolarHBondContact CG-O 3.23Å
460	G	87.2	Confident	89.3	Confident	12 Å²	12	40.8 Å²	40.8	12%	0.124	24%	0.239	C	C	.	.			trans	-110	-179.1	175.3	0	0	0	0	0	113.7	R389 E407 F463	R389-G460 PolarHBondContact NE-O 3.03Å; R389-G460 PolarHBondContact NH2-O 3.29Å; E407-G460 WeakPolarHBondContact OE1-CA 3.21Å; G460-F463 CarbonylContact C-O 3.59Å; G460-F463 PolarHBondContact N-O 3.13Å; G460-F463 VanDerWaalsContact O-O 3.07Å
461	K	88.1	Confident	89.6	Confident	99 Å²	99	36.8 Å²	36.8	43%	0.43	21%	0.21	S	C	.	.	S	Bend	trans	-68.6	-37.6	166.9	-66.4	-175.3	164.9	-156.7	0	111.8	R389 P393 E394 E407	R389-K461 WeakPolarHBondContact CD-O 3.47Å; P393-K461 VanDerWaalsContact CD-O 3.28Å; P393-K461 WeakPolarHBondContact CD-O 3.32Å; E394-K461 WeakPolarHBondContact OE1-CE 3.45Å; E394-K461 IonicContact OE1-NZ 2.84Å; E394-K461 PolarHBondContact OE1-NZ 3.13Å; E394-K461 WeakPolarHBondContact OE2-CE 3.34Å; E394-K461 IonicContact OE2-NZ 3.46Å; E394-K461 PolarHBondContact OE2-NZ 3.3Å; E407-K461 VanDerWaalsContact CD-N 3.35Å; E407-K461 WeakPolarHBondContact OE1-CB 3.29Å; E407-K461 PolarHBondContact OE1-N 3.4Å; E407-K461 PolarHBondContact OE2-N 3.47Å; E407-K461 VanDerWaalsContact OE2-N 3.12Å
462	T	89.3	Confident	89.7	Confident	21 Å²	21	35.6 Å²	35.6	13%	0.129	21%	0.211	C	C	.	.	S	Bend	trans	-103.8	-20.8	-173.6	64.5	0	0	0	0	113.4	P388 R389 P399 D403 V404 E407	P388-T462 CarbonylContact C-O 3.58Å; P388-T462 WeakPolarHBondContact CA-O 3.27Å; R389-T462 PolarHBondContact N-O 3.37Å; P399-T462 HydrophobicContact CB-CG2 4.15Å; P399-T462 VanDerWaalsContact CG-O 3.31Å; P399-T462 WeakPolarHBondContact CG-O 3.41Å; D403-T462 HydrophobicContact CB-CG2 4.18Å; V404-T462 VanDerWaalsContact CA-OG1 3.31Å; V404-T462 WeakPolarHBondContact CA-OG1 3.22Å; E407-T462 HydrophobicContact CB-CG2 4.36Å; E407-T462 WeakPolarHBondContact OE2-CB 3.41Å; E407-T462 PolarHBondContact OE2-N 3.49Å; E407-T462 PolarHBondContact OE2-OG1 2.94Å
463	F	92.4	Very high	90.1	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.6	176.8	65.4	-86	0	0	0	112.5	L386 L387 R389 V404 E407 L411 L458 G460	L386-F463 HydrophobicContact CB-CB 4.43Å; L386-F463 HydrophobicContact CD2-CD1 4.4Å; L386-F463 HydrophobicContact CD2-CD2 3.66Å; L386-F463 HydrophobicContact CD2-CE1 4.39Å; L386-F463 HydrophobicContact CD2-CE2 3.64Å; L386-F463 HydrophobicContact CD2-CG 4.06Å; L386-F463 HydrophobicContact CD2-CZ 4.03Å; L387-F463 CarbonylContact O-C 3.43Å; L387-F463 WeakPolarHBondContact O-CA 3.35Å; L387-F463 WeakPolarHBondContact O-CB 3.49Å; R389-F463 VanDerWaalsContact CG-C 3.5Å; R389-F463 PolarHBondContact NE-O 2.76Å; R389-F463 PolarHBondContact NH2-O 2.78Å; V404-F463 HydrophobicContact CG1-CB 4.16Å; V404-F463 HydrophobicContact CG1-CD1 4.37Å; V404-F463 HydrophobicContact CG2-CB 4.47Å; E407-F463 HydrophobicContact CG-CE1 4.23Å; L411-F463 HydrophobicContact CD1-CE1 3.69Å; L411-F463 HydrophobicContact CD1-CZ 3.77Å; L458-F463 HydrophobicContact CG-CE2 4.49Å; L458-F463 HydrophobicContact CG-CZ 4.39Å; L458-F463 WeakPolarHBondContact O-CE2 3.29Å; G460-F463 CarbonylContact C-O 3.59Å; G460-F463 PolarHBondContact N-O 3.13Å; G460-F463 VanDerWaalsContact O-O 3.07Å
464	S	91.6	Very high	90.4	Very high	15 Å²	15	32.3 Å²	32.3	11%	0.105	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-48.8	179.7	41.3	0	0	0	0	112.3	L387 Q459	L387-S464 WeakPolarHBondContact CD2-OG 3.31Å; L387-S464 PolarHBondContact O-N 3.03Å; L387-S464 PolarHBondContact O-OG 2.9Å; Q459-S464 WeakPolarHBondContact CG-O 3.23Å
465	H	91.3	Very high	90.5	Very high	27 Å²	27	32.9 Å²	32.9	13%	0.125	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	156.6	-174.4	-70.5	-76.8	0	0	0	112	L387 D435 F467	L387-H465 HydrophobicContact CB-CB 4.44Å; L387-H465 HydrophobicContact CD2-CB 4.39Å; L387-H465 PolarHBondContact N-O 3.33Å; L387-H465 VanDerWaalsContact N-O 3.08Å; D435-H465 IonicContact OD1-NE2 3.95Å; D435-H465 PolarHBondContact OD1-NE2 3.29Å; D435-H465 IonicContact OD2-CD2 3.26Å; D435-H465 IonicContact OD2-CE1 2.71Å; D435-H465 IonicContact OD2-NE2 3.45Å; D435-H465 PolarHBondContact OD2-NE2 2.86Å; H465-F467 HydrophobicContact CB-CE2 3.82Å; H465-F467 HydrophobicContact CB-CZ 4.11Å
466	I	93.4	Very high	90.6	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.036	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.6	172.2	-173	176.7	0	0	0	109.1	I384 F385 L386 L454 A456 L458 T469	I384-I466 HydrophobicContact CB-CD1 4.47Å; I384-I466 HydrophobicContact CB-CG1 4.37Å; I384-I466 HydrophobicContact CD1-CD1 3.94Å; F385-I466 WeakPolarHBondContact O-CA 3.45Å; L386-I466 HydrophobicContact CD2-CB 4.05Å; L386-I466 HydrophobicContact CD2-CD1 3.92Å; L386-I466 HydrophobicContact CD2-CG1 3.81Å; L454-I466 HydrophobicContact CB-CD1 4.06Å; L454-I466 HydrophobicContact CD1-CD1 3.75Å; A456-I466 WeakPolarHBondContact O-CG2 3.21Å; L458-I466 HydrophobicContact CB-CG2 4.3Å; L458-I466 WeakPolarHBondContact O-CG2 3.45Å; I466-T469 HydrophobicContact CB-CG2 4.28Å; I466-T469 HydrophobicContact CD1-CG2 3.62Å; I466-T469 HydrophobicContact CG1-CG2 3.61Å; I466-T469 HydrophobicContact CG2-CG2 3.83Å
467	F	94.1	Very high	90.9	Very high	6 Å²	6	29.2 Å²	29.2	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	156.7	177	-60.2	-84.9	0	0	0	110.3	I384 F385 Y429 Y433 V436 Y442 H465 I901	I384-F467 CarbonylContact C-O 3.46Å; I384-F467 WeakPolarHBondContact CA-O 3.32Å; I384-F467 WeakPolarHBondContact CB-O 3.32Å; F385-F467 HydrophobicContact CB-CB 4.43Å; F385-F467 PolarHBondContact N-O 3.27Å; F385-F467 PolarHBondContact O-N 3.38Å; Y429-F467 HydrophobicContact CD2-CE1 4.43Å; Y429-F467 HydrophobicContact CD2-CZ 4.45Å; Y429-F467 AromaticContact CE2-CE1 3.88Å; Y429-F467 HydrophobicContact CE2-CE1 3.88Å; Y429-F467 HydrophobicContact CE2-CZ 4.17Å; Y433-F467 AromaticContact CD2-CE1 3.89Å; Y433-F467 HydrophobicContact CD2-CE1 3.89Å; Y433-F467 HydrophobicContact CD2-CZ 4.07Å; Y433-F467 HydrophobicContact CE2-CE1 4.02Å; V436-F467 HydrophobicContact CG2-CZ 4.17Å; Y442-F467 HydrophobicContact CE1-CD2 4.06Å; Y442-F467 HydrophobicContact CE1-CE2 4.02Å; H465-F467 HydrophobicContact CB-CE2 3.82Å; H465-F467 HydrophobicContact CB-CZ 4.11Å; F467-I901 HydrophobicContact CB-CG2 3.8Å; F467-I901 HydrophobicContact CD1-CG2 4Å; F467-I901 HydrophobicContact CD2-CG2 4.25Å; F467-I901 HydrophobicContact CG-CG2 3.76Å
468	G	92.1	Very high	91.3	Very high	7 Å²	7	23.5 Å²	23.5	7%	0.072	13%	0.125	C	C	.	.	S	Bend	trans	85.2	14.5	176.9	0	0	0	0	0	114.4	R383 T471 D904	R383-G468 WeakPolarHBondContact O-CA 3.1Å; G468-T471 VanDerWaalsContact CA-OG1 3.27Å; G468-T471 WeakPolarHBondContact CA-OG1 3.43Å; G468-D904 VanDerWaalsContact CA-OD1 3.23Å; G468-D904 WeakPolarHBondContact CA-OD1 3.19Å; G468-D904 VanDerWaalsContact N-CG 3.28Å; G468-D904 PolarHBondContact N-OD1 2.78Å; G468-D904 PolarHBondContact N-OD2 2.79Å
469	T	89.8	Confident	91.4	Very high	4 Å²	4	23.2 Å²	23.2	3%	0.025	12%	0.124	C	C	.	.	S	Bend	trans	-73.7	-37.4	-167.9	58.1	0	0	0	0	113.1	I384 A456 I466 D904	I384-T469 HydrophobicContact CG2-CG2 4.45Å; A456-T469 WeakPolarHBondContact CB-OG1 3.04Å; I466-T469 HydrophobicContact CB-CG2 4.28Å; I466-T469 HydrophobicContact CD1-CG2 3.62Å; I466-T469 HydrophobicContact CG1-CG2 3.61Å; I466-T469 HydrophobicContact CG2-CG2 3.83Å; T469-D904 PolarHBondContact N-OD2 2.93Å; T469-D904 VanDerWaalsContact N-OD2 3.16Å; T469-D904 PolarHBondContact OG1-OD2 2.93Å
470	N	88.4	Confident	91.5	Very high	17 Å²	17	20.7 Å²	20.7	9%	0.091	11%	0.113	C	C	.	.	S	Bend	trans	-114.9	-1.5	-168.6	67.3	-16.5	0	0	0	112.5	D904 P905 V907 W920	N470-D904 VanDerWaalsContact OD1-CB 3.23Å; N470-D904 WeakPolarHBondContact OD1-CB 3.19Å; N470-D904 PolarHBondContact OD1-OD2 2.76Å; N470-P905 PolarHBondContact ND2-O 2.94Å; N470-P905 WeakPolarHBondContact OD1-CD 3.26Å; N470-V907 WeakPolarHBondContact ND2-CG2 3.15Å; N470-W920 HydrophobicContact CB-CH2 4.13Å; N470-W920 HydrophobicContact CB-CZ2 3.78Å
471	T	91.1	Very high	91.7	Very high	18 Å²	18	21.1 Å²	21.1	11%	0.11	11%	0.113	C	C	.	.			trans	-58.8	140.3	179.1	-35	0	0	0	0	112.1	G468 E475 N476	G468-T471 VanDerWaalsContact CA-OG1 3.27Å; G468-T471 WeakPolarHBondContact CA-OG1 3.43Å; T471-E475 HydrophobicContact CG2-CB 4.34Å; T471-E475 HydrophobicContact CG2-CG 4.15Å; T471-E475 VanDerWaalsContact CG2-OE1 3.28Å; T471-E475 WeakPolarHBondContact CG2-OE1 3.42Å; T471-E475 WeakPolarHBondContact CG2-OE2 3.32Å; T471-N476 WeakPolarHBondContact CG2-ND2 3.41Å
472	S	90.7	Very high	91.9	Very high	36 Å²	36	21.1 Å²	21.1	25%	0.252	11%	0.114	S	C	.	.			trans	-69.6	158.5	179	68.3	0	0	0	0	113	E346 E475 N476	E346-S472 WeakPolarHBondContact OE1-CB 3.26Å; S472-E475 WeakPolarHBondContact OG-CB 3.45Å; S472-E475 PolarHBondContact OG-N 3.34Å; S472-N476 PolarHBondContact O-N 3.33Å; S472-N476 PolarHBondContact O-ND2 3.47Å
473	F	93	Very high	92.1	Very high	8 Å²	8	20.2 Å²	20.2	4%	0.035	11%	0.108	C	C	.	.	H	α-helix	trans	-76.4	-33.4	176	-63.4	-76	0	0	0	110.9	E346 P352 G353 V355 L380 R382 A449 L477	E346-F473 PolarHBondContact OE2-N 3.03Å; E346-F473 VanDerWaalsContact OE2-N 3.12Å; P352-F473 HydrophobicContact CB-CE2 4.06Å; G353-F473 VanDerWaalsContact N-CE2 3.33Å; V355-F473 HydrophobicContact CG2-CB 4.06Å; L380-F473 HydrophobicContact CB-CB 4.37Å; L380-F473 HydrophobicContact CB-CD1 3.9Å; L380-F473 HydrophobicContact CB-CG 4.44Å; L380-F473 HydrophobicContact CD1-CB 4.26Å; R382-F473 HydrophobicContact CG-CE1 3.76Å; R382-F473 HydrophobicContact CG-CZ 3.79Å; A449-F473 HydrophobicContact CB-CE1 3.59Å; A449-F473 HydrophobicContact CB-CE2 4.2Å; A449-F473 HydrophobicContact CB-CZ 3.35Å; F473-L477 WeakPolarHBondContact O-CB 3.39Å; F473-L477 PolarHBondContact O-N 3.39Å
474	L	92.9	Very high	92	Very high	26 Å²	26	22.5 Å²	22.5	14%	0.136	12%	0.117	C	C	.	.	H	α-helix	trans	-62.6	-45.9	172.4	178.6	57.7	0	0	0	112.1	A344 E346 V355 L477 L478 V874	A344-L474 HydrophobicContact CB-CD1 3.65Å; A344-L474 HydrophobicContact CB-CD2 4.27Å; E346-L474 HydrophobicContact CG-CB 4.13Å; E346-L474 WeakPolarHBondContact OE2-CB 3.25Å; E346-L474 PolarHBondContact OE2-N 2.92Å; V355-L474 HydrophobicContact CG1-CD1 3.98Å; V355-L474 HydrophobicContact CG2-CB 4.35Å; L474-L477 PolarHBondContact O-N 3.08Å; L474-L478 HydrophobicContact CD1-CD1 4.07Å; L474-L478 HydrophobicContact CD1-CD2 4.47Å; L474-L478 HydrophobicContact CD1-CG 4.03Å; L474-L478 HydrophobicContact CG-CD1 4.07Å; L474-L478 HydrophobicContact CG-CG 4.44Å; L474-L478 WeakPolarHBondContact O-CB 3.43Å; L474-L478 VanDerWaalsContact O-CG 3.27Å; L474-L478 WeakPolarHBondContact O-CG 3Å; L474-L478 PolarHBondContact O-N 3.37Å; L474-V874 HydrophobicContact CD2-CG2 4.32Å
475	E	93.2	Very high	91.9	Very high	22 Å²	22	21.8 Å²	21.8	10%	0.103	11%	0.112	C	C	.	.	H	α-helix	trans	-59.8	-51	175.1	178.6	-173.5	150.8	0	0	111.3	T471 S472 L477 L478 L479 L892 R1093	T471-E475 HydrophobicContact CG2-CB 4.34Å; T471-E475 HydrophobicContact CG2-CG 4.15Å; T471-E475 VanDerWaalsContact CG2-OE1 3.28Å; T471-E475 WeakPolarHBondContact CG2-OE1 3.42Å; T471-E475 WeakPolarHBondContact CG2-OE2 3.32Å; S472-E475 WeakPolarHBondContact OG-CB 3.45Å; S472-E475 PolarHBondContact OG-N 3.34Å; E475-L477 PolarHBondContact O-N 3.24Å; E475-L478 PolarHBondContact O-N 2.82Å; E475-L478 VanDerWaalsContact O-N 3.16Å; E475-L479 HydrophobicContact CG-CD1 3.78Å; E475-L479 HydrophobicContact CG-CG 4.37Å; E475-L479 WeakPolarHBondContact O-CB 3.45Å; E475-L479 WeakPolarHBondContact O-CG 3.32Å; E475-L479 PolarHBondContact O-N 2.69Å; E475-L892 HydrophobicContact CG-CD1 4.24Å; E475-R1093 IonicContact OE1-CZ 2.72Å; E475-R1093 IonicContact OE1-NH1 2.64Å; E475-R1093 PolarHBondContact OE1-NH1 3.39Å; E475-R1093 VanDerWaalsContact OE1-NH1 3.13Å; E475-R1093 IonicContact OE1-NH2 2.67Å; E475-R1093 PolarHBondContact OE1-NH2 2.93Å; E475-R1093 IonicContact OE2-CZ 3.51Å; E475-R1093 IonicContact OE2-NH1 3.53Å; E475-R1093 PolarHBondContact OE2-NH1 3.25Å; E475-R1093 IonicContact OE2-NH2 2.67Å
476	N	92.2	Very high	92	Very high	21 Å²	21	21.1 Å²	21.1	11%	0.112	11%	0.11	C	C	.	.	H	α-helix	trans	-56.1	-39.6	176.8	-86.4	-83.1	0	0	0	112.1	T471 S472 D480	T471-N476 WeakPolarHBondContact CG2-ND2 3.41Å; S472-N476 PolarHBondContact O-N 3.33Å; S472-N476 PolarHBondContact O-ND2 3.47Å; N476-D480 WeakPolarHBondContact O-CB 3.41Å; N476-D480 PolarHBondContact O-N 3.34Å
477	L	93.1	Very high	92	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-67.2	-46	176	178.9	70.4	0	0	0	112.5	V355 L357 I377 L380 F473 L474 E475 L479 L481 W512	V355-L477 HydrophobicContact CB-CD2 4.15Å; V355-L477 HydrophobicContact CG1-CD2 3.76Å; V355-L477 HydrophobicContact CG2-CD2 4.49Å; L357-L477 HydrophobicContact CD2-CD2 4.33Å; I377-L477 HydrophobicContact CD1-CD1 4.11Å; I377-L477 HydrophobicContact CD1-CD2 3.55Å; I377-L477 HydrophobicContact CD1-CG 4.48Å; L380-L477 HydrophobicContact CD2-CB 4.49Å; L380-L477 HydrophobicContact CD2-CD1 4.28Å; F473-L477 WeakPolarHBondContact O-CB 3.39Å; F473-L477 PolarHBondContact O-N 3.39Å; L474-L477 PolarHBondContact O-N 3.08Å; E475-L477 PolarHBondContact O-N 3.24Å; L477-L479 VanDerWaalsContact C-N 3.28Å; L477-L479 PolarHBondContact O-N 2.91Å; L477-L481 HydrophobicContact CD1-CD1 3.55Å; L477-L481 HydrophobicContact CD1-CG 4.22Å; L477-L481 HydrophobicContact CG-CD1 4.16Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.45Å; L477-L481 PolarHBondContact O-N 3.47Å; L477-W512 HydrophobicContact CD1-CE3 4Å; L477-W512 HydrophobicContact CD1-CH2 3.9Å; L477-W512 HydrophobicContact CD1-CZ3 3.61Å
478	L	94	Very high	91.9	Very high	15 Å²	15	22.3 Å²	22.3	8%	0.079	12%	0.117	C	C	.	.	H	α-helix	trans	-63.7	-35.2	179.4	-69.4	173	0	0	0	111.6	W341 L474 E475 Q482 L483 V874	W341-L478 HydrophobicContact CH2-CD2 3.62Å; W341-L478 HydrophobicContact CZ2-CD2 4Å; W341-L478 HydrophobicContact CZ3-CD2 4.35Å; L474-L478 HydrophobicContact CD1-CD1 4.07Å; L474-L478 HydrophobicContact CD1-CD2 4.47Å; L474-L478 HydrophobicContact CD1-CG 4.03Å; L474-L478 HydrophobicContact CG-CD1 4.07Å; L474-L478 HydrophobicContact CG-CG 4.44Å; L474-L478 WeakPolarHBondContact O-CB 3.43Å; L474-L478 VanDerWaalsContact O-CG 3.27Å; L474-L478 WeakPolarHBondContact O-CG 3Å; L474-L478 PolarHBondContact O-N 3.37Å; E475-L478 PolarHBondContact O-N 2.82Å; E475-L478 VanDerWaalsContact O-N 3.16Å; L478-Q482 WeakPolarHBondContact O-CA 3.32Å; L478-Q482 PolarHBondContact O-N 2.89Å; L478-L483 HydrophobicContact CD2-CB 3.78Å; L478-L483 HydrophobicContact CD2-CD1 4.22Å; L478-L483 PolarHBondContact O-N 3.49Å; L478-V874 HydrophobicContact CD1-CG2 4.09Å
479	L	93	Very high	92	Very high	20 Å²	20	22 Å²	22	11%	0.105	11%	0.114	C	C	.	.	H	α-helix	trans	-78.6	-51.9	178.2	-66.6	175.9	0	0	0	113.1	E475 L477 L481 Q482 L892 T896	E475-L479 HydrophobicContact CG-CD1 3.78Å; E475-L479 HydrophobicContact CG-CG 4.37Å; E475-L479 WeakPolarHBondContact O-CB 3.45Å; E475-L479 WeakPolarHBondContact O-CG 3.32Å; E475-L479 PolarHBondContact O-N 2.69Å; L477-L479 VanDerWaalsContact C-N 3.28Å; L477-L479 PolarHBondContact O-N 2.91Å; L479-L481 PolarHBondContact O-N 3.35Å; L479-L481 VanDerWaalsContact O-N 3.12Å; L479-Q482 PolarHBondContact O-N 2.84Å; L479-Q482 VanDerWaalsContact O-N 3.11Å; L479-L892 HydrophobicContact CD2-CB 4.17Å; L479-T896 HydrophobicContact CB-CG2 4.36Å
480	D	90.7	Very high	92.1	Very high	52 Å²	52	22.3 Å²	22.3	28%	0.278	12%	0.115	S	C	.	.	H	α-helix	trans	-62	-19.8	178.2	-92.7	9	0	0	0	111.8	R383 R446 N476 W512 S514	R383-D480 IonicContact CZ-OD1 2.77Å; R383-D480 IonicContact NH1-OD1 3.33Å; R383-D480 PolarHBondContact NH1-OD1 2.81Å; R446-D480 IonicContact CZ-OD2 3.89Å; R446-D480 IonicContact NH1-OD2 2.65Å; R446-D480 PolarHBondContact NH1-OD2 3Å; R446-D480 IonicContact NH2-OD1 2.85Å; R446-D480 IonicContact NH2-OD2 3.66Å; R446-D480 PolarHBondContact NH2-OD2 2.77Å; R446-D480 VanDerWaalsContact NH2-OD2 3.15Å; N476-D480 WeakPolarHBondContact O-CB 3.41Å; N476-D480 PolarHBondContact O-N 3.34Å; D480-W512 HydrophobicContact CB-CH2 4.47Å; D480-W512 HydrophobicContact CB-CZ2 4.15Å; D480-S514 PolarHBondContact OD2-OG 3.39Å
481	L	91.1	Very high	92.2	Very high	22 Å²	22	21.6 Å²	21.6	12%	0.115	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-2.1	174.7	-66.4	179.8	0	0	0	115.5	L477 L479 L483 W512 I520	L477-L481 HydrophobicContact CD1-CD1 3.55Å; L477-L481 HydrophobicContact CD1-CG 4.22Å; L477-L481 HydrophobicContact CG-CD1 4.16Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.45Å; L477-L481 PolarHBondContact O-N 3.47Å; L479-L481 PolarHBondContact O-N 3.35Å; L479-L481 VanDerWaalsContact O-N 3.12Å; L481-L483 VanDerWaalsContact C-N 3.31Å; L481-L483 HydrophobicContact CB-CD1 4.2Å; L481-L483 HydrophobicContact CB-CD2 4.02Å; L481-L483 HydrophobicContact CB-CG 3.7Å; L481-L483 HydrophobicContact CD1-CD1 4.07Å; L481-L483 HydrophobicContact CD1-CG 4.46Å; L481-L483 PolarHBondContact O-N 3.04Å; L481-W512 HydrophobicContact CD1-CH2 4.31Å; L481-W512 HydrophobicContact CD1-CZ3 4.12Å; L481-W512 HydrophobicContact CD2-CH2 3.88Å; L481-W512 HydrophobicContact CD2-CZ3 4.09Å; L481-W512 HydrophobicContact CG-CH2 3.87Å; L481-W512 HydrophobicContact CG-CZ3 4.16Å; L481-I520 HydrophobicContact CD1-CB 4.18Å; L481-I520 HydrophobicContact CD1-CG2 3.77Å; L481-I520 HydrophobicContact CD2-CB 4.36Å; L481-I520 HydrophobicContact CD2-CG2 4.39Å; L481-I520 WeakPolarHBondContact CD2-O 3.43Å
482	Q	92.5	Very high	92.1	Very high	99 Å²	99	23.9 Å²	23.9	46%	0.463	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	46.1	-176.2	-59.6	-178	-9	0	0	114	L478 L479 R484 K522	L478-Q482 WeakPolarHBondContact O-CA 3.32Å; L478-Q482 PolarHBondContact O-N 2.89Å; L479-Q482 PolarHBondContact O-N 2.84Å; L479-Q482 VanDerWaalsContact O-N 3.11Å; Q482-R484 PolarHBondContact O-N 3.28Å; Q482-R484 VanDerWaalsContact O-N 3.12Å; Q482-K522 PolarHBondContact O-NZ 3.29Å
483	L	92.7	Very high	91.9	Very high	1 Å²	1	27 Å²	27	1%	0.005	13%	0.133	C	C	.	.			trans	-82.6	87.8	-178.6	-60.9	-171	0	0	0	111.3	W341 L478 L481 G485 L489	W341-L483 HydrophobicContact CZ2-CB 3.99Å; W341-L483 HydrophobicContact CZ2-CD1 4.44Å; L478-L483 HydrophobicContact CD2-CB 3.78Å; L478-L483 HydrophobicContact CD2-CD1 4.22Å; L478-L483 PolarHBondContact O-N 3.49Å; L481-L483 VanDerWaalsContact C-N 3.31Å; L481-L483 HydrophobicContact CB-CD1 4.2Å; L481-L483 HydrophobicContact CB-CD2 4.02Å; L481-L483 HydrophobicContact CB-CG 3.7Å; L481-L483 HydrophobicContact CD1-CD1 4.07Å; L481-L483 HydrophobicContact CD1-CG 4.46Å; L481-L483 PolarHBondContact O-N 3.04Å; L483-G485 PolarHBondContact O-N 3.38Å; L483-L489 HydrophobicContact CD1-CD1 4.38Å; L483-L489 HydrophobicContact CD1-CD2 4.34Å; L483-L489 HydrophobicContact CD2-CD2 3.55Å
484	R	91.5	Very high	91.6	Very high	50 Å²	50	26.8 Å²	26.8	19%	0.189	13%	0.133	C	C	.	.			trans	-85.2	82	172.4	-58.6	-165.1	-169.3	-169.4	8.1	111.4	Q482	Q482-R484 PolarHBondContact O-N 3.28Å; Q482-R484 VanDerWaalsContact O-N 3.12Å
485	G	89.8	Confident	91.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	72.7	-171.5	177.9	0	0	0	0	0	115.8	W341 L483 C487	W341-G485 WeakPolarHBondContact CZ2-O 3.49Å; W341-G485 PolarHBondContact NE1-O 3.12Å; L483-G485 PolarHBondContact O-N 3.38Å; G485-C487 PolarHBondContact O-N 3.39Å
486	P	93.2	Very high	91.4	Very high	12 Å²	12	31.5 Å²	31.5	8%	0.078	16%	0.161	C	C	.	.	S	Bend	trans	-58.9	122.3	-172.5	-26.4	35.4	0	0	0	113.8	Y340 W341 F342 L875	Y340-P486 HydrophobicContact CE1-CB 4.07Å; Y340-P486 WeakPolarHBondContact OH-CB 3.14Å; W341-P486 VanDerWaalsContact O-CA 3.23Å; W341-P486 WeakPolarHBondContact O-CA 3.49Å; W341-P486 WeakPolarHBondContact O-CB 3.39Å; F342-P486 HydrophobicContact CB-CB 4.16Å; F342-P486 HydrophobicContact CB-CG 4.26Å; P486-L875 HydrophobicContact CG-CB 4.13Å; P486-L875 HydrophobicContact CG-CD2 3.95Å
487	C	92.8	Very high	91.2	Very high	24 Å²	24	31.4 Å²	31.4	16%	0.162	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	171.3	-176.5	72.2	0	0	0	0	113.6	Y340 W341 G485	Y340-C487 WeakPolarHBondContact CA-O 3.44Å; W341-C487 PolarHBondContact N-O 3.19Å; W341-C487 VanDerWaalsContact N-O 3.13Å; W341-C487 PolarHBondContact NE1-SG 3.33Å; W341-C487 PolarHBondContact O-N 3.43Å; G485-C487 PolarHBondContact O-N 3.39Å
488	W	93	Very high	90.8	Very high	15 Å²	15	38.8 Å²	38.8	6%	0.057	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.2	174.8	-76.5	110.5	0	0	0	112.3	F339 Y340 Y370 L523 V542 P543 P544	F339-W488 VanDerWaalsContact C-CE3 3.49Å; Y340-W488 AromaticContact CD2-CD1 3.93Å; Y340-W488 AromaticContact CD2-CD2 3.98Å; Y340-W488 HydrophobicContact CD2-CD2 3.98Å; Y340-W488 AromaticContact CD2-CE2 3.86Å; Y340-W488 AromaticContact CD2-CG 3.99Å; Y340-W488 HydrophobicContact CD2-CG 3.99Å; Y340-W488 HydrophobicContact CD2-CZ2 4.43Å; Y340-W488 AromaticContact CD2-NE1 3.86Å; Y340-W488 HydrophobicContact CG-CD2 4.42Å; Y370-W488 HydrophobicContact CD1-CH2 4.35Å; Y370-W488 AromaticContact CE1-CH2 3.95Å; Y370-W488 HydrophobicContact CE1-CH2 3.95Å; Y370-W488 HydrophobicContact CE1-CZ2 4.14Å; W488-L523 HydrophobicContact CB-CB 3.81Å; W488-L523 HydrophobicContact CB-CD2 3.73Å; W488-L523 HydrophobicContact CB-CG 4.39Å; W488-L523 HydrophobicContact CG-CD2 4.2Å; W488-L523 WeakPolarHBondContact O-CB 3.24Å; W488-L523 PolarHBondContact O-N 3.21Å; W488-V542 HydrophobicContact CG-CG1 4.43Å; W488-P543 HydrophobicContact CD2-CG 4.45Å; W488-P543 HydrophobicContact CH2-CB 4.37Å; W488-P543 HydrophobicContact CZ2-CB 3.73Å; W488-P543 HydrophobicContact CZ2-CG 4.37Å; W488-P543 PolarHBondContact NE1-O 3.04Å; W488-P544 WeakPolarHBondContact CZ2-O 3.35Å
489	L	93.5	Very high	90.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	137.5	172	-51.3	-175.7	0	0	0	109.9	Y338 F339 W341 L357 L483 I491 I520	Y338-L489 WeakPolarHBondContact CA-O 3.4Å; F339-L489 HydrophobicContact CD1-CD1 4.22Å; F339-L489 PolarHBondContact N-O 2.89Å; F339-L489 PolarHBondContact O-N 3.47Å; W341-L489 HydrophobicContact CB-CD1 4.31Å; W341-L489 HydrophobicContact CG-CD1 4.29Å; L357-L489 HydrophobicContact CD1-CD1 3.95Å; L483-L489 HydrophobicContact CD1-CD1 4.38Å; L483-L489 HydrophobicContact CD1-CD2 4.34Å; L483-L489 HydrophobicContact CD2-CD2 3.55Å; L489-I491 HydrophobicContact CB-CG1 4.49Å; L489-I520 HydrophobicContact CB-CG2 4.37Å; L489-I520 HydrophobicContact CD1-CG2 4.16Å
490	E	91.7	Very high	90.1	Very high	11 Å²	11	46 Å²	46	5%	0.051	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.2	162.8	-178	175.9	113.4	0	0	108.5	I336 L337 Y338 K492 I520 T521	I336-E490 HydrophobicContact CG2-CG 3.57Å; L337-E490 WeakPolarHBondContact O-CA 3.37Å; Y338-E490 HydrophobicContact CD1-CB 4.05Å; Y338-E490 HydrophobicContact CD1-CG 4.25Å; Y338-E490 HydrophobicContact CE1-CB 3.8Å; Y338-E490 HydrophobicContact CE1-CG 3.66Å; Y338-E490 WeakPolarHBondContact CE1-OE2 3.46Å; Y338-E490 PolarHBondContact OH-OE2 3.05Å; E490-K492 WeakPolarHBondContact OE1-CE 3.46Å; E490-K492 IonicContact OE1-NZ 2.72Å; E490-K492 PolarHBondContact OE1-NZ 2.78Å; E490-I520 WeakPolarHBondContact O-CA 3.32Å; E490-T521 PolarHBondContact N-O 3.39Å; E490-T521 PolarHBondContact O-N 3.26Å
491	I	91.2	Very high	90.1	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.7	-178.6	-48.2	162.6	0	0	0	108.9	I336 L337 F339 L375 L489 A494 V510 P519 I520	I336-I491 CarbonylContact C-O 3.59Å; I336-I491 WeakPolarHBondContact CA-O 3.28Å; L337-I491 HydrophobicContact CB-CB 4.41Å; L337-I491 PolarHBondContact N-O 2.78Å; L337-I491 PolarHBondContact O-N 2.91Å; F339-I491 HydrophobicContact CB-CD1 3.57Å; F339-I491 HydrophobicContact CB-CG1 4.49Å; F339-I491 HydrophobicContact CD1-CD1 4.11Å; F339-I491 HydrophobicContact CG-CD1 4.02Å; L375-I491 HydrophobicContact CD1-CD1 4.06Å; L375-I491 HydrophobicContact CD1-CG2 4.47Å; L375-I491 HydrophobicContact CD2-CD1 3.63Å; L375-I491 HydrophobicContact CD2-CG1 4.34Å; L375-I491 HydrophobicContact CG-CD1 4.38Å; L489-I491 HydrophobicContact CB-CG1 4.49Å; I491-A494 HydrophobicContact CG2-CB 4.01Å; I491-V510 HydrophobicContact CG2-CB 4.49Å; I491-V510 HydrophobicContact CG2-CG2 4.4Å; I491-P519 CarbonylContact C-O 3.57Å; I491-P519 WeakPolarHBondContact CA-O 3Å; I491-I520 HydrophobicContact CG2-CG1 4.4Å
492	K	89.3	Confident	90.2	Very high	65 Å²	65	43.9 Å²	43.9	28%	0.283	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	157.1	177.6	-58.1	-179.2	177.8	81.2	0	110.3	N335 I336 E490 A494 P519 T521	N335-K492 WeakPolarHBondContact O-CA 3.4Å; I336-K492 HydrophobicContact CG1-CG 4.48Å; E490-K492 WeakPolarHBondContact OE1-CE 3.46Å; E490-K492 IonicContact OE1-NZ 2.72Å; E490-K492 PolarHBondContact OE1-NZ 2.78Å; K492-A494 PolarHBondContact O-N 2.87Å; K492-P519 PolarHBondContact N-O 3.46Å; K492-P519 WeakPolarHBondContact O-CB 3.38Å; K492-T521 PolarHBondContact NZ-OG1 3.4Å
493	D	85.6	Confident	90.2	Very high	101 Å²	101	39.7 Å²	39.7	54%	0.54	21%	0.207	S	C	.	.	S	Bend	trans	54.8	21.8	176	-62.2	-14.5	0	0	0	115.2	N335 R513	N335-D493 PolarHBondContact O-N 2.77Å; D493-R513 IonicContact OD2-NH1 3.16Å
494	A	87.8	Confident	90.3	Very high	4 Å²	4	39.8 Å²	39.8	3%	0.033	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-69.1	132	-178.3	0	0	0	0	0	112.2	N335 L337 I491 K492 Y508	N335-A494 PolarHBondContact ND2-O 3.15Å; L337-A494 HydrophobicContact CD1-CB 3.59Å; L337-A494 HydrophobicContact CG-CB 4.41Å; I491-A494 HydrophobicContact CG2-CB 4.01Å; K492-A494 PolarHBondContact O-N 2.87Å; A494-Y508 HydrophobicContact CB-CD1 4.02Å
495	S	90.6	Very high	90.3	Very high	59 Å²	59	43.1 Å²	43.1	41%	0.413	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.7	177.4	60.3	0	0	0	0	110.7	Y508 E509	S495-Y508 CarbonylContact O-C 3.46Å; S495-Y508 VanDerWaalsContact O-CA 3.3Å; S495-Y508 WeakPolarHBondContact O-CA 3.46Å; S495-E509 PolarHBondContact N-O 3.01Å; S495-E509 PolarHBondContact O-N 2.87Å; S495-E509 PolarHBondContact OG-O 3.02Å
496	Q	89.5	Confident	90.3	Very high	89 Å²	89	43.2 Å²	43.2	42%	0.416	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.1	177.5	-167	-177.6	10	0	0	109.9	I506 Y508	Q496-I506 HydrophobicContact CG-CG2 4.21Å; Q496-Y508 HydrophobicContact CB-CD1 4.25Å; Q496-Y508 HydrophobicContact CB-CE1 3.98Å; Q496-Y508 HydrophobicContact CG-CE1 4.39Å
497	V	88.8	Confident	90.4	Very high	18 Å²	18	42.7 Å²	42.7	11%	0.109	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-91.2	125.3	-174.4	-173.7	0	0	0	0	111	I501 D507 E509	V497-I501 HydrophobicContact CG1-CG1 4.31Å; V497-I501 HydrophobicContact CG1-CG2 3.94Å; V497-D507 HydrophobicContact CB-CB 3.91Å; V497-D507 HydrophobicContact CG2-CB 4.39Å; V497-D507 PolarHBondContact N-O 2.74Å; V497-E509 HydrophobicContact CG2-CB 3.45Å; V497-E509 VanDerWaalsContact CG2-CB 3.45Å
498	Q	85.3	Confident	90.5	Very high	155 Å²	155	42 Å²	42	72%	0.724	22%	0.217	S	C	*	.	S	Bend	trans	-135.5	137.9	167.7	-63.8	-168.6	13.4	0	0	110.5
499	P	85.3	Confident	90.5	Very high	116 Å²	116	42.8 Å²	42.8	75%	0.753	22%	0.221	S	C	*	.	S	Bend	cis	-63.7	156.5	-9.1	30.5	-36.6	0	0	0	111.9
500	Q	87	Confident	90.5	Very high	72 Å²	72	43 Å²	43	34%	0.336	22%	0.222	S	C	.	.			trans	-57.4	139.2	179.6	-79.8	-179.7	-34.6	0	0	112.4	C504 Q505 D507 R715	Q500-C504 PolarHBondContact NE2-O 3.33Å; Q500-Q505 PolarHBondContact NE2-O 3.12Å; Q500-D507 WeakPolarHBondContact CA-OD2 3.37Å; Q500-D507 VanDerWaalsContact CB-OD2 3.25Å; Q500-D507 WeakPolarHBondContact CB-OD2 3.34Å; Q500-D507 WeakPolarHBondContact CG-OD2 3.23Å; Q500-R715 WeakPolarHBondContact O-CD 3.34Å
501	I	90.9	Very high	90.5	Very high	28 Å²	28	46.4 Å²	46.4	14%	0.144	24%	0.24	C	C	.	.	S	Bend	trans	-96.6	-15.7	176	52.7	166.7	0	0	0	112	Y356 R376 V497 D507 R715	Y356-I501 HydrophobicContact CE1-CD1 4.18Å; R376-I501 HydrophobicContact CB-CD1 3.72Å; R376-I501 HydrophobicContact CG-CD1 4.43Å; V497-I501 HydrophobicContact CG1-CG1 4.31Å; V497-I501 HydrophobicContact CG1-CG2 3.94Å; I501-D507 HydrophobicContact CD1-CB 4.36Å; I501-D507 HydrophobicContact CG1-CB 3.81Å; I501-D507 VanDerWaalsContact CG1-CG 3.5Å; I501-D507 VanDerWaalsContact CG1-OD2 3.26Å; I501-D507 WeakPolarHBondContact CG1-OD2 3.48Å; I501-D507 PolarHBondContact N-OD2 2.95Å; I501-R715 VanDerWaalsContact O-CB 3.29Å; I501-R715 WeakPolarHBondContact O-CB 3.47Å; I501-R715 PolarHBondContact O-N 2.88Å
502	S	93.2	Very high	90.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-129.2	177.2	178.3	94.2	0	0	0	0	112.8	C374 C504 D507 R713 R715	C374-S502 WeakPolarHBondContact CB-OG 3.48Å; S502-C504 WeakPolarHBondContact OG-CB 3.44Å; S502-C504 PolarHBondContact OG-N 2.96Å; S502-C504 PolarHBondContact OG-SG 3.45Å; S502-D507 VanDerWaalsContact CB-OD1 3.23Å; S502-D507 WeakPolarHBondContact CB-OD1 3.24Å; S502-D507 PolarHBondContact N-OD2 3.19Å; S502-D507 PolarHBondContact OG-OD1 3.12Å; S502-R713 CarbonylContact C-O 3.57Å; S502-R713 WeakPolarHBondContact CA-O 3.34Å; S502-R713 VanDerWaalsContact CB-O 3.24Å; S502-R713 WeakPolarHBondContact CB-O 3.39Å; S502-R715 PolarHBondContact O-NE 3.47Å; S502-R715 PolarHBondContact O-NH2 3.17Å; S502-R715 VanDerWaalsContact O-NH2 3.09Å
503	W	92.8	Very high	90.3	Very high	12 Å²	12	49.8 Å²	49.8	5%	0.045	25%	0.251	C	S	.	.	S	Bend	trans	-97.8	6.4	170.2	-62.7	120.5	0	0	0	112.8	H676 H707 H709 R710 R713 R715	W503-H676 AromaticContact CE3-CD2 3.96Å; W503-H676 AromaticContact CE3-CE1 3.51Å; W503-H676 AromaticContact CE3-NE2 3.37Å; W503-H676 AromaticContact CZ3-NE2 3.78Å; W503-H707 HydrophobicContact CH2-CB 4.4Å; W503-H707 AromaticContact CH2-ND1 3.93Å; W503-H707 HydrophobicContact CZ2-CB 4Å; W503-H709 AromaticContact CE2-CD2 3.81Å; W503-H709 AromaticContact CE2-NE2 3.9Å; W503-H709 AromaticContact CZ2-CD2 3.92Å; W503-H709 AromaticContact CZ2-NE2 3.55Å; W503-H709 AromaticContact NE1-CD2 3.16Å; W503-H709 PolarHBondContact NE1-CD2 2.94Å; W503-H709 AromaticContact NE1-NE2 3.74Å; W503-H709 PolarHBondContact NE1-O 3.13Å; W503-R710 HydrophobicContact CD2-CG 3.87Å; W503-R710 HydrophobicContact CE3-CG 4.48Å; W503-R710 HydrophobicContact CG-CG 4.26Å; W503-R710 HydrophobicContact CH2-CG 4.26Å; W503-R710 HydrophobicContact CZ2-CG 3.59Å; W503-R713 PolarHBondContact N-O 2.95Å; W503-R715 HydrophobicContact CD2-CG 4.27Å; W503-R715 HydrophobicContact CZ2-CG 4.39Å
504	C	93.2	Very high	89.8	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.02	24%	0.236	C	C	.	.	S	Bend	trans	-60.3	163.7	164.5	-64.5	0	0	0	0	110.4	C374 Q500 S502 I506	C374-C504 HydrophobicContact CB-CB 4.46Å; Q500-C504 PolarHBondContact NE2-O 3.33Å; S502-C504 WeakPolarHBondContact OG-CB 3.44Å; S502-C504 PolarHBondContact OG-N 2.96Å; S502-C504 PolarHBondContact OG-SG 3.45Å; C504-I506 VanDerWaalsContact C-N 3.3Å; C504-I506 PolarHBondContact O-N 3.28Å
505	Q	91.4	Very high	89.1	Confident	119 Å²	119	48.9 Å²	48.9	56%	0.556	26%	0.26	S	S	*	.	S	Bend	trans	-64.7	-35.4	175.3	-68.2	171	0.5	0	0	111.9	A371 S372 Q500	A371-Q505 VanDerWaalsContact CA-OE1 3.27Å; A371-Q505 HydrophobicContact CB-CB 4.38Å; A371-Q505 VanDerWaalsContact CB-OE1 3.28Å; S372-Q505 PolarHBondContact O-N 3.47Å; S372-Q505 PolarHBondContact OG-N 2.98Å; S372-Q505 VanDerWaalsContact OG-N 3.09Å; Q500-Q505 PolarHBondContact NE2-O 3.12Å
506	I	91.5	Very high	88	Confident	3 Å²	3	54 Å²	54	2%	0.015	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	145.9	179.5	-57.8	-179.3	0	0	0	110.9	V325 F327 S372 C373 C374 Q496 C504 Y508	V325-I506 WeakPolarHBondContact O-CD1 3.47Å; F327-I506 HydrophobicContact CB-CD1 4.01Å; F327-I506 HydrophobicContact CD2-CD1 3.28Å; F327-I506 HydrophobicContact CE2-CD1 3.86Å; F327-I506 HydrophobicContact CG-CD1 3.81Å; S372-I506 PolarHBondContact O-N 3.17Å; C373-I506 VanDerWaalsContact CA-O 3.31Å; C373-I506 WeakPolarHBondContact CA-O 3.37Å; C374-I506 PolarHBondContact N-O 2.97Å; C374-I506 VanDerWaalsContact N-O 3.14Å; Q496-I506 HydrophobicContact CG-CG2 4.21Å; C504-I506 VanDerWaalsContact C-N 3.3Å; C504-I506 PolarHBondContact O-N 3.28Å; I506-Y508 HydrophobicContact CB-CE2 4.47Å; I506-Y508 HydrophobicContact CG2-CD2 3.78Å; I506-Y508 HydrophobicContact CG2-CE2 3.39Å
507	D	93.9	Very high	87.2	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135	171.9	-65.2	-31.8	0	0	0	110.4	C374 V497 Q500 I501 S502	C374-D507 WeakPolarHBondContact CB-OD1 3.29Å; C374-D507 WeakPolarHBondContact O-CA 3.28Å; V497-D507 HydrophobicContact CB-CB 3.91Å; V497-D507 HydrophobicContact CG2-CB 4.39Å; V497-D507 PolarHBondContact N-O 2.74Å; Q500-D507 WeakPolarHBondContact CA-OD2 3.37Å; Q500-D507 VanDerWaalsContact CB-OD2 3.25Å; Q500-D507 WeakPolarHBondContact CB-OD2 3.34Å; Q500-D507 WeakPolarHBondContact CG-OD2 3.23Å; I501-D507 HydrophobicContact CD1-CB 4.36Å; I501-D507 HydrophobicContact CG1-CB 3.81Å; I501-D507 VanDerWaalsContact CG1-CG 3.5Å; I501-D507 VanDerWaalsContact CG1-OD2 3.26Å; I501-D507 WeakPolarHBondContact CG1-OD2 3.48Å; I501-D507 PolarHBondContact N-OD2 2.95Å; S502-D507 VanDerWaalsContact CB-OD1 3.23Å; S502-D507 WeakPolarHBondContact CB-OD1 3.24Å; S502-D507 PolarHBondContact N-OD2 3.19Å; S502-D507 PolarHBondContact OG-OD1 3.12Å
508	Y	94.4	Very high	86.8	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.035	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	152.7	172.1	-76.8	-82.8	0	0	0	111.5	L337 L361 C374 L375 R376 A494 S495 Q496 I506	L337-Y508 HydrophobicContact CD1-CD1 3.68Å; L337-Y508 HydrophobicContact CD1-CD2 3.93Å; L337-Y508 HydrophobicContact CD1-CE1 3.61Å; L337-Y508 HydrophobicContact CD1-CE2 3.85Å; L337-Y508 HydrophobicContact CD1-CG 3.85Å; L361-Y508 HydrophobicContact CD1-CE2 4.39Å; L361-Y508 HydrophobicContact CD2-CE2 3.98Å; C374-Y508 PolarHBondContact O-N 3.11Å; L375-Y508 WeakPolarHBondContact CA-O 3.17Å; R376-Y508 PolarHBondContact N-O 2.99Å; A494-Y508 HydrophobicContact CB-CD1 4.02Å; S495-Y508 CarbonylContact O-C 3.46Å; S495-Y508 VanDerWaalsContact O-CA 3.3Å; S495-Y508 WeakPolarHBondContact O-CA 3.46Å; Q496-Y508 HydrophobicContact CB-CD1 4.25Å; Q496-Y508 HydrophobicContact CB-CE1 3.98Å; Q496-Y508 HydrophobicContact CG-CE1 4.39Å; I506-Y508 HydrophobicContact CB-CE2 4.47Å; I506-Y508 HydrophobicContact CG2-CD2 3.78Å; I506-Y508 HydrophobicContact CG2-CE2 3.39Å
509	E	94.3	Very high	86.8	Confident	32 Å²	32	45 Å²	45	15%	0.15	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.4	177.5	165.8	154.6	116.9	0	0	111.1	R376 K378 S495 V497	R376-E509 IonicContact CZ-OE2 2.81Å; R376-E509 IonicContact NE-OE2 3.23Å; R376-E509 PolarHBondContact NE-OE2 2.89Å; R376-E509 IonicContact NH2-OE1 3.1Å; R376-E509 IonicContact NH2-OE2 3.43Å; R376-E509 PolarHBondContact NH2-OE2 2.94Å; R376-E509 WeakPolarHBondContact O-CA 3.35Å; K378-E509 HydrophobicContact CD-CG 4.43Å; K378-E509 WeakPolarHBondContact CD-OE2 3.35Å; K378-E509 WeakPolarHBondContact CE-OE2 3.49Å; K378-E509 IonicContact NZ-OE1 2.71Å; K378-E509 PolarHBondContact NZ-OE1 3.33Å; K378-E509 IonicContact NZ-OE2 2.77Å; K378-E509 PolarHBondContact NZ-OE2 3.18Å; S495-E509 PolarHBondContact N-O 3.01Å; S495-E509 PolarHBondContact O-N 2.87Å; S495-E509 PolarHBondContact OG-O 3.02Å; V497-E509 HydrophobicContact CG2-CB 3.45Å; V497-E509 VanDerWaalsContact CG2-CB 3.45Å
510	V	93.3	Very high	87	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.03	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	139.5	175.3	68.3	0	0	0	0	110.4	L375 R376 I377 K378 I491 P519 I520	L375-V510 HydrophobicContact CD1-CB 4.45Å; L375-V510 HydrophobicContact CD1-CG1 3.97Å; L375-V510 HydrophobicContact CD2-CG1 4.31Å; L375-V510 HydrophobicContact CG-CG1 4.26Å; R376-V510 PolarHBondContact O-N 3.02Å; I377-V510 WeakPolarHBondContact CA-O 3.45Å; I377-V510 HydrophobicContact CB-CG1 4.46Å; I377-V510 HydrophobicContact CG1-CG1 3.91Å; K378-V510 PolarHBondContact N-O 2.76Å; I491-V510 HydrophobicContact CG2-CB 4.49Å; I491-V510 HydrophobicContact CG2-CG2 4.4Å; V510-P519 HydrophobicContact CG2-CB 3.59Å; V510-P519 HydrophobicContact CG2-CG 3.42Å; V510-P519 VanDerWaalsContact CG2-CG 3.42Å; V510-I520 HydrophobicContact CG1-CD1 4.07Å; V510-I520 HydrophobicContact CG1-CG1 4.41Å
511	I	91.3	Very high	87.1	Confident	81 Å²	81	38.1 Å²	38.1	42%	0.415	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.2	177.1	-64.3	172.5	0	0	0	108.3	D379 P519	D379-I511 HydrophobicContact CB-CG2 4.22Å; I511-P519 WeakPolarHBondContact O-CG 3.44Å
512	W	90.1	Very high	86.9	Confident	18 Å²	18	39.4 Å²	39.4	7%	0.068	23%	0.226	C	C	.	.			trans	-64.8	141.9	-179.5	-178.4	-113.5	0	0	0	112.3	I377 K378 L380 L477 D480 L481	I377-W512 HydrophobicContact CG2-CB 4.07Å; I377-W512 HydrophobicContact CG2-CE3 4.36Å; K378-W512 WeakPolarHBondContact O-CB 3.44Å; K378-W512 PolarHBondContact O-N 2.87Å; L380-W512 HydrophobicContact CD2-CB 4.09Å; L380-W512 HydrophobicContact CD2-CD2 3.79Å; L380-W512 HydrophobicContact CD2-CE3 4.45Å; L380-W512 HydrophobicContact CD2-CG 3.59Å; L380-W512 HydrophobicContact CG-CB 4.22Å; L380-W512 HydrophobicContact CG-CG 4.22Å; L477-W512 HydrophobicContact CD1-CE3 4Å; L477-W512 HydrophobicContact CD1-CH2 3.9Å; L477-W512 HydrophobicContact CD1-CZ3 3.61Å; D480-W512 HydrophobicContact CB-CH2 4.47Å; D480-W512 HydrophobicContact CB-CZ2 4.15Å; L481-W512 HydrophobicContact CD1-CH2 4.31Å; L481-W512 HydrophobicContact CD1-CZ3 4.12Å; L481-W512 HydrophobicContact CD2-CH2 3.88Å; L481-W512 HydrophobicContact CD2-CZ3 4.09Å; L481-W512 HydrophobicContact CG-CH2 3.87Å; L481-W512 HydrophobicContact CG-CZ3 4.16Å
513	R	86	Confident	86.3	Confident	120 Å²	120	39.7 Å²	39.7	45%	0.453	23%	0.227	S	C	.	.			trans	-147.3	101.7	175.6	-61	179.3	-173.3	143.6	2.9	108.9	D493 C518	D493-R513 IonicContact OD2-NH1 3.16Å; R513-C518 WeakPolarHBondContact O-CA 3.35Å; R513-C518 WeakPolarHBondContact O-CB 3.23Å; R513-C518 PolarHBondContact O-N 3.04Å
514	S	75.7	Confident	85.6	Confident	34 Å²	34	41.1 Å²	41.1	24%	0.238	24%	0.239	C	C	.	.			trans	-67.6	142.8	175.2	-173	0	0	0	0	111.5	R446 D480	R446-S514 PolarHBondContact NH1-OG 2.87Å; D480-S514 PolarHBondContact OD2-OG 3.39Å
515	G	72.6	Confident	85	Confident	52 Å²	52	44.6 Å²	44.6	54%	0.536	26%	0.26	S	S	.	.	S	Bend	trans	95.7	-152.4	177.7	0	0	0	0	0	114.9	G517 C518	G515-G517 PolarHBondContact O-N 3.23Å; G515-C518 WeakPolarHBondContact O-CB 3.48Å; G515-C518 PolarHBondContact O-N 3.45Å
516	T	66.7	Low	84.2	Confident	166 Å²	166	40 Å²	40	100%	1.018	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	0.2	-171.4	49.9	0	0	0	0	115.9
517	G	73.7	Confident	83.5	Confident	42 Å²	42	40.7 Å²	40.7	43%	0.433	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	18.6	174.2	0	0	0	0	0	114	G515	G515-G517 PolarHBondContact O-N 3.23Å
518	C	80.4	Confident	82.6	Confident	29 Å²	29	45.5 Å²	45.5	20%	0.196	27%	0.266	C	S	.	.			trans	-62.6	124.4	-178.9	-170.6	0	0	0	0	111.7	R513 G515 I520	R513-C518 WeakPolarHBondContact O-CA 3.35Å; R513-C518 WeakPolarHBondContact O-CB 3.23Å; R513-C518 PolarHBondContact O-N 3.04Å; G515-C518 WeakPolarHBondContact O-CB 3.48Å; G515-C518 PolarHBondContact O-N 3.45Å; C518-I520 VanDerWaalsContact C-N 3.31Å; C518-I520 PolarHBondContact SG-O 3Å
519	P	85.3	Confident	81.4	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.026	29%	0.289	C	S	.	.	S	Bend	trans	-79.6	-12.2	179.7	32	-34.9	0	0	0	113.2	I491 K492 V510 I511	I491-P519 CarbonylContact C-O 3.57Å; I491-P519 WeakPolarHBondContact CA-O 3Å; K492-P519 PolarHBondContact N-O 3.46Å; K492-P519 WeakPolarHBondContact O-CB 3.38Å; V510-P519 HydrophobicContact CG2-CB 3.59Å; V510-P519 HydrophobicContact CG2-CG 3.42Å; V510-P519 VanDerWaalsContact CG2-CG 3.42Å; I511-P519 WeakPolarHBondContact O-CG 3.44Å
520	I	90.2	Very high	80.1	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.9	178.1	-55.8	172.5	0	0	0	108.8	L375 I377 L481 L489 E490 I491 V510 C518	L375-I520 HydrophobicContact CD2-CD1 4.21Å; I377-I520 HydrophobicContact CD1-CD1 3.53Å; I377-I520 HydrophobicContact CG1-CD1 3.93Å; L481-I520 HydrophobicContact CD1-CB 4.18Å; L481-I520 HydrophobicContact CD1-CG2 3.77Å; L481-I520 HydrophobicContact CD2-CB 4.36Å; L481-I520 HydrophobicContact CD2-CG2 4.39Å; L481-I520 WeakPolarHBondContact CD2-O 3.43Å; L489-I520 HydrophobicContact CB-CG2 4.37Å; L489-I520 HydrophobicContact CD1-CG2 4.16Å; E490-I520 WeakPolarHBondContact O-CA 3.32Å; I491-I520 HydrophobicContact CG2-CG1 4.4Å; V510-I520 HydrophobicContact CG1-CD1 4.07Å; V510-I520 HydrophobicContact CG1-CG1 4.41Å; C518-I520 VanDerWaalsContact C-N 3.31Å; C518-I520 PolarHBondContact SG-O 3Å
521	T	87.8	Confident	78.6	Confident	41 Å²	41	57 Å²	57	25%	0.252	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	137.8	177.3	41.9	0	0	0	0	110.8	E490 K492 L523	E490-T521 PolarHBondContact N-O 3.39Å; E490-T521 PolarHBondContact O-N 3.26Å; K492-T521 PolarHBondContact NZ-OG1 3.4Å; T521-L523 PolarHBondContact O-N 3.11Å
522	K	86.2	Confident	76.9	Confident	54 Å²	54	58 Å²	58	24%	0.235	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	126.7	178.1	-169.8	178.2	-177.9	175.4	0	110.2	Q482 S524 T525 V526	Q482-K522 PolarHBondContact O-NZ 3.29Å; K522-S524 VanDerWaalsContact C-N 3.3Å; K522-S524 PolarHBondContact O-N 3.2Å; K522-T525 PolarHBondContact O-N 3.37Å; K522-T525 VanDerWaalsContact O-N 3.16Å; K522-V526 PolarHBondContact O-N 3.33Å
523	L	81.8	Confident	75	Confident	6 Å²	6	60.1 Å²	60.1	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-65.4	-30.1	-168.1	-176.3	58.5	0	0	0	113.6	Y338 W488 T521 T525 V526 I527 V542	Y338-L523 HydrophobicContact CD1-CD1 4.02Å; Y338-L523 HydrophobicContact CD1-CD2 4.07Å; Y338-L523 HydrophobicContact CE1-CD1 3.59Å; Y338-L523 HydrophobicContact CE1-CD2 4.4Å; W488-L523 HydrophobicContact CB-CB 3.81Å; W488-L523 HydrophobicContact CB-CD2 3.73Å; W488-L523 HydrophobicContact CB-CG 4.39Å; W488-L523 HydrophobicContact CG-CD2 4.2Å; W488-L523 WeakPolarHBondContact O-CB 3.24Å; W488-L523 PolarHBondContact O-N 3.21Å; T521-L523 PolarHBondContact O-N 3.11Å; L523-T525 PolarHBondContact O-N 3.05Å; L523-V526 PolarHBondContact O-N 3.4Å; L523-I527 HydrophobicContact CD1-CD1 4.14Å; L523-I527 HydrophobicContact CD1-CG1 4.46Å; L523-I527 HydrophobicContact CG-CD1 3.94Å; L523-I527 WeakPolarHBondContact O-CG1 3.14Å; L523-I527 PolarHBondContact O-N 3.13Å; L523-I527 VanDerWaalsContact O-N 3.14Å; L523-V542 HydrophobicContact CD2-CG1 4.48Å
524	S	78.5	Confident	73	Confident	43 Å²	43	61.9 Å²	61.9	30%	0.301	38%	0.376	S	S	.	.	H	α-helix	trans	-59.2	-47.2	174.7	59.6	0	0	0	0	111.5	K522 V526 I527 E528	K522-S524 VanDerWaalsContact C-N 3.3Å; K522-S524 PolarHBondContact O-N 3.2Å; S524-V526 VanDerWaalsContact C-N 3.33Å; S524-V526 PolarHBondContact O-N 3.22Å; S524-I527 PolarHBondContact O-N 3.23Å; S524-I527 VanDerWaalsContact O-N 3.13Å; S524-E528 WeakPolarHBondContact O-CB 3.4Å; S524-E528 VanDerWaalsContact O-CD 3.23Å; S524-E528 WeakPolarHBondContact O-CG 3.46Å; S524-E528 PolarHBondContact O-N 3.22Å
525	T	79.1	Confident	71.5	Confident	76 Å²	76	67 Å²	67	47%	0.466	40%	0.401	S	S	.	.	H	α-helix	trans	-65.7	-34.4	-179	-49.5	0	0	0	0	112.3	K522 L523 E528 S529	K522-T525 PolarHBondContact O-N 3.37Å; K522-T525 VanDerWaalsContact O-N 3.16Å; L523-T525 PolarHBondContact O-N 3.05Å; T525-E528 WeakPolarHBondContact CA-OE2 3.43Å; T525-S529 WeakPolarHBondContact O-CB 3.48Å; T525-S529 PolarHBondContact O-N 3.26Å; T525-S529 PolarHBondContact O-OG 3.47Å
526	V	76	Confident	69.9	Low	22 Å²	22	69.9 Å²	69.9	13%	0.133	41%	0.408	C	S	.	.	H	α-helix	trans	-62.9	-47.6	171.9	-179.8	0	0	0	0	110.5	K522 L523 S524 S529 Q530	K522-V526 PolarHBondContact O-N 3.33Å; L523-V526 PolarHBondContact O-N 3.4Å; S524-V526 VanDerWaalsContact C-N 3.33Å; S524-V526 PolarHBondContact O-N 3.22Å; V526-S529 PolarHBondContact O-N 3.4Å; V526-S529 PolarHBondContact O-OG 3.24Å; V526-Q530 WeakPolarHBondContact O-CG 3.42Å; V526-Q530 PolarHBondContact O-N 3.06Å; V526-Q530 VanDerWaalsContact O-N 3.12Å
527	I	76.4	Confident	68.8	Low	18 Å²	18	67 Å²	67	9%	0.092	40%	0.395	C	S	.	.	H	α-helix	trans	-68.7	-36.1	-179.3	-69.1	162.9	0	0	0	111.7	L523 S524 Q530 K531 M540 V542	L523-I527 HydrophobicContact CD1-CD1 4.14Å; L523-I527 HydrophobicContact CD1-CG1 4.46Å; L523-I527 HydrophobicContact CG-CD1 3.94Å; L523-I527 WeakPolarHBondContact O-CG1 3.14Å; L523-I527 PolarHBondContact O-N 3.13Å; L523-I527 VanDerWaalsContact O-N 3.14Å; S524-I527 PolarHBondContact O-N 3.23Å; S524-I527 VanDerWaalsContact O-N 3.13Å; I527-Q530 PolarHBondContact O-N 3Å; I527-K531 WeakPolarHBondContact O-CG 3.34Å; I527-K531 PolarHBondContact O-N 3.45Å; I527-K531 VanDerWaalsContact O-N 3.13Å; I527-M540 VanDerWaalsContact CD1-O 3.27Å; I527-M540 WeakPolarHBondContact CD1-O 3.37Å; I527-V542 HydrophobicContact CD1-CB 4.39Å; I527-V542 HydrophobicContact CD1-CG2 3.47Å; I527-V542 VanDerWaalsContact CD1-CG2 3.47Å
528	E	74.2	Confident	67.5	Low	102 Å²	102	71.7 Å²	71.7	48%	0.477	41%	0.41	S	S	.	.	H	α-helix	trans	-59.2	-47.9	171	-75.8	144.8	-161.2	0	0	111	S524 T525 Q530 K531	S524-E528 WeakPolarHBondContact O-CB 3.4Å; S524-E528 VanDerWaalsContact O-CD 3.23Å; S524-E528 WeakPolarHBondContact O-CG 3.46Å; S524-E528 PolarHBondContact O-N 3.22Å; T525-E528 WeakPolarHBondContact CA-OE2 3.43Å; E528-Q530 PolarHBondContact O-N 3.33Å; E528-K531 PolarHBondContact O-N 3.22Å
529	S	69.8	Low	66	Low	73 Å²	73	74.3 Å²	74.3	51%	0.51	42%	0.421	S	S	.	.	H	α-helix	trans	-64.4	-24.1	176.9	75.1	0	0	0	0	114.5	T525 V526 S532	T525-S529 WeakPolarHBondContact O-CB 3.48Å; T525-S529 PolarHBondContact O-N 3.26Å; T525-S529 PolarHBondContact O-OG 3.47Å; V526-S529 PolarHBondContact O-N 3.4Å; V526-S529 PolarHBondContact O-OG 3.24Å; S529-S532 PolarHBondContact O-OG 3.23Å
530	Q	66.8	Low	64.5	Low	76 Å²	76	78.2 Å²	78.2	36%	0.355	44%	0.44	S	S	.	.	H	α-helix	trans	-79.7	-33.8	175.2	-72.2	176.1	7.7	0	0	112.6	V526 I527 E528 S532 S533	V526-Q530 WeakPolarHBondContact O-CG 3.42Å; V526-Q530 PolarHBondContact O-N 3.06Å; V526-Q530 VanDerWaalsContact O-N 3.12Å; I527-Q530 PolarHBondContact O-N 3Å; E528-Q530 PolarHBondContact O-N 3.33Å; Q530-S532 PolarHBondContact O-N 3.32Å; Q530-S533 PolarHBondContact O-N 3.44Å; Q530-S533 VanDerWaalsContact O-N 3.13Å; Q530-S533 PolarHBondContact O-OG 3.3Å
531	K	62.9	Low	63.2	Low	138 Å²	138	87 Å²	87	60%	0.6	48%	0.479	S	S	*	.	H	α-helix	trans	-61	-30.5	175.9	-72.3	172.5	-177.7	173.8	0	112.8	I527 E528 S533 L539	I527-K531 WeakPolarHBondContact O-CG 3.34Å; I527-K531 PolarHBondContact O-N 3.45Å; I527-K531 VanDerWaalsContact O-N 3.13Å; E528-K531 PolarHBondContact O-N 3.22Å; K531-S533 PolarHBondContact O-N 3.09Å; K531-S533 VanDerWaalsContact O-N 3.15Å; K531-L539 HydrophobicContact CG-CD2 4.04Å
532	S	54.5	Low	62.3	Low	102 Å²	102	88.8 Å²	88.8	71%	0.713	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	18.9	174.3	42.6	0	0	0	0	114.4	S529 Q530	S529-S532 PolarHBondContact O-OG 3.23Å; Q530-S532 PolarHBondContact O-N 3.32Å
533	S	51	Low	61.8	Low	62 Å²	62	87.1 Å²	87.1	43%	0.434	48%	0.484	S	S	.	.	S	Bend	trans	-136.2	126.6	174.6	68.1	0	0	0	0	111.5	Q530 K531 N535	Q530-S533 PolarHBondContact O-N 3.44Å; Q530-S533 VanDerWaalsContact O-N 3.13Å; Q530-S533 PolarHBondContact O-OG 3.3Å; K531-S533 PolarHBondContact O-N 3.09Å; K531-S533 VanDerWaalsContact O-N 3.15Å; S533-N535 PolarHBondContact O-N 3.01Å
534	D	42.7	Very low	61.5	Low	158 Å²	158	91.2 Å²	91.2	85%	0.845	51%	0.511	S	S	*	.	S	Bend	trans	-69.2	13.2	-164.1	-67	-50.5	0	0	0	117	T536	D534-T536 PolarHBondContact O-N 2.89Å
535	N	44.2	Very low	61.8	Low	140 Å²	140	91 Å²	91	75%	0.749	51%	0.511	S	S	*	.			trans	-89.4	71.6	175.1	-80	-46.7	0	0	0	111.3	S533 S537	S533-N535 PolarHBondContact O-N 3.01Å; N535-S537 PolarHBondContact O-N 3.12Å
536	T	39.1	Very low	62.3	Low	114 Å²	114	87.6 Å²	87.6	70%	0.699	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	24.1	-170.6	48.5	0	0	0	0	116	D534	D534-T536 PolarHBondContact O-N 2.89Å
537	S	43.8	Very low	62.9	Low	105 Å²	105	88.6 Å²	88.6	73%	0.734	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-19.5	-175	54.3	0	0	0	0	116.2	N535	N535-S537 PolarHBondContact O-N 3.12Å
538	D	46.2	Very low	63.7	Low	141 Å²	141	87.8 Å²	87.8	75%	0.754	49%	0.494	S	S	*	.			trans	-134.4	40.2	-173.2	-114.5	-18.1	0	0	0	111.9	M540	D538-M540 PolarHBondContact O-N 3.08Å
539	L	49	Very low	64.6	Low	83 Å²	83	83.4 Å²	83.4	44%	0.435	47%	0.474	S	S	.	.			trans	-66	101.3	-179.5	-103.7	166.4	0	0	0	111.6	K531 K541	K531-L539 HydrophobicContact CG-CD2 4.04Å; L539-K541 PolarHBondContact O-N 3.33Å; L539-K541 VanDerWaalsContact O-N 3.16Å
540	M	54.3	Low	65.7	Low	86 Å²	86	80 Å²	80	42%	0.424	45%	0.45	S	S	.	.			trans	-66.5	111.4	-174.9	-161.7	166	-162.6	0	0	111	Y338 I527 D538	Y338-M540 HydrophobicContact CE2-CE 3.55Å; Y338-M540 HydrophobicContact CE2-SD 4.28Å; I527-M540 VanDerWaalsContact CD1-O 3.27Å; I527-M540 WeakPolarHBondContact CD1-O 3.37Å; D538-M540 PolarHBondContact O-N 3.08Å
541	K	63.7	Low	67	Low	188 Å²	188	76.3 Å²	76.3	82%	0.817	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-72.7	136.5	179.5	-66.1	-177.7	179.7	178.7	0	110.3	L539	L539-K541 PolarHBondContact O-N 3.33Å; L539-K541 VanDerWaalsContact O-N 3.16Å
542	V	68.9	Low	68.5	Low	77 Å²	77	69.8 Å²	69.8	47%	0.467	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-52.3	128.4	169.8	-173.1	0	0	0	0	108.5	W488 L523 I527	W488-V542 HydrophobicContact CG-CG1 4.43Å; L523-V542 HydrophobicContact CD2-CG1 4.48Å; I527-V542 HydrophobicContact CD1-CB 4.39Å; I527-V542 HydrophobicContact CD1-CG2 3.47Å; I527-V542 VanDerWaalsContact CD1-CG2 3.47Å
543	P	74.1	Confident	70.5	Confident	19 Å²	19	65.3 Å²	65.3	12%	0.123	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-60	146	174.2	-20.5	31.5	0	0	0	110.5	W488	W488-P543 HydrophobicContact CD2-CG 4.45Å; W488-P543 HydrophobicContact CH2-CB 4.37Å; W488-P543 HydrophobicContact CZ2-CB 3.73Å; W488-P543 HydrophobicContact CZ2-CG 4.37Å; W488-P543 PolarHBondContact NE1-O 3.04Å
544	P	75.8	Confident	72.4	Confident	92 Å²	92	62.6 Å²	62.6	60%	0.597	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-57.3	152	172.9	26.5	-34	0	0	0	110.3	W488	W488-P544 WeakPolarHBondContact CZ2-O 3.35Å
545	A	84.5	Confident	74.8	Confident	38 Å²	38	55.8 Å²	55.8	31%	0.314	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-56.1	135.5	174.5	0	0	0	0	0	109.5
546	P	89.9	Confident	76.9	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.032	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-71.1	144.1	-174.1	30.5	-36.5	0	0	0	110.8	Y340 K360 Y370 L548	Y340-P546 HydrophobicContact CD1-CG 3.47Å; Y340-P546 VanDerWaalsContact CD1-CG 3.47Å; Y340-P546 HydrophobicContact CD2-CG 4.48Å; Y340-P546 HydrophobicContact CE1-CG 4.12Å; Y340-P546 VanDerWaalsContact CG-CD 3.46Å; Y340-P546 HydrophobicContact CG-CG 3.68Å; K360-P546 HydrophobicContact CB-CB 3.99Å; K360-P546 HydrophobicContact CB-CG 3.97Å; K360-P546 HydrophobicContact CG-CB 3.86Å; K360-P546 HydrophobicContact CG-CG 3.85Å; Y370-P546 HydrophobicContact CD1-CB 3.73Å; Y370-P546 HydrophobicContact CD2-CB 4.45Å; Y370-P546 HydrophobicContact CE1-CB 3.7Å; Y370-P546 HydrophobicContact CE2-CB 4.45Å; Y370-P546 HydrophobicContact CG-CB 4.1Å; P546-L548 HydrophobicContact CG-CD2 4.44Å
547	P	89.2	Confident	79.2	Confident	43 Å²	43	46 Å²	46	28%	0.279	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-61.7	140	163.4	27	-31.7	0	0	0	110.2	Y370 Y579 L580	Y370-P547 HydrophobicContact CD2-CG 4.27Å; Y370-P547 HydrophobicContact CE2-CG 4.25Å; P547-Y579 WeakPolarHBondContact CA-O 3.46Å; P547-L580 HydrophobicContact CB-CD2 4.41Å
548	L	92.4	Very high	81.1	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	150.1	177.7	-60.6	-174.3	0	0	0	110.5	F342 K360 P546 Y579 L581 D681 I682	F342-L548 HydrophobicContact CD1-CD2 4.08Å; F342-L548 HydrophobicContact CE1-CD2 3.82Å; K360-L548 HydrophobicContact CG-CD2 4.08Å; P546-L548 HydrophobicContact CG-CD2 4.44Å; L548-Y579 PolarHBondContact N-O 2.85Å; L548-Y579 WeakPolarHBondContact O-CB 3.44Å; L548-Y579 PolarHBondContact O-N 3Å; L548-L581 HydrophobicContact CD1-CD1 3.57Å; L548-L581 HydrophobicContact CD1-CG 3.96Å; L548-D681 HydrophobicContact CB-CB 4.16Å; L548-D681 HydrophobicContact CD2-CB 4.27Å; L548-I682 HydrophobicContact CD1-CD1 4.07Å; L548-I682 HydrophobicContact CD1-CG1 4.38Å
549	C	93	Very high	82.6	Confident	11 Å²	11	35.6 Å²	35.6	7%	0.074	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	116.3	170.9	-177.7	0	0	0	0	109.2	D576 P680 D681 I682	C549-D576 CarbonylContact C-O 3.57Å; C549-D576 WeakPolarHBondContact CA-O 3.32Å; C549-P680 CarbonylContact O-C 3.57Å; C549-D681 PolarHBondContact N-OD2 2.84Å; C549-D681 PolarHBondContact O-N 2.84Å; C549-I682 PolarHBondContact O-N 3.29Å; C549-I682 VanDerWaalsContact O-N 3.07Å
550	L	93.9	Very high	83.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.7	-178.2	174.3	167.8	0	0	0	108.6	I575 D576 Y579 I684 L852 L861	L550-I575 WeakPolarHBondContact O-CA 3.5Å; L550-D576 HydrophobicContact CB-CB 4.38Å; L550-D576 HydrophobicContact CD2-CB 4.45Å; L550-D576 PolarHBondContact N-O 3.36Å; L550-D576 PolarHBondContact O-N 3.32Å; L550-Y579 HydrophobicContact CB-CD1 4.46Å; L550-Y579 HydrophobicContact CB-CG 4.26Å; L550-Y579 HydrophobicContact CD1-CD1 3.56Å; L550-Y579 HydrophobicContact CD1-CD2 3.78Å; L550-Y579 HydrophobicContact CD1-CE1 3.96Å; L550-Y579 HydrophobicContact CD1-CE2 4.22Å; L550-Y579 HydrophobicContact CD1-CG 3.46Å; L550-Y579 VanDerWaalsContact CD1-CG 3.46Å; L550-I684 HydrophobicContact CD1-CD1 3.72Å; L550-I684 HydrophobicContact CD2-CD1 3.7Å; L550-I684 HydrophobicContact CD2-CG1 4.46Å; L550-I684 HydrophobicContact CG-CD1 3.66Å; L550-I684 HydrophobicContact CG-CG1 4.31Å; L550-L852 HydrophobicContact CD2-CD1 3.71Å; L550-L861 HydrophobicContact CD1-CD1 3.96Å
551	A	94.5	Very high	84.2	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	113.9	177	0	0	0	0	0	111.3	L573 L574 L678 P680 I682 I683 I684	A551-L573 HydrophobicContact CB-CD2 4.44Å; A551-L574 CarbonylContact C-O 3.58Å; A551-L574 VanDerWaalsContact CA-O 3.31Å; A551-L574 WeakPolarHBondContact CA-O 3.45Å; A551-L678 HydrophobicContact CB-CD2 4.26Å; A551-P680 HydrophobicContact CB-CB 3.82Å; A551-P680 HydrophobicContact CB-CG 4.18Å; A551-I682 PolarHBondContact N-O 2.86Å; A551-I683 CarbonylContact O-C 3.57Å; A551-I683 WeakPolarHBondContact O-CA 3.33Å; A551-I684 PolarHBondContact O-N 3.27Å
552	A	95.1	Very high	84.2	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	115.3	170.8	0	0	0	0	0	110.2	L573 L574 I684 L852	A552-L573 CarbonylContact O-C 3.49Å; A552-L573 VanDerWaalsContact O-CA 3.3Å; A552-L573 WeakPolarHBondContact O-CA 3.35Å; A552-L574 HydrophobicContact CB-CB 4.39Å; A552-L574 PolarHBondContact N-O 3.19Å; A552-L574 PolarHBondContact O-N 2.75Å; A552-I684 CarbonylContact C-O 3.45Å; A552-I684 VanDerWaalsContact CA-O 3.3Å; A552-I684 WeakPolarHBondContact CA-O 3.47Å; A552-I684 HydrophobicContact CB-CB 4.41Å; A552-L852 HydrophobicContact CB-CB 3.98Å; A552-L852 HydrophobicContact CB-CD1 4.19Å; A552-L852 HydrophobicContact CB-CG 4.49Å
553	I	94.4	Very high	84.2	Confident	9 Å²	9	30.8 Å²	30.8	5%	0.046	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	143.4	-176.2	-166.7	169.8	0	0	0	112.5	I555 I571 G572 L573 F671 I683 I684 L688	I553-I555 HydrophobicContact CD1-CD1 4.18Å; I553-I555 HydrophobicContact CD1-CG1 4.15Å; I553-I555 HydrophobicContact CG1-CG1 4.15Å; I553-I571 HydrophobicContact CD1-CG2 3.88Å; I553-I571 HydrophobicContact CG1-CG2 3.96Å; I553-G572 WeakPolarHBondContact CA-O 3.47Å; I553-L573 HydrophobicContact CB-CD2 3.74Å; I553-L573 HydrophobicContact CD1-CD2 4.04Å; I553-L573 HydrophobicContact CG1-CD2 3.7Å; I553-F671 HydrophobicContact CD1-CE2 3.98Å; I553-F671 HydrophobicContact CD1-CZ 3.93Å; I553-I683 HydrophobicContact CB-CG2 4.28Å; I553-I683 HydrophobicContact CG2-CG2 3.61Å; I553-I684 PolarHBondContact N-O 2.93Å; I553-L688 HydrophobicContact CG2-CD1 4.38Å; I553-L688 HydrophobicContact CG2-CD2 3.88Å
554	N	92.2	Very high	83.8	Confident	5 Å²	5	34.3 Å²	34.3	3%	0.027	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	119.1	170.5	177.9	26.6	0	0	0	109.4	K556 G572 C844 D847 A848	N554-K556 WeakPolarHBondContact OD1-CE 3.42Å; N554-K556 PolarHBondContact OD1-NZ 2.99Å; N554-G572 PolarHBondContact N-O 2.82Å; N554-G572 PolarHBondContact O-N 3.21Å; N554-C844 PolarHBondContact ND2-O 2.94Å; N554-D847 WeakPolarHBondContact ND2-CB 3.39Å; N554-A848 HydrophobicContact CB-CB 3.88Å
555	I	91.8	Very high	83.7	Confident	15 Å²	15	34.5 Å²	34.5	8%	0.077	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.2	177.6	-54.1	-173.9	0	0	0	109.3	I553 I568 S570 I571 Q692 L696	I553-I555 HydrophobicContact CD1-CD1 4.18Å; I553-I555 HydrophobicContact CD1-CG1 4.15Å; I553-I555 HydrophobicContact CG1-CG1 4.15Å; I555-I568 HydrophobicContact CG2-CD1 4.04Å; I555-I568 HydrophobicContact CG2-CG1 3.94Å; I555-I568 HydrophobicContact CG2-CG2 3.87Å; I555-S570 WeakPolarHBondContact CA-O 3.32Å; I555-I571 HydrophobicContact CG1-CG1 4.2Å; I555-I571 HydrophobicContact CG1-CG2 4.34Å; I555-I571 HydrophobicContact CG2-CG1 4.27Å; I555-Q692 HydrophobicContact CD1-CB 4.36Å; I555-Q692 VanDerWaalsContact N-OE1 3.14Å; I555-L696 HydrophobicContact CD1-CB 4.15Å; I555-L696 HydrophobicContact CD1-CD1 4.45Å; I555-L696 HydrophobicContact CD1-CD2 4.24Å
556	K	89.7	Confident	83.6	Confident	26 Å²	26	33.8 Å²	33.8	11%	0.113	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.4	168.1	-57.3	-56.8	-178	-146.6	0	111.1	N554 I569 S570 L827 F843 D847	N554-K556 WeakPolarHBondContact OD1-CE 3.42Å; N554-K556 PolarHBondContact OD1-NZ 2.99Å; K556-I569 HydrophobicContact CB-CD1 4.33Å; K556-I569 HydrophobicContact CB-CG1 4.05Å; K556-I569 WeakPolarHBondContact O-CG1 3.29Å; K556-I569 PolarHBondContact O-N 2.81Å; K556-S570 WeakPolarHBondContact CB-OG 3.33Å; K556-S570 WeakPolarHBondContact CG-OG 3.42Å; K556-S570 PolarHBondContact N-O 2.74Å; K556-S570 PolarHBondContact O-N 2.84Å; K556-L827 HydrophobicContact CB-CD1 4.28Å; K556-F843 HydrophobicContact CD-CE1 4.47Å; K556-D847 WeakPolarHBondContact CE-OD2 3.43Å; K556-D847 IonicContact NZ-OD2 3.17Å; K556-D847 PolarHBondContact NZ-OD2 3.06Å
557	S	86.7	Confident	83.5	Confident	23 Å²	23	33.6 Å²	33.6	16%	0.161	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	164.2	179.5	60.2	0	0	0	0	111.9	E567 S824	S557-E567 CarbonylContact C-O 3.57Å; S557-E567 WeakPolarHBondContact CA-O 3.27Å; S557-E567 WeakPolarHBondContact CB-O 3.43Å; S557-S824 WeakPolarHBondContact O-CB 3.42Å
558	V	84.7	Confident	83.7	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	125.2	177.8	174.5	0	0	0	0	108.4	S566 E567 I569 P600 S824 L827 R828	V558-S566 WeakPolarHBondContact O-CA 3.34Å; V558-E567 PolarHBondContact N-O 2.92Å; V558-E567 PolarHBondContact O-N 2.64Å; V558-I569 HydrophobicContact CB-CG2 4.09Å; V558-I569 HydrophobicContact CG2-CB 4.36Å; V558-I569 HydrophobicContact CG2-CD1 3.62Å; V558-I569 HydrophobicContact CG2-CG1 3.92Å; V558-I569 HydrophobicContact CG2-CG2 3.56Å; V558-P600 HydrophobicContact CG1-CB 4.47Å; V558-S824 WeakPolarHBondContact CG2-O 3.28Å; V558-L827 HydrophobicContact CG2-CB 4.24Å; V558-R828 HydrophobicContact CG1-CB 4.45Å
559	T	76.2	Confident	83.7	Confident	25 Å²	25	31.6 Å²	31.6	15%	0.153	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	135.4	173.5	-60.6	0	0	0	0	111	S566 S824	T559-S566 PolarHBondContact OG1-OG 2.75Å; T559-S824 PolarHBondContact N-OG 2.81Å; T559-S824 PolarHBondContact OG1-OG 3.49Å
560	Q	71.9	Confident	83.7	Confident	40 Å²	40	31 Å²	31	19%	0.187	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134.2	-172.1	-67.1	-171.3	-21.3	0	0	112	H562 S563 H565 E567	Q560-H562 PolarHBondContact O-N 3.06Å; Q560-S563 PolarHBondContact O-N 2.67Å; Q560-S563 VanDerWaalsContact O-N 3.09Å; Q560-H565 PolarHBondContact N-O 2.78Å; Q560-E567 HydrophobicContact CG-CB 4.27Å; Q560-E567 PolarHBondContact NE2-OE2 3.05Å
561	K	65.5	Low	83.7	Confident	96 Å²	96	31.1 Å²	31.1	42%	0.417	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-15.5	-179.6	-77	178.4	177.4	168.1	0	115.9	K1311	K561-K1311 WeakPolarHBondContact O-CB 3.35Å; K561-K1311 WeakPolarHBondContact O-CD 3.46Å; K561-K1311 WeakPolarHBondContact O-CG 3.47Å
562	H	64.7	Low	83.6	Confident	162 Å²	162	31.1 Å²	31.1	75%	0.75	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.6	8.3	-174.5	-56.7	-25.7	0	0	0	112.9	Q560	Q560-H562 PolarHBondContact O-N 3.06Å
563	S	67.7	Low	83.5	Confident	36 Å²	36	31.3 Å²	31.3	25%	0.252	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	134.5	-174.8	138.4	0	0	0	0	110.2	Q560 H565	Q560-S563 PolarHBondContact O-N 2.67Å; Q560-S563 VanDerWaalsContact O-N 3.09Å; S563-H565 PolarHBondContact O-N 2.99Å; S563-H565 WeakPolarHBondContact OG-CB 3.19Å; S563-H565 PolarHBondContact OG-N 2.71Å; S563-H565 VanDerWaalsContact OG-N 3.14Å; S563-H565 PolarHBondContact OG-ND1 2.85Å
564	S	67	Low	83.4	Confident	92 Å²	92	30.9 Å²	30.9	64%	0.643	16%	0.163	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.4	-9.8	175.7	49.1	0	0	0	0	114.8
565	H	73.8	Confident	83.4	Confident	97 Å²	97	31.2 Å²	31.2	45%	0.449	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	130.5	175.1	-49.1	88.2	0	0	0	111.9	Q560 S563	Q560-H565 PolarHBondContact N-O 2.78Å; S563-H565 PolarHBondContact O-N 2.99Å; S563-H565 WeakPolarHBondContact OG-CB 3.19Å; S563-H565 PolarHBondContact OG-N 2.71Å; S563-H565 VanDerWaalsContact OG-N 3.14Å; S563-H565 PolarHBondContact OG-ND1 2.85Å
566	S	81.7	Confident	83.3	Confident	23 Å²	23	30.9 Å²	30.9	16%	0.161	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	146.8	166	-46.1	0	0	0	0	111.6	V558 T559 R699	V558-S566 WeakPolarHBondContact O-CA 3.34Å; T559-S566 PolarHBondContact OG1-OG 2.75Å; S566-R699 VanDerWaalsContact O-CD 3.25Å; S566-R699 WeakPolarHBondContact O-CD 3.46Å; S566-R699 PolarHBondContact O-NE 2.9Å; S566-R699 VanDerWaalsContact O-NE 3.17Å; S566-R699 PolarHBondContact O-NH1 2.87Å; S566-R699 VanDerWaalsContact O-NH1 3.13Å
567	E	88.1	Confident	83.2	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.5	177.6	165.8	160.8	-130.5	0	0	109.3	S557 V558 Q560 I569 P600 K601 E664	S557-E567 CarbonylContact C-O 3.57Å; S557-E567 WeakPolarHBondContact CA-O 3.27Å; S557-E567 WeakPolarHBondContact CB-O 3.43Å; V558-E567 PolarHBondContact N-O 2.92Å; V558-E567 PolarHBondContact O-N 2.64Å; Q560-E567 HydrophobicContact CG-CB 4.27Å; Q560-E567 PolarHBondContact NE2-OE2 3.05Å; E567-I569 PolarHBondContact O-N 2.87Å; E567-P600 WeakPolarHBondContact OE2-CA 3.24Å; E567-K601 WeakPolarHBondContact OE1-CE 3.39Å; E567-K601 WeakPolarHBondContact OE1-CG 3.38Å; E567-K601 PolarHBondContact OE2-N 3.35Å; E567-E664 WeakPolarHBondContact CA-OE1 3.48Å; E567-E664 HydrophobicContact CG-CB 4.07Å; E567-E664 HydrophobicContact CG-CG 4.31Å
568	I	91.9	Very high	83.2	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	121.8	179.7	-67.6	168.2	0	0	0	109.7	I555 I571 E664 L667 L668 L695 L696 R699	I555-I568 HydrophobicContact CG2-CD1 4.04Å; I555-I568 HydrophobicContact CG2-CG1 3.94Å; I555-I568 HydrophobicContact CG2-CG2 3.87Å; I568-I571 HydrophobicContact CG2-CD1 4.17Å; I568-I571 HydrophobicContact CG2-CG1 3.82Å; I568-E664 PolarHBondContact N-OE1 2.95Å; I568-L667 HydrophobicContact CG2-CD2 3.79Å; I568-L668 HydrophobicContact CD1-CD2 4.24Å; I568-L695 HydrophobicContact CD1-CG 4.3Å; I568-L695 HydrophobicContact CG1-CD2 4.19Å; I568-L695 HydrophobicContact CG1-CG 4.34Å; I568-L696 HydrophobicContact CD1-CD1 4.31Å; I568-R699 HydrophobicContact CD1-CB 3.94Å; I568-R699 HydrophobicContact CD1-CG 3.76Å; I568-R699 HydrophobicContact CG1-CG 4.01Å
569	I	92.5	Very high	83.3	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-23.7	179.7	58.1	155.5	0	0	0	113.2	K556 V558 E567 L597 A598 P600 L667 L827 F831 L840	K556-I569 HydrophobicContact CB-CD1 4.33Å; K556-I569 HydrophobicContact CB-CG1 4.05Å; K556-I569 WeakPolarHBondContact O-CG1 3.29Å; K556-I569 PolarHBondContact O-N 2.81Å; V558-I569 HydrophobicContact CB-CG2 4.09Å; V558-I569 HydrophobicContact CG2-CB 4.36Å; V558-I569 HydrophobicContact CG2-CD1 3.62Å; V558-I569 HydrophobicContact CG2-CG1 3.92Å; V558-I569 HydrophobicContact CG2-CG2 3.56Å; E567-I569 PolarHBondContact O-N 2.87Å; I569-L597 WeakPolarHBondContact O-CA 3.48Å; I569-A598 PolarHBondContact O-N 2.81Å; I569-P600 HydrophobicContact CG2-CB 4.22Å; I569-P600 HydrophobicContact CG2-CG 4.39Å; I569-L667 WeakPolarHBondContact O-CD1 3.45Å; I569-L827 HydrophobicContact CD1-CB 4.01Å; I569-L827 HydrophobicContact CD1-CD1 4.39Å; I569-F831 HydrophobicContact CB-CE2 4.24Å; I569-F831 HydrophobicContact CB-CZ 4.21Å; I569-F831 HydrophobicContact CD1-CE2 3.94Å; I569-F831 HydrophobicContact CD1-CZ 4.48Å; I569-F831 HydrophobicContact CG2-CE2 4.44Å; I569-L840 HydrophobicContact CD1-CD2 4.36Å
570	S	93.2	Very high	83.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	147.4	175.2	85.9	0	0	0	0	113.1	I555 K556 V596 C844	I555-S570 WeakPolarHBondContact CA-O 3.32Å; K556-S570 WeakPolarHBondContact CB-OG 3.33Å; K556-S570 WeakPolarHBondContact CG-OG 3.42Å; K556-S570 PolarHBondContact N-O 2.74Å; K556-S570 PolarHBondContact O-N 2.84Å; S570-V596 VanDerWaalsContact CA-O 3.25Å; S570-V596 WeakPolarHBondContact CA-O 3.39Å; S570-C844 PolarHBondContact OG-SG 3.45Å
571	I	94.8	Very high	84.3	Confident	1 Å²	1	35 Å²	35	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	113.2	163.8	-57.7	174.5	0	0	0	107.9	I553 I555 I568 V596 L667 L668 F671 L696	I553-I571 HydrophobicContact CD1-CG2 3.88Å; I553-I571 HydrophobicContact CG1-CG2 3.96Å; I555-I571 HydrophobicContact CG1-CG1 4.2Å; I555-I571 HydrophobicContact CG1-CG2 4.34Å; I555-I571 HydrophobicContact CG2-CG1 4.27Å; I568-I571 HydrophobicContact CG2-CD1 4.17Å; I568-I571 HydrophobicContact CG2-CG1 3.82Å; I571-V596 PolarHBondContact N-O 3.41Å; I571-V596 PolarHBondContact O-N 3.02Å; I571-L667 HydrophobicContact CD1-CD2 3.84Å; I571-L667 HydrophobicContact CG1-CD2 4.1Å; I571-L668 HydrophobicContact CD1-CD2 4.15Å; I571-F671 HydrophobicContact CB-CD2 4.27Å; I571-F671 HydrophobicContact CD1-CB 4.06Å; I571-F671 HydrophobicContact CD1-CD1 3.86Å; I571-F671 HydrophobicContact CD1-CD2 4.08Å; I571-F671 HydrophobicContact CD1-CE1 4.35Å; I571-F671 HydrophobicContact CD1-CG 3.71Å; I571-F671 HydrophobicContact CG2-CD2 3.6Å; I571-F671 HydrophobicContact CG2-CE2 3.65Å; I571-F671 HydrophobicContact CG2-CG 4.33Å; I571-F671 HydrophobicContact CG2-CZ 4.42Å; I571-L696 HydrophobicContact CD1-CD1 4.16Å
572	G	91.8	Very high	84.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	146.1	173.9	0	0	0	0	0	112.1	I553 N554 Y594	I553-G572 WeakPolarHBondContact CA-O 3.47Å; N554-G572 PolarHBondContact N-O 2.82Å; N554-G572 PolarHBondContact O-N 3.21Å; G572-Y594 CarbonylContact C-O 3.49Å; G572-Y594 WeakPolarHBondContact CA-O 3.43Å
573	L	93.3	Very high	85	Confident	4 Å²	4	31.6 Å²	31.6	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.8	175.4	-62.8	175.2	0	0	0	109.7	A551 A552 I553 I575 H593 Y594 F671	A551-L573 HydrophobicContact CB-CD2 4.44Å; A552-L573 CarbonylContact O-C 3.49Å; A552-L573 VanDerWaalsContact O-CA 3.3Å; A552-L573 WeakPolarHBondContact O-CA 3.35Å; I553-L573 HydrophobicContact CB-CD2 3.74Å; I553-L573 HydrophobicContact CD1-CD2 4.04Å; I553-L573 HydrophobicContact CG1-CD2 3.7Å; L573-I575 HydrophobicContact CB-CG1 4.32Å; L573-H593 CarbonylContact O-C 3.54Å; L573-H593 WeakPolarHBondContact O-CA 3.45Å; L573-Y594 HydrophobicContact CD1-CD1 4.41Å; L573-Y594 PolarHBondContact N-O 3.07Å; L573-Y594 PolarHBondContact O-N 2.93Å; L573-F671 HydrophobicContact CD1-CE2 4.31Å; L573-F671 HydrophobicContact CD2-CE2 4.45Å
574	L	92.5	Very high	84.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	137.1	161.2	-57	-177	0	0	0	109	A551 A552 F590 H593 L845 A848 H849 L852	A551-L574 CarbonylContact C-O 3.58Å; A551-L574 VanDerWaalsContact CA-O 3.31Å; A551-L574 WeakPolarHBondContact CA-O 3.45Å; A552-L574 HydrophobicContact CB-CB 4.39Å; A552-L574 PolarHBondContact N-O 3.19Å; A552-L574 PolarHBondContact O-N 2.75Å; L574-F590 HydrophobicContact CB-CB 4.29Å; L574-F590 HydrophobicContact CB-CG 4.25Å; L574-F590 HydrophobicContact CD1-CD1 4.25Å; L574-F590 HydrophobicContact CD1-CE1 4.32Å; L574-F590 HydrophobicContact CD2-CD2 4.37Å; L574-F590 HydrophobicContact CD2-CE2 4.29Å; L574-H593 HydrophobicContact CD2-CB 3.52Å; L574-L845 HydrophobicContact CD2-CD2 4.02Å; L574-A848 HydrophobicContact CD1-CB 4.06Å; L574-A848 HydrophobicContact CG-CB 3.93Å; L574-H849 VanDerWaalsContact CD1-CA 3.47Å; L574-H849 HydrophobicContact CD1-CB 3.75Å; L574-L852 HydrophobicContact CB-CD2 4.27Å; L574-L852 HydrophobicContact CD1-CD2 4.25Å
575	I	91.8	Very high	84.7	Confident	12 Å²	12	30.5 Å²	30.5	6%	0.062	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	122.5	-161.5	-56.8	165.6	0	0	0	111	L550 L573 F590 Q591 T592 L678	L550-I575 WeakPolarHBondContact O-CA 3.5Å; L573-I575 HydrophobicContact CB-CG1 4.32Å; I575-F590 WeakPolarHBondContact O-CB 3.5Å; I575-Q591 PolarHBondContact O-N 3.26Å; I575-T592 WeakPolarHBondContact CB-O 3.45Å; I575-T592 WeakPolarHBondContact CB-OG1 3.37Å; I575-T592 PolarHBondContact N-O 2.89Å; I575-T592 PolarHBondContact O-N 3.05Å; I575-L678 HydrophobicContact CD1-CD1 4.15Å; I575-L678 HydrophobicContact CD1-CD2 3.73Å; I575-L678 HydrophobicContact CG1-CD2 3.87Å; I575-L678 HydrophobicContact CG2-CD1 3.65Å; I575-L678 HydrophobicContact CG2-CD2 4.21Å
576	D	90.3	Very high	83.9	Confident	9 Å²	9	32.6 Å²	32.6	5%	0.048	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.8	163.1	179.9	2.7	0	0	0	108.9	C549 L550 A578 Y579 Q591	C549-D576 CarbonylContact C-O 3.57Å; C549-D576 WeakPolarHBondContact CA-O 3.32Å; L550-D576 HydrophobicContact CB-CB 4.38Å; L550-D576 HydrophobicContact CD2-CB 4.45Å; L550-D576 PolarHBondContact N-O 3.36Å; L550-D576 PolarHBondContact O-N 3.32Å; D576-A578 VanDerWaalsContact C-N 3.34Å; D576-A578 WeakPolarHBondContact OD1-CA 3.26Å; D576-A578 PolarHBondContact OD1-N 3Å; D576-Y579 PolarHBondContact OD1-N 2.77Å; D576-Q591 PolarHBondContact OD1-NE2 3.1Å
577	N	86.7	Confident	82.8	Confident	75 Å²	75	38.9 Å²	38.9	40%	0.401	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-1.3	179.9	-56.8	-80.5	0	0	0	113.2	Q591	N577-Q591 PolarHBondContact ND2-OE1 3.39Å; N577-Q591 VanDerWaalsContact ND2-OE1 3.11Å
578	A	86.1	Confident	81.9	Confident	55 Å²	55	42 Å²	42	46%	0.455	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	24.3	-168.3	0	0	0	0	0	112.6	D576	D576-A578 VanDerWaalsContact C-N 3.34Å; D576-A578 WeakPolarHBondContact OD1-CA 3.26Å; D576-A578 PolarHBondContact OD1-N 3Å
579	Y	87.6	Confident	81.2	Confident	5 Å²	5	44.3 Å²	44.3	2%	0.02	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	132.9	-173	-174.9	-112.2	0	0	0	112.2	P547 L548 L550 D576 L581 I585 I682 H856 L861	P547-Y579 WeakPolarHBondContact CA-O 3.46Å; L548-Y579 PolarHBondContact N-O 2.85Å; L548-Y579 WeakPolarHBondContact O-CB 3.44Å; L548-Y579 PolarHBondContact O-N 3Å; L550-Y579 HydrophobicContact CB-CD1 4.46Å; L550-Y579 HydrophobicContact CB-CG 4.26Å; L550-Y579 HydrophobicContact CD1-CD1 3.56Å; L550-Y579 HydrophobicContact CD1-CD2 3.78Å; L550-Y579 HydrophobicContact CD1-CE1 3.96Å; L550-Y579 HydrophobicContact CD1-CE2 4.22Å; L550-Y579 HydrophobicContact CD1-CG 3.46Å; L550-Y579 VanDerWaalsContact CD1-CG 3.46Å; D576-Y579 PolarHBondContact OD1-N 2.77Å; Y579-L581 HydrophobicContact CE1-CD2 4.06Å; Y579-I585 HydrophobicContact CD2-CD1 4.05Å; Y579-I585 HydrophobicContact CD2-CG1 4.31Å; Y579-I585 HydrophobicContact CE2-CD1 3.93Å; Y579-I585 HydrophobicContact CE2-CG1 4.01Å; Y579-I682 HydrophobicContact CD1-CD1 4.14Å; Y579-I682 HydrophobicContact CE1-CD1 4.41Å; Y579-H856 AromaticContact CE2-CE1 3.63Å; Y579-L861 HydrophobicContact CD1-CD1 4.33Å; Y579-L861 HydrophobicContact CE1-CB 4.13Å; Y579-L861 HydrophobicContact CE1-CD1 3.59Å
580	L	86.5	Confident	80.9	Confident	55 Å²	55	45.7 Å²	45.7	29%	0.288	23%	0.233	S	C	.	.			trans	-109	123.5	177.7	-68.6	174.9	0	0	0	110.3	P547 D582 R583	P547-L580 HydrophobicContact CB-CD2 4.41Å; L580-D582 VanDerWaalsContact C-N 3.3Å; L580-D582 PolarHBondContact O-N 3.46Å; L580-R583 HydrophobicContact CB-CB 4.49Å
581	L	82.9	Confident	80.5	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.052	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.2	178	-73.5	169.4	0	0	0	113.3	L548 Y579 I682 L861 P862 M865 L875	L548-L581 HydrophobicContact CD1-CD1 3.57Å; L548-L581 HydrophobicContact CD1-CG 3.96Å; Y579-L581 HydrophobicContact CE1-CD2 4.06Å; L581-I682 HydrophobicContact CD2-CD1 4.02Å; L581-L861 HydrophobicContact CD2-CB 3.95Å; L581-P862 WeakPolarHBondContact O-CA 3.46Å; L581-M865 HydrophobicContact CB-CE 4.3Å; L581-M865 HydrophobicContact CB-SD 3.5Å; L581-M865 VanDerWaalsContact CB-SD 3.5Å; L581-M865 HydrophobicContact CD1-SD 4.22Å; L581-M865 HydrophobicContact CG-SD 4.46Å; L581-M865 WeakPolarHBondContact O-CE 3.25Å; L581-L875 HydrophobicContact CD1-CD2 4.34Å
582	D	72.9	Confident	80.1	Confident	38 Å²	38	51.5 Å²	51.5	20%	0.203	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-12.9	-174.6	68.6	-52.5	0	0	0	114	L580 M865 Q1068	L580-D582 VanDerWaalsContact C-N 3.3Å; L580-D582 PolarHBondContact O-N 3.46Å; D582-M865 HydrophobicContact CB-CE 4.15Å; D582-Q1068 PolarHBondContact O-NE2 2.86Å
583	R	71	Confident	80	Confident	149 Å²	149	52 Å²	52	56%	0.562	27%	0.266	S	S	*	.	S	Bend	trans	-132	149	-169.9	-59.2	-178.9	-169.2	-148.2	-3.2	113.1	L580	L580-R583 HydrophobicContact CB-CB 4.49Å
584	P	64.3	Low	79.8	Confident	47 Å²	47	52.5 Å²	52.5	31%	0.305	27%	0.267	S	S	.	.			trans	-70.2	154	166.7	30.6	-33.2	0	0	0	111.4	A1064 A1067	P584-A1064 HydrophobicContact CG-CB 3.82Å; P584-A1067 HydrophobicContact CG-CB 4.2Å
585	I	66	Low	79.8	Confident	58 Å²	58	52.5 Å²	52.5	30%	0.297	27%	0.267	S	S	.	.			trans	-74.7	131.6	178.9	-67.3	-177.9	0	0	0	110.5	Y579 S588 L589 H856	Y579-I585 HydrophobicContact CD2-CD1 4.05Å; Y579-I585 HydrophobicContact CD2-CG1 4.31Å; Y579-I585 HydrophobicContact CE2-CD1 3.93Å; Y579-I585 HydrophobicContact CE2-CG1 4.01Å; I585-S588 WeakPolarHBondContact CG2-O 3.26Å; I585-L589 HydrophobicContact CD1-CD2 4.23Å; I585-H856 WeakPolarHBondContact CD1-CE1 3.44Å
586	E	56.5	Low	79.8	Confident	142 Å²	142	52 Å²	52	66%	0.664	26%	0.264	S	S	*	.			trans	-87.4	-40.1	-179.2	-63.4	-172.7	-171.2	0	0	115.5
587	K	59.1	Low	80	Confident	155 Å²	155	51.6 Å²	51.6	67%	0.674	26%	0.262	S	S	*	.	S	Bend	trans	-142	-25.5	-161.3	-62.9	-172.8	-178.3	84.5	0	118.4
588	S	68.1	Low	80.3	Confident	65 Å²	65	48 Å²	48	46%	0.455	24%	0.243	S	C	.	.			trans	-151.8	139	175.8	63.3	0	0	0	0	111.9	I585	I585-S588 WeakPolarHBondContact CG2-O 3.26Å
589	L	77.3	Confident	80.5	Confident	51 Å²	51	46 Å²	46	27%	0.267	23%	0.225	S	C	.	.	S	Bend	trans	-82.2	-23.8	-176.2	-64.3	167.6	0	0	0	114	I585 L852 R853	I585-L589 HydrophobicContact CD1-CD2 4.23Å; L589-L852 HydrophobicContact CB-CD2 4.04Å; L589-L852 HydrophobicContact CB-CG 4.45Å; L589-R853 HydrophobicContact CD1-CG 3.7Å
590	F	85.4	Confident	80.5	Confident	28 Å²	28	45.8 Å²	45.8	12%	0.123	23%	0.225	C	C	.	.			trans	-154.6	153.9	177.3	64.6	-83.1	0	0	0	109.1	L574 I575 H593 Y620 H849 L852	L574-F590 HydrophobicContact CB-CB 4.29Å; L574-F590 HydrophobicContact CB-CG 4.25Å; L574-F590 HydrophobicContact CD1-CD1 4.25Å; L574-F590 HydrophobicContact CD1-CE1 4.32Å; L574-F590 HydrophobicContact CD2-CD2 4.37Å; L574-F590 HydrophobicContact CD2-CE2 4.29Å; I575-F590 WeakPolarHBondContact O-CB 3.5Å; F590-H593 HydrophobicContact CE2-CB 4.46Å; F590-Y620 HydrophobicContact CE2-CD1 4.36Å; F590-Y620 AromaticContact CZ-CD1 3.86Å; F590-Y620 HydrophobicContact CZ-CD1 3.86Å; F590-Y620 HydrophobicContact CZ-CE1 4.3Å; F590-H849 AromaticContact CE1-ND1 3.67Å; F590-L852 HydrophobicContact CB-CD2 4.22Å; F590-L852 HydrophobicContact CD1-CD2 4.15Å
591	Q	85.7	Confident	80.5	Confident	89 Å²	89	49.7 Å²	49.7	42%	0.416	24%	0.239	S	C	.	.	S	Bend	trans	-101.7	-29.1	172.2	-52.1	98.5	24	0	0	113.3	I575 D576 N577	I575-Q591 PolarHBondContact O-N 3.26Å; D576-Q591 PolarHBondContact OD1-NE2 3.1Å; N577-Q591 PolarHBondContact ND2-OE1 3.39Å; N577-Q591 VanDerWaalsContact ND2-OE1 3.11Å
592	T	86.6	Confident	80.4	Confident	35 Å²	35	52.8 Å²	52.8	22%	0.215	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.1	-176.4	56	0	0	0	0	111.3	I575 A655	I575-T592 WeakPolarHBondContact CB-O 3.45Å; I575-T592 WeakPolarHBondContact CB-OG1 3.37Å; I575-T592 PolarHBondContact N-O 2.89Å; I575-T592 PolarHBondContact O-N 3.05Å; T592-A655 HydrophobicContact CG2-CB 4.5Å
593	H	88.8	Confident	81	Confident	11 Å²	11	52.6 Å²	52.6	5%	0.051	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.5	178.5	66.7	-68.8	0	0	0	109.9	L573 L574 F590 G617 Y620 G656 G657 L845	L573-H593 CarbonylContact O-C 3.54Å; L573-H593 WeakPolarHBondContact O-CA 3.45Å; L574-H593 HydrophobicContact CD2-CB 3.52Å; F590-H593 HydrophobicContact CE2-CB 4.46Å; H593-G617 PolarHBondContact CE1-O 2.83Å; H593-G617 PolarHBondContact NE2-O 3.2Å; H593-Y620 PolarHBondContact CE1-N 3.3Å; H593-G656 WeakPolarHBondContact O-CA 3.44Å; H593-G657 PolarHBondContact O-N 2.96Å; H593-L845 HydrophobicContact CB-CD2 4.3Å
594	Y	89.4	Confident	81.6	Confident	13 Å²	13	49 Å²	49	5%	0.051	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	139.3	178	-176.5	-114.9	0	0	0	110.5	G572 L573 V596 G657 D659 R670 R674	G572-Y594 CarbonylContact C-O 3.49Å; G572-Y594 WeakPolarHBondContact CA-O 3.43Å; L573-Y594 HydrophobicContact CD1-CD1 4.41Å; L573-Y594 PolarHBondContact N-O 3.07Å; L573-Y594 PolarHBondContact O-N 2.93Å; Y594-V596 HydrophobicContact CD1-CG2 4.28Å; Y594-V596 HydrophobicContact CE1-CG2 3.33Å; Y594-V596 WeakPolarHBondContact OH-CG2 3.35Å; Y594-G657 WeakPolarHBondContact CA-O 3.2Å; Y594-G657 WeakPolarHBondContact CD2-O 3.21Å; Y594-D659 HydrophobicContact CE2-CB 4.27Å; Y594-D659 VanDerWaalsContact CE2-OD2 3.27Å; Y594-D659 WeakPolarHBondContact CE2-OD2 3.21Å; Y594-D659 VanDerWaalsContact CZ-OD2 3.31Å; Y594-D659 PolarHBondContact OH-OD2 3.33Å; Y594-R670 WeakPolarHBondContact OH-CD 3.28Å; Y594-R670 WeakPolarHBondContact OH-CG 3.48Å; Y594-R674 HydrophobicContact CD1-CB 4.16Å; Y594-R674 HydrophobicContact CD1-CG 4.31Å; Y594-R674 HydrophobicContact CE1-CB 3.66Å; Y594-R674 HydrophobicContact CE1-CG 3.46Å; Y594-R674 VanDerWaalsContact CE1-CG 3.46Å; Y594-R674 HydrophobicContact CE2-CG 4.4Å; Y594-R674 VanDerWaalsContact CZ-CD 3.48Å; Y594-R674 WeakPolarHBondContact OH-CG 3.47Å; Y594-R674 PolarHBondContact OH-NE 3.19Å
595	L	92.1	Very high	82.7	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	131.3	178.7	177.1	65.6	0	0	0	109.6	L597 G657 V658 D659 I841 C844 L845	L595-L597 HydrophobicContact CD2-CD1 4.06Å; L595-L597 HydrophobicContact CD2-CG 4.3Å; L595-L597 HydrophobicContact CG-CD1 4.46Å; L595-L597 HydrophobicContact CG-CG 4.24Å; L595-G657 PolarHBondContact N-O 2.99Å; L595-G657 VanDerWaalsContact N-O 3.15Å; L595-V658 HydrophobicContact CB-CG1 4.24Å; L595-V658 HydrophobicContact CB-CG2 4.28Å; L595-V658 HydrophobicContact CD2-CG1 4.05Å; L595-V658 HydrophobicContact CD2-CG2 4.35Å; L595-V658 HydrophobicContact CG-CG1 4.21Å; L595-V658 CarbonylContact O-C 3.6Å; L595-V658 WeakPolarHBondContact O-CA 3.19Å; L595-D659 PolarHBondContact O-N 3.44Å; L595-I841 HydrophobicContact CD2-CB 3.99Å; L595-I841 HydrophobicContact CD2-CG1 3.83Å; L595-I841 HydrophobicContact CD2-CG2 3.86Å; L595-C844 HydrophobicContact CD1-CB 3.97Å; L595-C844 HydrophobicContact CD2-CB 4.38Å; L595-L845 HydrophobicContact CB-CD2 4.42Å
596	V	93.5	Very high	83.7	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.8	168	-161.9	0	0	0	0	109	S570 I571 Y594 D659 E661 L667 R670	S570-V596 VanDerWaalsContact CA-O 3.25Å; S570-V596 WeakPolarHBondContact CA-O 3.39Å; I571-V596 PolarHBondContact N-O 3.41Å; I571-V596 PolarHBondContact O-N 3.02Å; Y594-V596 HydrophobicContact CD1-CG2 4.28Å; Y594-V596 HydrophobicContact CE1-CG2 3.33Å; Y594-V596 WeakPolarHBondContact OH-CG2 3.35Å; V596-D659 WeakPolarHBondContact CA-O 3.42Å; V596-E661 HydrophobicContact CG1-CG 3.97Å; V596-L667 HydrophobicContact CB-CD1 4.35Å; V596-L667 HydrophobicContact CB-CG 4.05Å; V596-L667 HydrophobicContact CG1-CB 3.99Å; V596-L667 HydrophobicContact CG1-CD1 4.17Å; V596-L667 HydrophobicContact CG1-CG 3.71Å; V596-R670 HydrophobicContact CG1-CB 4.23Å; V596-R670 HydrophobicContact CG1-CG 4.03Å; V596-R670 HydrophobicContact CG2-CG 3.98Å
597	L	92.9	Very high	85	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144.4	175.4	-77.5	162.9	0	0	0	111.3	I569 L595 V658 D659 V660 E661 F831 V837 L840 I841	I569-L597 WeakPolarHBondContact O-CA 3.48Å; L595-L597 HydrophobicContact CD2-CD1 4.06Å; L595-L597 HydrophobicContact CD2-CG 4.3Å; L595-L597 HydrophobicContact CG-CD1 4.46Å; L595-L597 HydrophobicContact CG-CG 4.24Å; L597-V658 HydrophobicContact CD1-CG1 4.03Å; L597-D659 PolarHBondContact N-O 2.66Å; L597-V660 HydrophobicContact CB-CG2 4.31Å; L597-V660 CarbonylContact O-C 3.52Å; L597-V660 WeakPolarHBondContact O-CA 3.49Å; L597-E661 PolarHBondContact O-N 3.21Å; L597-F831 HydrophobicContact CD2-CZ 4.49Å; L597-V837 HydrophobicContact CD1-CG1 4.25Å; L597-L840 HydrophobicContact CD2-CD2 3.76Å; L597-L840 HydrophobicContact CD2-CG 4.09Å; L597-I841 HydrophobicContact CD1-CD1 4.11Å; L597-I841 HydrophobicContact CD1-CG1 3.48Å; L597-I841 VanDerWaalsContact CD1-CG1 3.48Å
598	A	93.2	Very high	86.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.239	C	C	.	.			trans	-143.8	146.1	167.6	0	0	0	0	0	110.2	I569 E661 L667 F831	I569-A598 PolarHBondContact O-N 2.81Å; A598-E661 WeakPolarHBondContact CA-O 3.11Å; A598-L667 HydrophobicContact CB-CB 3.88Å; A598-L667 HydrophobicContact CB-CD1 3.84Å; A598-F831 WeakPolarHBondContact O-CZ 3.39Å
599	P	91.4	Very high	87.2	Confident	12 Å²	12	42.6 Å²	42.6	8%	0.078	22%	0.218	C	C	.	.			trans	-71.4	147.1	173.6	33.3	-34.3	0	0	0	109.8	A603 L605 E661 F831	P599-A603 HydrophobicContact CB-CB 4.4Å; P599-L605 HydrophobicContact CB-CD2 4.32Å; P599-L605 HydrophobicContact CG-CD2 4.12Å; P599-L605 HydrophobicContact CG-CG 4.08Å; P599-E661 WeakPolarHBondContact CD-O 3.47Å; P599-F831 HydrophobicContact CB-CD1 4.16Å; P599-F831 HydrophobicContact CB-CE1 4.33Å
600	P	88	Confident	87.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	25%	0.246	C	C	.	.			trans	-62.7	155.2	165.2	28.6	-34.2	0	0	0	110.2	V558 E567 I569 D602 A603	V558-P600 HydrophobicContact CG1-CB 4.47Å; E567-P600 WeakPolarHBondContact OE2-CA 3.24Å; I569-P600 HydrophobicContact CG2-CB 4.22Å; I569-P600 HydrophobicContact CG2-CG 4.39Å; P600-D602 PolarHBondContact O-N 2.89Å; P600-A603 HydrophobicContact CG-CB 3.88Å; P600-A603 PolarHBondContact O-N 2.89Å
601	K	85.3	Confident	87.4	Confident	137 Å²	137	55 Å²	55	60%	0.596	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-20	-169.6	-74.2	171	-164.2	178.6	0	116.7	E567	E567-K601 WeakPolarHBondContact OE1-CE 3.39Å; E567-K601 WeakPolarHBondContact OE1-CG 3.38Å; E567-K601 PolarHBondContact OE2-N 3.35Å
602	D	82	Confident	87.2	Confident	76 Å²	76	53.8 Å²	53.8	41%	0.406	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	27.4	-179	62.6	-13.6	0	0	0	112.8	P600 R828	P600-D602 PolarHBondContact O-N 2.89Å; D602-R828 VanDerWaalsContact CG-NH2 3.35Å; D602-R828 IonicContact OD1-CZ 3.62Å; D602-R828 IonicContact OD1-NH1 2.78Å; D602-R828 PolarHBondContact OD1-NH1 3.15Å; D602-R828 IonicContact OD1-NH2 2.74Å; D602-R828 PolarHBondContact OD1-NH2 2.79Å; D602-R828 IonicContact OD2-CZ 3.5Å; D602-R828 IonicContact OD2-NH1 2.92Å; D602-R828 PolarHBondContact OD2-NH1 2.73Å; D602-R828 IonicContact OD2-NH2 3.64Å; D602-R828 PolarHBondContact OD2-NH2 3.25Å
603	A	84.4	Confident	86.9	Confident	34 Å²	34	53.6 Å²	53.6	28%	0.281	27%	0.265	S	S	.	.			trans	-128.4	166.7	161.3	0	0	0	0	0	110.2	P599 P600 F831	P599-A603 HydrophobicContact CB-CB 4.4Å; P600-A603 HydrophobicContact CG-CB 3.88Å; P600-A603 PolarHBondContact O-N 2.89Å; A603-F831 HydrophobicContact CB-CB 4.47Å
604	A	84.2	Confident	86.4	Confident	74 Å²	74	57.8 Å²	57.8	61%	0.612	29%	0.293	S	S	*	.			trans	-124.4	159.4	174.5	0	0	0	0	0	110.1
605	L	86.5	Confident	85.7	Confident	66 Å²	66	61.1 Å²	61.1	35%	0.346	32%	0.318	S	S	.	.			trans	-72.7	141.1	172.2	-65.7	174.3	0	0	0	110.5	P599 Y607 L609 V660 F831	P599-L605 HydrophobicContact CB-CD2 4.32Å; P599-L605 HydrophobicContact CG-CD2 4.12Å; P599-L605 HydrophobicContact CG-CG 4.08Å; L605-Y607 PolarHBondContact O-N 3.43Å; L605-L609 HydrophobicContact CD2-CD2 4.03Å; L605-V660 HydrophobicContact CD1-CG1 3.57Å; L605-V660 HydrophobicContact CD2-CG1 3.61Å; L605-V660 HydrophobicContact CG-CG1 4.25Å; L605-F831 HydrophobicContact CD2-CD1 4.27Å; L605-F831 HydrophobicContact CD2-CE1 4.41Å
606	P	87.2	Confident	84.8	Confident	15 Å²	15	61.7 Å²	61.7	10%	0.097	32%	0.32	C	S	.	.			trans	-56.3	135.1	170.8	-21.9	30.6	0	0	0	111.4	D608 L609 F831 V837	P606-D608 WeakPolarHBondContact CB-OD1 3.48Å; P606-D608 PolarHBondContact O-N 2.97Å; P606-L609 HydrophobicContact CB-CB 4.11Å; P606-L609 HydrophobicContact CG-CB 4.42Å; P606-L609 VanDerWaalsContact O-CB 3.25Å; P606-L609 WeakPolarHBondContact O-CB 3.33Å; P606-L609 PolarHBondContact O-N 3.23Å; P606-F831 WeakPolarHBondContact CD-O 3.36Å; P606-F831 WeakPolarHBondContact CG-O 3.33Å; P606-V837 HydrophobicContact CG-CG2 4Å
607	Y	85	Confident	83.2	Confident	217 Å²	217	62.2 Å²	62.2	85%	0.851	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-28.8	-173.3	74.4	-85.9	0	0	0	113.4	L605	L605-Y607 PolarHBondContact O-N 3.43Å
608	D	88.4	Confident	81.6	Confident	28 Å²	28	65.4 Å²	65.4	15%	0.15	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-9.7	178.9	66.5	-31.2	0	0	0	113.3	P606 R610 T611 K612 S834	P606-D608 WeakPolarHBondContact CB-OD1 3.48Å; P606-D608 PolarHBondContact O-N 2.97Å; D608-R610 PolarHBondContact O-N 3.03Å; D608-T611 PolarHBondContact O-N 2.83Å; D608-T611 PolarHBondContact O-OG1 3.35Å; D608-K612 PolarHBondContact O-N 3.48Å; D608-K612 VanDerWaalsContact O-N 3.14Å; D608-K612 WeakPolarHBondContact OD2-CD 3.35Å; D608-K612 WeakPolarHBondContact OD2-CE 3.32Å; D608-K612 IonicContact OD2-NZ 3.38Å; D608-K612 PolarHBondContact OD2-NZ 2.97Å; D608-S834 PolarHBondContact OD2-OG 3.49Å
609	L	84.5	Confident	80.1	Confident	5 Å²	5	73.7 Å²	73.7	3%	0.026	39%	0.391	C	S	.	.	H	α-helix	trans	-56.3	-40	-178.9	-179.5	63.2	0	0	0	111.2	L605 P606 T611 K612 L613 Y616 V660 V837	L605-L609 HydrophobicContact CD2-CD2 4.03Å; P606-L609 HydrophobicContact CB-CB 4.11Å; P606-L609 HydrophobicContact CG-CB 4.42Å; P606-L609 VanDerWaalsContact O-CB 3.25Å; P606-L609 WeakPolarHBondContact O-CB 3.33Å; P606-L609 PolarHBondContact O-N 3.23Å; L609-T611 PolarHBondContact O-N 2.8Å; L609-K612 PolarHBondContact O-N 2.93Å; L609-L613 WeakPolarHBondContact O-CB 3.45Å; L609-L613 PolarHBondContact O-N 3.43Å; L609-Y616 HydrophobicContact CD1-CD2 4.2Å; L609-Y616 HydrophobicContact CD1-CE2 3.96Å; L609-V660 HydrophobicContact CD2-CG1 4.2Å; L609-V660 HydrophobicContact CD2-CG2 4.3Å; L609-V837 HydrophobicContact CD1-CB 4.16Å; L609-V837 HydrophobicContact CD1-CG1 3.8Å; L609-V837 HydrophobicContact CD2-CG1 3.98Å; L609-V837 HydrophobicContact CD2-CG2 4.48Å
610	R	82.1	Confident	78.9	Confident	226 Å²	226	74.2 Å²	74.2	85%	0.853	39%	0.391	S	S	*	.	H	α-helix	trans	-66.5	-22.1	-178	-165.4	172.4	-176	174.4	2.8	113.9	D608	D608-R610 PolarHBondContact O-N 3.03Å
611	T	83.4	Confident	77.7	Confident	115 Å²	115	78.7 Å²	78.7	71%	0.706	42%	0.423	S	S	*	.	H	α-helix	trans	-90.7	-30.4	174.5	63.4	0	0	0	0	112.2	D608 L609	D608-T611 PolarHBondContact O-N 2.83Å; D608-T611 PolarHBondContact O-OG1 3.35Å; L609-T611 PolarHBondContact O-N 2.8Å
612	K	83.4	Confident	76.5	Confident	62 Å²	62	74.3 Å²	74.3	27%	0.27	41%	0.409	S	S	.	.	H	α-helix	trans	-83.1	-29.1	177.8	-70.8	173.2	168	177.6	0	113.9	D608 L609 P614 S615 Y616 S834 D835	D608-K612 PolarHBondContact O-N 3.48Å; D608-K612 VanDerWaalsContact O-N 3.14Å; D608-K612 WeakPolarHBondContact OD2-CD 3.35Å; D608-K612 WeakPolarHBondContact OD2-CE 3.32Å; D608-K612 IonicContact OD2-NZ 3.38Å; D608-K612 PolarHBondContact OD2-NZ 2.97Å; L609-K612 PolarHBondContact O-N 2.93Å; K612-P614 VanDerWaalsContact C-CD 3.46Å; K612-S615 WeakPolarHBondContact O-CA 3.25Å; K612-S615 WeakPolarHBondContact O-CB 3.4Å; K612-S615 PolarHBondContact O-N 3.43Å; K612-S615 PolarHBondContact O-OG 2.79Å; K612-Y616 HydrophobicContact CB-CE1 4.29Å; K612-Y616 HydrophobicContact CB-CE2 3.99Å; K612-S834 WeakPolarHBondContact CD-OG 3.35Å; K612-S834 PolarHBondContact NZ-OG 3.07Å; K612-D835 IonicContact NZ-OD1 2.67Å; K612-D835 IonicContact NZ-OD2 2.74Å; K612-D835 PolarHBondContact NZ-OD2 2.77Å
613	L	80.4	Confident	75.1	Confident	32 Å²	32	73.6 Å²	73.6	17%	0.168	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-52.2	-40.4	-174.2	-177.1	67.6	0	0	0	114.8	L609 S615 Y616 V658 V660 I841	L609-L613 WeakPolarHBondContact O-CB 3.45Å; L609-L613 PolarHBondContact O-N 3.43Å; L613-S615 PolarHBondContact O-N 3.32Å; L613-S615 VanDerWaalsContact O-N 3.08Å; L613-Y616 PolarHBondContact O-N 2.7Å; L613-V658 HydrophobicContact CD1-CB 4.05Å; L613-V658 HydrophobicContact CD1-CG1 3.95Å; L613-V660 HydrophobicContact CD1-CG2 3.79Å; L613-V660 HydrophobicContact CD2-CB 4.2Å; L613-V660 HydrophobicContact CD2-CG2 3.62Å; L613-V660 HydrophobicContact CG-CG2 4.36Å; L613-I841 HydrophobicContact CD1-CD1 4.46Å
614	P	77.1	Confident	73.1	Confident	99 Å²	99	77.8 Å²	77.8	64%	0.643	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-62	-16.3	175.5	-23.7	35.8	0	0	0	114.7	K612	K612-P614 VanDerWaalsContact C-CD 3.46Å
615	S	74.2	Confident	71.1	Confident	83 Å²	83	76.9 Å²	76.9	58%	0.58	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-93	-8.7	173.6	75.5	0	0	0	0	113.7	K612 L613	K612-S615 WeakPolarHBondContact O-CA 3.25Å; K612-S615 WeakPolarHBondContact O-CB 3.4Å; K612-S615 PolarHBondContact O-N 3.43Å; K612-S615 PolarHBondContact O-OG 2.79Å; L613-S615 PolarHBondContact O-N 3.32Å; L613-S615 VanDerWaalsContact O-N 3.08Å
616	Y	73.3	Confident	68.8	Low	12 Å²	12	79.5 Å²	79.5	5%	0.047	44%	0.443	C	S	.	.	S	Bend	trans	-102.3	120.5	-178.4	-61.7	-16.5	0	0	0	109.6	L609 K612 L613 A618 S834 D835 R838 I841	L609-Y616 HydrophobicContact CD1-CD2 4.2Å; L609-Y616 HydrophobicContact CD1-CE2 3.96Å; K612-Y616 HydrophobicContact CB-CE1 4.29Å; K612-Y616 HydrophobicContact CB-CE2 3.99Å; L613-Y616 PolarHBondContact O-N 2.7Å; Y616-A618 VanDerWaalsContact C-N 3.3Å; Y616-A618 PolarHBondContact O-N 2.7Å; Y616-S834 WeakPolarHBondContact CE2-O 3.45Å; Y616-S834 WeakPolarHBondContact OH-CB 3.39Å; Y616-S834 PolarHBondContact OH-O 3.04Å; Y616-S834 PolarHBondContact OH-OG 2.75Å; Y616-D835 PolarHBondContact OH-OD1 3.44Å; Y616-R838 HydrophobicContact CD1-CB 4.33Å; Y616-R838 HydrophobicContact CD1-CG 4.03Å; Y616-R838 HydrophobicContact CD2-CB 4.11Å; Y616-R838 HydrophobicContact CD2-CG 4.48Å; Y616-R838 HydrophobicContact CE1-CB 4.12Å; Y616-R838 HydrophobicContact CE1-CG 4.15Å; Y616-R838 HydrophobicContact CE2-CB 3.9Å; Y616-R838 HydrophobicContact CG-CB 4.32Å; Y616-R838 HydrophobicContact CG-CG 4.19Å; Y616-I841 HydrophobicContact CD2-CD1 4.08Å; Y616-I841 HydrophobicContact CG-CD1 4.48Å
617	G	60.1	Low	66.5	Low	12 Å²	12	85 Å²	85	12%	0.124	46%	0.462	C	S	.	.	S	Bend	trans	65.1	25.7	174	0	0	0	0	0	115.4	H593 Q619	H593-G617 PolarHBondContact CE1-O 2.83Å; H593-G617 PolarHBondContact NE2-O 3.2Å; G617-Q619 VanDerWaalsContact C-N 3.33Å
618	A	60.2	Low	64.2	Low	67 Å²	67	81.7 Å²	81.7	55%	0.554	46%	0.459	S	S	*	.	S	Bend	trans	-66.4	-35.8	171.6	0	0	0	0	0	112.1	Y616	Y616-A618 VanDerWaalsContact C-N 3.3Å; Y616-A618 PolarHBondContact O-N 2.7Å
619	Q	61.5	Low	61.5	Low	175 Å²	175	84.3 Å²	84.3	82%	0.818	48%	0.479	S	S	*	.	S	Bend	trans	-138.9	110	166.4	-70	-177.8	-17.9	0	0	107.5	G617 S621	G617-Q619 VanDerWaalsContact C-N 3.33Å; Q619-S621 PolarHBondContact O-N 3.13Å
620	Y	65.4	Low	59	Low	22 Å²	22	89 Å²	89	9%	0.086	50%	0.504	C	S	.	.			trans	-86.2	101.9	175.2	176.4	-102	0	0	0	109.5	F590 H593 L845 S846	F590-Y620 HydrophobicContact CE2-CD1 4.36Å; F590-Y620 AromaticContact CZ-CD1 3.86Å; F590-Y620 HydrophobicContact CZ-CD1 3.86Å; F590-Y620 HydrophobicContact CZ-CE1 4.3Å; H593-Y620 PolarHBondContact CE1-N 3.3Å; Y620-L845 HydrophobicContact CD1-CB 4.11Å; Y620-L845 HydrophobicContact CD1-CD1 4.5Å; Y620-L845 HydrophobicContact CD2-CB 3.87Å; Y620-L845 HydrophobicContact CD2-CD1 3.68Å; Y620-L845 HydrophobicContact CD2-CG 4.43Å; Y620-L845 HydrophobicContact CE1-CB 3.95Å; Y620-L845 HydrophobicContact CE2-CB 3.69Å; Y620-L845 HydrophobicContact CE2-CD1 4.34Å; Y620-L845 HydrophobicContact CG-CB 4.08Å; Y620-L845 HydrophobicContact CG-CD1 3.79Å; Y620-S846 WeakPolarHBondContact OH-CA 3.31Å; Y620-S846 PolarHBondContact OH-N 2.62Å
621	S	63.3	Low	56.8	Low	95 Å²	95	83.8 Å²	83.8	66%	0.664	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-89.9	128.6	165.7	-63.7	0	0	0	0	108.8	Q619	Q619-S621 PolarHBondContact O-N 3.13Å
622	P	60.3	Low	54.2	Low	46 Å²	46	84.9 Å²	84.9	30%	0.299	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-63.5	155.2	174.3	28.1	-34.4	0	0	0	110.7	S624	P622-S624 PolarHBondContact O-N 3.19Å
623	P	51.9	Low	51.6	Low	61 Å²	61	85.3 Å²	85.3	40%	0.396	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-52.2	140.7	171.2	-21.4	31	0	0	0	110.5	S625 Q787	P623-S625 PolarHBondContact O-N 3.16Å; P623-Q787 VanDerWaalsContact CG-CD 3.49Å; P623-Q787 VanDerWaalsContact CG-NE2 3.28Å
624	S	43.3	Very low	49.2	Very low	122 Å²	122	88.7 Å²	88.7	85%	0.853	55%	0.545	S	S	*	.			trans	-67.4	84	-165.9	58.3	0	0	0	0	113.5	P622	P622-S624 PolarHBondContact O-N 3.19Å
625	S	41.6	Very low	46.7	Very low	55 Å²	55	90.3 Å²	90.3	39%	0.385	56%	0.559	S	S	.	*			trans	-84.4	111.8	171.9	68.3	0	0	0	0	110.5	P623 W627 R853	P623-S625 PolarHBondContact O-N 3.16Å; S625-W627 VanDerWaalsContact C-N 3.28Å; S625-W627 PolarHBondContact O-N 3.25Å; S625-R853 PolarHBondContact OG-NH1 3.13Å
626	T	38.5	Very low	44.6	Very low	121 Å²	121	90.5 Å²	90.5	74%	0.742	56%	0.561	S	S	*	*			trans	-70.2	74.9	-178.3	-42.8	0	0	0	0	111.8
627	W	37.9	Very low	42.4	Very low	130 Å²	130	95.4 Å²	95.4	49%	0.492	59%	0.592	S	S	.	*			trans	-118	-20.4	-170.4	-146.2	70.1	0	0	0	114.8	S625 S629	S625-W627 VanDerWaalsContact C-N 3.28Å; S625-W627 PolarHBondContact O-N 3.25Å; W627-S629 PolarHBondContact O-N 2.77Å; W627-S629 VanDerWaalsContact O-N 3.11Å
628	L	37.6	Very low	41	Very low	148 Å²	148	101 Å²	101	78%	0.775	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	8.9	177.9	-75.5	169.8	0	0	0	114.5
629	S	31	Very low	39.3	Very low	83 Å²	83	102.3 Å²	102.3	58%	0.58	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	5.6	-172.2	55.5	0	0	0	0	114.9	W627 N631	W627-S629 PolarHBondContact O-N 2.77Å; W627-S629 VanDerWaalsContact O-N 3.11Å; S629-N631 PolarHBondContact O-N 2.69Å
630	L	32.4	Very low	37.7	Very low	104 Å²	104	99.5 Å²	99.5	55%	0.545	63%	0.626	S	S	.	*			trans	-102.2	59.4	-178.3	-79.5	165.6	0	0	0	113.2	V769	L630-V769 HydrophobicContact CD1-CG1 3.41Å; L630-V769 VanDerWaalsContact CD1-CG1 3.41Å
631	N	35.3	Very low	36	Very low	116 Å²	116	104.7 Å²	104.7	62%	0.62	66%	0.66	S	S	*	*			trans	-130.2	92.8	157.4	-100.4	-32.8	0	0	0	108	S629 G633	S629-N631 PolarHBondContact O-N 2.69Å; N631-G633 PolarHBondContact O-N 3.07Å
632	P	29	Very low	34.2	Very low	138 Å²	138	108.7 Å²	108.7	90%	0.896	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	68.5	-179.1	32.4	-35.4	0	0	0	110.8
633	G	28.5	Very low	32.5	Very low	71 Å²	71	115.1 Å²	115.1	73%	0.732	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.6	-0.7	-174.1	0	0	0	0	0	117.9	N631	N631-G633 PolarHBondContact O-N 3.07Å
634	V	30.8	Very low	31.4	Very low	102 Å²	102	123.5 Å²	123.5	62%	0.618	72%	0.716	S	S	*	*			trans	-130	94.1	-179.3	-171.4	0	0	0	0	112	S636	V634-S636 VanDerWaalsContact C-N 3.29Å; V634-S636 PolarHBondContact O-N 2.69Å; V634-S636 VanDerWaalsContact O-N 3.12Å
635	S	25.5	Very low	30.5	Very low	133 Å²	133	125.9 Å²	125.9	93%	0.93	71%	0.711	S	S	*	*			trans	-84.2	60.2	173.8	50.5	0	0	0	0	112.6
636	S	28.5	Very low	29.7	Very low	88 Å²	88	130.1 Å²	130.1	62%	0.615	73%	0.73	S	S	*	*			trans	-100	126.8	172.4	62.7	0	0	0	0	111.5	V634	V634-S636 VanDerWaalsContact C-N 3.29Å; V634-S636 PolarHBondContact O-N 2.69Å; V634-S636 VanDerWaalsContact O-N 3.12Å
637	T	28.6	Very low	29.1	Very low	114 Å²	114	133.9 Å²	133.9	70%	0.699	74%	0.739	S	S	*	*			trans	-69.6	137.4	-173.7	52.2	0	0	0	0	113.2	S639	T637-S639 VanDerWaalsContact C-N 3.33Å; T637-S639 PolarHBondContact O-N 3.29Å; T637-S639 PolarHBondContact O-OG 2.92Å
638	P	29.1	Very low	28.5	Very low	130 Å²	130	133 Å²	133	84%	0.844	75%	0.752	S	S	*	*			trans	-76.8	80.5	179.4	31.5	-35.1	0	0	0	111.1
639	S	25.2	Very low	27.9	Very low	94 Å²	94	134.4 Å²	134.4	66%	0.657	76%	0.76	S	S	*	*			trans	-119.9	16.7	-169.9	56	0	0	0	0	115.8	T637	T637-S639 VanDerWaalsContact C-N 3.33Å; T637-S639 PolarHBondContact O-N 3.29Å; T637-S639 PolarHBondContact O-OG 2.92Å
640	T	27.8	Very low	27.6	Very low	117 Å²	117	133.5 Å²	133.5	72%	0.718	76%	0.764	S	S	*	*			trans	-142.6	67.2	176.6	-41.4	0	0	0	0	113.5
641	V	29.3	Very low	27.3	Very low	131 Å²	131	135.6 Å²	135.6	79%	0.794	78%	0.776	S	S	*	*			trans	-112	-7	175.7	-175.3	0	0	0	0	112.9	K643	V641-K643 PolarHBondContact O-N 2.72Å
642	E	25.9	Very low	27	Very low	178 Å²	178	136.6 Å²	136.6	83%	0.832	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	18.3	-174.1	-64.4	-159.9	111.5	0	0	116
643	K	25.7	Very low	27.1	Very low	181 Å²	181	134.9 Å²	134.9	79%	0.787	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	10.5	-178.4	-90.1	-172.3	174.8	-176.8	0	117.1	V641	V641-K643 PolarHBondContact O-N 2.72Å
644	Y	27.9	Very low	27.5	Very low	237 Å²	237	134.5 Å²	134.5	93%	0.929	78%	0.78	S	S	*	*	S	Bend	trans	-119.1	50.3	168.1	-75.5	-73.8	0	0	0	112.6
645	K	24.7	Very low	28.1	Very low	172 Å²	172	133.8 Å²	133.8	75%	0.748	79%	0.785	S	S	*	*			trans	-121.3	145.9	157.5	-73.7	179.1	179.6	170.4	0	108.2
646	N	24.3	Very low	29.7	Very low	144 Å²	144	129.5 Å²	129.5	77%	0.77	76%	0.761	S	S	*	*			trans	73.7	79.5	179	-50	-18	0	0	0	116.1
647	H	26.4	Very low	32	Very low	201 Å²	201	126 Å²	126	93%	0.931	74%	0.739	S	S	*	*				-160.6	92.4	116.1	-90.7	-36.8	0	0	0	110.3
648	S	25.1	Very low	34.7	Very low	110 Å²	110	121.2 Å²	121.2	77%	0.769	71%	0.71	S	S	*	*			trans	-146.9	57.9	174.2	54.3	0	0	0	0	111.4
649	N	24.4	Very low	37.5	Very low	178 Å²	178	117 Å²	117	95%	0.952	68%	0.68	S	S	*	*			trans	-100.6	106	160.2	-85.6	-5.4	0	0	0	107.6
650	G	25.6	Very low	40.6	Very low	64 Å²	64	114.3 Å²	114.3	66%	0.66	66%	0.659	S	S	*	*	S	Bend	trans	124.7	135.5	-174.2	0	0	0	0	0	112
651	D	27	Very low	43.7	Very low	149 Å²	149	110.1 Å²	110.1	80%	0.797	63%	0.632	S	S	*	*			trans	45.8	66.5	166.3	-61.5	-7.1	0	0	0	118.4	S653	D651-S653 PolarHBondContact O-N 3.04Å
652	S	27.7	Very low	46.6	Very low	136 Å²	136	108 Å²	108	95%	0.951	62%	0.621	S	S	*	*			trans	-72	51.5	163.7	51.6	0	0	0	0	113.3
653	S	31.3	Very low	49.8	Very low	102 Å²	102	102.7 Å²	102.7	71%	0.713	60%	0.598	S	S	*	*	S	Bend	trans	-141.3	16.3	-169.3	56.7	0	0	0	0	115.3	D651	D651-S653 PolarHBondContact O-N 3.04Å
654	G	35.8	Very low	53	Low	64 Å²	64	94.2 Å²	94.2	66%	0.66	56%	0.561	S	S	*	*	S	Bend	trans	-116.8	-50.3	-169.3	0	0	0	0	0	118.6
655	A	44.9	Very low	56.2	Low	87 Å²	87	88.4 Å²	88.4	72%	0.719	54%	0.537	S	S	*	.	S	Bend	trans	-113.6	98	-152.6	0	0	0	0	0	115.2	T592	T592-A655 HydrophobicContact CG2-CB 4.5Å
656	G	58	Low	59.6	Low	43 Å²	43	81.5 Å²	81.5	44%	0.443	51%	0.512	S	S	.	.			trans	84.5	157.7	171.5	0	0	0	0	0	115.4	H593	H593-G656 WeakPolarHBondContact O-CA 3.44Å
657	G	77	Confident	63	Low	14 Å²	14	74.6 Å²	74.6	14%	0.144	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143.6	-178.1	176	0	0	0	0	0	115.7	H593 Y594 L595	H593-G657 PolarHBondContact O-N 2.96Å; Y594-G657 WeakPolarHBondContact CA-O 3.2Å; Y594-G657 WeakPolarHBondContact CD2-O 3.21Å; L595-G657 PolarHBondContact N-O 2.99Å; L595-G657 VanDerWaalsContact N-O 3.15Å
658	V	85.6	Confident	66.3	Low	14 Å²	14	65 Å²	65	9%	0.085	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.6	179.4	-173.5	0	0	0	0	110.2	L595 L597 L613 I841	L595-V658 HydrophobicContact CB-CG1 4.24Å; L595-V658 HydrophobicContact CB-CG2 4.28Å; L595-V658 HydrophobicContact CD2-CG1 4.05Å; L595-V658 HydrophobicContact CD2-CG2 4.35Å; L595-V658 HydrophobicContact CG-CG1 4.21Å; L595-V658 CarbonylContact O-C 3.6Å; L595-V658 WeakPolarHBondContact O-CA 3.19Å; L597-V658 HydrophobicContact CD1-CG1 4.03Å; L613-V658 HydrophobicContact CD1-CB 4.05Å; L613-V658 HydrophobicContact CD1-CG1 3.95Å; V658-I841 HydrophobicContact CG1-CD1 3.96Å; V658-I841 HydrophobicContact CG1-CG1 4.12Å; V658-I841 HydrophobicContact CG2-CD1 4.42Å; V658-I841 HydrophobicContact CG2-CG2 3.95Å
659	D	88.1	Confident	69.6	Low	42 Å²	42	61 Å²	61	23%	0.225	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	143.4	170.8	-75.9	-27.9	0	0	0	110.2	Y594 L595 V596 L597 R674	Y594-D659 HydrophobicContact CE2-CB 4.27Å; Y594-D659 VanDerWaalsContact CE2-OD2 3.27Å; Y594-D659 WeakPolarHBondContact CE2-OD2 3.21Å; Y594-D659 VanDerWaalsContact CZ-OD2 3.31Å; Y594-D659 PolarHBondContact OH-OD2 3.33Å; L595-D659 PolarHBondContact O-N 3.44Å; V596-D659 WeakPolarHBondContact CA-O 3.42Å; L597-D659 PolarHBondContact N-O 2.66Å; D659-R674 IonicContact OD1-NH2 3.6Å; D659-R674 IonicContact OD2-CZ 2.78Å; D659-R674 IonicContact OD2-NE 3Å; D659-R674 PolarHBondContact OD2-NE 3.12Å; D659-R674 IonicContact OD2-NH2 2.71Å; D659-R674 PolarHBondContact OD2-NH2 2.9Å
660	V	89.5	Confident	72.9	Confident	36 Å²	36	57.1 Å²	57.1	22%	0.218	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.5	175.4	-176	0	0	0	0	109.4	L597 L605 L609 L613	L597-V660 HydrophobicContact CB-CG2 4.31Å; L597-V660 CarbonylContact O-C 3.52Å; L597-V660 WeakPolarHBondContact O-CA 3.49Å; L605-V660 HydrophobicContact CD1-CG1 3.57Å; L605-V660 HydrophobicContact CD2-CG1 3.61Å; L605-V660 HydrophobicContact CG-CG1 4.25Å; L609-V660 HydrophobicContact CD2-CG1 4.2Å; L609-V660 HydrophobicContact CD2-CG2 4.3Å; L613-V660 HydrophobicContact CD1-CG2 3.79Å; L613-V660 HydrophobicContact CD2-CB 4.2Å; L613-V660 HydrophobicContact CD2-CG2 3.62Å; L613-V660 HydrophobicContact CG-CG2 4.36Å
661	E	93.3	Very high	76.2	Confident	29 Å²	29	54.3 Å²	54.3	14%	0.136	35%	0.349	C	S	.	.			trans	-110.6	153.7	-175.6	-71.3	-67.2	173	0	0	111.2	V596 L597 A598 P599 N663 A666 L667 R670	V596-E661 HydrophobicContact CG1-CG 3.97Å; L597-E661 PolarHBondContact O-N 3.21Å; A598-E661 WeakPolarHBondContact CA-O 3.11Å; P599-E661 WeakPolarHBondContact CD-O 3.47Å; E661-N663 VanDerWaalsContact C-N 3.33Å; E661-N663 PolarHBondContact O-N 2.75Å; E661-A666 HydrophobicContact CB-CB 3.93Å; E661-A666 HydrophobicContact CG-CB 4.36Å; E661-L667 HydrophobicContact CB-CB 4.36Å; E661-R670 HydrophobicContact CG-CB 4.07Å; E661-R670 HydrophobicContact CG-CG 4.37Å; E661-R670 IonicContact OE1-CZ 2.79Å; E661-R670 IonicContact OE1-NE 2.64Å; E661-R670 PolarHBondContact OE1-NE 3.44Å; E661-R670 IonicContact OE1-NH2 2.72Å; E661-R670 PolarHBondContact OE1-NH2 2.92Å
662	P	90.6	Very high	79.4	Confident	87 Å²	87	47.3 Å²	47.3	57%	0.565	31%	0.311	S	S	*	.	S	Bend	trans	-78.1	-10	-170.4	30.5	-36.2	0	0	0	115	A666	P662-A666 HydrophobicContact CG-CB 4.2Å
663	N	92.9	Very high	82.5	Confident	67 Å²	67	44.2 Å²	44.2	36%	0.358	29%	0.287	S	S	.	.	S	Bend	trans	-168	166.7	178.7	54.6	73.3	0	0	0	111.8	E661 R665 A666 L667	E661-N663 VanDerWaalsContact C-N 3.33Å; E661-N663 PolarHBondContact O-N 2.75Å; N663-R665 PolarHBondContact O-N 2.95Å; N663-R665 WeakPolarHBondContact OD1-CB 3.44Å; N663-R665 PolarHBondContact OD1-N 3.23Å; N663-A666 PolarHBondContact O-N 2.74Å; N663-A666 VanDerWaalsContact O-N 3.11Å; N663-A666 PolarHBondContact OD1-N 3.41Å; N663-L667 PolarHBondContact O-N 3.12Å
664	E	93.8	Very high	85.3	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.009	27%	0.268	C	S	.	.	H	α-helix	trans	-51.7	-44.1	178.3	-178.1	-176.5	-141.9	0	0	113.7	E567 I568 A666 L667 L668 R699 N703	E567-E664 WeakPolarHBondContact CA-OE1 3.48Å; E567-E664 HydrophobicContact CG-CB 4.07Å; E567-E664 HydrophobicContact CG-CG 4.31Å; I568-E664 PolarHBondContact N-OE1 2.95Å; E664-A666 VanDerWaalsContact C-N 3.31Å; E664-A666 PolarHBondContact O-N 3.01Å; E664-L667 PolarHBondContact O-N 2.92Å; E664-L668 HydrophobicContact CG-CD1 3.86Å; E664-L668 HydrophobicContact CG-CG 4.3Å; E664-L668 WeakPolarHBondContact O-CB 3.37Å; E664-L668 VanDerWaalsContact O-CG 3.3Å; E664-L668 WeakPolarHBondContact O-CG 3.35Å; E664-L668 PolarHBondContact O-N 3.37Å; E664-R699 WeakPolarHBondContact OE1-CG 3.31Å; E664-R699 IonicContact OE1-CZ 2.71Å; E664-R699 IonicContact OE1-NE 2.82Å; E664-R699 PolarHBondContact OE1-NE 2.93Å; E664-R699 IonicContact OE1-NH2 2.77Å; E664-R699 PolarHBondContact OE1-NH2 3.47Å; E664-R699 IonicContact OE2-CZ 3.02Å; E664-R699 IonicContact OE2-NE 2.7Å; E664-R699 PolarHBondContact OE2-NE 3.48Å; E664-R699 IonicContact OE2-NH2 3.08Å; E664-R699 PolarHBondContact OE2-NH2 3.3Å; E664-N703 PolarHBondContact OE2-ND2 2.9Å
665	R	95.1	Very high	88	Confident	115 Å²	115	40.5 Å²	40.5	43%	0.434	24%	0.238	S	C	.	.	H	α-helix	trans	-60.8	-40.7	179.1	178.1	-177.4	162.8	90.2	4	111.6	N663 G669 N703 K704 V705	N663-R665 PolarHBondContact O-N 2.95Å; N663-R665 WeakPolarHBondContact OD1-CB 3.44Å; N663-R665 PolarHBondContact OD1-N 3.23Å; R665-G669 PolarHBondContact O-N 3.09Å; R665-N703 HydrophobicContact CB-CB 4.06Å; R665-N703 HydrophobicContact CG-CB 4.33Å; R665-N703 PolarHBondContact NH1-O 3.26Å; R665-K704 VanDerWaalsContact NH1-C 3.29Å; R665-K704 PolarHBondContact NH1-O 3.25Å; R665-V705 HydrophobicContact CG-CG2 4.38Å
666	A	94.7	Very high	90.2	Very high	27 Å²	27	38.6 Å²	38.6	22%	0.223	21%	0.214	C	C	.	.	H	α-helix	trans	-70	-42.3	176.8	0	0	0	0	0	111.7	E661 P662 N663 E664 L668 G669 R670	E661-A666 HydrophobicContact CB-CB 3.93Å; E661-A666 HydrophobicContact CG-CB 4.36Å; P662-A666 HydrophobicContact CG-CB 4.2Å; N663-A666 PolarHBondContact O-N 2.74Å; N663-A666 VanDerWaalsContact O-N 3.11Å; N663-A666 PolarHBondContact OD1-N 3.41Å; E664-A666 VanDerWaalsContact C-N 3.31Å; E664-A666 PolarHBondContact O-N 3.01Å; A666-L668 VanDerWaalsContact C-N 3.34Å; A666-L668 PolarHBondContact O-N 3.37Å; A666-G669 PolarHBondContact O-N 3.28Å; A666-R670 VanDerWaalsContact O-CB 3.31Å; A666-R670 WeakPolarHBondContact O-CB 3.42Å; A666-R670 PolarHBondContact O-N 3.38Å
667	L	95.5	Very high	91.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-55.6	-47.1	172.3	169.7	153.4	0	0	0	111.9	I568 I569 I571 V596 A598 E661 N663 E664 R670 F671	I568-L667 HydrophobicContact CG2-CD2 3.79Å; I569-L667 WeakPolarHBondContact O-CD1 3.45Å; I571-L667 HydrophobicContact CD1-CD2 3.84Å; I571-L667 HydrophobicContact CG1-CD2 4.1Å; V596-L667 HydrophobicContact CB-CD1 4.35Å; V596-L667 HydrophobicContact CB-CG 4.05Å; V596-L667 HydrophobicContact CG1-CB 3.99Å; V596-L667 HydrophobicContact CG1-CD1 4.17Å; V596-L667 HydrophobicContact CG1-CG 3.71Å; A598-L667 HydrophobicContact CB-CB 3.88Å; A598-L667 HydrophobicContact CB-CD1 3.84Å; E661-L667 HydrophobicContact CB-CB 4.36Å; N663-L667 PolarHBondContact O-N 3.12Å; E664-L667 PolarHBondContact O-N 2.92Å; L667-R670 PolarHBondContact O-N 3.46Å; L667-F671 WeakPolarHBondContact O-CB 3.19Å; L667-F671 PolarHBondContact O-N 3.09Å
668	L	95.7	Very high	92.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-42.3	-179.4	-71.3	171.6	0	0	0	111.8	I568 I571 E664 A666 F671 L672 L696 R699 L700 N703 V705	I568-L668 HydrophobicContact CD1-CD2 4.24Å; I571-L668 HydrophobicContact CD1-CD2 4.15Å; E664-L668 HydrophobicContact CG-CD1 3.86Å; E664-L668 HydrophobicContact CG-CG 4.3Å; E664-L668 WeakPolarHBondContact O-CB 3.37Å; E664-L668 VanDerWaalsContact O-CG 3.3Å; E664-L668 WeakPolarHBondContact O-CG 3.35Å; E664-L668 PolarHBondContact O-N 3.37Å; A666-L668 VanDerWaalsContact C-N 3.34Å; A666-L668 PolarHBondContact O-N 3.37Å; L668-F671 PolarHBondContact O-N 3.23Å; L668-L672 WeakPolarHBondContact O-CG 3.43Å; L668-L672 PolarHBondContact O-N 3.37Å; L668-L696 HydrophobicContact CD2-CD1 3.76Å; L668-R699 HydrophobicContact CD1-CB 4.02Å; L668-L700 HydrophobicContact CB-CD2 3.93Å; L668-L700 HydrophobicContact CD1-CD2 4.33Å; L668-L700 HydrophobicContact CD2-CD2 4.18Å; L668-L700 HydrophobicContact CD2-CG 4.41Å; L668-L700 HydrophobicContact CG-CD2 4.38Å; L668-N703 HydrophobicContact CD1-CB 4.38Å; L668-V705 HydrophobicContact CB-CG2 3.94Å; L668-V705 HydrophobicContact CD1-CG2 4.18Å
669	G	94.8	Very high	92.8	Very high	25 Å²	25	46.6 Å²	46.6	26%	0.258	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-39.9	174.5	0	0	0	0	0	113.1	R665 A666 T673	R665-G669 PolarHBondContact O-N 3.09Å; A666-G669 PolarHBondContact O-N 3.28Å; G669-T673 WeakPolarHBondContact O-CB 3.45Å; G669-T673 PolarHBondContact O-N 3.4Å; G669-T673 VanDerWaalsContact O-N 3.14Å; G669-T673 PolarHBondContact O-OG1 3.25Å
670	R	93.8	Very high	93.1	Very high	97 Å²	97	44.6 Å²	44.6	37%	0.366	22%	0.222	S	C	.	.	H	α-helix	trans	-62.7	-49.1	173.5	178.7	66	64.6	-172.9	0.4	111.2	Y594 V596 E661 A666 L667 T673 R674	Y594-R670 WeakPolarHBondContact OH-CD 3.28Å; Y594-R670 WeakPolarHBondContact OH-CG 3.48Å; V596-R670 HydrophobicContact CG1-CB 4.23Å; V596-R670 HydrophobicContact CG1-CG 4.03Å; V596-R670 HydrophobicContact CG2-CG 3.98Å; E661-R670 HydrophobicContact CG-CB 4.07Å; E661-R670 HydrophobicContact CG-CG 4.37Å; E661-R670 IonicContact OE1-CZ 2.79Å; E661-R670 IonicContact OE1-NE 2.64Å; E661-R670 PolarHBondContact OE1-NE 3.44Å; E661-R670 IonicContact OE1-NH2 2.72Å; E661-R670 PolarHBondContact OE1-NH2 2.92Å; A666-R670 VanDerWaalsContact O-CB 3.31Å; A666-R670 WeakPolarHBondContact O-CB 3.42Å; A666-R670 PolarHBondContact O-N 3.38Å; L667-R670 PolarHBondContact O-N 3.46Å; R670-T673 PolarHBondContact O-N 3.34Å; R670-R674 VanDerWaalsContact O-CG 3.29Å; R670-R674 WeakPolarHBondContact O-CG 3.4Å; R670-R674 PolarHBondContact O-N 3.32Å
671	F	94.9	Very high	93.4	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.018	21%	0.212	C	C	.	.	H	α-helix	trans	-55.9	-52.3	176.9	165.4	-107.1	0	0	0	111.7	I553 I571 L573 L667 L668 T673 R674 L675 L696	I553-F671 HydrophobicContact CD1-CE2 3.98Å; I553-F671 HydrophobicContact CD1-CZ 3.93Å; I571-F671 HydrophobicContact CB-CD2 4.27Å; I571-F671 HydrophobicContact CD1-CB 4.06Å; I571-F671 HydrophobicContact CD1-CD1 3.86Å; I571-F671 HydrophobicContact CD1-CD2 4.08Å; I571-F671 HydrophobicContact CD1-CE1 4.35Å; I571-F671 HydrophobicContact CD1-CG 3.71Å; I571-F671 HydrophobicContact CG2-CD2 3.6Å; I571-F671 HydrophobicContact CG2-CE2 3.65Å; I571-F671 HydrophobicContact CG2-CG 4.33Å; I571-F671 HydrophobicContact CG2-CZ 4.42Å; L573-F671 HydrophobicContact CD1-CE2 4.31Å; L573-F671 HydrophobicContact CD2-CE2 4.45Å; L667-F671 WeakPolarHBondContact O-CB 3.19Å; L667-F671 PolarHBondContact O-N 3.09Å; L668-F671 PolarHBondContact O-N 3.23Å; F671-T673 VanDerWaalsContact C-N 3.28Å; F671-T673 PolarHBondContact O-N 2.7Å; F671-R674 PolarHBondContact O-N 2.82Å; F671-R674 VanDerWaalsContact O-N 3.16Å; F671-L675 HydrophobicContact CE1-CD2 4.15Å; F671-L675 HydrophobicContact CE2-CB 4.43Å; F671-L675 HydrophobicContact CE2-CD1 4.48Å; F671-L675 HydrophobicContact CZ-CB 4.49Å; F671-L675 HydrophobicContact CZ-CD1 4.45Å; F671-L675 HydrophobicContact CZ-CD2 3.86Å; F671-L675 WeakPolarHBondContact O-CB 3.49Å; F671-L675 PolarHBondContact O-N 3.37Å; F671-L696 HydrophobicContact CD1-CD1 4.4Å; F671-L696 HydrophobicContact CE1-CD1 4.1Å; F671-L696 HydrophobicContact CE1-CD2 3.98Å; F671-L696 HydrophobicContact CZ-CD2 4.37Å
672	L	93.9	Very high	93.5	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-35.8	179	-68.4	-173.9	0	0	0	113.3	L668 H676 L700 V705 R710 V711	L668-L672 WeakPolarHBondContact O-CG 3.43Å; L668-L672 PolarHBondContact O-N 3.37Å; L672-H676 WeakPolarHBondContact O-CB 3.09Å; L672-H676 PolarHBondContact O-N 2.8Å; L672-L700 HydrophobicContact CD1-CD2 3.71Å; L672-L700 HydrophobicContact CD2-CD1 4.29Å; L672-L700 HydrophobicContact CD2-CD2 4.42Å; L672-L700 HydrophobicContact CG-CD2 4.11Å; L672-V705 HydrophobicContact CD1-CG1 3.86Å; L672-R710 HydrophobicContact CB-CB 4.19Å; L672-R710 HydrophobicContact CD2-CB 4.25Å; L672-V711 HydrophobicContact CD2-CG2 3.6Å
673	T	92.7	Very high	93.7	Very high	71 Å²	71	37.7 Å²	37.7	44%	0.436	18%	0.18	S	C	.	.	H	α-helix	trans	-68.4	-39.1	177.7	-56.2	0	0	0	0	111.2	G669 R670 F671 K677	G669-T673 WeakPolarHBondContact O-CB 3.45Å; G669-T673 PolarHBondContact O-N 3.4Å; G669-T673 VanDerWaalsContact O-N 3.14Å; G669-T673 PolarHBondContact O-OG1 3.25Å; R670-T673 PolarHBondContact O-N 3.34Å; F671-T673 VanDerWaalsContact C-N 3.28Å; F671-T673 PolarHBondContact O-N 2.7Å; T673-K677 PolarHBondContact O-N 3.13Å; T673-K677 VanDerWaalsContact O-N 3.07Å
674	R	90.8	Very high	93.8	Very high	85 Å²	85	34.5 Å²	34.5	32%	0.321	16%	0.163	S	C	.	.	H	α-helix	trans	-74.1	-40.9	177.2	-68.5	-93.2	-163.4	-166.2	7.4	112.3	Y594 D659 R670 F671 H676 K677 L678	Y594-R674 HydrophobicContact CD1-CB 4.16Å; Y594-R674 HydrophobicContact CD1-CG 4.31Å; Y594-R674 HydrophobicContact CE1-CB 3.66Å; Y594-R674 HydrophobicContact CE1-CG 3.46Å; Y594-R674 VanDerWaalsContact CE1-CG 3.46Å; Y594-R674 HydrophobicContact CE2-CG 4.4Å; Y594-R674 VanDerWaalsContact CZ-CD 3.48Å; Y594-R674 WeakPolarHBondContact OH-CG 3.47Å; Y594-R674 PolarHBondContact OH-NE 3.19Å; D659-R674 IonicContact OD1-NH2 3.6Å; D659-R674 IonicContact OD2-CZ 2.78Å; D659-R674 IonicContact OD2-NE 3Å; D659-R674 PolarHBondContact OD2-NE 3.12Å; D659-R674 IonicContact OD2-NH2 2.71Å; D659-R674 PolarHBondContact OD2-NH2 2.9Å; R670-R674 VanDerWaalsContact O-CG 3.29Å; R670-R674 WeakPolarHBondContact O-CG 3.4Å; R670-R674 PolarHBondContact O-N 3.32Å; F671-R674 PolarHBondContact O-N 2.82Å; F671-R674 VanDerWaalsContact O-N 3.16Å; R674-H676 VanDerWaalsContact C-N 3.32Å; R674-H676 PolarHBondContact O-N 3.12Å; R674-K677 PolarHBondContact O-N 3.3Å; R674-L678 WeakPolarHBondContact O-CB 3.43Å; R674-L678 PolarHBondContact O-N 3.45Å
675	L	92.1	Very high	93.8	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-42	173.9	-174.2	70.7	0	0	0	111.2	F671 D679 P680 I683	F671-L675 HydrophobicContact CE1-CD2 4.15Å; F671-L675 HydrophobicContact CE2-CB 4.43Å; F671-L675 HydrophobicContact CE2-CD1 4.48Å; F671-L675 HydrophobicContact CZ-CB 4.49Å; F671-L675 HydrophobicContact CZ-CD1 4.45Å; F671-L675 HydrophobicContact CZ-CD2 3.86Å; F671-L675 WeakPolarHBondContact O-CB 3.49Å; F671-L675 PolarHBondContact O-N 3.37Å; L675-D679 WeakPolarHBondContact O-CA 3.38Å; L675-D679 PolarHBondContact O-N 3.49Å; L675-P680 HydrophobicContact CD1-CG 3.59Å; L675-P680 WeakPolarHBondContact O-CD 3.35Å; L675-I683 HydrophobicContact CD1-CD1 4.39Å
676	H	91.4	Very high	93.6	Very high	47 Å²	47	29.5 Å²	29.5	22%	0.218	15%	0.145	C	C	.	.	H	α-helix	trans	-67.4	-42.1	174.6	177.9	31.1	0	0	0	112.9	W503 L672 R674 L678 D679 R710	W503-H676 AromaticContact CE3-CD2 3.96Å; W503-H676 AromaticContact CE3-CE1 3.51Å; W503-H676 AromaticContact CE3-NE2 3.37Å; W503-H676 AromaticContact CZ3-NE2 3.78Å; L672-H676 WeakPolarHBondContact O-CB 3.09Å; L672-H676 PolarHBondContact O-N 2.8Å; R674-H676 VanDerWaalsContact C-N 3.32Å; R674-H676 PolarHBondContact O-N 3.12Å; H676-L678 VanDerWaalsContact C-N 3.31Å; H676-L678 PolarHBondContact O-N 3.13Å; H676-D679 PolarHBondContact O-N 3.43Å; H676-R710 HydrophobicContact CB-CG 4.25Å; H676-R710 PolarHBondContact CD2-NH2 3.08Å
677	K	90.7	Very high	93.3	Very high	188 Å²	188	28.7 Å²	28.7	82%	0.817	14%	0.137	S	C	*	.	H	α-helix	trans	-68.5	-28.8	177.8	-176.6	164.5	-177.6	166.2	0	113.2	T673 R674	T673-K677 PolarHBondContact O-N 3.13Å; T673-K677 VanDerWaalsContact O-N 3.07Å; R674-K677 PolarHBondContact O-N 3.3Å
678	L	90.7	Very high	93	Very high	39 Å²	39	28.8 Å²	28.8	20%	0.204	14%	0.138	C	C	.	.	H	α-helix	trans	-77.8	-40.5	173	178.7	63.9	0	0	0	112.2	A551 I575 R674 H676 P680	A551-L678 HydrophobicContact CB-CD2 4.26Å; I575-L678 HydrophobicContact CD1-CD1 4.15Å; I575-L678 HydrophobicContact CD1-CD2 3.73Å; I575-L678 HydrophobicContact CG1-CD2 3.87Å; I575-L678 HydrophobicContact CG2-CD1 3.65Å; I575-L678 HydrophobicContact CG2-CD2 4.21Å; R674-L678 WeakPolarHBondContact O-CB 3.43Å; R674-L678 PolarHBondContact O-N 3.45Å; H676-L678 VanDerWaalsContact C-N 3.31Å; H676-L678 PolarHBondContact O-N 3.13Å; L678-P680 HydrophobicContact CD2-CB 4.33Å; L678-P680 HydrophobicContact CD2-CG 4.22Å; L678-P680 HydrophobicContact CG-CB 4.5Å; L678-P680 HydrophobicContact CG-CG 4.49Å
679	D	93.8	Very high	92.4	Very high	11 Å²	11	31.2 Å²	31.2	6%	0.059	15%	0.147	C	C	.	.			trans	47.2	59.6	-173.6	-166.5	41.8	0	0	0	114.9	S372 L675 H676 R713 R738	S372-D679 WeakPolarHBondContact CB-OD2 3.48Å; S372-D679 PolarHBondContact OG-OD2 3.06Å; L675-D679 WeakPolarHBondContact O-CA 3.38Å; L675-D679 PolarHBondContact O-N 3.49Å; H676-D679 PolarHBondContact O-N 3.43Å; D679-R713 PolarHBondContact O-NH2 2.9Å; D679-R713 IonicContact OD1-CZ 3.89Å; D679-R713 IonicContact OD1-NE 3.98Å; D679-R713 PolarHBondContact OD1-NE 2.74Å; D679-R713 IonicContact OD1-NH2 2.77Å; D679-R713 PolarHBondContact OD1-NH2 2.8Å; D679-R713 IonicContact OD2-CZ 3Å; D679-R713 IonicContact OD2-NE 2.85Å; D679-R713 PolarHBondContact OD2-NE 3.34Å; D679-R713 IonicContact OD2-NH2 3.75Å; D679-R713 PolarHBondContact OD2-NH2 3.38Å; D679-R738 IonicContact OD1-CZ 3.71Å; D679-R738 IonicContact OD1-NH1 3.59Å; D679-R738 PolarHBondContact OD1-NH1 2.67Å; D679-R738 IonicContact OD1-NH2 3.67Å; D679-R738 PolarHBondContact OD1-NH2 2.91Å
680	P	94.5	Very high	91.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.143	C	C	.	.			trans	-66.6	140.1	-179	29.4	-34.3	0	0	0	112.2	C549 A551 L675 L678 I683 R738	C549-P680 CarbonylContact O-C 3.57Å; A551-P680 HydrophobicContact CB-CB 3.82Å; A551-P680 HydrophobicContact CB-CG 4.18Å; L675-P680 HydrophobicContact CD1-CG 3.59Å; L675-P680 WeakPolarHBondContact O-CD 3.35Å; L678-P680 HydrophobicContact CD2-CB 4.33Å; L678-P680 HydrophobicContact CD2-CG 4.22Å; L678-P680 HydrophobicContact CG-CB 4.5Å; L678-P680 HydrophobicContact CG-CG 4.49Å; P680-I683 HydrophobicContact CG-CG1 4.31Å; P680-R738 PolarHBondContact O-NH1 2.96Å
681	D	95.3	Very high	90.9	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-83.1	-33.3	174.8	-51.8	-69.2	0	0	0	111.9	F342 K360 L548 C549 R713 L739	F342-D681 HydrophobicContact CE1-CB 4.41Å; F342-D681 HydrophobicContact CE2-CB 4.24Å; F342-D681 HydrophobicContact CZ-CB 3.81Å; F342-D681 WeakPolarHBondContact CZ-OD1 3.38Å; K360-D681 WeakPolarHBondContact CE-OD1 3.35Å; K360-D681 WeakPolarHBondContact CE-OD2 3.2Å; K360-D681 IonicContact NZ-OD1 2.9Å; K360-D681 PolarHBondContact NZ-OD1 3.47Å; K360-D681 IonicContact NZ-OD2 3.3Å; K360-D681 PolarHBondContact NZ-OD2 3.21Å; L548-D681 HydrophobicContact CB-CB 4.16Å; L548-D681 HydrophobicContact CD2-CB 4.27Å; C549-D681 PolarHBondContact N-OD2 2.84Å; C549-D681 PolarHBondContact O-N 2.84Å; D681-R713 IonicContact OD1-CZ 3.95Å; D681-R713 VanDerWaalsContact OD1-CZ 3.29Å; D681-R713 IonicContact OD1-NH1 3.62Å; D681-R713 PolarHBondContact OD1-NH1 3.13Å; D681-R713 IonicContact OD1-NH2 3.63Å; D681-R713 PolarHBondContact OD1-NH2 3.3Å; D681-L739 PolarHBondContact O-N 2.9Å
682	I	95.4	Very high	90.5	Very high	1 Å²	1	30 Å²	30	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.1	-179.6	-47.8	-178.3	0	0	0	109.5	L548 C549 A551 Y579 L581 I684 L739 L861	L548-I682 HydrophobicContact CD1-CD1 4.07Å; L548-I682 HydrophobicContact CD1-CG1 4.38Å; C549-I682 PolarHBondContact O-N 3.29Å; C549-I682 VanDerWaalsContact O-N 3.07Å; A551-I682 PolarHBondContact N-O 2.86Å; Y579-I682 HydrophobicContact CD1-CD1 4.14Å; Y579-I682 HydrophobicContact CE1-CD1 4.41Å; L581-I682 HydrophobicContact CD2-CD1 4.02Å; I682-I684 HydrophobicContact CG2-CG1 4.03Å; I682-L739 CarbonylContact C-O 3.52Å; I682-L739 WeakPolarHBondContact CA-O 3.48Å; I682-L739 HydrophobicContact CG1-CB 4.3Å; I682-L739 HydrophobicContact CG1-CD1 4.21Å; I682-L739 HydrophobicContact CG2-CB 4.46Å; I682-L861 HydrophobicContact CD1-CD1 3.97Å; I682-L861 HydrophobicContact CG2-CD1 4.09Å; I682-L861 HydrophobicContact CG2-CD2 4.08Å
683	I	95.3	Very high	90.2	Very high	6 Å²	6	30 Å²	30	3%	0.031	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.1	170.8	-62.7	177.6	0	0	0	108.3	A551 I553 L675 P680 L688 M735 R738 L739 C741	A551-I683 CarbonylContact O-C 3.57Å; A551-I683 WeakPolarHBondContact O-CA 3.33Å; I553-I683 HydrophobicContact CB-CG2 4.28Å; I553-I683 HydrophobicContact CG2-CG2 3.61Å; L675-I683 HydrophobicContact CD1-CD1 4.39Å; P680-I683 HydrophobicContact CG-CG1 4.31Å; I683-L688 HydrophobicContact CG2-CD1 4.28Å; I683-M735 HydrophobicContact CD1-CE 4.21Å; I683-M735 HydrophobicContact CD1-SD 4.03Å; I683-R738 HydrophobicContact CD1-CB 4.41Å; I683-L739 PolarHBondContact N-O 3.05Å; I683-C741 PolarHBondContact O-N 2.9Å
684	I	95.2	Very high	89.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	135.5	179	-48.9	176.3	0	0	0	109.2	L550 A551 A552 I553 I682 C741 T743 V851 L852 C855 L861	L550-I684 HydrophobicContact CD1-CD1 3.72Å; L550-I684 HydrophobicContact CD2-CD1 3.7Å; L550-I684 HydrophobicContact CD2-CG1 4.46Å; L550-I684 HydrophobicContact CG-CD1 3.66Å; L550-I684 HydrophobicContact CG-CG1 4.31Å; A551-I684 PolarHBondContact O-N 3.27Å; A552-I684 CarbonylContact C-O 3.45Å; A552-I684 VanDerWaalsContact CA-O 3.3Å; A552-I684 WeakPolarHBondContact CA-O 3.47Å; A552-I684 HydrophobicContact CB-CB 4.41Å; I553-I684 PolarHBondContact N-O 2.93Å; I682-I684 HydrophobicContact CG2-CG1 4.03Å; I684-C741 CarbonylContact C-O 3.59Å; I684-C741 WeakPolarHBondContact CA-O 3.15Å; I684-C741 HydrophobicContact CG1-CB 4.19Å; I684-C741 HydrophobicContact CG2-CB 4.4Å; I684-T743 HydrophobicContact CG2-CG2 4.05Å; I684-V851 HydrophobicContact CG2-CG1 3.91Å; I684-L852 HydrophobicContact CD1-CD1 4.26Å; I684-C855 HydrophobicContact CD1-CB 4.27Å; I684-C855 HydrophobicContact CG2-CB 3.87Å; I684-L861 HydrophobicContact CD1-CD1 3.95Å
685	G	94	Very high	89.4	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	-162.5	176.4	0	0	0	0	0	113.1	C741 T743	G685-C741 PolarHBondContact N-O 2.8Å; G685-T743 WeakPolarHBondContact O-CB 3.46Å; G685-T743 WeakPolarHBondContact O-CG2 3.43Å; G685-T743 PolarHBondContact O-N 2.85Å; G685-T743 PolarHBondContact O-OG1 3.16Å
686	H	91.5	Very high	89.3	Confident	12 Å²	12	25 Å²	25	6%	0.056	12%	0.119	C	C	.	.	S	Bend	trans	-140.1	121.8	178	-178.4	84.2	0	0	0	109.5	L688 Q692 D742 T743 Y756 L758 V851	H686-L688 VanDerWaalsContact C-N 3.28Å; H686-Q692 PolarHBondContact O-NE2 3.06Å; H686-D742 WeakPolarHBondContact CA-OD1 3.42Å; H686-T743 WeakPolarHBondContact CB-OG1 3.45Å; H686-T743 PolarHBondContact ND1-OG1 2.74Å; H686-Y756 PolarHBondContact CE1-O 3.02Å; H686-Y756 VanDerWaalsContact CE1-O 3.23Å; H686-Y756 PolarHBondContact NE2-O 2.66Å; H686-L758 PolarHBondContact NE2-N 2.77Å; H686-V851 HydrophobicContact CB-CG2 3.86Å
687	D	88	Confident	89.1	Confident	10 Å²	10	23.2 Å²	23.2	5%	0.053	11%	0.111	C	C	.	.	S	Bend	trans	61.9	36.3	-171.1	-150.5	55.6	0	0	0	112.3	H691 Q692 D742 K744 R1316 R1319	D687-H691 PolarHBondContact O-N 3.05Å; D687-H691 WeakPolarHBondContact OD2-CB 3.42Å; D687-Q692 PolarHBondContact O-N 3.26Å; D687-D742 WeakPolarHBondContact CA-OD2 3.42Å; D687-D742 PolarHBondContact N-OD1 2.88Å; D687-D742 PolarHBondContact N-OD2 2.85Å; D687-K744 HydrophobicContact CB-CD 3.96Å; D687-K744 VanDerWaalsContact OD1-CD 3.23Å; D687-K744 WeakPolarHBondContact OD1-CD 3.33Å; D687-K744 WeakPolarHBondContact OD1-CE 3.35Å; D687-K744 IonicContact OD1-NZ 3.14Å; D687-K744 PolarHBondContact OD1-NZ 3.45Å; D687-K744 IonicContact OD2-NZ 2.84Å; D687-R1316 IonicContact OD1-NH2 2.89Å; D687-R1316 IonicContact OD2-CZ 3.33Å; D687-R1316 IonicContact OD2-NH1 2.71Å; D687-R1316 IonicContact OD2-NH2 3.63Å; D687-R1316 PolarHBondContact OD2-NH2 3.46Å; D687-R1319 IonicContact OD1-NH2 3.55Å; D687-R1319 PolarHBondContact OD1-NH2 3.23Å; D687-R1319 IonicContact OD2-CZ 2.9Å; D687-R1319 IonicContact OD2-NH1 2.87Å; D687-R1319 IonicContact OD2-NH2 3.51Å; D687-R1319 PolarHBondContact OD2-NH2 3.02Å
688	L	89.5	Confident	88.8	Confident	3 Å²	3	17.2 Å²	17.2	2%	0.016	9%	0.086	C	C	.	.	I	π-helix	trans	-66.9	-54.4	176.3	-71	-167.5	0	0	0	112	I553 I683 H686 G690 Q692 I693 V740 D742	I553-L688 HydrophobicContact CG2-CD1 4.38Å; I553-L688 HydrophobicContact CG2-CD2 3.88Å; I683-L688 HydrophobicContact CG2-CD1 4.28Å; H686-L688 VanDerWaalsContact C-N 3.28Å; L688-G690 PolarHBondContact O-N 3.23Å; L688-Q692 HydrophobicContact CD2-CB 3.87Å; L688-Q692 HydrophobicContact CD2-CG 4.36Å; L688-I693 HydrophobicContact CB-CD1 3.93Å; L688-I693 HydrophobicContact CB-CG1 4.19Å; L688-I693 WeakPolarHBondContact O-CB 3.39Å; L688-I693 WeakPolarHBondContact O-CG1 3.49Å; L688-I693 PolarHBondContact O-N 3.27Å; L688-I693 VanDerWaalsContact O-N 3.1Å; L688-V740 HydrophobicContact CB-CG1 4.24Å; L688-V740 HydrophobicContact CD1-CG1 3.8Å; L688-D742 HydrophobicContact CB-CB 4.26Å; L688-D742 PolarHBondContact N-OD2 3.41Å
689	W	82.5	Confident	88.7	Confident	51 Å²	51	16 Å²	16	19%	0.193	8%	0.078	C	C	.	.	I	π-helix	trans	-67.1	-33.3	174.9	-56.8	107.1	0	0	0	110.2	I731 V740 D742 S880	W689-I731 HydrophobicContact CD2-CG2 4.3Å; W689-I731 HydrophobicContact CE3-CB 4.12Å; W689-I731 HydrophobicContact CE3-CG2 3.29Å; W689-I731 HydrophobicContact CZ3-CB 4.38Å; W689-I731 HydrophobicContact CZ3-CG2 3.57Å; W689-I731 WeakPolarHBondContact O-CD1 3.39Å; W689-V740 HydrophobicContact CD2-CG1 4.38Å; W689-V740 HydrophobicContact CH2-CB 4.04Å; W689-V740 HydrophobicContact CH2-CG1 4.28Å; W689-V740 HydrophobicContact CZ2-CB 3.65Å; W689-V740 HydrophobicContact CZ2-CG1 3.68Å; W689-D742 HydrophobicContact CG-CB 4.44Å; W689-D742 PolarHBondContact N-OD2 2.9Å; W689-D742 VanDerWaalsContact N-OD2 3.11Å; W689-S880 WeakPolarHBondContact CH2-OG 3.44Å; W689-S880 VanDerWaalsContact CZ2-OG 3.31Å; W689-S880 WeakPolarHBondContact CZ2-OG 3.5Å
690	G	77.4	Confident	88.5	Confident	18 Å²	18	15.5 Å²	15.5	19%	0.186	8%	0.076	C	C	.	.	I	π-helix	trans	-74.8	-35.2	-175.5	0	0	0	0	0	115.6	L688 R1319	L688-G690 PolarHBondContact O-N 3.23Å; G690-R1319 VanDerWaalsContact CA-NH2 3.28Å; G690-R1319 PolarHBondContact O-NE 3Å; G690-R1319 PolarHBondContact O-NH2 3.37Å
691	H	78.8	Confident	88	Confident	57 Å²	57	17.7 Å²	17.7	26%	0.264	9%	0.087	S	C	.	.	I	π-helix	trans	-155.9	-42.9	-175.9	-177.1	50.7	0	0	0	115	D687 I693 E694 L695	D687-H691 PolarHBondContact O-N 3.05Å; D687-H691 WeakPolarHBondContact OD2-CB 3.42Å; H691-I693 PolarHBondContact O-N 3.33Å; H691-E694 IonicContact ND1-OE2 2.85Å; H691-E694 PolarHBondContact O-N 2.73Å; H691-L695 WeakPolarHBondContact O-CB 3.28Å; H691-L695 PolarHBondContact O-N 3.21Å
692	Q	87	Confident	87.6	Confident	24 Å²	24	20.7 Å²	20.7	11%	0.112	11%	0.112	C	C	.	.	I	π-helix	trans	-66.5	-35.5	-166.6	-59.7	-163.1	33.8	0	0	113.3	I555 H686 D687 L688 L696	I555-Q692 HydrophobicContact CD1-CB 4.36Å; I555-Q692 VanDerWaalsContact N-OE1 3.14Å; H686-Q692 PolarHBondContact O-NE2 3.06Å; D687-Q692 PolarHBondContact O-N 3.26Å; L688-Q692 HydrophobicContact CD2-CB 3.87Å; L688-Q692 HydrophobicContact CD2-CG 4.36Å; Q692-L696 VanDerWaalsContact O-CB 3.26Å; Q692-L696 WeakPolarHBondContact O-CB 3.44Å; Q692-L696 PolarHBondContact O-N 2.86Å
693	I	87.5	Confident	87.3	Confident	3 Å²	3	21.9 Å²	21.9	2%	0.015	12%	0.119	C	C	.	.	H	α-helix	trans	-75.3	-42.8	178.1	-59.4	170.7	0	0	0	111.1	L688 H691 L695 L696 I697 I731 M735 V740	L688-I693 HydrophobicContact CB-CD1 3.93Å; L688-I693 HydrophobicContact CB-CG1 4.19Å; L688-I693 WeakPolarHBondContact O-CB 3.39Å; L688-I693 WeakPolarHBondContact O-CG1 3.49Å; L688-I693 PolarHBondContact O-N 3.27Å; L688-I693 VanDerWaalsContact O-N 3.1Å; H691-I693 PolarHBondContact O-N 3.33Å; I693-L695 VanDerWaalsContact C-N 3.34Å; I693-L695 PolarHBondContact O-N 3.09Å; I693-L696 PolarHBondContact O-N 2.97Å; I693-I697 HydrophobicContact CG2-CG1 4.11Å; I693-I697 WeakPolarHBondContact O-CB 3.44Å; I693-I697 WeakPolarHBondContact O-CG1 3.29Å; I693-I697 PolarHBondContact O-N 2.93Å; I693-I731 HydrophobicContact CB-CG2 4.09Å; I693-I731 HydrophobicContact CD1-CG2 3.82Å; I693-I731 HydrophobicContact CG2-CG2 3.94Å; I693-M735 HydrophobicContact CD1-CE 3.72Å; I693-M735 HydrophobicContact CG1-CE 3.86Å; I693-M735 HydrophobicContact CG2-CE 4.37Å; I693-V740 HydrophobicContact CD1-CG1 3.85Å; I693-V740 HydrophobicContact CD1-CG2 4.33Å
694	E	82	Confident	87.1	Confident	43 Å²	43	29.6 Å²	29.6	20%	0.201	15%	0.152	C	C	.	.	H	α-helix	trans	-52.8	-52.3	173.2	-179.2	-167.1	-154.3	0	0	110.4	H691 I697 Q698 R727	H691-E694 IonicContact ND1-OE2 2.85Å; H691-E694 PolarHBondContact O-N 2.73Å; E694-I697 PolarHBondContact O-N 3.39Å; E694-Q698 VanDerWaalsContact O-CB 3.3Å; E694-Q698 WeakPolarHBondContact O-CB 3.28Å; E694-Q698 PolarHBondContact O-N 3.48Å; E694-R727 WeakPolarHBondContact OE1-CD 3.19Å; E694-R727 IonicContact OE1-CZ 2.83Å; E694-R727 IonicContact OE1-NE 3.23Å; E694-R727 PolarHBondContact OE1-NE 3.31Å; E694-R727 IonicContact OE2-NE 2.64Å
695	L	85.3	Confident	86.8	Confident	8 Å²	8	29.9 Å²	29.9	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-50.8	177.1	-179.5	65.5	0	0	0	111.4	I568 H691 I693 I697 Q698 R699	I568-L695 HydrophobicContact CD1-CG 4.3Å; I568-L695 HydrophobicContact CG1-CD2 4.19Å; I568-L695 HydrophobicContact CG1-CG 4.34Å; H691-L695 WeakPolarHBondContact O-CB 3.28Å; H691-L695 PolarHBondContact O-N 3.21Å; I693-L695 VanDerWaalsContact C-N 3.34Å; I693-L695 PolarHBondContact O-N 3.09Å; L695-I697 PolarHBondContact O-N 3.26Å; L695-Q698 PolarHBondContact O-N 3.12Å; L695-R699 HydrophobicContact CD1-CG 3.85Å; L695-R699 HydrophobicContact CG-CG 4.19Å; L695-R699 WeakPolarHBondContact O-CB 3.41Å; L695-R699 VanDerWaalsContact O-CG 3.27Å; L695-R699 WeakPolarHBondContact O-CG 3.38Å; L695-R699 PolarHBondContact O-N 3.13Å
696	L	89.5	Confident	86.5	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-56.1	-47.7	-179.2	176.9	62.3	0	0	0	112	I555 I568 I571 L668 F671 Q692 I693 R699 L700 V711	I555-L696 HydrophobicContact CD1-CB 4.15Å; I555-L696 HydrophobicContact CD1-CD1 4.45Å; I555-L696 HydrophobicContact CD1-CD2 4.24Å; I568-L696 HydrophobicContact CD1-CD1 4.31Å; I571-L696 HydrophobicContact CD1-CD1 4.16Å; L668-L696 HydrophobicContact CD2-CD1 3.76Å; F671-L696 HydrophobicContact CD1-CD1 4.4Å; F671-L696 HydrophobicContact CE1-CD1 4.1Å; F671-L696 HydrophobicContact CE1-CD2 3.98Å; F671-L696 HydrophobicContact CZ-CD2 4.37Å; Q692-L696 VanDerWaalsContact O-CB 3.26Å; Q692-L696 WeakPolarHBondContact O-CB 3.44Å; Q692-L696 PolarHBondContact O-N 2.86Å; I693-L696 PolarHBondContact O-N 2.97Å; L696-R699 PolarHBondContact O-N 3.23Å; L696-L700 HydrophobicContact CD1-CD1 4.19Å; L696-L700 HydrophobicContact CD1-CG 4.34Å; L696-L700 HydrophobicContact CG-CD1 4.1Å; L696-L700 WeakPolarHBondContact O-CB 3.37Å; L696-L700 VanDerWaalsContact O-CG 3.22Å; L696-L700 WeakPolarHBondContact O-CG 3.46Å; L696-L700 PolarHBondContact O-N 3.39Å; L696-V711 HydrophobicContact CD2-CG2 4.39Å
697	I	86.6	Confident	86.3	Confident	9 Å²	9	37.7 Å²	37.7	5%	0.046	20%	0.197	C	C	.	.	H	α-helix	trans	-65.8	-43.5	178.7	-65.2	-60.9	0	0	0	111.2	I693 E694 L695 R699 L700 N701 V711 F720 I730	I693-I697 HydrophobicContact CG2-CG1 4.11Å; I693-I697 WeakPolarHBondContact O-CB 3.44Å; I693-I697 WeakPolarHBondContact O-CG1 3.29Å; I693-I697 PolarHBondContact O-N 2.93Å; E694-I697 PolarHBondContact O-N 3.39Å; L695-I697 PolarHBondContact O-N 3.26Å; I697-R699 PolarHBondContact O-N 2.83Å; I697-L700 HydrophobicContact CD1-CD1 4.37Å; I697-L700 PolarHBondContact O-N 3.08Å; I697-N701 PolarHBondContact O-N 3.32Å; I697-V711 HydrophobicContact CD1-CG1 4.31Å; I697-V711 HydrophobicContact CD1-CG2 4.3Å; I697-F720 HydrophobicContact CD1-CE2 4.12Å; I697-F720 HydrophobicContact CG1-CE2 4.42Å; I697-F720 HydrophobicContact CG2-CD1 4.38Å; I697-F720 HydrophobicContact CG2-CD2 3.64Å; I697-F720 HydrophobicContact CG2-CE1 4.21Å; I697-F720 HydrophobicContact CG2-CE2 3.45Å; I697-F720 VanDerWaalsContact CG2-CE2 3.45Å; I697-F720 HydrophobicContact CG2-CG 4.13Å; I697-F720 HydrophobicContact CG2-CZ 3.77Å; I697-I730 HydrophobicContact CB-CG2 4.41Å; I697-I730 HydrophobicContact CG2-CG2 4.03Å
698	Q	84.4	Confident	86.3	Confident	63 Å²	63	38.4 Å²	38.4	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-60.2	-44.8	176.2	-167.4	-165	56.1	0	0	111.4	E694 L695 N701 A702	E694-Q698 VanDerWaalsContact O-CB 3.3Å; E694-Q698 WeakPolarHBondContact O-CB 3.28Å; E694-Q698 PolarHBondContact O-N 3.48Å; L695-Q698 PolarHBondContact O-N 3.12Å; Q698-N701 PolarHBondContact O-N 3.42Å; Q698-A702 VanDerWaalsContact O-CB 3.24Å; Q698-A702 WeakPolarHBondContact O-CB 3.48Å; Q698-A702 PolarHBondContact O-N 3.26Å
699	R	89	Confident	86.3	Confident	12 Å²	12	39.2 Å²	39.2	5%	0.045	20%	0.203	C	C	.	.	H	α-helix	trans	-69.2	-35.8	178.8	-62.5	-40.9	-66.5	-175	-11.5	112.9	S566 I568 E664 L668 L695 L696 I697 N703	S566-R699 VanDerWaalsContact O-CD 3.25Å; S566-R699 WeakPolarHBondContact O-CD 3.46Å; S566-R699 PolarHBondContact O-NE 2.9Å; S566-R699 VanDerWaalsContact O-NE 3.17Å; S566-R699 PolarHBondContact O-NH1 2.87Å; S566-R699 VanDerWaalsContact O-NH1 3.13Å; I568-R699 HydrophobicContact CD1-CB 3.94Å; I568-R699 HydrophobicContact CD1-CG 3.76Å; I568-R699 HydrophobicContact CG1-CG 4.01Å; E664-R699 WeakPolarHBondContact OE1-CG 3.31Å; E664-R699 IonicContact OE1-CZ 2.71Å; E664-R699 IonicContact OE1-NE 2.82Å; E664-R699 PolarHBondContact OE1-NE 2.93Å; E664-R699 IonicContact OE1-NH2 2.77Å; E664-R699 PolarHBondContact OE1-NH2 3.47Å; E664-R699 IonicContact OE2-CZ 3.02Å; E664-R699 IonicContact OE2-NE 2.7Å; E664-R699 PolarHBondContact OE2-NE 3.48Å; E664-R699 IonicContact OE2-NH2 3.08Å; E664-R699 PolarHBondContact OE2-NH2 3.3Å; L668-R699 HydrophobicContact CD1-CB 4.02Å; L695-R699 HydrophobicContact CD1-CG 3.85Å; L695-R699 HydrophobicContact CG-CG 4.19Å; L695-R699 WeakPolarHBondContact O-CB 3.41Å; L695-R699 VanDerWaalsContact O-CG 3.27Å; L695-R699 WeakPolarHBondContact O-CG 3.38Å; L695-R699 PolarHBondContact O-N 3.13Å; L696-R699 PolarHBondContact O-N 3.23Å; I697-R699 PolarHBondContact O-N 2.83Å; R699-N703 VanDerWaalsContact O-CB 3.31Å; R699-N703 WeakPolarHBondContact O-CB 3.48Å; R699-N703 PolarHBondContact O-N 3.01Å; R699-N703 PolarHBondContact O-ND2 2.92Å
700	L	89.6	Confident	86.7	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-45.6	173	-78.1	170.5	0	0	0	111.7	L668 L672 L696 I697 K704 V705 W708 V711	L668-L700 HydrophobicContact CB-CD2 3.93Å; L668-L700 HydrophobicContact CD1-CD2 4.33Å; L668-L700 HydrophobicContact CD2-CD2 4.18Å; L668-L700 HydrophobicContact CD2-CG 4.41Å; L668-L700 HydrophobicContact CG-CD2 4.38Å; L672-L700 HydrophobicContact CD1-CD2 3.71Å; L672-L700 HydrophobicContact CD2-CD1 4.29Å; L672-L700 HydrophobicContact CD2-CD2 4.42Å; L672-L700 HydrophobicContact CG-CD2 4.11Å; L696-L700 HydrophobicContact CD1-CD1 4.19Å; L696-L700 HydrophobicContact CD1-CG 4.34Å; L696-L700 HydrophobicContact CG-CD1 4.1Å; L696-L700 WeakPolarHBondContact O-CB 3.37Å; L696-L700 VanDerWaalsContact O-CG 3.22Å; L696-L700 WeakPolarHBondContact O-CG 3.46Å; L696-L700 PolarHBondContact O-N 3.39Å; I697-L700 HydrophobicContact CD1-CD1 4.37Å; I697-L700 PolarHBondContact O-N 3.08Å; L700-K704 PolarHBondContact O-N 3.16Å; L700-V705 HydrophobicContact CD2-CB 3.73Å; L700-V705 HydrophobicContact CD2-CG1 3.84Å; L700-V705 HydrophobicContact CD2-CG2 3.94Å; L700-V705 PolarHBondContact O-N 3.02Å; L700-W708 HydrophobicContact CB-CB 4.47Å; L700-V711 HydrophobicContact CD1-CG2 3.62Å
701	N	84.7	Confident	87.4	Confident	45 Å²	45	37.6 Å²	37.6	24%	0.241	19%	0.191	C	C	.	.	H	α-helix	trans	-71.7	-45.8	178.7	-161.5	11.8	0	0	0	111.9	I697 Q698 N703 K704 M722	I697-N701 PolarHBondContact O-N 3.32Å; Q698-N701 PolarHBondContact O-N 3.42Å; N701-N703 VanDerWaalsContact C-N 3.31Å; N701-N703 PolarHBondContact O-N 2.78Å; N701-K704 WeakPolarHBondContact O-CA 3.48Å; N701-K704 PolarHBondContact O-N 2.99Å; N701-M722 HydrophobicContact CB-SD 4.33Å; N701-M722 WeakPolarHBondContact ND2-CG 3.46Å; N701-M722 PolarHBondContact ND2-SD 2.97Å
702	A	86.3	Confident	88	Confident	64 Å²	64	34.9 Å²	34.9	53%	0.529	18%	0.179	S	C	.	.	H	α-helix	trans	-59.5	-38.4	178.4	0	0	0	0	0	112.9	Q698 K704	Q698-A702 VanDerWaalsContact O-CB 3.24Å; Q698-A702 WeakPolarHBondContact O-CB 3.48Å; Q698-A702 PolarHBondContact O-N 3.26Å; A702-K704 VanDerWaalsContact C-N 3.29Å
703	N	90.1	Very high	88.3	Confident	25 Å²	25	33.8 Å²	33.8	13%	0.134	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	1.2	173.8	-73.5	-78.2	0	0	0	113.9	E664 R665 L668 R699 N701 V705	E664-N703 PolarHBondContact OE2-ND2 2.9Å; R665-N703 HydrophobicContact CB-CB 4.06Å; R665-N703 HydrophobicContact CG-CB 4.33Å; R665-N703 PolarHBondContact NH1-O 3.26Å; L668-N703 HydrophobicContact CD1-CB 4.38Å; R699-N703 VanDerWaalsContact O-CB 3.31Å; R699-N703 WeakPolarHBondContact O-CB 3.48Å; R699-N703 PolarHBondContact O-N 3.01Å; R699-N703 PolarHBondContact O-ND2 2.92Å; N701-N703 VanDerWaalsContact C-N 3.31Å; N701-N703 PolarHBondContact O-N 2.78Å; N703-V705 VanDerWaalsContact C-N 3.31Å; N703-V705 HydrophobicContact CB-CG2 3.84Å; N703-V705 PolarHBondContact O-N 3.4Å
704	K	89.8	Confident	88.5	Confident	168 Å²	168	34.3 Å²	34.3	73%	0.73	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	43.2	-179.3	-57	-175.6	179.6	-176.3	0	113.3	R665 L700 N701 A702	R665-K704 VanDerWaalsContact NH1-C 3.29Å; R665-K704 PolarHBondContact NH1-O 3.25Å; L700-K704 PolarHBondContact O-N 3.16Å; N701-K704 WeakPolarHBondContact O-CA 3.48Å; N701-K704 PolarHBondContact O-N 2.99Å; A702-K704 VanDerWaalsContact C-N 3.29Å
705	V	90.1	Very high	88.9	Confident	7 Å²	7	36.4 Å²	36.4	4%	0.042	18%	0.182	C	C	.	.			trans	-71.8	124.8	-174.4	-176.6	0	0	0	0	109.7	R665 L668 L672 L700 N703	R665-V705 HydrophobicContact CG-CG2 4.38Å; L668-V705 HydrophobicContact CB-CG2 3.94Å; L668-V705 HydrophobicContact CD1-CG2 4.18Å; L672-V705 HydrophobicContact CD1-CG1 3.86Å; L700-V705 HydrophobicContact CD2-CB 3.73Å; L700-V705 HydrophobicContact CD2-CG1 3.84Å; L700-V705 HydrophobicContact CD2-CG2 3.94Å; L700-V705 PolarHBondContact O-N 3.02Å; N703-V705 VanDerWaalsContact C-N 3.31Å; N703-V705 HydrophobicContact CB-CG2 3.84Å; N703-V705 PolarHBondContact O-N 3.4Å
706	P	87.2	Confident	88.9	Confident	78 Å²	78	38 Å²	38	51%	0.506	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	153	-179.8	30.1	-35.7	0	0	0	111.1	W708	P706-W708 VanDerWaalsContact C-N 3.26Å; P706-W708 PolarHBondContact O-N 2.71Å
707	H	87.6	Confident	88	Confident	98 Å²	98	43.6 Å²	43.6	45%	0.454	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	35.7	-178.8	-49.1	-73	0	0	0	114.3	W503 H709 R710	W503-H707 HydrophobicContact CH2-CB 4.4Å; W503-H707 AromaticContact CH2-ND1 3.93Å; W503-H707 HydrophobicContact CZ2-CB 4Å; H707-H709 PolarHBondContact O-N 3.28Å; H707-R710 HydrophobicContact CB-CG 4.13Å; H707-R710 WeakPolarHBondContact O-CB 3.47Å; H707-R710 WeakPolarHBondContact O-CG 3.28Å; H707-R710 PolarHBondContact O-N 2.87Å
708	W	87.2	Confident	87.1	Confident	25 Å²	25	47.1 Å²	47.1	10%	0.095	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-46.4	-35.1	177.9	68.1	-99.8	0	0	0	113.6	L700 P706 R710 V711 R716 F720	L700-W708 HydrophobicContact CB-CB 4.47Å; P706-W708 VanDerWaalsContact C-N 3.26Å; P706-W708 PolarHBondContact O-N 2.71Å; W708-R710 PolarHBondContact O-N 3.3Å; W708-V711 WeakPolarHBondContact O-CG2 3.21Å; W708-V711 PolarHBondContact O-N 2.98Å; W708-R716 HydrophobicContact CZ2-CB 4.26Å; W708-F720 HydrophobicContact CD2-CD2 4.07Å; W708-F720 AromaticContact CE3-CD2 3.62Å; W708-F720 HydrophobicContact CE3-CD2 3.62Å; W708-F720 AromaticContact CE3-CE2 3.97Å; W708-F720 HydrophobicContact CE3-CE2 3.97Å; W708-F720 AromaticContact CH2-CD2 3.45Å; W708-F720 HydrophobicContact CH2-CD2 3.45Å; W708-F720 VanDerWaalsContact CH2-CD2 3.45Å; W708-F720 AromaticContact CH2-CE2 3.73Å; W708-F720 HydrophobicContact CH2-CE2 3.73Å; W708-F720 HydrophobicContact CH2-CG 4.32Å; W708-F720 HydrophobicContact CZ2-CB 4.43Å; W708-F720 AromaticContact CZ2-CD2 3.9Å; W708-F720 HydrophobicContact CZ2-CD2 3.9Å; W708-F720 HydrophobicContact CZ2-CG 4.47Å; W708-F720 AromaticContact CZ3-CD2 3.31Å; W708-F720 HydrophobicContact CZ3-CD2 3.31Å; W708-F720 AromaticContact CZ3-CE2 3.37Å; W708-F720 HydrophobicContact CZ3-CE2 3.37Å
709	H	89	Confident	86	Confident	20 Å²	20	50 Å²	50	9%	0.093	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-71.8	5.1	-179.8	56.4	-99.2	0	0	0	114	W503 H707 V711 G712 R716	W503-H709 AromaticContact CE2-CD2 3.81Å; W503-H709 AromaticContact CE2-NE2 3.9Å; W503-H709 AromaticContact CZ2-CD2 3.92Å; W503-H709 AromaticContact CZ2-NE2 3.55Å; W503-H709 AromaticContact NE1-CD2 3.16Å; W503-H709 PolarHBondContact NE1-CD2 2.94Å; W503-H709 AromaticContact NE1-NE2 3.74Å; W503-H709 PolarHBondContact NE1-O 3.13Å; H707-H709 PolarHBondContact O-N 3.28Å; H709-V711 PolarHBondContact O-N 3.13Å; H709-G712 PolarHBondContact O-N 3.06Å; H709-R716 HydrophobicContact CB-CB 4.33Å; H709-R716 PolarHBondContact CD2-N 3.05Å; H709-R716 PolarHBondContact CE1-O 3.04Å; H709-R716 PolarHBondContact ND1-O 3.38Å
710	R	92.4	Very high	84.7	Confident	33 Å²	33	50.1 Å²	50.1	13%	0.125	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-65.2	-14.1	161	-77.4	178	169.3	-177.2	-6.3	113.3	W503 L672 H676 H707 W708 G712	W503-R710 HydrophobicContact CD2-CG 3.87Å; W503-R710 HydrophobicContact CE3-CG 4.48Å; W503-R710 HydrophobicContact CG-CG 4.26Å; W503-R710 HydrophobicContact CH2-CG 4.26Å; W503-R710 HydrophobicContact CZ2-CG 3.59Å; L672-R710 HydrophobicContact CB-CB 4.19Å; L672-R710 HydrophobicContact CD2-CB 4.25Å; H676-R710 HydrophobicContact CB-CG 4.25Å; H676-R710 PolarHBondContact CD2-NH2 3.08Å; H707-R710 HydrophobicContact CB-CG 4.13Å; H707-R710 WeakPolarHBondContact O-CB 3.47Å; H707-R710 WeakPolarHBondContact O-CG 3.28Å; H707-R710 PolarHBondContact O-N 2.87Å; W708-R710 PolarHBondContact O-N 3.3Å; R710-G712 CarbonylContact C-O 3.58Å; R710-G712 VanDerWaalsContact O-O 3.09Å
711	V	91.3	Very high	83	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	29%	0.289	C	S	.	.	S	Bend	trans	-57.8	-53.5	169.3	171	0	0	0	0	110.4	L672 L696 I697 L700 W708 H709 M735 R738	L672-V711 HydrophobicContact CD2-CG2 3.6Å; L696-V711 HydrophobicContact CD2-CG2 4.39Å; I697-V711 HydrophobicContact CD1-CG1 4.31Å; I697-V711 HydrophobicContact CD1-CG2 4.3Å; L700-V711 HydrophobicContact CD1-CG2 3.62Å; W708-V711 WeakPolarHBondContact O-CG2 3.21Å; W708-V711 PolarHBondContact O-N 2.98Å; H709-V711 PolarHBondContact O-N 3.13Å; V711-M735 HydrophobicContact CG1-CE 3.82Å; V711-M735 HydrophobicContact CG1-CG 4.04Å; V711-M735 HydrophobicContact CG1-SD 3.43Å; V711-M735 WeakPolarHBondContact CG1-SD 3.37Å; V711-R738 WeakPolarHBondContact O-CD 3.32Å; V711-R738 PolarHBondContact O-NE 3.08Å
712	G	91.7	Very high	81.5	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.01	30%	0.299	C	S	.	.	S	Bend	trans	-83.4	-160.2	166.8	0	0	0	0	0	112.8	H709 R710 S734 R738	H709-G712 PolarHBondContact O-N 3.06Å; R710-G712 CarbonylContact C-O 3.58Å; R710-G712 VanDerWaalsContact O-O 3.09Å; G712-S734 PolarHBondContact N-O 3.23Å; G712-R738 PolarHBondContact O-NE 2.64Å; G712-R738 PolarHBondContact O-NH2 2.77Å
713	R	93.6	Very high	79.9	Confident	1 Å²	1	56.4 Å²	56.4	0%	0.004	29%	0.294	C	S	.	.	S	Bend	trans	-108.8	-21.7	172.2	-76.8	179.2	162.6	148.2	-13.6	114.4	F358 S502 W503 D679 D681 P736 G737 R738	F358-R713 HydrophobicContact CD1-CB 4.05Å; F358-R713 HydrophobicContact CE1-CB 3.76Å; S502-R713 CarbonylContact C-O 3.57Å; S502-R713 WeakPolarHBondContact CA-O 3.34Å; S502-R713 VanDerWaalsContact CB-O 3.24Å; S502-R713 WeakPolarHBondContact CB-O 3.39Å; W503-R713 PolarHBondContact N-O 2.95Å; D679-R713 PolarHBondContact O-NH2 2.9Å; D679-R713 IonicContact OD1-CZ 3.89Å; D679-R713 IonicContact OD1-NE 3.98Å; D679-R713 PolarHBondContact OD1-NE 2.74Å; D679-R713 IonicContact OD1-NH2 2.77Å; D679-R713 PolarHBondContact OD1-NH2 2.8Å; D679-R713 IonicContact OD2-CZ 3Å; D679-R713 IonicContact OD2-NE 2.85Å; D679-R713 PolarHBondContact OD2-NE 3.34Å; D679-R713 IonicContact OD2-NH2 3.75Å; D679-R713 PolarHBondContact OD2-NH2 3.38Å; D681-R713 IonicContact OD1-CZ 3.95Å; D681-R713 VanDerWaalsContact OD1-CZ 3.29Å; D681-R713 IonicContact OD1-NH1 3.62Å; D681-R713 PolarHBondContact OD1-NH1 3.13Å; D681-R713 IonicContact OD1-NH2 3.63Å; D681-R713 PolarHBondContact OD1-NH2 3.3Å; R713-P736 PolarHBondContact N-O 3.32Å; R713-G737 WeakPolarHBondContact CD-O 3.49Å; R713-G737 PolarHBondContact NH1-O 3.1Å; R713-R738 HydrophobicContact CG-CG 4.19Å
714	L	91.4	Very high	77.9	Confident	13 Å²	13	59.2 Å²	59.2	7%	0.068	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-78.5	134.6	-179.1	-169.2	62.3	0	0	0	112.4	Y356 F358 P736	Y356-L714 HydrophobicContact CD1-CD1 3.73Å; Y356-L714 HydrophobicContact CE1-CD1 3.5Å; Y356-L714 VanDerWaalsContact CE1-CD1 3.5Å; Y356-L714 HydrophobicContact CE2-CD2 4.39Å; Y356-L714 HydrophobicContact CG-CD1 4.34Å; F358-L714 HydrophobicContact CZ-CB 4.41Å; L714-P736 HydrophobicContact CB-CG 3.88Å
715	R	90.9	Very high	75.8	Confident	88 Å²	88	55.7 Å²	55.7	33%	0.332	30%	0.298	S	S	.	.			trans	-76.4	137.3	173.2	-63	-172.7	-166.9	-146.9	2.1	111	Q500 I501 S502 W503	Q500-R715 WeakPolarHBondContact O-CD 3.34Å; I501-R715 VanDerWaalsContact O-CB 3.29Å; I501-R715 WeakPolarHBondContact O-CB 3.47Å; I501-R715 PolarHBondContact O-N 2.88Å; S502-R715 PolarHBondContact O-NE 3.47Å; S502-R715 PolarHBondContact O-NH2 3.17Å; S502-R715 VanDerWaalsContact O-NH2 3.09Å; W503-R715 HydrophobicContact CD2-CG 4.27Å; W503-R715 HydrophobicContact CZ2-CG 4.39Å
716	R	83.9	Confident	74.2	Confident	40 Å²	40	55.6 Å²	55.6	15%	0.151	30%	0.298	C	S	.	.			trans	-134.7	130.1	178.5	-69	-168.4	-179.6	149.9	9.5	112	W708 H709 H733	W708-R716 HydrophobicContact CZ2-CB 4.26Å; H709-R716 HydrophobicContact CB-CB 4.33Å; H709-R716 PolarHBondContact CD2-N 3.05Å; H709-R716 PolarHBondContact CE1-O 3.04Å; H709-R716 PolarHBondContact ND1-O 3.38Å; R716-H733 VanDerWaalsContact CZ-O 3.25Å; R716-H733 PolarHBondContact NH1-O 2.95Å; R716-H733 PolarHBondContact NH2-O 3.17Å
717	S	71.4	Confident	72.8	Confident	123 Å²	123	55.8 Å²	55.8	86%	0.86	29%	0.288	S	S	*	.			trans	-82.9	-33.1	179.7	48.8	0	0	0	0	113.2
718	V	67.8	Low	71.3	Confident	83 Å²	83	52.2 Å²	52.2	50%	0.503	27%	0.274	S	S	.	.	S	Bend	trans	-74.3	138.6	-179.6	-159	0	0	0	0	110
719	N	60.8	Low	70.2	Confident	124 Å²	124	52.9 Å²	52.9	66%	0.663	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-62.2	151.4	165.6	-75	-38.2	0	0	0	109.8	P721	N719-P721 WeakPolarHBondContact O-CD 3.43Å; N719-P721 VanDerWaalsContact O-N 3.1Å
720	F	62.1	Low	68.9	Low	13 Å²	13	52.5 Å²	52.5	6%	0.057	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-54.5	118	-175.7	-144.9	-68.8	0	0	0	110.7	I697 W708 M722 W729 I730	I697-F720 HydrophobicContact CD1-CE2 4.12Å; I697-F720 HydrophobicContact CG1-CE2 4.42Å; I697-F720 HydrophobicContact CG2-CD1 4.38Å; I697-F720 HydrophobicContact CG2-CD2 3.64Å; I697-F720 HydrophobicContact CG2-CE1 4.21Å; I697-F720 HydrophobicContact CG2-CE2 3.45Å; I697-F720 VanDerWaalsContact CG2-CE2 3.45Å; I697-F720 HydrophobicContact CG2-CG 4.13Å; I697-F720 HydrophobicContact CG2-CZ 3.77Å; W708-F720 HydrophobicContact CD2-CD2 4.07Å; W708-F720 AromaticContact CE3-CD2 3.62Å; W708-F720 HydrophobicContact CE3-CD2 3.62Å; W708-F720 AromaticContact CE3-CE2 3.97Å; W708-F720 HydrophobicContact CE3-CE2 3.97Å; W708-F720 AromaticContact CH2-CD2 3.45Å; W708-F720 HydrophobicContact CH2-CD2 3.45Å; W708-F720 VanDerWaalsContact CH2-CD2 3.45Å; W708-F720 AromaticContact CH2-CE2 3.73Å; W708-F720 HydrophobicContact CH2-CE2 3.73Å; W708-F720 HydrophobicContact CH2-CG 4.32Å; W708-F720 HydrophobicContact CZ2-CB 4.43Å; W708-F720 AromaticContact CZ2-CD2 3.9Å; W708-F720 HydrophobicContact CZ2-CD2 3.9Å; W708-F720 HydrophobicContact CZ2-CG 4.47Å; W708-F720 AromaticContact CZ3-CD2 3.31Å; W708-F720 HydrophobicContact CZ3-CD2 3.31Å; W708-F720 AromaticContact CZ3-CE2 3.37Å; W708-F720 HydrophobicContact CZ3-CE2 3.37Å; F720-M722 PolarHBondContact O-N 3.48Å; F720-W729 HydrophobicContact CD1-CZ3 4.37Å; F720-W729 HydrophobicContact CE1-CE3 4.45Å; F720-W729 AromaticContact CE1-CZ3 3.74Å; F720-W729 HydrophobicContact CE1-CZ3 3.74Å; F720-W729 HydrophobicContact CZ-CZ3 4.5Å; F720-I730 HydrophobicContact CE1-CB 4.24Å; F720-I730 HydrophobicContact CE1-CG1 4.05Å; F720-I730 HydrophobicContact CE1-CG2 3.92Å; F720-I730 HydrophobicContact CZ-CB 4.46Å; F720-I730 HydrophobicContact CZ-CG2 3.87Å
721	P	54.6	Low	67.6	Low	72 Å²	72	51.3 Å²	51.3	47%	0.468	27%	0.271	S	S	.	.			trans	-71.4	98.5	175.6	29	-31.9	0	0	0	107.5	N719 N723 W729	N719-P721 WeakPolarHBondContact O-CD 3.43Å; N719-P721 VanDerWaalsContact O-N 3.1Å; P721-N723 PolarHBondContact O-N 3.48Å; P721-W729 HydrophobicContact CG-CH2 3.53Å; P721-W729 HydrophobicContact CG-CZ3 3.8Å
722	M	52.9	Low	66.4	Low	93 Å²	93	54.5 Å²	54.5	46%	0.458	28%	0.283	S	S	.	.			trans	-78.8	73.1	-178.5	-70.9	-156	-52.8	0	0	111	N701 F720 L724	N701-M722 HydrophobicContact CB-SD 4.33Å; N701-M722 WeakPolarHBondContact ND2-CG 3.46Å; N701-M722 PolarHBondContact ND2-SD 2.97Å; F720-M722 PolarHBondContact O-N 3.48Å; M722-L724 HydrophobicContact CB-CD1 4.22Å; M722-L724 HydrophobicContact CB-CG 4.21Å; M722-L724 HydrophobicContact CE-CD1 4.19Å; M722-L724 PolarHBondContact O-N 3.47Å; M722-L724 VanDerWaalsContact O-N 3.08Å; M722-L724 HydrophobicContact SD-CD1 4.35Å
723	N	52	Low	65.7	Low	78 Å²	78	55.3 Å²	55.3	42%	0.417	29%	0.287	S	S	.	.			trans	-76.2	82.4	154.8	-163.8	-1.5	0	0	0	107.8	P721 N725 S726	P721-N723 PolarHBondContact O-N 3.48Å; N723-N725 PolarHBondContact O-N 2.67Å; N723-N725 VanDerWaalsContact O-N 3.13Å; N723-S726 PolarHBondContact O-N 2.9Å
724	L	48.6	Very low	65	Low	84 Å²	84	55.3 Å²	55.3	44%	0.44	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-15.8	-172.6	-88.4	148.8	0	0	0	113.8	M722 S726	M722-L724 HydrophobicContact CB-CD1 4.22Å; M722-L724 HydrophobicContact CB-CG 4.21Å; M722-L724 HydrophobicContact CE-CD1 4.19Å; M722-L724 PolarHBondContact O-N 3.47Å; M722-L724 VanDerWaalsContact O-N 3.08Å; M722-L724 HydrophobicContact SD-CD1 4.35Å; L724-S726 PolarHBondContact O-N 2.92Å
725	N	46.3	Very low	64.9	Low	94 Å²	94	55.5 Å²	55.5	50%	0.503	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	4.3	177.9	-66.5	52.6	0	0	0	113.5	N723 Q926	N723-N725 PolarHBondContact O-N 2.67Å; N723-N725 VanDerWaalsContact O-N 3.13Å; N725-Q926 VanDerWaalsContact O-CG 3.25Å; N725-Q926 WeakPolarHBondContact O-CG 3.35Å; N725-Q926 PolarHBondContact O-NE2 3.11Å
726	S	56.2	Low	64.8	Low	6 Å²	6	51.7 Å²	51.7	4%	0.042	28%	0.275	C	S	.	.			trans	-134.7	87.3	178.1	-163.7	0	0	0	0	111.9	N723 L724 S728 W729 I730 Q926	N723-S726 PolarHBondContact O-N 2.9Å; L724-S726 PolarHBondContact O-N 2.92Å; S726-S728 VanDerWaalsContact C-N 3.35Å; S726-W729 PolarHBondContact O-N 2.63Å; S726-W729 WeakPolarHBondContact OG-CB 3.46Å; S726-I730 WeakPolarHBondContact O-CG1 3.45Å; S726-I730 PolarHBondContact O-N 3.41Å; S726-Q926 PolarHBondContact OG-OE1 3.22Å
727	R	57.3	Low	65.2	Low	82 Å²	82	49.8 Å²	49.8	31%	0.309	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-42.9	179	-50.4	-176.7	177.5	88.7	3.3	110.6	E694 W729 I730 I731 E925	E694-R727 WeakPolarHBondContact OE1-CD 3.19Å; E694-R727 IonicContact OE1-CZ 2.83Å; E694-R727 IonicContact OE1-NE 3.23Å; E694-R727 PolarHBondContact OE1-NE 3.31Å; E694-R727 IonicContact OE2-NE 2.64Å; R727-W729 VanDerWaalsContact C-N 3.27Å; R727-W729 PolarHBondContact O-N 3.47Å; R727-I730 CarbonylContact O-C 3.57Å; R727-I730 WeakPolarHBondContact O-CA 3.38Å; R727-I730 WeakPolarHBondContact O-CB 3.29Å; R727-I730 PolarHBondContact O-N 3.37Å; R727-I731 HydrophobicContact CB-CD1 4.05Å; R727-I731 WeakPolarHBondContact O-CD1 3.49Å; R727-I731 WeakPolarHBondContact O-CG1 3.45Å; R727-I731 PolarHBondContact O-N 3.02Å; R727-E925 VanDerWaalsContact CB-OE2 3.32Å; R727-E925 WeakPolarHBondContact CB-OE2 3.16Å; R727-E925 WeakPolarHBondContact CD-OE1 3.12Å; R727-E925 WeakPolarHBondContact CG-OE1 3.5Å; R727-E925 IonicContact CZ-OE1 2.92Å; R727-E925 PolarHBondContact N-OE2 3.37Å; R727-E925 IonicContact NH1-OE1 3.26Å; R727-E925 PolarHBondContact NH1-OE1 3.26Å
728	S	56.3	Low	66.2	Low	23 Å²	23	44.2 Å²	44.2	16%	0.161	23%	0.227	C	C	.	.	H	α-helix	trans	-54.8	-41.2	179.5	-68.2	0	0	0	0	112.2	S726 R732 E925	S726-S728 VanDerWaalsContact C-N 3.35Å; S728-R732 VanDerWaalsContact O-CB 3.22Å; S728-R732 WeakPolarHBondContact O-CB 3.45Å; S728-R732 WeakPolarHBondContact O-CG 3.49Å; S728-R732 PolarHBondContact O-N 3.06Å; S728-E925 WeakPolarHBondContact CB-OE2 3.46Å; S728-E925 PolarHBondContact N-OE2 3.37Å; S728-E925 PolarHBondContact OG-OE2 2.98Å
729	W	63.5	Low	67.5	Low	39 Å²	39	40.3 Å²	40.3	15%	0.148	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-50.1	172	-171.9	86.2	0	0	0	112.2	F720 P721 S726 R727 I731 H733	F720-W729 HydrophobicContact CD1-CZ3 4.37Å; F720-W729 HydrophobicContact CE1-CE3 4.45Å; F720-W729 AromaticContact CE1-CZ3 3.74Å; F720-W729 HydrophobicContact CE1-CZ3 3.74Å; F720-W729 HydrophobicContact CZ-CZ3 4.5Å; P721-W729 HydrophobicContact CG-CH2 3.53Å; P721-W729 HydrophobicContact CG-CZ3 3.8Å; S726-W729 PolarHBondContact O-N 2.63Å; S726-W729 WeakPolarHBondContact OG-CB 3.46Å; R727-W729 VanDerWaalsContact C-N 3.27Å; R727-W729 PolarHBondContact O-N 3.47Å; W729-I731 VanDerWaalsContact C-N 3.28Å; W729-I731 PolarHBondContact O-N 3.23Å; W729-H733 AromaticContact CD1-CD2 3.52Å; W729-H733 AromaticContact CD1-NE2 3.63Å; W729-H733 AromaticContact CE2-CD2 3.75Å; W729-H733 AromaticContact CE2-CG 3.75Å; W729-H733 AromaticContact CG-CD2 3.97Å; W729-H733 HydrophobicContact CH2-CB 4.28Å; W729-H733 HydrophobicContact CZ2-CB 3.99Å; W729-H733 AromaticContact CZ2-CG 3.92Å; W729-H733 AromaticContact NE1-CD2 3.39Å; W729-H733 PolarHBondContact NE1-CD2 3.22Å; W729-H733 AromaticContact NE1-CE1 3.78Å; W729-H733 AromaticContact NE1-CG 3.74Å; W729-H733 AromaticContact NE1-ND1 3.95Å; W729-H733 AromaticContact NE1-NE2 3.45Å; W729-H733 PolarHBondContact NE1-NE2 2.83Å; W729-H733 WeakPolarHBondContact O-CB 3.36Å; W729-H733 PolarHBondContact O-CD2 3.01Å; W729-H733 VanDerWaalsContact O-CD2 3.28Å; W729-H733 PolarHBondContact O-N 3.31Å
730	I	62.9	Low	69.1	Low	11 Å²	11	34.5 Å²	34.5	6%	0.056	17%	0.173	C	C	.	.	H	α-helix	trans	-53.2	-48	178.7	-68.1	170	0	0	0	110.4	I697 F720 S726 R727 S734	I697-I730 HydrophobicContact CB-CG2 4.41Å; I697-I730 HydrophobicContact CG2-CG2 4.03Å; F720-I730 HydrophobicContact CE1-CB 4.24Å; F720-I730 HydrophobicContact CE1-CG1 4.05Å; F720-I730 HydrophobicContact CE1-CG2 3.92Å; F720-I730 HydrophobicContact CZ-CB 4.46Å; F720-I730 HydrophobicContact CZ-CG2 3.87Å; S726-I730 WeakPolarHBondContact O-CG1 3.45Å; S726-I730 PolarHBondContact O-N 3.41Å; R727-I730 CarbonylContact O-C 3.57Å; R727-I730 WeakPolarHBondContact O-CA 3.38Å; R727-I730 WeakPolarHBondContact O-CB 3.29Å; R727-I730 PolarHBondContact O-N 3.37Å; I730-S734 WeakPolarHBondContact O-CB 3.36Å; I730-S734 PolarHBondContact O-N 3.42Å; I730-S734 VanDerWaalsContact O-N 3.12Å; I730-S734 PolarHBondContact O-OG 2.67Å
731	I	64.9	Low	70.5	Confident	8 Å²	8	33.9 Å²	33.9	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-74	-52.7	-174.3	-49.4	149	0	0	0	110.4	W689 I693 R727 W729 H733 S734	W689-I731 HydrophobicContact CD2-CG2 4.3Å; W689-I731 HydrophobicContact CE3-CB 4.12Å; W689-I731 HydrophobicContact CE3-CG2 3.29Å; W689-I731 HydrophobicContact CZ3-CB 4.38Å; W689-I731 HydrophobicContact CZ3-CG2 3.57Å; W689-I731 WeakPolarHBondContact O-CD1 3.39Å; I693-I731 HydrophobicContact CB-CG2 4.09Å; I693-I731 HydrophobicContact CD1-CG2 3.82Å; I693-I731 HydrophobicContact CG2-CG2 3.94Å; R727-I731 HydrophobicContact CB-CD1 4.05Å; R727-I731 WeakPolarHBondContact O-CD1 3.49Å; R727-I731 WeakPolarHBondContact O-CG1 3.45Å; R727-I731 PolarHBondContact O-N 3.02Å; W729-I731 VanDerWaalsContact C-N 3.28Å; W729-I731 PolarHBondContact O-N 3.23Å; I731-H733 VanDerWaalsContact C-N 3.26Å; I731-H733 PolarHBondContact O-N 3.03Å; I731-S734 PolarHBondContact O-N 2.82Å; I731-S734 VanDerWaalsContact O-N 3.08Å; I731-S734 PolarHBondContact O-OG 2.83Å
732	R	65.5	Low	72.4	Confident	69 Å²	69	30.5 Å²	30.5	26%	0.26	15%	0.148	S	C	.	.	H	α-helix	trans	-52.4	-43.2	178.9	-75.3	177	179.5	-175.8	3.1	111.9	S728 I923 Q924	S728-R732 VanDerWaalsContact O-CB 3.22Å; S728-R732 WeakPolarHBondContact O-CB 3.45Å; S728-R732 WeakPolarHBondContact O-CG 3.49Å; S728-R732 PolarHBondContact O-N 3.06Å; R732-I923 PolarHBondContact NH2-O 2.87Å; R732-Q924 VanDerWaalsContact NH2-CD 3.3Å
733	H	76.5	Confident	74.3	Confident	17 Å²	17	26.2 Å²	26.2	8%	0.079	13%	0.127	C	C	.	.	H	α-helix	trans	-89.4	-5.4	-176.9	-64.9	-104	0	0	0	114	H345 R716 W729 I731 D921	H345-H733 AromaticContact CE1-CE1 3.44Å; H345-H733 PolarHBondContact CE1-CE1 2.87Å; H345-H733 VanDerWaalsContact CE1-CE1 3.44Å; H345-H733 AromaticContact CE1-CG 3.58Å; H345-H733 AromaticContact CE1-ND1 2.92Å; H345-H733 PolarHBondContact CE1-ND1 3.39Å; R716-H733 VanDerWaalsContact CZ-O 3.25Å; R716-H733 PolarHBondContact NH1-O 2.95Å; R716-H733 PolarHBondContact NH2-O 3.17Å; W729-H733 AromaticContact CD1-CD2 3.52Å; W729-H733 AromaticContact CD1-NE2 3.63Å; W729-H733 AromaticContact CE2-CD2 3.75Å; W729-H733 AromaticContact CE2-CG 3.75Å; W729-H733 AromaticContact CG-CD2 3.97Å; W729-H733 HydrophobicContact CH2-CB 4.28Å; W729-H733 HydrophobicContact CZ2-CB 3.99Å; W729-H733 AromaticContact CZ2-CG 3.92Å; W729-H733 AromaticContact NE1-CD2 3.39Å; W729-H733 PolarHBondContact NE1-CD2 3.22Å; W729-H733 AromaticContact NE1-CE1 3.78Å; W729-H733 AromaticContact NE1-CG 3.74Å; W729-H733 AromaticContact NE1-ND1 3.95Å; W729-H733 AromaticContact NE1-NE2 3.45Å; W729-H733 PolarHBondContact NE1-NE2 2.83Å; W729-H733 WeakPolarHBondContact O-CB 3.36Å; W729-H733 PolarHBondContact O-CD2 3.01Å; W729-H733 VanDerWaalsContact O-CD2 3.28Å; W729-H733 PolarHBondContact O-N 3.31Å; I731-H733 VanDerWaalsContact C-N 3.26Å; I731-H733 PolarHBondContact O-N 3.03Å; H733-D921 IonicContact NE2-OD1 3.72Å
734	S	79.2	Confident	76.1	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.014	11%	0.108	C	C	.	.	H	α-helix	trans	-81.5	-29.8	-177.9	64.5	0	0	0	0	115.7	G712 I730 I731 P736	G712-S734 PolarHBondContact N-O 3.23Å; I730-S734 WeakPolarHBondContact O-CB 3.36Å; I730-S734 PolarHBondContact O-N 3.42Å; I730-S734 VanDerWaalsContact O-N 3.12Å; I730-S734 PolarHBondContact O-OG 2.67Å; I731-S734 PolarHBondContact O-N 2.82Å; I731-S734 VanDerWaalsContact O-N 3.08Å; I731-S734 PolarHBondContact O-OG 2.83Å; S734-P736 WeakPolarHBondContact O-CD 3.37Å
735	M	88.6	Confident	78	Confident	17 Å²	17	20.6 Å²	20.6	8%	0.084	10%	0.099	C	C	.	.			trans	-113.3	22.8	-166.8	-73.2	-89.7	-154.6	0	0	116.1	I683 I693 V711 G737 R738 V740	I683-M735 HydrophobicContact CD1-CE 4.21Å; I683-M735 HydrophobicContact CD1-SD 4.03Å; I693-M735 HydrophobicContact CD1-CE 3.72Å; I693-M735 HydrophobicContact CG1-CE 3.86Å; I693-M735 HydrophobicContact CG2-CE 4.37Å; V711-M735 HydrophobicContact CG1-CE 3.82Å; V711-M735 HydrophobicContact CG1-CG 4.04Å; V711-M735 HydrophobicContact CG1-SD 3.43Å; V711-M735 WeakPolarHBondContact CG1-SD 3.37Å; M735-G737 PolarHBondContact O-N 3.36Å; M735-R738 PolarHBondContact O-N 2.79Å; M735-V740 HydrophobicContact CB-CG2 3.99Å; M735-V740 HydrophobicContact CE-CG2 4.12Å; M735-V740 HydrophobicContact CG-CG2 3.88Å; M735-V740 HydrophobicContact SD-CG2 4.02Å
736	P	89.5	Confident	80.1	Confident	8 Å²	8	16.6 Å²	16.6	5%	0.052	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	130.5	-169.3	27.6	-36.8	0	0	0	112.1	H345 F358 R713 L714 S734	H345-P736 HydrophobicContact CB-CB 3.9Å; F358-P736 HydrophobicContact CE2-CB 4.42Å; R713-P736 PolarHBondContact N-O 3.32Å; L714-P736 HydrophobicContact CB-CG 3.88Å; S734-P736 WeakPolarHBondContact O-CD 3.37Å
737	G	91.6	Very high	81.7	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	-0.5	-176.4	0	0	0	0	0	115.7	D343 R713 M735	D343-G737 WeakPolarHBondContact OD2-CA 3.29Å; D343-G737 PolarHBondContact OD2-N 3.19Å; R713-G737 WeakPolarHBondContact CD-O 3.49Å; R713-G737 PolarHBondContact NH1-O 3.1Å; M735-G737 PolarHBondContact O-N 3.36Å
738	R	93.9	Very high	83	Confident	5 Å²	5	17 Å²	17	2%	0.019	8%	0.079	C	C	.	.	S	Bend	trans	-121.3	123.6	171.1	-56.3	-164.9	-162.8	-69.5	-8.6	110.1	D679 P680 I683 V711 G712 R713 M735 V740	D679-R738 IonicContact OD1-CZ 3.71Å; D679-R738 IonicContact OD1-NH1 3.59Å; D679-R738 PolarHBondContact OD1-NH1 2.67Å; D679-R738 IonicContact OD1-NH2 3.67Å; D679-R738 PolarHBondContact OD1-NH2 2.91Å; P680-R738 PolarHBondContact O-NH1 2.96Å; I683-R738 HydrophobicContact CD1-CB 4.41Å; V711-R738 WeakPolarHBondContact O-CD 3.32Å; V711-R738 PolarHBondContact O-NE 3.08Å; G712-R738 PolarHBondContact O-NE 2.64Å; G712-R738 PolarHBondContact O-NH2 2.77Å; R713-R738 HydrophobicContact CG-CG 4.19Å; M735-R738 PolarHBondContact O-N 2.79Å; R738-V740 PolarHBondContact O-N 3.13Å
739	L	94.1	Very high	84.2	Confident	1 Å²	1	17.9 Å²	17.9	1%	0.005	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	115.9	177.9	-63.1	173.3	0	0	0	109.5	F342 D343 D681 I682 I683 L875 L879	F342-L739 HydrophobicContact CB-CD1 4.42Å; F342-L739 HydrophobicContact CD2-CD1 3.76Å; F342-L739 HydrophobicContact CD2-CD2 4.46Å; F342-L739 HydrophobicContact CD2-CG 3.98Å; F342-L739 HydrophobicContact CE2-CD1 4.46Å; F342-L739 HydrophobicContact CE2-CG 4.44Å; F342-L739 HydrophobicContact CG-CD1 4.33Å; D343-L739 HydrophobicContact CB-CD2 3.96Å; D681-L739 PolarHBondContact O-N 2.9Å; I682-L739 CarbonylContact C-O 3.52Å; I682-L739 WeakPolarHBondContact CA-O 3.48Å; I682-L739 HydrophobicContact CG1-CB 4.3Å; I682-L739 HydrophobicContact CG1-CD1 4.21Å; I682-L739 HydrophobicContact CG2-CB 4.46Å; I683-L739 PolarHBondContact N-O 3.05Å; L739-L875 HydrophobicContact CD1-CD2 3.61Å; L739-L875 HydrophobicContact CD1-CG 4.14Å; L739-L875 HydrophobicContact CD2-CB 4.12Å; L739-L875 HydrophobicContact CD2-CD2 4.45Å; L739-L875 HydrophobicContact CD2-CG 4.14Å; L739-L879 HydrophobicContact CB-CD1 4.06Å
740	V	93.5	Very high	85.2	Confident	3 Å²	3	18.7 Å²	18.7	2%	0.018	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.6	178.4	174.4	0	0	0	0	109.6	L688 W689 I693 M735 R738 L879	L688-V740 HydrophobicContact CB-CG1 4.24Å; L688-V740 HydrophobicContact CD1-CG1 3.8Å; W689-V740 HydrophobicContact CD2-CG1 4.38Å; W689-V740 HydrophobicContact CH2-CB 4.04Å; W689-V740 HydrophobicContact CH2-CG1 4.28Å; W689-V740 HydrophobicContact CZ2-CB 3.65Å; W689-V740 HydrophobicContact CZ2-CG1 3.68Å; I693-V740 HydrophobicContact CD1-CG1 3.85Å; I693-V740 HydrophobicContact CD1-CG2 4.33Å; M735-V740 HydrophobicContact CB-CG2 3.99Å; M735-V740 HydrophobicContact CE-CG2 4.12Å; M735-V740 HydrophobicContact CG-CG2 3.88Å; M735-V740 HydrophobicContact SD-CG2 4.02Å; R738-V740 PolarHBondContact O-N 3.13Å; V740-L879 WeakPolarHBondContact O-CB 3.36Å
741	C	93.5	Very high	86.2	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	115	177.1	178.3	0	0	0	0	109.9	I683 I684 G685 L861 L879	I683-C741 PolarHBondContact O-N 2.9Å; I684-C741 CarbonylContact C-O 3.59Å; I684-C741 WeakPolarHBondContact CA-O 3.15Å; I684-C741 HydrophobicContact CG1-CB 4.19Å; I684-C741 HydrophobicContact CG2-CB 4.4Å; G685-C741 PolarHBondContact N-O 2.8Å; C741-L861 HydrophobicContact CB-CD2 3.91Å; C741-L879 HydrophobicContact CB-CD2 4.37Å
742	D	92.9	Very high	86.6	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	108.6	178	-170.2	-19.3	0	0	0	110.7	H686 D687 L688 W689 K744 V745 S746	H686-D742 WeakPolarHBondContact CA-OD1 3.42Å; D687-D742 WeakPolarHBondContact CA-OD2 3.42Å; D687-D742 PolarHBondContact N-OD1 2.88Å; D687-D742 PolarHBondContact N-OD2 2.85Å; L688-D742 HydrophobicContact CB-CB 4.26Å; L688-D742 PolarHBondContact N-OD2 3.41Å; W689-D742 HydrophobicContact CG-CB 4.44Å; W689-D742 PolarHBondContact N-OD2 2.9Å; W689-D742 VanDerWaalsContact N-OD2 3.11Å; D742-K744 PolarHBondContact O-N 2.89Å; D742-K744 VanDerWaalsContact O-N 3.08Å; D742-K744 WeakPolarHBondContact OD1-CB 3.46Å; D742-K744 PolarHBondContact OD1-N 2.99Å; D742-V745 HydrophobicContact CB-CB 4.24Å; D742-V745 HydrophobicContact CB-CG2 4.05Å; D742-V745 PolarHBondContact O-N 3.41Å; D742-S746 PolarHBondContact O-N 3.04Å; D742-S746 PolarHBondContact O-OG 2.87Å
743	T	92.6	Very high	87	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-57.1	-24.8	178.9	54.9	0	0	0	0	113.3	I684 G685 H686 A747 V851 L854 C855	I684-T743 HydrophobicContact CG2-CG2 4.05Å; G685-T743 WeakPolarHBondContact O-CB 3.46Å; G685-T743 WeakPolarHBondContact O-CG2 3.43Å; G685-T743 PolarHBondContact O-N 2.85Å; G685-T743 PolarHBondContact O-OG1 3.16Å; H686-T743 WeakPolarHBondContact CB-OG1 3.45Å; H686-T743 PolarHBondContact ND1-OG1 2.74Å; T743-A747 WeakPolarHBondContact O-CB 3.3Å; T743-A747 PolarHBondContact O-N 3.14Å; T743-V851 HydrophobicContact CG2-CG1 4Å; T743-L854 HydrophobicContact CG2-CB 4.48Å; T743-C855 HydrophobicContact CG2-CB 4.03Å
744	K	90.5	Very high	86.7	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.017	11%	0.114	C	C	.	.	H	α-helix	trans	-73.9	-38.8	176	-173.2	171.6	174.1	-172.9	0	112.4	D687 D742 R748 Y756 R1316 D1322	D687-K744 HydrophobicContact CB-CD 3.96Å; D687-K744 VanDerWaalsContact OD1-CD 3.23Å; D687-K744 WeakPolarHBondContact OD1-CD 3.33Å; D687-K744 WeakPolarHBondContact OD1-CE 3.35Å; D687-K744 IonicContact OD1-NZ 3.14Å; D687-K744 PolarHBondContact OD1-NZ 3.45Å; D687-K744 IonicContact OD2-NZ 2.84Å; D742-K744 PolarHBondContact O-N 2.89Å; D742-K744 VanDerWaalsContact O-N 3.08Å; D742-K744 WeakPolarHBondContact OD1-CB 3.46Å; D742-K744 PolarHBondContact OD1-N 2.99Å; K744-R748 WeakPolarHBondContact O-CG 3.21Å; K744-R748 PolarHBondContact O-N 2.84Å; K744-Y756 WeakPolarHBondContact CD-O 3.35Å; K744-Y756 WeakPolarHBondContact CG-O 3.26Å; K744-R1316 VanDerWaalsContact NZ-NH2 3.2Å; K744-D1322 IonicContact NZ-OD1 3.29Å; K744-D1322 PolarHBondContact NZ-OD1 2.98Å
745	V	88	Confident	86.6	Confident	41 Å²	41	25 Å²	25	25%	0.248	12%	0.116	C	C	.	.	H	α-helix	trans	-72.5	-47.3	176.1	178.6	0	0	0	0	109.8	D742 A747 R748 E749	D742-V745 HydrophobicContact CB-CB 4.24Å; D742-V745 HydrophobicContact CB-CG2 4.05Å; D742-V745 PolarHBondContact O-N 3.41Å; V745-A747 PolarHBondContact O-N 3.29Å; V745-R748 WeakPolarHBondContact O-CB 3.11Å; V745-R748 PolarHBondContact O-N 3.34Å; V745-R748 VanDerWaalsContact O-N 3.15Å; V745-E749 PolarHBondContact O-N 3.19Å
746	S	90.8	Very high	86.4	Confident	10 Å²	10	24.6 Å²	24.6	7%	0.07	11%	0.114	C	C	.	.	H	α-helix	trans	-65.8	-35.3	178.5	-49.4	0	0	0	0	112.8	D742 R748 E749 L750 V860	D742-S746 PolarHBondContact O-N 3.04Å; D742-S746 PolarHBondContact O-OG 2.87Å; S746-R748 VanDerWaalsContact C-N 3.33Å; S746-R748 PolarHBondContact O-N 2.96Å; S746-E749 PolarHBondContact O-N 3.44Å; S746-L750 WeakPolarHBondContact O-CB 3.3Å; S746-L750 VanDerWaalsContact O-CG 3.24Å; S746-L750 WeakPolarHBondContact O-CG 3.26Å; S746-L750 PolarHBondContact O-N 3.3Å; S746-L750 VanDerWaalsContact O-N 3.14Å; S746-V860 VanDerWaalsContact OG-CG1 3.29Å; S746-V860 WeakPolarHBondContact OG-CG1 3.45Å
747	A	89.9	Confident	86	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.008	12%	0.117	C	C	.	.	H	α-helix	trans	-62.9	-38.6	172.6	0	0	0	0	0	112.1	T743 V745 E749 L750 V751 Y756 L761 L858	T743-A747 WeakPolarHBondContact O-CB 3.3Å; T743-A747 PolarHBondContact O-N 3.14Å; V745-A747 PolarHBondContact O-N 3.29Å; A747-E749 VanDerWaalsContact C-N 3.3Å; A747-E749 PolarHBondContact O-N 3.29Å; A747-L750 PolarHBondContact O-N 3.05Å; A747-V751 CarbonylContact O-C 3.21Å; A747-V751 PolarHBondContact O-N 3.4Å; A747-Y756 HydrophobicContact CB-CD1 4.2Å; A747-L761 HydrophobicContact CB-CD1 3.69Å; A747-L761 HydrophobicContact CB-CD2 4.04Å; A747-L858 HydrophobicContact CB-CD1 4.2Å
748	R	84.4	Confident	85.6	Confident	94 Å²	94	25.8 Å²	25.8	36%	0.355	12%	0.12	S	C	.	.	H	α-helix	trans	-64.4	-30.7	175.9	-74.3	171.6	178.5	-171.9	-3.4	113.9	K744 V745 S746 Y756 G1321	K744-R748 WeakPolarHBondContact O-CG 3.21Å; K744-R748 PolarHBondContact O-N 2.84Å; V745-R748 WeakPolarHBondContact O-CB 3.11Å; V745-R748 PolarHBondContact O-N 3.34Å; V745-R748 VanDerWaalsContact O-N 3.15Å; S746-R748 VanDerWaalsContact C-N 3.33Å; S746-R748 PolarHBondContact O-N 2.96Å; R748-Y756 HydrophobicContact CB-CD1 4.49Å; R748-Y756 HydrophobicContact CB-CE1 4.28Å; R748-Y756 HydrophobicContact CG-CD1 3.51Å; R748-Y756 HydrophobicContact CG-CD2 3.93Å; R748-Y756 HydrophobicContact CG-CE1 3.63Å; R748-Y756 HydrophobicContact CG-CE2 4.02Å; R748-Y756 HydrophobicContact CG-CG 3.68Å; R748-G1321 PolarHBondContact NH2-O 3.35Å
749	E	81.8	Confident	84.9	Confident	43 Å²	43	25.7 Å²	25.7	20%	0.201	12%	0.12	C	C	.	.	H	α-helix	trans	-79.6	-25.9	175.7	175.6	152.2	-129.3	0	0	112.9	V745 S746 A747 R883 R886	V745-E749 PolarHBondContact O-N 3.19Å; S746-E749 PolarHBondContact O-N 3.44Å; A747-E749 VanDerWaalsContact C-N 3.3Å; A747-E749 PolarHBondContact O-N 3.29Å; E749-R883 IonicContact OE1-CZ 2.75Å; E749-R883 IonicContact OE1-NE 3.07Å; E749-R883 PolarHBondContact OE1-NE 2.85Å; E749-R883 IonicContact OE1-NH2 2.72Å; E749-R886 VanDerWaalsContact CD-NH1 3.32Å; E749-R886 IonicContact OE1-CZ 3.04Å; E749-R886 IonicContact OE1-NH1 3.7Å; E749-R886 PolarHBondContact OE1-NH1 3.16Å; E749-R886 IonicContact OE1-NH2 3.18Å; E749-R886 IonicContact OE2-CZ 3.31Å; E749-R886 IonicContact OE2-NH1 2.69Å; E749-R886 PolarHBondContact OE2-NH1 3.17Å; E749-R886 VanDerWaalsContact OE2-NH1 3.13Å; E749-R886 IonicContact OE2-NH2 2.77Å; E749-R886 PolarHBondContact OE2-NH2 3.05Å
750	L	84.6	Confident	84.1	Confident	56 Å²	56	26.8 Å²	26.8	29%	0.293	13%	0.126	S	C	.	.	H	α-helix	trans	-116.1	-21.9	-166.7	-58.8	175.7	0	0	0	115.7	S746 A747 L858 V860 L863	S746-L750 WeakPolarHBondContact O-CB 3.3Å; S746-L750 VanDerWaalsContact O-CG 3.24Å; S746-L750 WeakPolarHBondContact O-CG 3.26Å; S746-L750 PolarHBondContact O-N 3.3Å; S746-L750 VanDerWaalsContact O-N 3.14Å; A747-L750 PolarHBondContact O-N 3.05Å; L750-L858 HydrophobicContact CD1-CB 4.36Å; L750-V860 HydrophobicContact CD1-CG2 4.23Å; L750-L863 HydrophobicContact CD1-CD2 4.08Å; L750-L863 HydrophobicContact CD2-CD2 3.46Å; L750-L863 VanDerWaalsContact CD2-CD2 3.46Å; L750-L863 HydrophobicContact CG-CD2 4.43Å
751	V	83.8	Confident	83.6	Confident	32 Å²	32	26.8 Å²	26.8	19%	0.194	13%	0.126	C	C	.	.			trans	-141.3	132.5	-173.9	176.7	0	0	0	0	111.1	A747 Y756 V765 L858	A747-V751 CarbonylContact O-C 3.21Å; A747-V751 PolarHBondContact O-N 3.4Å; V751-Y756 WeakPolarHBondContact O-CE1 3.37Å; V751-Y756 PolarHBondContact O-OH 3.02Å; V751-V765 HydrophobicContact CG1-CG2 4.28Å; V751-V765 HydrophobicContact CG2-CG2 4.47Å; V751-L858 HydrophobicContact CG2-CD2 3.45Å; V751-L858 VanDerWaalsContact CG2-CD2 3.45Å
752	R	72.9	Confident	83.2	Confident	84 Å²	84	26.9 Å²	26.9	32%	0.317	13%	0.127	S	C	.	.			trans	-81.4	120.7	174.2	-167.2	160.1	-162.8	65	24.9	110.8	V37 D47 Q764	V37-R752 VanDerWaalsContact CG1-CZ 3.49Å; D47-R752 IonicContact OD1-CZ 3.21Å; D47-R752 VanDerWaalsContact OD1-CZ 3.23Å; D47-R752 IonicContact OD1-NH1 3.42Å; D47-R752 PolarHBondContact OD1-NH1 3.4Å; D47-R752 IonicContact OD1-NH2 3.4Å; D47-R752 PolarHBondContact OD1-NH2 2.93Å; R752-Q764 PolarHBondContact O-NE2 3.33Å
753	S	74.9	Confident	82.5	Confident	18 Å²	18	30.1 Å²	30.1	13%	0.126	15%	0.149	C	C	.	.			trans	-140.2	160.6	175.6	-160.1	0	0	0	0	113.5	T755 Y756 Q764	S753-T755 WeakPolarHBondContact CB-O 3.49Å; S753-T755 PolarHBondContact OG-O 3.31Å; S753-Y756 PolarHBondContact N-OH 3.02Å; S753-Q764 PolarHBondContact OG-OE1 2.76Å
754	R	70.4	Confident	82	Confident	94 Å²	94	33.9 Å²	33.9	36%	0.355	17%	0.167	S	C	.	.	S	Bend	trans	-66.7	-48.1	176.4	-69.6	-175.9	170.1	177.6	-3.3	111	R1224	R754-R1224 HydrophobicContact CB-CB 4.4Å; R754-R1224 HydrophobicContact CG-CB 4.21Å; R754-R1224 WeakPolarHBondContact O-CD 3.4Å; R754-R1224 PolarHBondContact O-NH1 3.37Å
755	T	75.6	Confident	81.6	Confident	10 Å²	10	34.9 Å²	34.9	6%	0.061	17%	0.173	C	C	.	.			trans	-129.5	144.7	-175.9	42.5	0	0	0	0	108	S753 D760 T1278 T1323	S753-T755 WeakPolarHBondContact CB-O 3.49Å; S753-T755 PolarHBondContact OG-O 3.31Å; T755-D760 VanDerWaalsContact CB-OD2 3.26Å; T755-D760 WeakPolarHBondContact CB-OD2 3.34Å; T755-D760 WeakPolarHBondContact OG1-CB 3.15Å; T755-D760 PolarHBondContact OG1-OD2 2.92Å; T755-T1278 HydrophobicContact CG2-CG2 3.85Å; T755-T1323 HydrophobicContact CG2-CG2 3.88Å
756	Y	84.1	Confident	81.4	Confident	9 Å²	9	33.7 Å²	33.7	4%	0.035	17%	0.165	C	C	.	.			trans	-109.2	41.1	179.4	-67.1	-87.4	0	0	0	110.9	H686 K744 A747 R748 V751 S753 L761	H686-Y756 PolarHBondContact CE1-O 3.02Å; H686-Y756 VanDerWaalsContact CE1-O 3.23Å; H686-Y756 PolarHBondContact NE2-O 2.66Å; K744-Y756 WeakPolarHBondContact CD-O 3.35Å; K744-Y756 WeakPolarHBondContact CG-O 3.26Å; A747-Y756 HydrophobicContact CB-CD1 4.2Å; R748-Y756 HydrophobicContact CB-CD1 4.49Å; R748-Y756 HydrophobicContact CB-CE1 4.28Å; R748-Y756 HydrophobicContact CG-CD1 3.51Å; R748-Y756 HydrophobicContact CG-CD2 3.93Å; R748-Y756 HydrophobicContact CG-CE1 3.63Å; R748-Y756 HydrophobicContact CG-CE2 4.02Å; R748-Y756 HydrophobicContact CG-CG 3.68Å; V751-Y756 WeakPolarHBondContact O-CE1 3.37Å; V751-Y756 PolarHBondContact O-OH 3.02Å; S753-Y756 PolarHBondContact N-OH 3.02Å; Y756-L761 HydrophobicContact CD1-CD1 4.4Å; Y756-L761 HydrophobicContact CD1-CD2 4.01Å
757	N	81.5	Confident	80	Confident	23 Å²	23	34 Å²	34	12%	0.123	17%	0.169	C	C	.	.	S	Bend	trans	-94	156.9	178.6	-58.6	-21.3	0	0	0	109.9	S759 D760 L761	N757-S759 VanDerWaalsContact C-N 3.3Å; N757-S759 PolarHBondContact O-N 3.39Å; N757-D760 PolarHBondContact O-N 3.37Å; N757-L761 WeakPolarHBondContact O-CG 3.42Å; N757-L761 PolarHBondContact O-N 3Å
758	L	84.5	Confident	77.9	Confident	10 Å²	10	42.6 Å²	42.6	5%	0.052	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-34.2	-174.6	-174.6	60.6	0	0	0	113.6	H686 A762 D847 L850 V851 L854	H686-L758 PolarHBondContact NE2-N 2.77Å; L758-A762 WeakPolarHBondContact O-CB 3.5Å; L758-A762 PolarHBondContact O-N 2.96Å; L758-A762 VanDerWaalsContact O-N 3.17Å; L758-D847 HydrophobicContact CD2-CB 4.09Å; L758-L850 HydrophobicContact CD1-CB 4.29Å; L758-V851 HydrophobicContact CD1-CG2 3.7Å; L758-V851 HydrophobicContact CD2-CG2 4Å; L758-L854 HydrophobicContact CD1-CD1 3.69Å
759	S	78.7	Confident	75.6	Confident	3 Å²	3	42 Å²	42	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-53.1	176.3	-51.9	0	0	0	0	111.4	N757 A762 S763 R786 D819	N757-S759 VanDerWaalsContact C-N 3.3Å; N757-S759 PolarHBondContact O-N 3.39Å; S759-A762 PolarHBondContact O-N 3.45Å; S759-S763 PolarHBondContact O-N 2.93Å; S759-S763 PolarHBondContact O-OG 3.46Å; S759-R786 WeakPolarHBondContact OG-CD 3.32Å; S759-R786 PolarHBondContact OG-NH1 3.42Å; S759-D819 WeakPolarHBondContact CB-O 3.18Å; S759-D819 PolarHBondContact OG-O 3.5Å
760	D	77.6	Confident	73.1	Confident	25 Å²	25	45.9 Å²	45.9	13%	0.134	24%	0.243	C	C	.	.	H	α-helix	trans	-75.7	-39.6	-169.4	-45.8	-47.6	0	0	0	112	T755 N757 A762 S763 Q764	T755-D760 VanDerWaalsContact CB-OD2 3.26Å; T755-D760 WeakPolarHBondContact CB-OD2 3.34Å; T755-D760 WeakPolarHBondContact OG1-CB 3.15Å; T755-D760 PolarHBondContact OG1-OD2 2.92Å; N757-D760 PolarHBondContact O-N 3.37Å; D760-A762 VanDerWaalsContact C-N 3.32Å; D760-A762 PolarHBondContact O-N 3.25Å; D760-S763 PolarHBondContact O-N 3.34Å; D760-S763 PolarHBondContact O-OG 3.03Å; D760-S763 VanDerWaalsContact O-OG 3.05Å; D760-Q764 VanDerWaalsContact O-CB 3.3Å; D760-Q764 WeakPolarHBondContact O-CB 3.39Å; D760-Q764 PolarHBondContact O-N 2.93Å
761	L	83.4	Confident	70.5	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-64.9	-38.6	173.1	-66.6	176.9	0	0	0	110.8	A747 Y756 N757 V765 L854	A747-L761 HydrophobicContact CB-CD1 3.69Å; A747-L761 HydrophobicContact CB-CD2 4.04Å; Y756-L761 HydrophobicContact CD1-CD1 4.4Å; Y756-L761 HydrophobicContact CD1-CD2 4.01Å; N757-L761 WeakPolarHBondContact O-CG 3.42Å; N757-L761 PolarHBondContact O-N 3Å; L761-V765 WeakPolarHBondContact O-CB 3.25Å; L761-V765 WeakPolarHBondContact O-CG2 3.38Å; L761-V765 PolarHBondContact O-N 2.96Å; L761-L854 HydrophobicContact CB-CD1 4.17Å; L761-L854 HydrophobicContact CB-CD2 4.42Å; L761-L854 WeakPolarHBondContact O-CD2 3.46Å
762	A	83.5	Confident	67.8	Low	2 Å²	2	56.4 Å²	56.4	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-42.5	174.8	0	0	0	0	0	112.4	L758 S759 D760 L766 L850	L758-A762 WeakPolarHBondContact O-CB 3.5Å; L758-A762 PolarHBondContact O-N 2.96Å; L758-A762 VanDerWaalsContact O-N 3.17Å; S759-A762 PolarHBondContact O-N 3.45Å; D760-A762 VanDerWaalsContact C-N 3.32Å; D760-A762 PolarHBondContact O-N 3.25Å; A762-L766 HydrophobicContact CB-CD1 4.34Å; A762-L766 WeakPolarHBondContact O-CB 3.21Å; A762-L766 PolarHBondContact O-N 2.88Å; A762-L766 VanDerWaalsContact O-N 3.14Å; A762-L850 HydrophobicContact CB-CD1 4.33Å; A762-L850 HydrophobicContact CB-CD2 4.18Å
763	S	79.5	Confident	65.7	Low	68 Å²	68	61.1 Å²	61.1	48%	0.476	32%	0.321	S	S	.	.	H	α-helix	trans	-69.6	-40.9	179.6	67.6	0	0	0	0	112.5	S759 D760 G767	S759-S763 PolarHBondContact O-N 2.93Å; S759-S763 PolarHBondContact O-OG 3.46Å; D760-S763 PolarHBondContact O-N 3.34Å; D760-S763 PolarHBondContact O-OG 3.03Å; D760-S763 VanDerWaalsContact O-OG 3.05Å; S763-G767 WeakPolarHBondContact O-CA 3.49Å; S763-G767 PolarHBondContact O-N 3.13Å
764	Q	80.5	Confident	63.4	Low	81 Å²	81	67.3 Å²	67.3	38%	0.379	35%	0.353	S	S	.	.	H	α-helix	trans	-70.2	-54.2	177.2	-175.3	179.9	-7.9	0	0	112.4	R752 S753 D760	R752-Q764 PolarHBondContact O-NE2 3.33Å; S753-Q764 PolarHBondContact OG-OE1 2.76Å; D760-Q764 VanDerWaalsContact O-CB 3.3Å; D760-Q764 WeakPolarHBondContact O-CB 3.39Å; D760-Q764 PolarHBondContact O-N 2.93Å
765	V	83.8	Confident	61.5	Low	25 Å²	25	70 Å²	70	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-80.9	-25.6	-168.8	177.7	0	0	0	0	112.8	V751 L761 L854 Q857 L858	V751-V765 HydrophobicContact CG1-CG2 4.28Å; V751-V765 HydrophobicContact CG2-CG2 4.47Å; L761-V765 WeakPolarHBondContact O-CB 3.25Å; L761-V765 WeakPolarHBondContact O-CG2 3.38Å; L761-V765 PolarHBondContact O-N 2.96Å; V765-L854 HydrophobicContact CB-CD2 3.69Å; V765-L854 HydrophobicContact CG1-CD2 3.89Å; V765-L854 HydrophobicContact CG2-CD2 4.27Å; V765-Q857 HydrophobicContact CG1-CB 4.12Å; V765-Q857 HydrophobicContact CG1-CG 3.7Å; V765-L858 HydrophobicContact CG1-CD2 3.63Å; V765-L858 HydrophobicContact CG1-CG 4.08Å; V765-L858 HydrophobicContact CG2-CD2 4.28Å
766	L	82.1	Confident	59.3	Low	17 Å²	17	79.3 Å²	79.3	9%	0.089	41%	0.414	C	S	.	.	H	α-helix	trans	-105.9	0.3	-179.1	-46.6	176.5	0	0	0	113.5	A762 P784 L850 R853 L854 Q857	A762-L766 HydrophobicContact CB-CD1 4.34Å; A762-L766 WeakPolarHBondContact O-CB 3.21Å; A762-L766 PolarHBondContact O-N 2.88Å; A762-L766 VanDerWaalsContact O-N 3.14Å; L766-P784 HydrophobicContact CB-CG 4.16Å; L766-L850 HydrophobicContact CD1-CD2 4.07Å; L766-R853 HydrophobicContact CD1-CB 4.01Å; L766-R853 HydrophobicContact CD2-CB 4.27Å; L766-L854 HydrophobicContact CD1-CD2 4.43Å; L766-L854 HydrophobicContact CD1-CG 4.44Å; L766-L854 HydrophobicContact CD2-CD2 4.27Å; L766-L854 HydrophobicContact CG-CD2 4.11Å; L766-Q857 HydrophobicContact CD2-CB 3.91Å; L766-Q857 HydrophobicContact CD2-CG 4.09Å
767	G	62.7	Low	56.5	Low	15 Å²	15	84.2 Å²	84.2	16%	0.155	45%	0.45	C	S	.	.			trans	-88.5	-28.2	-168.7	0	0	0	0	0	116.9	S763 V769 L783	S763-G767 WeakPolarHBondContact O-CA 3.49Å; S763-G767 PolarHBondContact O-N 3.13Å; G767-V769 PolarHBondContact O-N 3.33Å; G767-L783 WeakPolarHBondContact O-CD2 3.47Å
768	E	45.8	Very low	54	Low	182 Å²	182	88.3 Å²	88.3	85%	0.85	48%	0.48	S	S	*	.			trans	-79.8	33.9	-164.5	-61.7	-158	129.9	0	0	116.3	T770	E768-T770 VanDerWaalsContact C-N 3.34Å; E768-T770 PolarHBondContact O-N 3.5Å
769	V	35.4	Very low	51.4	Low	83 Å²	83	96.7 Å²	96.7	50%	0.503	52%	0.519	S	S	.	.			trans	-94.9	61.3	174.9	-166	0	0	0	0	111.2	L630 G767	L630-V769 HydrophobicContact CD1-CG1 3.41Å; L630-V769 VanDerWaalsContact CD1-CG1 3.41Å; G767-V769 PolarHBondContact O-N 3.33Å
770	T	30.2	Very low	49	Very low	123 Å²	123	104.1 Å²	104.1	76%	0.755	56%	0.557	S	S	*	*			trans	-119.2	101.9	164.8	55.6	0	0	0	0	109.7	E768	E768-T770 VanDerWaalsContact C-N 3.34Å; E768-T770 PolarHBondContact O-N 3.5Å
771	S	28.9	Very low	46.9	Very low	115 Å²	115	106.3 Å²	106.3	80%	0.804	59%	0.585	S	S	*	*			trans	-62.5	142	-179.1	49.5	0	0	0	0	112.6	K773	S771-K773 PolarHBondContact O-N 2.82Å; S771-K773 VanDerWaalsContact O-N 3.13Å
772	K	28	Very low	44.8	Very low	195 Å²	195	112.6 Å²	112.6	85%	0.848	62%	0.623	S	S	*	*			trans	-65.3	110	178.7	-66	178	-179.7	177.9	0	111.5
773	K	28.3	Very low	42.9	Very low	182 Å²	182	117 Å²	117	79%	0.791	65%	0.645	S	S	*	*	S	Bend	trans	65.1	160.6	158.9	-77.4	-171.3	174.7	-178.7	0	119	S771	S771-K773 PolarHBondContact O-N 2.82Å; S771-K773 VanDerWaalsContact O-N 3.13Å
774	D	27.4	Very low	41.6	Very low	149 Å²	149	115.9 Å²	115.9	80%	0.797	64%	0.637	S	S	*	*			trans	61	73.1	158	-51.1	-24.4	0	0	0	119.1
775	D	30.4	Very low	40.6	Very low	149 Å²	149	116.9 Å²	116.9	80%	0.797	64%	0.64	S	S	*	*				-162.5	161.3	110.7	-137.3	-29.2	0	0	0	114.5	S777	D775-S777 PolarHBondContact O-N 2.88Å
776	K	28.6	Very low	40	Very low	207 Å²	207	117.4 Å²	117.4	90%	0.9	64%	0.639	S	S	*	*	S	Bend	trans	-91.3	60.2	-174.3	-70.6	-176.9	177.4	174.9	0	114.6
777	S	25.9	Very low	39.5	Very low	112 Å²	112	120.9 Å²	120.9	78%	0.783	66%	0.655	S	S	*	*			trans	-163.5	39.7	165.4	51.2	0	0	0	0	115.7	D775 Q779	D775-S777 PolarHBondContact O-N 2.88Å; S777-Q779 PolarHBondContact O-N 2.86Å
778	S	29.9	Very low	40	Very low	108 Å²	108	121.1 Å²	121.1	76%	0.755	65%	0.653	S	S	*	*			trans	-72.5	123.7	-178.2	43.1	0	0	0	0	114.1
779	Q	29.2	Very low	41.5	Very low	187 Å²	187	112.7 Å²	112.7	87%	0.874	61%	0.614	S	S	*	*			trans	-65	136.5	154.8	-70.9	-180	-23.5	0	0	108.6	S777 G781	S777-Q779 PolarHBondContact O-N 2.86Å; Q779-G781 PolarHBondContact O-N 3.17Å
780	I	28.9	Very low	43.4	Very low	159 Å²	159	112.9 Å²	112.9	82%	0.815	62%	0.617	S	S	*	*			trans	-70.4	105.1	177.5	-60.2	174.1	0	0	0	108.5	V782	I780-V782 PolarHBondContact O-N 3.46Å; I780-V782 VanDerWaalsContact O-N 3.13Å
781	G	33.7	Very low	45.5	Very low	70 Å²	70	108.9 Å²	108.9	72%	0.722	59%	0.59	S	S	*	*			trans	-64.3	108.7	169.8	0	0	0	0	0	109.6	Q779 L783	Q779-G781 PolarHBondContact O-N 3.17Å; G781-L783 PolarHBondContact O-N 3.45Å
782	V	38.8	Very low	47.4	Very low	135 Å²	135	103.4 Å²	103.4	82%	0.818	55%	0.552	S	S	*	*			trans	-68.2	117.3	179.4	-179.1	0	0	0	0	108.8	I780	I780-V782 PolarHBondContact O-N 3.46Å; I780-V782 VanDerWaalsContact O-N 3.13Å
783	L	43.3	Very low	49.1	Very low	94 Å²	94	97.4 Å²	97.4	49%	0.492	53%	0.528	S	S	.	.			trans	-49.3	143	173.1	-76.5	163	0	0	0	110.7	G767 G781 K785	G767-L783 WeakPolarHBondContact O-CD2 3.47Å; G781-L783 PolarHBondContact O-N 3.45Å; L783-K785 HydrophobicContact CB-CG 4.45Å; L783-K785 PolarHBondContact O-N 3.47Å
784	P	51.6	Low	50.7	Low	46 Å²	46	91.1 Å²	91.1	30%	0.299	51%	0.507	S	S	.	.			trans	-74.1	60.6	179.8	33	-36.6	0	0	0	111.9	L766	L766-P784 HydrophobicContact CB-CG 4.16Å
785	K	60.4	Low	52.1	Low	101 Å²	101	89.4 Å²	89.4	44%	0.439	49%	0.49	S	S	.	.			trans	-62.8	143.1	173.9	-71.2	-164.4	172.6	-158.2	0	110.4	L783 Q787 A815 A818	L783-K785 HydrophobicContact CB-CG 4.45Å; L783-K785 PolarHBondContact O-N 3.47Å; K785-Q787 PolarHBondContact O-N 3.45Å; K785-A815 PolarHBondContact NZ-O 3.04Å; K785-A818 HydrophobicContact CD-CB 4.01Å
786	R	70.3	Confident	53.2	Low	37 Å²	37	84.3 Å²	84.3	14%	0.14	46%	0.462	C	S	.	.			trans	-56.4	127.6	177.3	-170.9	179	-175.9	-162.4	-1.6	110.9	S759 I788 D847 L850	S759-R786 WeakPolarHBondContact OG-CD 3.32Å; S759-R786 PolarHBondContact OG-NH1 3.42Å; R786-I788 HydrophobicContact CG-CG1 4.49Å; R786-I788 PolarHBondContact O-N 3.38Å; R786-D847 IonicContact CZ-OD1 3.88Å; R786-D847 IonicContact CZ-OD2 2.66Å; R786-D847 IonicContact NE-OD1 2.71Å; R786-D847 PolarHBondContact NE-OD1 3.46Å; R786-D847 IonicContact NE-OD2 3.06Å; R786-D847 IonicContact NH2-OD1 2.73Å; R786-D847 PolarHBondContact NH2-OD1 3.02Å; R786-D847 IonicContact NH2-OD2 2.7Å; R786-D847 PolarHBondContact NH2-OD2 2.82Å; R786-L850 HydrophobicContact CB-CD1 4.14Å; R786-L850 HydrophobicContact CG-CD1 4.01Å
787	Q	71.9	Confident	54.3	Low	90 Å²	90	76.8 Å²	76.8	42%	0.421	43%	0.432	S	S	.	.			trans	-85.1	79.3	-172.4	-66.8	-168.5	-48.9	0	0	112.3	P623 K785 F843 S846	P623-Q787 VanDerWaalsContact CG-CD 3.49Å; P623-Q787 VanDerWaalsContact CG-NE2 3.28Å; K785-Q787 PolarHBondContact O-N 3.45Å; Q787-F843 WeakPolarHBondContact O-CD2 3.31Å; Q787-S846 PolarHBondContact OE1-OG 2.92Å
788	I	72.8	Confident	55.3	Low	20 Å²	20	72.7 Å²	72.7	10%	0.103	41%	0.408	C	S	.	.			trans	-73.8	130.4	175.7	-57.7	-176.9	0	0	0	110	R786 L792 I793 A818 I822	R786-I788 HydrophobicContact CG-CG1 4.49Å; R786-I788 PolarHBondContact O-N 3.38Å; I788-L792 HydrophobicContact CG2-CB 4.04Å; I788-L792 HydrophobicContact CG2-CD1 4.4Å; I788-I793 HydrophobicContact CB-CD1 4.19Å; I788-I793 HydrophobicContact CB-CG1 4.08Å; I788-I793 HydrophobicContact CG2-CD1 4.33Å; I788-I793 HydrophobicContact CG2-CG1 3.67Å; I788-A818 WeakPolarHBondContact CD1-O 3.44Å; I788-I822 HydrophobicContact CB-CD1 4.5Å; I788-I822 HydrophobicContact CD1-CD1 4.43Å; I788-I822 HydrophobicContact CD1-CG1 4.44Å; I788-I822 HydrophobicContact CG1-CD1 4.17Å; I788-I822 HydrophobicContact CG2-CD1 3.88Å; I788-I822 HydrophobicContact CG2-CG1 4.18Å
789	P	78.3	Confident	55.8	Low	5 Å²	5	71.9 Å²	71.9	3%	0.032	40%	0.395	C	S	.	.			trans	-53.6	129.6	173.8	-31.9	38	0	0	0	113.4	I791 L792 I793 L830 Q839 F843	P789-I791 VanDerWaalsContact C-N 3.25Å; P789-I791 PolarHBondContact O-N 3.27Å; P789-I791 VanDerWaalsContact O-N 3.08Å; P789-L792 HydrophobicContact CB-CD1 3.88Å; P789-L792 HydrophobicContact CB-CG 4.06Å; P789-L792 HydrophobicContact CG-CD1 3.85Å; P789-L792 WeakPolarHBondContact O-CB 3.32Å; P789-L792 PolarHBondContact O-N 3.47Å; P789-I793 PolarHBondContact O-N 3.03Å; P789-L830 HydrophobicContact CB-CD2 4.13Å; P789-L830 HydrophobicContact CG-CD1 4.38Å; P789-Q839 HydrophobicContact CB-CB 3.96Å; P789-Q839 HydrophobicContact CG-CB 4.12Å; P789-F843 HydrophobicContact CG-CB 3.93Å; P789-F843 HydrophobicContact CG-CG 4.25Å
790	P	74.8	Confident	56	Low	87 Å²	87	69.1 Å²	69.1	57%	0.565	39%	0.391	S	S	*	.	H	α-helix	trans	-56.2	-31	-173.5	-30.5	36.3	0	0	0	115.9	L792 I793 S794	P790-L792 PolarHBondContact O-N 3.11Å; P790-I793 PolarHBondContact O-N 2.91Å; P790-S794 PolarHBondContact O-N 2.87Å; P790-S794 PolarHBondContact O-OG 3.17Å
791	I	73.7	Confident	56.2	Low	38 Å²	38	69.9 Å²	69.9	20%	0.195	39%	0.388	C	S	.	.	H	α-helix	trans	-67	-23.2	176.7	-165.5	168.6	0	0	0	113.2	P789 S794 R795 L830 L836	P789-I791 VanDerWaalsContact C-N 3.25Å; P789-I791 PolarHBondContact O-N 3.27Å; P789-I791 VanDerWaalsContact O-N 3.08Å; I791-S794 PolarHBondContact O-OG 3Å; I791-R795 WeakPolarHBondContact O-CD 3.47Å; I791-R795 VanDerWaalsContact O-CG 3.24Å; I791-R795 WeakPolarHBondContact O-CG 3.25Å; I791-R795 PolarHBondContact O-N 3.01Å; I791-L830 HydrophobicContact CG2-CD2 3.55Å; I791-L836 HydrophobicContact CB-CD2 4.28Å; I791-L836 HydrophobicContact CD1-CD1 3.76Å; I791-L836 HydrophobicContact CD1-CD2 4.15Å; I791-L836 HydrophobicContact CG2-CD2 3.87Å
792	L	68.5	Low	56	Low	1 Å²	1	75.7 Å²	75.7	1%	0.005	39%	0.394	C	S	.	.	H	α-helix	trans	-81	-41.6	174.8	-54.2	174.9	0	0	0	109.7	I788 P789 P790 S794 R795 L796 I822 D826 L827 L830	I788-L792 HydrophobicContact CG2-CB 4.04Å; I788-L792 HydrophobicContact CG2-CD1 4.4Å; P789-L792 HydrophobicContact CB-CD1 3.88Å; P789-L792 HydrophobicContact CB-CG 4.06Å; P789-L792 HydrophobicContact CG-CD1 3.85Å; P789-L792 WeakPolarHBondContact O-CB 3.32Å; P789-L792 PolarHBondContact O-N 3.47Å; P790-L792 PolarHBondContact O-N 3.11Å; L792-S794 VanDerWaalsContact C-N 3.34Å; L792-S794 PolarHBondContact O-N 3.3Å; L792-R795 PolarHBondContact O-N 3.26Å; L792-L796 WeakPolarHBondContact O-CB 3.43Å; L792-L796 VanDerWaalsContact O-CG 3.28Å; L792-L796 WeakPolarHBondContact O-CG 3.46Å; L792-L796 PolarHBondContact O-N 3.17Å; L792-I822 HydrophobicContact CD1-CD1 4.03Å; L792-I822 HydrophobicContact CD1-CG1 4.41Å; L792-I822 HydrophobicContact CD1-CG2 3.83Å; L792-D826 HydrophobicContact CD2-CB 3.92Å; L792-L827 HydrophobicContact CD1-CD2 4.24Å; L792-L830 HydrophobicContact CD1-CD1 4.13Å
793	I	65	Low	55.5	Low	69 Å²	69	75.4 Å²	75.4	35%	0.354	39%	0.392	S	S	.	.	H	α-helix	trans	-59.1	-44.9	175.7	-52.7	178.6	0	0	0	110.6	I788 P789 P790 R795 L796 N797	I788-I793 HydrophobicContact CB-CD1 4.19Å; I788-I793 HydrophobicContact CB-CG1 4.08Å; I788-I793 HydrophobicContact CG2-CD1 4.33Å; I788-I793 HydrophobicContact CG2-CG1 3.67Å; P789-I793 PolarHBondContact O-N 3.03Å; P790-I793 PolarHBondContact O-N 2.91Å; I793-R795 PolarHBondContact O-N 2.73Å; I793-L796 PolarHBondContact O-N 3.31Å; I793-N797 WeakPolarHBondContact O-CB 3.49Å; I793-N797 VanDerWaalsContact O-CG 3.27Å; I793-N797 PolarHBondContact O-N 3.27Å; I793-N797 PolarHBondContact O-ND2 3.19Å
794	S	61.3	Low	54.8	Low	50 Å²	50	76 Å²	76	35%	0.35	40%	0.403	S	S	.	.	H	α-helix	trans	-67.5	-33	178.4	60	0	0	0	0	113.6	P790 I791 L792 N797 G798 N799	P790-S794 PolarHBondContact O-N 2.87Å; P790-S794 PolarHBondContact O-OG 3.17Å; I791-S794 PolarHBondContact O-OG 3Å; L792-S794 VanDerWaalsContact C-N 3.34Å; L792-S794 PolarHBondContact O-N 3.3Å; S794-N797 CarbonylContact O-C 3.59Å; S794-G798 PolarHBondContact O-N 3.35Å; S794-N799 PolarHBondContact O-N 3.24Å
795	R	57.6	Low	53.5	Low	112 Å²	112	80.5 Å²	80.5	42%	0.423	43%	0.425	S	S	.	.	H	α-helix	trans	-68.6	-46	173.3	-79.1	176	171.6	-130.4	-5.5	112.9	I791 L792 I793 N797 G798 D826	I791-R795 WeakPolarHBondContact O-CD 3.47Å; I791-R795 VanDerWaalsContact O-CG 3.24Å; I791-R795 WeakPolarHBondContact O-CG 3.25Å; I791-R795 PolarHBondContact O-N 3.01Å; L792-R795 PolarHBondContact O-N 3.26Å; I793-R795 PolarHBondContact O-N 2.73Å; R795-N797 PolarHBondContact O-N 2.93Å; R795-G798 WeakPolarHBondContact O-CA 3.22Å; R795-G798 PolarHBondContact O-N 2.66Å; R795-D826 WeakPolarHBondContact CD-OD1 3.37Å; R795-D826 IonicContact CZ-OD1 3.78Å; R795-D826 IonicContact NE-OD1 3.13Å; R795-D826 IonicContact NH1-OD1 2.67Å; R795-D826 PolarHBondContact NH1-OD1 3.31Å
796	L	53.2	Low	52	Low	42 Å²	42	83.4 Å²	83.4	22%	0.22	45%	0.445	C	S	.	.	H	α-helix	trans	-61.4	-34.6	175.9	-68.7	168.4	0	0	0	111.1	L792 I793 G798 I820	L792-L796 WeakPolarHBondContact O-CB 3.43Å; L792-L796 VanDerWaalsContact O-CG 3.28Å; L792-L796 WeakPolarHBondContact O-CG 3.46Å; L792-L796 PolarHBondContact O-N 3.17Å; I793-L796 PolarHBondContact O-N 3.31Å; L796-G798 PolarHBondContact O-N 2.9Å; L796-I820 HydrophobicContact CB-CD1 4.34Å; L796-I820 HydrophobicContact CD1-CB 4.28Å; L796-I820 HydrophobicContact CD1-CD1 4.25Å; L796-I820 HydrophobicContact CD1-CG2 3.97Å; L796-I820 HydrophobicContact CD2-CG2 4.14Å
797	N	51.2	Low	49.8	Very low	49 Å²	49	87.8 Å²	87.8	26%	0.262	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	14.5	171.6	-65.8	-17.9	0	0	0	114.2	I793 S794 R795 N799	I793-N797 WeakPolarHBondContact O-CB 3.49Å; I793-N797 VanDerWaalsContact O-CG 3.27Å; I793-N797 PolarHBondContact O-N 3.27Å; I793-N797 PolarHBondContact O-ND2 3.19Å; S794-N797 CarbonylContact O-C 3.59Å; R795-N797 PolarHBondContact O-N 2.93Å; N797-N799 PolarHBondContact O-N 3.42Å; N797-N799 VanDerWaalsContact O-N 3.09Å
798	G	46	Very low	47.7	Very low	27 Å²	27	92.3 Å²	92.3	28%	0.278	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	3.9	173.2	0	0	0	0	0	116.9	S794 R795 L796 T800	S794-G798 PolarHBondContact O-N 3.35Å; R795-G798 WeakPolarHBondContact O-CA 3.22Å; R795-G798 PolarHBondContact O-N 2.66Å; L796-G798 PolarHBondContact O-N 2.9Å; G798-T800 PolarHBondContact O-N 3.02Å
799	N	41.7	Very low	45.5	Very low	91 Å²	91	95.4 Å²	95.4	49%	0.487	52%	0.521	S	S	.	.			trans	-98.9	98.3	-166.3	-162.5	-2.9	0	0	0	112	S794 N797	S794-N799 PolarHBondContact O-N 3.24Å; N797-N799 PolarHBondContact O-N 3.42Å; N797-N799 VanDerWaalsContact O-N 3.09Å
800	T	33.5	Very low	43	Very low	128 Å²	128	102.3 Å²	102.3	79%	0.785	56%	0.556	S	S	*	*			trans	-90	-0.5	-165.5	54.1	0	0	0	0	115.9	G798 F802	G798-T800 PolarHBondContact O-N 3.02Å; T800-F802 PolarHBondContact O-N 3.42Å
801	K	32.8	Very low	40.7	Very low	175 Å²	175	104.6 Å²	104.6	76%	0.761	56%	0.561	S	S	*	*			trans	-75.2	124.6	176.8	-80.7	-176.5	176.4	174.8	0	111.4	V803	K801-V803 PolarHBondContact O-N 3.28Å; K801-V803 VanDerWaalsContact O-N 3.09Å
802	F	29.6	Very low	38.4	Very low	192 Å²	192	107.1 Å²	107.1	84%	0.842	60%	0.596	S	S	*	*			trans	-60.3	109.5	168.4	-86.1	-99.8	0	0	0	110.1	T800 C804	T800-F802 PolarHBondContact O-N 3.42Å; F802-C804 PolarHBondContact O-N 3.37Å
803	V	28.7	Very low	36.5	Very low	130 Å²	130	113 Å²	113	79%	0.788	63%	0.632	S	S	*	*			trans	-87.5	93.3	165.3	-178.3	0	0	0	0	108.1	K801	K801-V803 PolarHBondContact O-N 3.28Å; K801-V803 VanDerWaalsContact O-N 3.09Å
804	C	27.2	Very low	34.7	Very low	106 Å²	106	112 Å²	112	72%	0.716	64%	0.639	S	S	*	*			trans	-98.9	83.7	164	52.5	0	0	0	0	109.1	F802	F802-C804 PolarHBondContact O-N 3.37Å
805	D	25.8	Very low	33.3	Very low	141 Å²	141	113.6 Å²	113.6	75%	0.754	66%	0.655	S	S	*	*	S	Bend	trans	176.2	171.2	144.8	-90.3	-27.1	0	0	0	111	D807	D805-D807 VanDerWaalsContact C-N 3.33Å; D805-D807 PolarHBondContact O-N 3.13Å; D805-D807 VanDerWaalsContact O-N 3.13Å
806	N	27.8	Very low	32.2	Very low	161 Å²	161	115.1 Å²	115.1	86%	0.861	67%	0.667	S	S	*	*			trans	-76.7	10.5	-158.1	-78.9	-45.1	0	0	0	117.8	L808	N806-L808 PolarHBondContact O-N 2.72Å
807	D	24.8	Very low	31.5	Very low	130 Å²	130	117.8 Å²	117.8	70%	0.695	68%	0.681	S	S	*	*			trans	-80.8	76.9	-173.6	-84.9	-53.6	0	0	0	113.8	D805 S809	D805-D807 VanDerWaalsContact C-N 3.33Å; D805-D807 PolarHBondContact O-N 3.13Å; D805-D807 VanDerWaalsContact O-N 3.13Å; D807-S809 PolarHBondContact O-N 2.93Å
808	L	27.9	Very low	30.9	Very low	184 Å²	184	116.4 Å²	116.4	96%	0.963	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	41	175.7	-151.8	82.6	0	0	0	113.2	N806	N806-L808 PolarHBondContact O-N 2.72Å
809	S	25.1	Very low	30.7	Very low	86 Å²	86	118.4 Å²	118.4	60%	0.601	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	-6.9	-165.8	59.4	0	0	0	0	115.1	D807	D807-S809 PolarHBondContact O-N 2.93Å
810	I	26.3	Very low	31.1	Very low	150 Å²	150	116.7 Å²	116.7	77%	0.769	67%	0.671	S	S	*	*			trans	-124.5	57.3	-173.3	-39.7	-177.8	0	0	0	112.8
811	M	26.8	Very low	32	Very low	135 Å²	135	114.5 Å²	114.5	67%	0.665	65%	0.652	S	S	*	*			trans	-142.4	92.9	159.8	-74.4	-156.8	75.9	0	0	111.4	V813	M811-V813 PolarHBondContact O-N 2.89Å
812	G	24.9	Very low	33.4	Very low	91 Å²	91	107.4 Å²	107.4	94%	0.938	62%	0.622	S	S	*	*			trans	-76.5	12.1	171.4	0	0	0	0	0	114.9
813	V	29.3	Very low	34.8	Very low	124 Å²	124	99.6 Å²	99.6	75%	0.752	59%	0.589	S	S	*	*	S	Bend	trans	-100	85.8	175.2	-175.2	0	0	0	0	107	M811	M811-V813 PolarHBondContact O-N 2.89Å
814	G	26.8	Very low	36.3	Very low	49 Å²	49	94.1 Å²	94.1	51%	0.505	56%	0.556	S	S	.	*			trans	-79.2	129.1	-165.7	0	0	0	0	0	114.3	E816	G814-E816 WeakPolarHBondContact O-CG 3.11Å; G814-E816 PolarHBondContact O-N 3.14Å
815	A	31.6	Very low	37.7	Very low	83 Å²	83	90.1 Å²	90.1	69%	0.686	53%	0.531	S	S	*	.	S	Bend	trans	48.9	5.8	135.4	0	0	0	0	0	122.4	K785	K785-A815 PolarHBondContact NZ-O 3.04Å
816	E	35.9	Very low	39.7	Very low	143 Å²	143	85 Å²	85	67%	0.668	50%	0.503	S	S	*	.			trans	-99	-10.1	-170.3	-72.8	179.5	161.2	0	0	115.4	G814	G814-E816 WeakPolarHBondContact O-CG 3.11Å; G814-E816 PolarHBondContact O-N 3.14Å
817	L	37.7	Very low	42.1	Very low	99 Å²	99	77.8 Å²	77.8	52%	0.518	46%	0.464	S	S	.	.			trans	-102.5	52.8	176.1	-74.7	164.5	0	0	0	111.7	I820	L817-I820 HydrophobicContact CB-CD1 4.38Å
818	A	38.5	Very low	44.6	Very low	20 Å²	20	73.2 Å²	73.2	17%	0.165	44%	0.438	C	S	.	.			trans	-86.9	-14.9	-171.1	0	0	0	0	0	114.6	K785 I788	K785-A818 HydrophobicContact CD-CB 4.01Å; I788-A818 WeakPolarHBondContact CD1-O 3.44Å
819	D	41.9	Very low	47.2	Very low	69 Å²	69	65 Å²	65	37%	0.369	40%	0.395	S	S	.	.			trans	-100.8	-8.3	-157.7	-52.3	-64.3	0	0	0	114.2	S759 E821	S759-D819 WeakPolarHBondContact CB-O 3.18Å; S759-D819 PolarHBondContact OG-O 3.5Å; D819-E821 PolarHBondContact O-N 3.05Å
820	I	49.7	Very low	50	Low	55 Å²	55	60.9 Å²	60.9	28%	0.282	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-52.9	128.2	-175.7	-54.5	171.8	0	0	0	112.6	L796 L817 I822	L796-I820 HydrophobicContact CB-CD1 4.34Å; L796-I820 HydrophobicContact CD1-CB 4.28Å; L796-I820 HydrophobicContact CD1-CD1 4.25Å; L796-I820 HydrophobicContact CD1-CG2 3.97Å; L796-I820 HydrophobicContact CD2-CG2 4.14Å; L817-I820 HydrophobicContact CB-CD1 4.38Å; I820-I822 PolarHBondContact O-N 3.1Å
821	E	53.5	Low	52.9	Low	82 Å²	82	54 Å²	54	38%	0.383	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-66.8	117.4	164.8	-78.5	-153.7	141.6	0	0	110.2	D819 D823 R1316	D819-E821 PolarHBondContact O-N 3.05Å; E821-D823 PolarHBondContact O-N 3.19Å; E821-R1316 IonicContact OE1-NH1 3.53Å; E821-R1316 PolarHBondContact OE1-NH1 2.98Å; E821-R1316 WeakPolarHBondContact OE2-CD 3.44Å; E821-R1316 IonicContact OE2-NH1 3.44Å
822	I	62.3	Low	55.8	Low	26 Å²	26	52 Å²	52	13%	0.133	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-65.8	127.5	-180	-60.1	157.1	0	0	0	110.3	I788 L792 I820 S824 L827 F843	I788-I822 HydrophobicContact CB-CD1 4.5Å; I788-I822 HydrophobicContact CD1-CD1 4.43Å; I788-I822 HydrophobicContact CD1-CG1 4.44Å; I788-I822 HydrophobicContact CG1-CD1 4.17Å; I788-I822 HydrophobicContact CG2-CD1 3.88Å; I788-I822 HydrophobicContact CG2-CG1 4.18Å; L792-I822 HydrophobicContact CD1-CD1 4.03Å; L792-I822 HydrophobicContact CD1-CG1 4.41Å; L792-I822 HydrophobicContact CD1-CG2 3.83Å; I820-I822 PolarHBondContact O-N 3.1Å; I822-S824 PolarHBondContact O-N 2.8Å; I822-L827 HydrophobicContact CG2-CD2 3.85Å; I822-L827 HydrophobicContact CG2-CG 4.1Å; I822-F843 HydrophobicContact CD1-CE1 3.8Å; I822-F843 HydrophobicContact CD1-CE2 3.96Å; I822-F843 HydrophobicContact CD1-CZ 3.4Å; I822-F843 VanDerWaalsContact CD1-CZ 3.4Å
823	D	58.2	Low	58.7	Low	28 Å²	28	50.9 Å²	50.9	15%	0.15	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-60.7	133.1	174.1	-171.4	-13	0	0	0	111.2	E821 A825 D826 L827 T1313 G1314 T1315	E821-D823 PolarHBondContact O-N 3.19Å; D823-A825 PolarHBondContact O-N 2.9Å; D823-A825 WeakPolarHBondContact OD1-CB 3.25Å; D823-A825 PolarHBondContact OD1-N 3.31Å; D823-D826 PolarHBondContact O-N 3.35Å; D823-L827 PolarHBondContact O-N 2.96Å; D823-T1313 WeakPolarHBondContact OD2-CA 3.28Å; D823-G1314 VanDerWaalsContact CG-N 3.33Å; D823-G1314 WeakPolarHBondContact OD1-CA 3.43Å; D823-G1314 PolarHBondContact OD1-N 3.02Å; D823-G1314 PolarHBondContact OD2-N 3.11Å; D823-T1315 PolarHBondContact OD1-N 3.02Å
824	S	60.4	Low	61.5	Low	15 Å²	15	45 Å²	45	11%	0.105	27%	0.267	C	S	.	.	H	α-helix	trans	-55.4	-30	172.6	86.4	0	0	0	0	112.3	S557 V558 T559 I822 D826 G1314	S557-S824 WeakPolarHBondContact O-CB 3.42Å; V558-S824 WeakPolarHBondContact CG2-O 3.28Å; T559-S824 PolarHBondContact N-OG 2.81Å; T559-S824 PolarHBondContact OG1-OG 3.49Å; I822-S824 PolarHBondContact O-N 2.8Å; S824-D826 VanDerWaalsContact C-N 3.34Å; S824-D826 PolarHBondContact O-N 2.87Å; S824-G1314 WeakPolarHBondContact CB-O 3.28Å; S824-G1314 PolarHBondContact OG-O 3.36Å
825	A	57.4	Low	64.4	Low	22 Å²	22	46.2 Å²	46.2	18%	0.182	26%	0.262	C	S	.	.	H	α-helix	trans	-66	-31.6	176.2	0	0	0	0	0	113.5	D823 R828 K1312	D823-A825 PolarHBondContact O-N 2.9Å; D823-A825 WeakPolarHBondContact OD1-CB 3.25Å; D823-A825 PolarHBondContact OD1-N 3.31Å; A825-R828 VanDerWaalsContact O-CB 3.29Å; A825-R828 WeakPolarHBondContact O-CB 3.08Å; A825-K1312 VanDerWaalsContact CB-O 3.26Å; A825-K1312 WeakPolarHBondContact CB-O 3.39Å
826	D	67.7	Low	67	Low	33 Å²	33	43.3 Å²	43.3	18%	0.176	24%	0.235	C	C	.	.	H	α-helix	trans	-83	-31	-177.9	-91.7	-39.1	0	0	0	113.1	L792 R795 D823 S824 R828 C829	L792-D826 HydrophobicContact CD2-CB 3.92Å; R795-D826 WeakPolarHBondContact CD-OD1 3.37Å; R795-D826 IonicContact CZ-OD1 3.78Å; R795-D826 IonicContact NE-OD1 3.13Å; R795-D826 IonicContact NH1-OD1 2.67Å; R795-D826 PolarHBondContact NH1-OD1 3.31Å; D823-D826 PolarHBondContact O-N 3.35Å; S824-D826 VanDerWaalsContact C-N 3.34Å; S824-D826 PolarHBondContact O-N 2.87Å; D826-R828 PolarHBondContact O-N 3.11Å; D826-C829 PolarHBondContact O-N 3.48Å; D826-C829 PolarHBondContact O-SG 2.83Å
827	L	77.2	Confident	69.5	Low	9 Å²	9	36.5 Å²	36.5	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-53	-29.5	174.5	-67.2	177.1	0	0	0	112.8	K556 V558 I569 L792 I822 D823 C829 L830 F843	K556-L827 HydrophobicContact CB-CD1 4.28Å; V558-L827 HydrophobicContact CG2-CB 4.24Å; I569-L827 HydrophobicContact CD1-CB 4.01Å; I569-L827 HydrophobicContact CD1-CD1 4.39Å; L792-L827 HydrophobicContact CD1-CD2 4.24Å; I822-L827 HydrophobicContact CG2-CD2 3.85Å; I822-L827 HydrophobicContact CG2-CG 4.1Å; D823-L827 PolarHBondContact O-N 2.96Å; L827-C829 VanDerWaalsContact C-N 3.27Å; L827-C829 PolarHBondContact O-N 3.33Å; L827-L830 HydrophobicContact CD2-CD1 4.07Å; L827-L830 WeakPolarHBondContact O-CB 3.17Å; L827-L830 PolarHBondContact O-N 3.11Å; L827-F843 HydrophobicContact CD2-CE1 4.13Å
828	R	78.2	Confident	71.9	Confident	34 Å²	34	37.1 Å²	37.1	13%	0.128	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-51.6	-39.7	171.2	176.3	-169.8	-76.1	-107.9	-4.7	113.6	V558 D602 A825 D826 L830 F831	V558-R828 HydrophobicContact CG1-CB 4.45Å; D602-R828 VanDerWaalsContact CG-NH2 3.35Å; D602-R828 IonicContact OD1-CZ 3.62Å; D602-R828 IonicContact OD1-NH1 2.78Å; D602-R828 PolarHBondContact OD1-NH1 3.15Å; D602-R828 IonicContact OD1-NH2 2.74Å; D602-R828 PolarHBondContact OD1-NH2 2.79Å; D602-R828 IonicContact OD2-CZ 3.5Å; D602-R828 IonicContact OD2-NH1 2.92Å; D602-R828 PolarHBondContact OD2-NH1 2.73Å; D602-R828 IonicContact OD2-NH2 3.64Å; D602-R828 PolarHBondContact OD2-NH2 3.25Å; A825-R828 VanDerWaalsContact O-CB 3.29Å; A825-R828 WeakPolarHBondContact O-CB 3.08Å; D826-R828 PolarHBondContact O-N 3.11Å; R828-L830 PolarHBondContact O-N 3.19Å; R828-F831 PolarHBondContact O-N 3.29Å
829	C	81.4	Confident	74.2	Confident	11 Å²	11	39.2 Å²	39.2	7%	0.074	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-68.1	-18.2	-174.4	82.8	0	0	0	0	112.4	D826 L827 F831 S832	D826-C829 PolarHBondContact O-N 3.48Å; D826-C829 PolarHBondContact O-SG 2.83Å; L827-C829 VanDerWaalsContact C-N 3.27Å; L827-C829 PolarHBondContact O-N 3.33Å; C829-F831 PolarHBondContact O-N 3.12Å; C829-S832 VanDerWaalsContact O-CB 3.31Å; C829-S832 WeakPolarHBondContact O-CB 3.19Å; C829-S832 PolarHBondContact O-N 3.19Å; C829-S832 VanDerWaalsContact O-N 3.17Å; C829-S832 PolarHBondContact O-OG 2.79Å
830	L	84.3	Confident	76.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-68.8	-19.5	179.3	-59	170.5	0	0	0	112.9	P789 I791 L792 L827 R828 S832 L836 V837 L840	P789-L830 HydrophobicContact CB-CD2 4.13Å; P789-L830 HydrophobicContact CG-CD1 4.38Å; I791-L830 HydrophobicContact CG2-CD2 3.55Å; L792-L830 HydrophobicContact CD1-CD1 4.13Å; L827-L830 HydrophobicContact CD2-CD1 4.07Å; L827-L830 WeakPolarHBondContact O-CB 3.17Å; L827-L830 PolarHBondContact O-N 3.11Å; R828-L830 PolarHBondContact O-N 3.19Å; L830-S832 PolarHBondContact O-N 3.45Å; L830-L836 HydrophobicContact CB-CB 4.46Å; L830-L836 HydrophobicContact CD2-CB 4.24Å; L830-L836 HydrophobicContact CD2-CD2 4.43Å; L830-L836 CarbonylContact O-C 3.54Å; L830-L836 VanDerWaalsContact O-C 3.25Å; L830-L836 VanDerWaalsContact O-CB 3.22Å; L830-L836 WeakPolarHBondContact O-CB 3.41Å; L830-V837 WeakPolarHBondContact O-CG2 3.49Å; L830-V837 PolarHBondContact O-N 3.04Å; L830-L840 HydrophobicContact CB-CB 4.11Å; L830-L840 HydrophobicContact CB-CD2 4.41Å; L830-L840 HydrophobicContact CD1-CB 3.91Å; L830-L840 HydrophobicContact CD1-CD1 3.93Å; L830-L840 HydrophobicContact CD1-CG 4.37Å
831	F	87.5	Confident	78.2	Confident	7 Å²	7	33.3 Å²	33.3	3%	0.031	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-77.2	1.3	173.2	-69.7	-85.9	0	0	0	114.2	I569 L597 A598 P599 A603 L605 P606 R828 C829 V837 L840	I569-F831 HydrophobicContact CB-CE2 4.24Å; I569-F831 HydrophobicContact CB-CZ 4.21Å; I569-F831 HydrophobicContact CD1-CE2 3.94Å; I569-F831 HydrophobicContact CD1-CZ 4.48Å; I569-F831 HydrophobicContact CG2-CE2 4.44Å; L597-F831 HydrophobicContact CD2-CZ 4.49Å; A598-F831 WeakPolarHBondContact O-CZ 3.39Å; P599-F831 HydrophobicContact CB-CD1 4.16Å; P599-F831 HydrophobicContact CB-CE1 4.33Å; A603-F831 HydrophobicContact CB-CB 4.47Å; L605-F831 HydrophobicContact CD2-CD1 4.27Å; L605-F831 HydrophobicContact CD2-CE1 4.41Å; P606-F831 WeakPolarHBondContact CD-O 3.36Å; P606-F831 WeakPolarHBondContact CG-O 3.33Å; R828-F831 PolarHBondContact O-N 3.29Å; C829-F831 PolarHBondContact O-N 3.12Å; F831-V837 HydrophobicContact CD1-CG2 4.21Å; F831-L840 HydrophobicContact CE1-CD2 4.48Å; F831-L840 HydrophobicContact CE2-CD2 3.76Å; F831-L840 HydrophobicContact CZ-CD2 3.75Å
832	S	86.8	Confident	79.7	Confident	91 Å²	91	31.7 Å²	31.7	64%	0.636	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-74.9	-27.3	-173.4	-49.9	0	0	0	0	114.7	C829 L830	C829-S832 VanDerWaalsContact O-CB 3.31Å; C829-S832 WeakPolarHBondContact O-CB 3.19Å; C829-S832 PolarHBondContact O-N 3.19Å; C829-S832 VanDerWaalsContact O-N 3.17Å; C829-S832 PolarHBondContact O-OG 2.79Å; L830-S832 PolarHBondContact O-N 3.45Å
833	N	87.5	Confident	80.8	Confident	69 Å²	69	30.6 Å²	30.6	37%	0.369	16%	0.162	S	C	.	.	S	Bend	trans	-148.9	167.6	171.6	80.9	17.7	0	0	0	110.8	D835 L836 V837	N833-D835 VanDerWaalsContact C-N 3.28Å; N833-D835 PolarHBondContact O-N 2.91Å; N833-D835 PolarHBondContact OD1-N 3.25Å; N833-L836 WeakPolarHBondContact OD1-CG 3.26Å; N833-L836 PolarHBondContact OD1-N 2.92Å; N833-V837 WeakPolarHBondContact O-CG2 3.4Å; N833-V837 PolarHBondContact O-N 2.97Å; N833-V837 VanDerWaalsContact O-N 3.15Å
834	S	87.1	Confident	82.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-35.1	-177	66	0	0	0	0	114.1	D608 K612 Y616 V837 R838	D608-S834 PolarHBondContact OD2-OG 3.49Å; K612-S834 WeakPolarHBondContact CD-OG 3.35Å; K612-S834 PolarHBondContact NZ-OG 3.07Å; Y616-S834 WeakPolarHBondContact CE2-O 3.45Å; Y616-S834 WeakPolarHBondContact OH-CB 3.39Å; Y616-S834 PolarHBondContact OH-O 3.04Å; Y616-S834 PolarHBondContact OH-OG 2.75Å; S834-V837 CarbonylContact O-C 3.57Å; S834-V837 WeakPolarHBondContact O-CB 3.44Å; S834-V837 PolarHBondContact O-N 3.47Å; S834-R838 PolarHBondContact O-N 2.84Å
835	D	86.8	Confident	83.5	Confident	75 Å²	75	28.5 Å²	28.5	40%	0.401	15%	0.15	S	C	.	.	H	α-helix	trans	-83.1	-25.1	-168.5	-51.1	-47.5	0	0	0	110.7	K612 Y616 N833 R838 Q839	K612-D835 IonicContact NZ-OD1 2.67Å; K612-D835 IonicContact NZ-OD2 2.74Å; K612-D835 PolarHBondContact NZ-OD2 2.77Å; Y616-D835 PolarHBondContact OH-OD1 3.44Å; N833-D835 VanDerWaalsContact C-N 3.28Å; N833-D835 PolarHBondContact O-N 2.91Å; N833-D835 PolarHBondContact OD1-N 3.25Å; D835-R838 WeakPolarHBondContact O-CB 3.32Å; D835-Q839 WeakPolarHBondContact O-CG 3.43Å; D835-Q839 PolarHBondContact O-N 2.72Å; D835-Q839 VanDerWaalsContact O-N 3.13Å
836	L	88.1	Confident	84.9	Confident	21 Å²	21	27.9 Å²	27.9	11%	0.11	14%	0.144	C	C	.	.	H	α-helix	trans	-74.8	-35.5	163.8	-64.6	-178.6	0	0	0	112.2	I791 L830 N833 R838 Q839 L840	I791-L836 HydrophobicContact CB-CD2 4.28Å; I791-L836 HydrophobicContact CD1-CD1 3.76Å; I791-L836 HydrophobicContact CD1-CD2 4.15Å; I791-L836 HydrophobicContact CG2-CD2 3.87Å; L830-L836 HydrophobicContact CB-CB 4.46Å; L830-L836 HydrophobicContact CD2-CB 4.24Å; L830-L836 HydrophobicContact CD2-CD2 4.43Å; L830-L836 CarbonylContact O-C 3.54Å; L830-L836 VanDerWaalsContact O-C 3.25Å; L830-L836 VanDerWaalsContact O-CB 3.22Å; L830-L836 WeakPolarHBondContact O-CB 3.41Å; N833-L836 WeakPolarHBondContact OD1-CG 3.26Å; N833-L836 PolarHBondContact OD1-N 2.92Å; L836-R838 PolarHBondContact O-N 3Å; L836-Q839 WeakPolarHBondContact O-CB 3.28Å; L836-Q839 PolarHBondContact O-N 3.25Å; L836-Q839 VanDerWaalsContact O-N 3.12Å; L836-L840 PolarHBondContact O-N 2.94Å
837	V	88.5	Confident	85.9	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-62.6	-36.3	169.3	173.7	0	0	0	0	110.3	L597 P606 L609 L830 F831 N833 S834 L840 I841	L597-V837 HydrophobicContact CD1-CG1 4.25Å; P606-V837 HydrophobicContact CG-CG2 4Å; L609-V837 HydrophobicContact CD1-CB 4.16Å; L609-V837 HydrophobicContact CD1-CG1 3.8Å; L609-V837 HydrophobicContact CD2-CG1 3.98Å; L609-V837 HydrophobicContact CD2-CG2 4.48Å; L830-V837 WeakPolarHBondContact O-CG2 3.49Å; L830-V837 PolarHBondContact O-N 3.04Å; F831-V837 HydrophobicContact CD1-CG2 4.21Å; N833-V837 WeakPolarHBondContact O-CG2 3.4Å; N833-V837 PolarHBondContact O-N 2.97Å; N833-V837 VanDerWaalsContact O-N 3.15Å; S834-V837 CarbonylContact O-C 3.57Å; S834-V837 WeakPolarHBondContact O-CB 3.44Å; S834-V837 PolarHBondContact O-N 3.47Å; V837-L840 WeakPolarHBondContact O-CB 3.32Å; V837-L840 PolarHBondContact O-N 2.9Å; V837-I841 HydrophobicContact CG1-CD1 4.34Å; V837-I841 WeakPolarHBondContact O-CG1 3.45Å; V837-I841 PolarHBondContact O-N 2.93Å
838	R	87.2	Confident	86.5	Confident	112 Å²	112	25.9 Å²	25.9	42%	0.423	13%	0.133	S	C	.	.	H	α-helix	trans	-60.7	-45.5	169.8	-173.5	-168.2	166.4	137.6	4.3	112.1	Y616 S834 D835 L836 L840 I841 D842	Y616-R838 HydrophobicContact CD1-CB 4.33Å; Y616-R838 HydrophobicContact CD1-CG 4.03Å; Y616-R838 HydrophobicContact CD2-CB 4.11Å; Y616-R838 HydrophobicContact CD2-CG 4.48Å; Y616-R838 HydrophobicContact CE1-CB 4.12Å; Y616-R838 HydrophobicContact CE1-CG 4.15Å; Y616-R838 HydrophobicContact CE2-CB 3.9Å; Y616-R838 HydrophobicContact CG-CB 4.32Å; Y616-R838 HydrophobicContact CG-CG 4.19Å; S834-R838 PolarHBondContact O-N 2.84Å; D835-R838 WeakPolarHBondContact O-CB 3.32Å; L836-R838 PolarHBondContact O-N 3Å; R838-L840 PolarHBondContact O-N 3.01Å; R838-I841 WeakPolarHBondContact O-CB 3.36Å; R838-I841 PolarHBondContact O-N 2.9Å; R838-I841 VanDerWaalsContact O-N 3.07Å; R838-D842 IonicContact CZ-OD2 3.45Å; R838-D842 IonicContact NE-OD2 3.32Å; R838-D842 PolarHBondContact NE-OD2 3.04Å; R838-D842 VanDerWaalsContact NE-OD2 3.14Å; R838-D842 IonicContact NH2-OD2 3.01Å; R838-D842 PolarHBondContact O-N 3.13Å
839	Q	86.3	Confident	87	Confident	63 Å²	63	24.9 Å²	24.9	29%	0.294	13%	0.13	S	C	.	.	H	α-helix	trans	-60.4	-34.6	175.3	-67.9	173	24.5	0	0	112.1	P789 D835 L836 F843	P789-Q839 HydrophobicContact CB-CB 3.96Å; P789-Q839 HydrophobicContact CG-CB 4.12Å; D835-Q839 WeakPolarHBondContact O-CG 3.43Å; D835-Q839 PolarHBondContact O-N 2.72Å; D835-Q839 VanDerWaalsContact O-N 3.13Å; L836-Q839 WeakPolarHBondContact O-CB 3.28Å; L836-Q839 PolarHBondContact O-N 3.25Å; L836-Q839 VanDerWaalsContact O-N 3.12Å; Q839-F843 WeakPolarHBondContact O-CB 3.19Å; Q839-F843 PolarHBondContact O-N 2.77Å
840	L	87.2	Confident	87.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.3	-41	171.5	179.7	59.1	0	0	0	112.5	I569 L597 L830 F831 L836 V837 R838 F843 C844	I569-L840 HydrophobicContact CD1-CD2 4.36Å; L597-L840 HydrophobicContact CD2-CD2 3.76Å; L597-L840 HydrophobicContact CD2-CG 4.09Å; L830-L840 HydrophobicContact CB-CB 4.11Å; L830-L840 HydrophobicContact CB-CD2 4.41Å; L830-L840 HydrophobicContact CD1-CB 3.91Å; L830-L840 HydrophobicContact CD1-CD1 3.93Å; L830-L840 HydrophobicContact CD1-CG 4.37Å; F831-L840 HydrophobicContact CE1-CD2 4.48Å; F831-L840 HydrophobicContact CE2-CD2 3.76Å; F831-L840 HydrophobicContact CZ-CD2 3.75Å; L836-L840 PolarHBondContact O-N 2.94Å; V837-L840 WeakPolarHBondContact O-CB 3.32Å; V837-L840 PolarHBondContact O-N 2.9Å; R838-L840 PolarHBondContact O-N 3.01Å; L840-F843 HydrophobicContact CD1-CD1 4.48Å; L840-C844 WeakPolarHBondContact O-CB 3.49Å; L840-C844 PolarHBondContact O-N 2.9Å; L840-C844 PolarHBondContact O-SG 2.84Å
841	I	88.6	Confident	87.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-55.6	173.9	-69.6	165.2	0	0	0	110.2	L595 L597 L613 Y616 V658 V837 R838 F843 C844 L845	L595-I841 HydrophobicContact CD2-CB 3.99Å; L595-I841 HydrophobicContact CD2-CG1 3.83Å; L595-I841 HydrophobicContact CD2-CG2 3.86Å; L597-I841 HydrophobicContact CD1-CD1 4.11Å; L597-I841 HydrophobicContact CD1-CG1 3.48Å; L597-I841 VanDerWaalsContact CD1-CG1 3.48Å; L613-I841 HydrophobicContact CD1-CD1 4.46Å; Y616-I841 HydrophobicContact CD2-CD1 4.08Å; Y616-I841 HydrophobicContact CG-CD1 4.48Å; V658-I841 HydrophobicContact CG1-CD1 3.96Å; V658-I841 HydrophobicContact CG1-CG1 4.12Å; V658-I841 HydrophobicContact CG2-CD1 4.42Å; V658-I841 HydrophobicContact CG2-CG2 3.95Å; V837-I841 HydrophobicContact CG1-CD1 4.34Å; V837-I841 WeakPolarHBondContact O-CG1 3.45Å; V837-I841 PolarHBondContact O-N 2.93Å; R838-I841 WeakPolarHBondContact O-CB 3.36Å; R838-I841 PolarHBondContact O-N 2.9Å; R838-I841 VanDerWaalsContact O-N 3.07Å; I841-F843 VanDerWaalsContact C-N 3.32Å; I841-F843 PolarHBondContact O-N 3.18Å; I841-C844 PolarHBondContact O-N 3.06Å; I841-L845 HydrophobicContact CG2-CD1 3.98Å; I841-L845 WeakPolarHBondContact O-CG 3.24Å; I841-L845 PolarHBondContact O-N 3.17Å; I841-L845 VanDerWaalsContact O-N 3.09Å
842	D	85.2	Confident	87.9	Confident	48 Å²	48	24.6 Å²	24.6	26%	0.257	13%	0.128	S	C	.	.	H	α-helix	trans	-62.5	-40.3	-175.8	-68	-25.9	0	0	0	110.2	R838 S846	R838-D842 IonicContact CZ-OD2 3.45Å; R838-D842 IonicContact NE-OD2 3.32Å; R838-D842 PolarHBondContact NE-OD2 3.04Å; R838-D842 VanDerWaalsContact NE-OD2 3.14Å; R838-D842 IonicContact NH2-OD2 3.01Å; R838-D842 PolarHBondContact O-N 3.13Å; D842-S846 WeakPolarHBondContact O-CB 3.3Å; D842-S846 PolarHBondContact O-N 3.36Å
843	F	85.5	Confident	87.9	Confident	3 Å²	3	21.6 Å²	21.6	1%	0.013	10%	0.103	C	C	.	.	H	α-helix	trans	-63.2	-45.5	173	172.9	-126.8	0	0	0	113.5	K556 Q787 P789 I822 L827 Q839 L840 I841 L845 S846 D847	K556-F843 HydrophobicContact CD-CE1 4.47Å; Q787-F843 WeakPolarHBondContact O-CD2 3.31Å; P789-F843 HydrophobicContact CG-CB 3.93Å; P789-F843 HydrophobicContact CG-CG 4.25Å; I822-F843 HydrophobicContact CD1-CE1 3.8Å; I822-F843 HydrophobicContact CD1-CE2 3.96Å; I822-F843 HydrophobicContact CD1-CZ 3.4Å; I822-F843 VanDerWaalsContact CD1-CZ 3.4Å; L827-F843 HydrophobicContact CD2-CE1 4.13Å; Q839-F843 WeakPolarHBondContact O-CB 3.19Å; Q839-F843 PolarHBondContact O-N 2.77Å; L840-F843 HydrophobicContact CD1-CD1 4.48Å; I841-F843 VanDerWaalsContact C-N 3.32Å; I841-F843 PolarHBondContact O-N 3.18Å; F843-L845 VanDerWaalsContact C-N 3.33Å; F843-L845 PolarHBondContact O-N 2.69Å; F843-S846 PolarHBondContact O-N 2.96Å; F843-D847 WeakPolarHBondContact CE2-OD1 3.43Å; F843-D847 WeakPolarHBondContact CE2-OD2 3.49Å; F843-D847 WeakPolarHBondContact CZ-OD2 3.4Å; F843-D847 PolarHBondContact O-N 3.32Å
844	C	88.3	Confident	88	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.7	-38.1	-179.6	-70.4	0	0	0	0	112.4	N554 S570 L595 L840 I841 A848	N554-C844 PolarHBondContact ND2-O 2.94Å; S570-C844 PolarHBondContact OG-SG 3.45Å; L595-C844 HydrophobicContact CD1-CB 3.97Å; L595-C844 HydrophobicContact CD2-CB 4.38Å; L840-C844 WeakPolarHBondContact O-CB 3.49Å; L840-C844 PolarHBondContact O-N 2.9Å; L840-C844 PolarHBondContact O-SG 2.84Å; I841-C844 PolarHBondContact O-N 3.06Å; C844-A848 PolarHBondContact O-N 2.71Å
845	L	87.7	Confident	88.2	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-76.1	-34.4	177.3	-63.9	172.3	0	0	0	111.9	L574 H593 L595 Y620 I841 F843 A848 H849	L574-L845 HydrophobicContact CD2-CD2 4.02Å; H593-L845 HydrophobicContact CB-CD2 4.3Å; L595-L845 HydrophobicContact CB-CD2 4.42Å; Y620-L845 HydrophobicContact CD1-CB 4.11Å; Y620-L845 HydrophobicContact CD1-CD1 4.5Å; Y620-L845 HydrophobicContact CD2-CB 3.87Å; Y620-L845 HydrophobicContact CD2-CD1 3.68Å; Y620-L845 HydrophobicContact CD2-CG 4.43Å; Y620-L845 HydrophobicContact CE1-CB 3.95Å; Y620-L845 HydrophobicContact CE2-CB 3.69Å; Y620-L845 HydrophobicContact CE2-CD1 4.34Å; Y620-L845 HydrophobicContact CG-CB 4.08Å; Y620-L845 HydrophobicContact CG-CD1 3.79Å; I841-L845 HydrophobicContact CG2-CD1 3.98Å; I841-L845 WeakPolarHBondContact O-CG 3.24Å; I841-L845 PolarHBondContact O-N 3.17Å; I841-L845 VanDerWaalsContact O-N 3.09Å; F843-L845 VanDerWaalsContact C-N 3.33Å; F843-L845 PolarHBondContact O-N 2.69Å; L845-A848 PolarHBondContact O-N 3.28Å; L845-H849 WeakPolarHBondContact O-CB 3.41Å; L845-H849 PolarHBondContact O-N 3.26Å
846	S	86.2	Confident	88.2	Confident	8 Å²	8	16.7 Å²	16.7	6%	0.056	8%	0.076	C	C	.	.	H	α-helix	trans	-65.3	-46.9	175.6	-162.1	0	0	0	0	112.2	Y620 Q787 D842 F843 A848 H849 L850	Y620-S846 WeakPolarHBondContact OH-CA 3.31Å; Y620-S846 PolarHBondContact OH-N 2.62Å; Q787-S846 PolarHBondContact OE1-OG 2.92Å; D842-S846 WeakPolarHBondContact O-CB 3.3Å; D842-S846 PolarHBondContact O-N 3.36Å; F843-S846 PolarHBondContact O-N 2.96Å; S846-A848 VanDerWaalsContact C-N 3.35Å; S846-A848 PolarHBondContact O-N 3.46Å; S846-H849 WeakPolarHBondContact O-CB 3.25Å; S846-H849 PolarHBondContact O-N 3.29Å; S846-H849 VanDerWaalsContact O-N 3.12Å; S846-L850 WeakPolarHBondContact O-CG 3.27Å; S846-L850 PolarHBondContact O-N 3.42Å
847	D	87.7	Confident	88.1	Confident	0 Å²	0	20 Å²	20	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.8	-42.2	174	-97	12.6	0	0	0	111.7	N554 K556 L758 R786 F843 H849 L850 V851	N554-D847 WeakPolarHBondContact ND2-CB 3.39Å; K556-D847 WeakPolarHBondContact CE-OD2 3.43Å; K556-D847 IonicContact NZ-OD2 3.17Å; K556-D847 PolarHBondContact NZ-OD2 3.06Å; L758-D847 HydrophobicContact CD2-CB 4.09Å; R786-D847 IonicContact CZ-OD1 3.88Å; R786-D847 IonicContact CZ-OD2 2.66Å; R786-D847 IonicContact NE-OD1 2.71Å; R786-D847 PolarHBondContact NE-OD1 3.46Å; R786-D847 IonicContact NE-OD2 3.06Å; R786-D847 IonicContact NH2-OD1 2.73Å; R786-D847 PolarHBondContact NH2-OD1 3.02Å; R786-D847 IonicContact NH2-OD2 2.7Å; R786-D847 PolarHBondContact NH2-OD2 2.82Å; F843-D847 WeakPolarHBondContact CE2-OD1 3.43Å; F843-D847 WeakPolarHBondContact CE2-OD2 3.49Å; F843-D847 WeakPolarHBondContact CZ-OD2 3.4Å; F843-D847 PolarHBondContact O-N 3.32Å; D847-H849 VanDerWaalsContact C-N 3.3Å; D847-H849 PolarHBondContact O-N 3.28Å; D847-L850 PolarHBondContact O-N 3.38Å; D847-V851 WeakPolarHBondContact O-CG2 3.47Å; D847-V851 PolarHBondContact O-N 3.05Å; D847-V851 VanDerWaalsContact O-N 3.11Å
848	A	90.2	Very high	88	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64.6	-34.1	175.9	0	0	0	0	0	112.3	N554 L574 C844 L845 S846 L852	N554-A848 HydrophobicContact CB-CB 3.88Å; L574-A848 HydrophobicContact CD1-CB 4.06Å; L574-A848 HydrophobicContact CG-CB 3.93Å; C844-A848 PolarHBondContact O-N 2.71Å; L845-A848 PolarHBondContact O-N 3.28Å; S846-A848 VanDerWaalsContact C-N 3.35Å; S846-A848 PolarHBondContact O-N 3.46Å; A848-L852 WeakPolarHBondContact O-CB 3.46Å; A848-L852 PolarHBondContact O-N 2.96Å; A848-L852 VanDerWaalsContact O-N 3.12Å
849	H	89.3	Confident	88.1	Confident	13 Å²	13	18.8 Å²	18.8	6%	0.06	9%	0.09	C	C	.	.	H	α-helix	trans	-69.8	-36.9	175.6	-172.6	64.7	0	0	0	112.4	L574 F590 L845 S846 D847 L852 R853	L574-H849 VanDerWaalsContact CD1-CA 3.47Å; L574-H849 HydrophobicContact CD1-CB 3.75Å; F590-H849 AromaticContact CE1-ND1 3.67Å; L845-H849 WeakPolarHBondContact O-CB 3.41Å; L845-H849 PolarHBondContact O-N 3.26Å; S846-H849 WeakPolarHBondContact O-CB 3.25Å; S846-H849 PolarHBondContact O-N 3.29Å; S846-H849 VanDerWaalsContact O-N 3.12Å; D847-H849 VanDerWaalsContact C-N 3.3Å; D847-H849 PolarHBondContact O-N 3.28Å; H849-L852 PolarHBondContact O-N 3.01Å; H849-R853 WeakPolarHBondContact NE2-CD 3.5Å; H849-R853 WeakPolarHBondContact O-CB 3.48Å; H849-R853 WeakPolarHBondContact O-CG 3.42Å; H849-R853 PolarHBondContact O-N 3.4Å
850	L	88.7	Confident	88.3	Confident	10 Å²	10	16 Å²	16	5%	0.052	8%	0.078	C	C	.	.	H	α-helix	trans	-64.1	-45.7	173.7	-69.2	175.2	0	0	0	111.7	L758 A762 L766 R786 S846 D847 L852 R853 L854	L758-L850 HydrophobicContact CD1-CB 4.29Å; A762-L850 HydrophobicContact CB-CD1 4.33Å; A762-L850 HydrophobicContact CB-CD2 4.18Å; L766-L850 HydrophobicContact CD1-CD2 4.07Å; R786-L850 HydrophobicContact CB-CD1 4.14Å; R786-L850 HydrophobicContact CG-CD1 4.01Å; S846-L850 WeakPolarHBondContact O-CG 3.27Å; S846-L850 PolarHBondContact O-N 3.42Å; D847-L850 PolarHBondContact O-N 3.38Å; L850-L852 VanDerWaalsContact C-N 3.33Å; L850-L852 PolarHBondContact O-N 2.94Å; L850-R853 PolarHBondContact O-N 3.44Å; L850-L854 WeakPolarHBondContact O-CB 3.28Å; L850-L854 WeakPolarHBondContact O-CG 3.27Å; L850-L854 PolarHBondContact O-N 3.15Å
851	V	91.5	Very high	88.5	Confident	2 Å²	2	16.2 Å²	16.2	1%	0.012	8%	0.079	C	C	.	.	H	α-helix	trans	-55.2	-48.3	174.2	168.4	0	0	0	0	111.4	I684 H686 T743 L758 D847 L854 C855	I684-V851 HydrophobicContact CG2-CG1 3.91Å; H686-V851 HydrophobicContact CB-CG2 3.86Å; T743-V851 HydrophobicContact CG2-CG1 4Å; L758-V851 HydrophobicContact CD1-CG2 3.7Å; L758-V851 HydrophobicContact CD2-CG2 4Å; D847-V851 WeakPolarHBondContact O-CG2 3.47Å; D847-V851 PolarHBondContact O-N 3.05Å; D847-V851 VanDerWaalsContact O-N 3.11Å; V851-L854 PolarHBondContact O-N 3.2Å; V851-C855 PolarHBondContact O-N 3.08Å
852	L	90.8	Very high	88.7	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.3	-47.7	178.5	-176.6	59.2	0	0	0	111.5	L550 A552 L574 L589 F590 I684 A848 H849 L850 L854 C855 H856	L550-L852 HydrophobicContact CD2-CD1 3.71Å; A552-L852 HydrophobicContact CB-CB 3.98Å; A552-L852 HydrophobicContact CB-CD1 4.19Å; A552-L852 HydrophobicContact CB-CG 4.49Å; L574-L852 HydrophobicContact CB-CD2 4.27Å; L574-L852 HydrophobicContact CD1-CD2 4.25Å; L589-L852 HydrophobicContact CB-CD2 4.04Å; L589-L852 HydrophobicContact CB-CG 4.45Å; F590-L852 HydrophobicContact CB-CD2 4.22Å; F590-L852 HydrophobicContact CD1-CD2 4.15Å; I684-L852 HydrophobicContact CD1-CD1 4.26Å; A848-L852 WeakPolarHBondContact O-CB 3.46Å; A848-L852 PolarHBondContact O-N 2.96Å; A848-L852 VanDerWaalsContact O-N 3.12Å; H849-L852 PolarHBondContact O-N 3.01Å; L850-L852 VanDerWaalsContact C-N 3.33Å; L850-L852 PolarHBondContact O-N 2.94Å; L852-L854 PolarHBondContact O-N 2.95Å; L852-C855 PolarHBondContact O-N 3.01Å; L852-H856 VanDerWaalsContact CD1-NE2 3.29Å; L852-H856 WeakPolarHBondContact CD1-NE2 3.23Å; L852-H856 PolarHBondContact O-CD2 3.19Å; L852-H856 PolarHBondContact O-N 3.04Å
853	R	87.8	Confident	89	Confident	29 Å²	29	15.4 Å²	15.4	11%	0.109	8%	0.075	C	C	.	.	H	α-helix	trans	-60.4	-41.9	176.7	-77.2	-179.2	67.4	143	4.6	113	L589 S625 L766 H849 L850 H856 Q857	L589-R853 HydrophobicContact CD1-CG 3.7Å; S625-R853 PolarHBondContact OG-NH1 3.13Å; L766-R853 HydrophobicContact CD1-CB 4.01Å; L766-R853 HydrophobicContact CD2-CB 4.27Å; H849-R853 WeakPolarHBondContact NE2-CD 3.5Å; H849-R853 WeakPolarHBondContact O-CB 3.48Å; H849-R853 WeakPolarHBondContact O-CG 3.42Å; H849-R853 PolarHBondContact O-N 3.4Å; L850-R853 PolarHBondContact O-N 3.44Å; R853-H856 PolarHBondContact O-N 2.71Å; R853-Q857 WeakPolarHBondContact O-CB 3.28Å; R853-Q857 PolarHBondContact O-N 3.4Å
854	L	89.6	Confident	89.4	Confident	3 Å²	3	15.6 Å²	15.6	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-61.5	-45.9	176.4	-76	169.9	0	0	0	111.5	T743 L758 L761 V765 L766 L850 V851 L852 H856 Q857 L858	T743-L854 HydrophobicContact CG2-CB 4.48Å; L758-L854 HydrophobicContact CD1-CD1 3.69Å; L761-L854 HydrophobicContact CB-CD1 4.17Å; L761-L854 HydrophobicContact CB-CD2 4.42Å; L761-L854 WeakPolarHBondContact O-CD2 3.46Å; V765-L854 HydrophobicContact CB-CD2 3.69Å; V765-L854 HydrophobicContact CG1-CD2 3.89Å; V765-L854 HydrophobicContact CG2-CD2 4.27Å; L766-L854 HydrophobicContact CD1-CD2 4.43Å; L766-L854 HydrophobicContact CD1-CG 4.44Å; L766-L854 HydrophobicContact CD2-CD2 4.27Å; L766-L854 HydrophobicContact CG-CD2 4.11Å; L850-L854 WeakPolarHBondContact O-CB 3.28Å; L850-L854 WeakPolarHBondContact O-CG 3.27Å; L850-L854 PolarHBondContact O-N 3.15Å; V851-L854 PolarHBondContact O-N 3.2Å; L852-L854 PolarHBondContact O-N 2.95Å; L854-H856 VanDerWaalsContact C-N 3.27Å; L854-H856 PolarHBondContact O-N 3.12Å; L854-Q857 PolarHBondContact O-N 3.43Å; L854-L858 WeakPolarHBondContact O-CB 3.27Å; L854-L858 VanDerWaalsContact O-CG 3.32Å; L854-L858 WeakPolarHBondContact O-CG 3.48Å; L854-L858 PolarHBondContact O-N 3.06Å
855	C	90.7	Very high	89.6	Confident	1 Å²	1	16.3 Å²	16.3	1%	0.007	8%	0.081	C	C	.	.	H	α-helix	trans	-59.6	-37.1	178.3	-170	0	0	0	0	112.8	I684 T743 V851 L852 Q859 V860	I684-C855 HydrophobicContact CD1-CB 4.27Å; I684-C855 HydrophobicContact CG2-CB 3.87Å; T743-C855 HydrophobicContact CG2-CB 4.03Å; V851-C855 PolarHBondContact O-N 3.08Å; L852-C855 PolarHBondContact O-N 3.01Å; C855-Q859 PolarHBondContact O-N 2.79Å; C855-V860 PolarHBondContact O-N 3.45Å; C855-V860 VanDerWaalsContact O-N 3.12Å
856	H	86.8	Confident	89.9	Confident	37 Å²	37	17.5 Å²	17.5	17%	0.171	9%	0.086	C	C	.	.	H	α-helix	trans	-77.4	-42.3	176.5	-67.7	-55.8	0	0	0	113.7	Y579 I585 L852 R853 L854 L858 Q859	Y579-H856 AromaticContact CE2-CE1 3.63Å; I585-H856 WeakPolarHBondContact CD1-CE1 3.44Å; L852-H856 VanDerWaalsContact CD1-NE2 3.29Å; L852-H856 WeakPolarHBondContact CD1-NE2 3.23Å; L852-H856 PolarHBondContact O-CD2 3.19Å; L852-H856 PolarHBondContact O-N 3.04Å; R853-H856 PolarHBondContact O-N 2.71Å; L854-H856 VanDerWaalsContact C-N 3.27Å; L854-H856 PolarHBondContact O-N 3.12Å; H856-L858 VanDerWaalsContact C-N 3.26Å; H856-L858 PolarHBondContact O-N 3.15Å; H856-Q859 PolarHBondContact O-N 3.32Å
857	Q	86.4	Confident	90.3	Very high	89 Å²	89	17.4 Å²	17.4	42%	0.416	9%	0.085	S	C	.	.	H	α-helix	trans	-64.2	-33.4	178.9	-172.3	64.5	17.1	0	0	111.8	V765 L766 R853 L854 Q859	V765-Q857 HydrophobicContact CG1-CB 4.12Å; V765-Q857 HydrophobicContact CG1-CG 3.7Å; L766-Q857 HydrophobicContact CD2-CB 3.91Å; L766-Q857 HydrophobicContact CD2-CG 4.09Å; R853-Q857 WeakPolarHBondContact O-CB 3.28Å; R853-Q857 PolarHBondContact O-N 3.4Å; L854-Q857 PolarHBondContact O-N 3.43Å; Q857-Q859 VanDerWaalsContact C-N 3.32Å
858	L	86.4	Confident	90.6	Very high	25 Å²	25	17.4 Å²	17.4	13%	0.131	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	1.3	173.9	-60.2	-178.1	0	0	0	113.8	A747 L750 V751 V765 L854 H856 V860	A747-L858 HydrophobicContact CB-CD1 4.2Å; L750-L858 HydrophobicContact CD1-CB 4.36Å; V751-L858 HydrophobicContact CG2-CD2 3.45Å; V751-L858 VanDerWaalsContact CG2-CD2 3.45Å; V765-L858 HydrophobicContact CG1-CD2 3.63Å; V765-L858 HydrophobicContact CG1-CG 4.08Å; V765-L858 HydrophobicContact CG2-CD2 4.28Å; L854-L858 WeakPolarHBondContact O-CB 3.27Å; L854-L858 VanDerWaalsContact O-CG 3.32Å; L854-L858 WeakPolarHBondContact O-CG 3.48Å; L854-L858 PolarHBondContact O-N 3.06Å; H856-L858 VanDerWaalsContact C-N 3.26Å; H856-L858 PolarHBondContact O-N 3.15Å; L858-V860 HydrophobicContact CB-CG2 3.76Å; L858-V860 PolarHBondContact O-N 3.26Å; L858-V860 VanDerWaalsContact O-N 3.08Å
859	Q	88.5	Confident	90.8	Very high	63 Å²	63	19.6 Å²	19.6	29%	0.294	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	34.8	-178.4	-54.8	-163.3	-98.1	0	0	114.9	C855 H856 Q857 L861 P862 L863 T1071	C855-Q859 PolarHBondContact O-N 2.79Å; H856-Q859 PolarHBondContact O-N 3.32Å; Q857-Q859 VanDerWaalsContact C-N 3.32Å; Q859-L861 PolarHBondContact O-N 3.13Å; Q859-P862 WeakPolarHBondContact O-CD 3.47Å; Q859-L863 VanDerWaalsContact O-CB 3.29Å; Q859-L863 WeakPolarHBondContact O-CB 3.41Å; Q859-L863 PolarHBondContact O-N 2.75Å; Q859-T1071 PolarHBondContact NE2-OG1 3.44Å
860	V	90.8	Very high	91	Very high	6 Å²	6	19.8 Å²	19.8	4%	0.036	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-49.5	-166.9	-178.6	0	0	0	0	112.7	S746 L750 C855 L858 L863 A864 L879	S746-V860 VanDerWaalsContact OG-CG1 3.29Å; S746-V860 WeakPolarHBondContact OG-CG1 3.45Å; L750-V860 HydrophobicContact CD1-CG2 4.23Å; C855-V860 PolarHBondContact O-N 3.45Å; C855-V860 VanDerWaalsContact O-N 3.12Å; L858-V860 HydrophobicContact CB-CG2 3.76Å; L858-V860 PolarHBondContact O-N 3.26Å; L858-V860 VanDerWaalsContact O-N 3.08Å; V860-L863 PolarHBondContact O-N 2.83Å; V860-A864 VanDerWaalsContact O-CB 3.29Å; V860-A864 WeakPolarHBondContact O-CB 3.5Å; V860-A864 PolarHBondContact O-N 3.21Å; V860-L879 HydrophobicContact CG1-CD2 4.25Å
861	L	92.6	Very high	91.3	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-69.6	-45.8	-174	-58	173.6	0	0	0	112.7	L550 Y579 L581 I682 I684 C741 Q859 L863 A864 M865 L879	L550-L861 HydrophobicContact CD1-CD1 3.96Å; Y579-L861 HydrophobicContact CD1-CD1 4.33Å; Y579-L861 HydrophobicContact CE1-CB 4.13Å; Y579-L861 HydrophobicContact CE1-CD1 3.59Å; L581-L861 HydrophobicContact CD2-CB 3.95Å; I682-L861 HydrophobicContact CD1-CD1 3.97Å; I682-L861 HydrophobicContact CG2-CD1 4.09Å; I682-L861 HydrophobicContact CG2-CD2 4.08Å; I684-L861 HydrophobicContact CD1-CD1 3.95Å; C741-L861 HydrophobicContact CB-CD2 3.91Å; Q859-L861 PolarHBondContact O-N 3.13Å; L861-L863 VanDerWaalsContact C-N 3.33Å; L861-L863 PolarHBondContact O-N 2.99Å; L861-A864 PolarHBondContact O-N 2.72Å; L861-M865 PolarHBondContact O-N 2.71Å; L861-L879 HydrophobicContact CD2-CD1 4.35Å; L861-L879 HydrophobicContact CD2-CD2 3.95Å
862	P	91.5	Very high	91.4	Very high	13 Å²	13	19.3 Å²	19.3	8%	0.084	10%	0.099	C	C	.	.	H	α-helix	trans	-59.1	-40.5	171	-27.6	37	0	0	0	113.3	L581 Q859 M865 Q866 T1071	L581-P862 WeakPolarHBondContact O-CA 3.46Å; Q859-P862 WeakPolarHBondContact O-CD 3.47Å; P862-M865 PolarHBondContact O-N 2.85Å; P862-Q866 WeakPolarHBondContact O-CG 3.35Å; P862-Q866 PolarHBondContact O-N 2.86Å; P862-T1071 HydrophobicContact CB-CG2 3.94Å
863	L	92.2	Very high	91.4	Very high	17 Å²	17	19.7 Å²	19.7	9%	0.089	10%	0.101	C	C	.	.	H	α-helix	trans	-66.2	-47.3	179.2	-177.5	60.5	0	0	0	111.7	L750 Q859 V860 L861 M865 Q866 I867 T1071 A1074 A1075 L1078	L750-L863 HydrophobicContact CD1-CD2 4.08Å; L750-L863 HydrophobicContact CD2-CD2 3.46Å; L750-L863 VanDerWaalsContact CD2-CD2 3.46Å; L750-L863 HydrophobicContact CG-CD2 4.43Å; Q859-L863 VanDerWaalsContact O-CB 3.29Å; Q859-L863 WeakPolarHBondContact O-CB 3.41Å; Q859-L863 PolarHBondContact O-N 2.75Å; V860-L863 PolarHBondContact O-N 2.83Å; L861-L863 VanDerWaalsContact C-N 3.33Å; L861-L863 PolarHBondContact O-N 2.99Å; L863-M865 VanDerWaalsContact C-N 3.3Å; L863-M865 PolarHBondContact O-N 3.4Å; L863-Q866 PolarHBondContact O-N 3.3Å; L863-I867 HydrophobicContact CD1-CD1 4.14Å; L863-I867 HydrophobicContact CD1-CG1 4.4Å; L863-I867 HydrophobicContact CG-CD1 3.96Å; L863-I867 WeakPolarHBondContact O-CG1 3.4Å; L863-I867 PolarHBondContact O-N 3Å; L863-T1071 HydrophobicContact CB-CG2 4.01Å; L863-T1071 HydrophobicContact CD1-CG2 4.23Å; L863-A1074 HydrophobicContact CD1-CB 4.23Å; L863-A1075 HydrophobicContact CD1-CB 3.94Å; L863-L1078 HydrophobicContact CD2-CD1 4.37Å
864	A	93.8	Very high	91.7	Very high	8 Å²	8	18.7 Å²	18.7	7%	0.066	10%	0.099	C	C	.	.	H	α-helix	trans	-60.4	-39	175.5	0	0	0	0	0	111.9	V860 L861 T868 L875 T878 L879	V860-A864 VanDerWaalsContact O-CB 3.29Å; V860-A864 WeakPolarHBondContact O-CB 3.5Å; V860-A864 PolarHBondContact O-N 3.21Å; L861-A864 PolarHBondContact O-N 2.72Å; A864-T868 WeakPolarHBondContact O-CB 3.49Å; A864-T868 PolarHBondContact O-N 3.45Å; A864-T868 PolarHBondContact O-OG1 3.12Å; A864-L875 HydrophobicContact CB-CD1 3.85Å; A864-T878 HydrophobicContact CB-CG2 3.97Å; A864-L879 HydrophobicContact CB-CD2 3.52Å; A864-L879 HydrophobicContact CB-CG 4.09Å
865	M	92.7	Very high	91.9	Very high	15 Å²	15	18.7 Å²	18.7	7%	0.074	10%	0.099	C	C	.	.	H	α-helix	trans	-61.7	-50.2	173.4	-172.8	-170.1	64	0	0	111.5	L581 D582 L861 P862 L863 I867 T868 S869	L581-M865 HydrophobicContact CB-CE 4.3Å; L581-M865 HydrophobicContact CB-SD 3.5Å; L581-M865 VanDerWaalsContact CB-SD 3.5Å; L581-M865 HydrophobicContact CD1-SD 4.22Å; L581-M865 HydrophobicContact CG-SD 4.46Å; L581-M865 WeakPolarHBondContact O-CE 3.25Å; D582-M865 HydrophobicContact CB-CE 4.15Å; L861-M865 PolarHBondContact O-N 2.71Å; P862-M865 PolarHBondContact O-N 2.85Å; L863-M865 VanDerWaalsContact C-N 3.3Å; L863-M865 PolarHBondContact O-N 3.4Å; M865-I867 PolarHBondContact O-N 3.4Å; M865-T868 PolarHBondContact O-N 3.28Å; M865-S869 PolarHBondContact O-N 3.27Å; M865-S869 PolarHBondContact O-OG 2.89Å
866	Q	93.4	Very high	91.9	Very high	25 Å²	25	19.6 Å²	19.6	12%	0.117	11%	0.105	C	C	.	.	H	α-helix	trans	-60.1	-45.6	179.4	-67.4	-62.9	-50.8	0	0	111.8	P862 L863 T868 S869 I870 T1071 R1072 A1075	P862-Q866 WeakPolarHBondContact O-CG 3.35Å; P862-Q866 PolarHBondContact O-N 2.86Å; L863-Q866 PolarHBondContact O-N 3.3Å; Q866-T868 VanDerWaalsContact C-N 3.34Å; Q866-T868 PolarHBondContact O-N 3.48Å; Q866-S869 PolarHBondContact O-N 3.34Å; Q866-I870 WeakPolarHBondContact O-CD1 3.45Å; Q866-I870 VanDerWaalsContact O-CG1 3.23Å; Q866-I870 WeakPolarHBondContact O-CG1 3.43Å; Q866-I870 PolarHBondContact O-N 3.31Å; Q866-T1071 HydrophobicContact CG-CG2 4.11Å; Q866-R1072 HydrophobicContact CG-CB 4.41Å; Q866-A1075 HydrophobicContact CB-CB 3.64Å
867	I	94.3	Very high	92	Very high	6 Å²	6	22.1 Å²	22.1	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	-57.6	-47.5	175.8	-69.1	170.8	0	0	0	110.6	L863 M865 S869 I870 C871 T878 R886 A1075 L1078	L863-I867 HydrophobicContact CD1-CD1 4.14Å; L863-I867 HydrophobicContact CD1-CG1 4.4Å; L863-I867 HydrophobicContact CG-CD1 3.96Å; L863-I867 WeakPolarHBondContact O-CG1 3.4Å; L863-I867 PolarHBondContact O-N 3Å; M865-I867 PolarHBondContact O-N 3.4Å; I867-S869 PolarHBondContact O-N 3Å; I867-I870 PolarHBondContact O-N 2.89Å; I867-C871 WeakPolarHBondContact O-CB 3.5Å; I867-C871 PolarHBondContact O-N 2.67Å; I867-C871 PolarHBondContact O-SG 2.67Å; I867-T878 HydrophobicContact CB-CG2 4.09Å; I867-T878 HydrophobicContact CG2-CG2 3.79Å; I867-R886 HydrophobicContact CG2-CG 4.28Å; I867-A1075 HydrophobicContact CG1-CB 3.73Å; I867-L1078 HydrophobicContact CD1-CD1 4.37Å
868	T	95.3	Very high	92.3	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.1	-38.4	-179.7	-50.9	0	0	0	0	112	A864 M865 Q866 I870 G872 N873 L875 T878	A864-T868 WeakPolarHBondContact O-CB 3.49Å; A864-T868 PolarHBondContact O-N 3.45Å; A864-T868 PolarHBondContact O-OG1 3.12Å; M865-T868 PolarHBondContact O-N 3.28Å; Q866-T868 VanDerWaalsContact C-N 3.34Å; Q866-T868 PolarHBondContact O-N 3.48Å; T868-I870 VanDerWaalsContact C-N 3.34Å; T868-G872 WeakPolarHBondContact O-CA 3.3Å; T868-G872 PolarHBondContact O-N 3.08Å; T868-N873 WeakPolarHBondContact CG2-O 3.45Å; T868-L875 HydrophobicContact CG2-CB 4.13Å; T868-L875 WeakPolarHBondContact OG1-CD1 3.45Å; T868-T878 VanDerWaalsContact OG1-CB 3.23Å; T868-T878 WeakPolarHBondContact OG1-CB 3.42Å; T868-T878 PolarHBondContact OG1-OG1 2.77Å
869	S	93.4	Very high	92.5	Very high	46 Å²	46	17.1 Å²	17.1	32%	0.322	9%	0.089	S	C	.	.	H	α-helix	trans	-72.7	-22.9	175.9	-66.7	0	0	0	0	114.1	M865 Q866 I867	M865-S869 PolarHBondContact O-N 3.27Å; M865-S869 PolarHBondContact O-OG 2.89Å; Q866-S869 PolarHBondContact O-N 3.34Å; I867-S869 PolarHBondContact O-N 3Å
870	I	93.9	Very high	92.4	Very high	17 Å²	17	16 Å²	16	9%	0.087	9%	0.088	C	C	.	.	H	α-helix	trans	-78.2	-48.4	173.1	-69.3	159.7	0	0	0	110.5	Q866 I867 T868 L1044 A1075 L1076 T1079	Q866-I870 WeakPolarHBondContact O-CD1 3.45Å; Q866-I870 VanDerWaalsContact O-CG1 3.23Å; Q866-I870 WeakPolarHBondContact O-CG1 3.43Å; Q866-I870 PolarHBondContact O-N 3.31Å; I867-I870 PolarHBondContact O-N 2.89Å; T868-I870 VanDerWaalsContact C-N 3.34Å; I870-L1044 HydrophobicContact CG2-CD2 3.43Å; I870-L1044 VanDerWaalsContact CG2-CD2 3.43Å; I870-A1075 HydrophobicContact CD1-CB 3.71Å; I870-L1076 HydrophobicContact CD1-CD2 3.72Å; I870-L1076 HydrophobicContact CD1-CG 3.86Å; I870-L1076 HydrophobicContact CG1-CD2 4.16Å; I870-T1079 HydrophobicContact CG2-CG2 4.02Å
871	C	94.6	Very high	91.5	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.007	9%	0.094	C	C	.	.	H	α-helix	trans	-82.4	-39.4	-172.1	-59.4	0	0	0	0	113.1	I867 R886 A889 L890	I867-C871 WeakPolarHBondContact O-CB 3.5Å; I867-C871 PolarHBondContact O-N 2.67Å; I867-C871 PolarHBondContact O-SG 2.67Å; C871-R886 HydrophobicContact CB-CB 4.27Å; C871-R886 WeakPolarHBondContact CB-O 3.42Å; C871-A889 CarbonylContact O-C 3.58Å; C871-A889 VanDerWaalsContact O-C 3.3Å; C871-L890 VanDerWaalsContact O-CA 3.3Å; C871-L890 WeakPolarHBondContact O-CA 3.14Å; C871-L890 PolarHBondContact O-N 2.72Å; C871-L890 VanDerWaalsContact O-N 3.15Å
872	G	93.2	Very high	90.8	Very high	1 Å²	1	17 Å²	17	1%	0.01	10%	0.101	C	C	.	.			trans	82.5	24.2	179.5	0	0	0	0	0	116.4	T868 H893	T868-G872 WeakPolarHBondContact O-CA 3.3Å; T868-G872 PolarHBondContact O-N 3.08Å; G872-H893 PolarHBondContact O-NE2 3.24Å
873	N	92.3	Very high	90.4	Very high	8 Å²	8	19.8 Å²	19.8	4%	0.043	11%	0.11	C	C	.	.	S	Bend	trans	-82	-168	163.4	66.9	-34.5	0	0	0	111.3	T868 T878 A889	T868-N873 WeakPolarHBondContact CG2-O 3.45Å; N873-T878 PolarHBondContact ND2-OG1 2.88Å; N873-T878 PolarHBondContact OD1-OG1 3.33Å; N873-A889 HydrophobicContact CB-CB 3.67Å
874	V	93.1	Very high	90	Very high	8 Å²	8	19.7 Å²	19.7	5%	0.048	11%	0.112	C	C	.	.			trans	-94.3	141.2	176.3	-170.9	0	0	0	0	110.6	W341 A344 L474 L478 S876 R877 T878	W341-V874 HydrophobicContact CH2-CG2 4.35Å; W341-V874 HydrophobicContact CZ3-CG1 4.15Å; W341-V874 HydrophobicContact CZ3-CG2 4.36Å; A344-V874 HydrophobicContact CB-CG1 4.32Å; A344-V874 HydrophobicContact CB-CG2 4.34Å; L474-V874 HydrophobicContact CD2-CG2 4.32Å; L478-V874 HydrophobicContact CD1-CG2 4.09Å; V874-S876 VanDerWaalsContact C-N 3.32Å; V874-S876 WeakPolarHBondContact CG1-OG 3.41Å; V874-S876 PolarHBondContact O-N 3.38Å; V874-R877 HydrophobicContact CB-CG 4.31Å; V874-R877 WeakPolarHBondContact O-CB 3.37Å; V874-R877 PolarHBondContact O-N 3.4Å; V874-T878 PolarHBondContact O-N 2.64Å
875	L	93.7	Very high	89.7	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-63.3	-34	-173.1	179.6	56.7	0	0	0	113.4	P486 L581 L739 A864 T868 R877 T878 L879	P486-L875 HydrophobicContact CG-CB 4.13Å; P486-L875 HydrophobicContact CG-CD2 3.95Å; L581-L875 HydrophobicContact CD1-CD2 4.34Å; L739-L875 HydrophobicContact CD1-CD2 3.61Å; L739-L875 HydrophobicContact CD1-CG 4.14Å; L739-L875 HydrophobicContact CD2-CB 4.12Å; L739-L875 HydrophobicContact CD2-CD2 4.45Å; L739-L875 HydrophobicContact CD2-CG 4.14Å; A864-L875 HydrophobicContact CB-CD1 3.85Å; T868-L875 HydrophobicContact CG2-CB 4.13Å; T868-L875 WeakPolarHBondContact OG1-CD1 3.45Å; L875-R877 VanDerWaalsContact C-N 3.29Å; L875-R877 PolarHBondContact O-N 3.23Å; L875-T878 PolarHBondContact O-N 3.38Å; L875-L879 HydrophobicContact CD1-CD1 4.48Å; L875-L879 HydrophobicContact CD1-CG 4.38Å; L875-L879 HydrophobicContact CG-CD1 4.27Å; L875-L879 WeakPolarHBondContact O-CG 3.41Å; L875-L879 PolarHBondContact O-N 3.08Å
876	S	91.8	Very high	89.7	Confident	20 Å²	20	22.1 Å²	22.1	14%	0.14	12%	0.121	C	C	.	.	H	α-helix	trans	-57.9	-40.5	173.2	45.2	0	0	0	0	112.3	D343 V874 L879 S880	D343-S876 VanDerWaalsContact OD1-CB 3.23Å; D343-S876 WeakPolarHBondContact OD1-CB 3.41Å; D343-S876 PolarHBondContact OD1-OG 3.46Å; V874-S876 VanDerWaalsContact C-N 3.32Å; V874-S876 WeakPolarHBondContact CG1-OG 3.41Å; V874-S876 PolarHBondContact O-N 3.38Å; S876-L879 PolarHBondContact O-N 3.37Å; S876-S880 PolarHBondContact O-N 3Å; S876-S880 PolarHBondContact O-OG 3.31Å; S876-S880 VanDerWaalsContact O-OG 3.11Å
877	R	88.9	Confident	89.6	Confident	89 Å²	89	21.1 Å²	21.1	34%	0.336	12%	0.116	S	C	.	.	H	α-helix	trans	-68.4	-42	176.7	-61.1	-58.5	-174.2	115.8	-7.2	112.6	V874 L875 L879 S880 E885	V874-R877 HydrophobicContact CB-CG 4.31Å; V874-R877 WeakPolarHBondContact O-CB 3.37Å; V874-R877 PolarHBondContact O-N 3.4Å; L875-R877 VanDerWaalsContact C-N 3.29Å; L875-R877 PolarHBondContact O-N 3.23Å; R877-L879 VanDerWaalsContact C-N 3.29Å; R877-L879 PolarHBondContact O-N 3.13Å; R877-S880 WeakPolarHBondContact O-CB 3.45Å; R877-S880 PolarHBondContact O-N 2.92Å; R877-S880 VanDerWaalsContact O-N 3.08Å; R877-E885 WeakPolarHBondContact CD-OE1 3.38Å; R877-E885 WeakPolarHBondContact CG-OE1 3.37Å; R877-E885 IonicContact CZ-OE1 3.12Å; R877-E885 IonicContact NE-OE1 2.65Å; R877-E885 IonicContact NH1-OE1 3.36Å; R877-E885 PolarHBondContact NH1-OE1 3.25Å; R877-E885 IonicContact NH1-OE2 3.52Å
878	T	92	Very high	89.5	Confident	4 Å²	4	23.1 Å²	23.1	3%	0.025	13%	0.126	C	C	.	.	H	α-helix	trans	-58	-42.3	173.6	-58.2	0	0	0	0	111.8	A864 I867 T868 N873 V874 L875 S880 G881 R886	A864-T878 HydrophobicContact CB-CG2 3.97Å; I867-T878 HydrophobicContact CB-CG2 4.09Å; I867-T878 HydrophobicContact CG2-CG2 3.79Å; T868-T878 VanDerWaalsContact OG1-CB 3.23Å; T868-T878 WeakPolarHBondContact OG1-CB 3.42Å; T868-T878 PolarHBondContact OG1-OG1 2.77Å; N873-T878 PolarHBondContact ND2-OG1 2.88Å; N873-T878 PolarHBondContact OD1-OG1 3.33Å; V874-T878 PolarHBondContact O-N 2.64Å; L875-T878 PolarHBondContact O-N 3.38Å; T878-S880 VanDerWaalsContact C-N 3.29Å; T878-S880 PolarHBondContact O-N 2.85Å; T878-G881 PolarHBondContact O-N 2.82Å; T878-R886 PolarHBondContact O-NH2 3.28Å
879	L	90.8	Very high	89.5	Confident	6 Å²	6	23.7 Å²	23.7	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-70.6	-18.3	177.2	-68.7	169.3	0	0	0	114.1	L739 V740 C741 V860 L861 A864 L875 S876 R877 G881	L739-L879 HydrophobicContact CB-CD1 4.06Å; V740-L879 WeakPolarHBondContact O-CB 3.36Å; C741-L879 HydrophobicContact CB-CD2 4.37Å; V860-L879 HydrophobicContact CG1-CD2 4.25Å; L861-L879 HydrophobicContact CD2-CD1 4.35Å; L861-L879 HydrophobicContact CD2-CD2 3.95Å; A864-L879 HydrophobicContact CB-CD2 3.52Å; A864-L879 HydrophobicContact CB-CG 4.09Å; L875-L879 HydrophobicContact CD1-CD1 4.48Å; L875-L879 HydrophobicContact CD1-CG 4.38Å; L875-L879 HydrophobicContact CG-CD1 4.27Å; L875-L879 WeakPolarHBondContact O-CG 3.41Å; L875-L879 PolarHBondContact O-N 3.08Å; S876-L879 PolarHBondContact O-N 3.37Å; R877-L879 VanDerWaalsContact C-N 3.29Å; R877-L879 PolarHBondContact O-N 3.13Å; L879-G881 VanDerWaalsContact C-N 3.31Å
880	S	85.3	Confident	89.6	Confident	39 Å²	39	21.6 Å²	21.6	27%	0.273	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-10.6	172.4	-59.4	0	0	0	0	113.9	W689 S876 R877 T878	W689-S880 WeakPolarHBondContact CH2-OG 3.44Å; W689-S880 VanDerWaalsContact CZ2-OG 3.31Å; W689-S880 WeakPolarHBondContact CZ2-OG 3.5Å; S876-S880 PolarHBondContact O-N 3Å; S876-S880 PolarHBondContact O-OG 3.31Å; S876-S880 VanDerWaalsContact O-OG 3.11Å; R877-S880 WeakPolarHBondContact O-CB 3.45Å; R877-S880 PolarHBondContact O-N 2.92Å; R877-S880 VanDerWaalsContact O-N 3.08Å; T878-S880 VanDerWaalsContact C-N 3.29Å; T878-S880 PolarHBondContact O-N 2.85Å
881	G	73	Confident	89.6	Confident	15 Å²	15	21 Å²	21	16%	0.155	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	2.2	172.4	0	0	0	0	0	116.9	T878 L879 R883	T878-G881 PolarHBondContact O-N 2.82Å; L879-G881 VanDerWaalsContact C-N 3.31Å; G881-R883 PolarHBondContact O-N 3.12Å
882	G	77.1	Confident	89.6	Confident	17 Å²	17	21.4 Å²	21.4	18%	0.175	11%	0.114	C	C	.	.			trans	-69.4	113.7	178.7	0	0	0	0	0	112.7	R886	G882-R886 WeakPolarHBondContact O-CD 3.19Å; G882-R886 WeakPolarHBondContact O-CG 3.17Å; G882-R886 PolarHBondContact O-NE 3.4Å; G882-R886 VanDerWaalsContact O-NE 3.16Å
883	R	83.5	Confident	89.7	Confident	71 Å²	71	21.8 Å²	21.8	27%	0.268	12%	0.116	S	C	.	.	H	α-helix	trans	-78.7	-39	176.6	-72.4	-178.5	178.1	168.5	-1	113.3	F52 E749 G881 R886 N887	F52-R883 HydrophobicContact CZ-CB 4.23Å; E749-R883 IonicContact OE1-CZ 2.75Å; E749-R883 IonicContact OE1-NE 3.07Å; E749-R883 PolarHBondContact OE1-NE 2.85Å; E749-R883 IonicContact OE1-NH2 2.72Å; G881-R883 PolarHBondContact O-N 3.12Å; R883-R886 PolarHBondContact O-N 2.83Å; R883-N887 PolarHBondContact O-N 3.2Å
884	A	83.2	Confident	89.8	Confident	15 Å²	15	21.5 Å²	21.5	12%	0.124	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-48.5	178.6	0	0	0	0	0	112.1	F52 R886 N887 E888 F1089	F52-A884 HydrophobicContact CD1-CB 4.41Å; F52-A884 HydrophobicContact CE1-CB 3.79Å; A884-R886 PolarHBondContact O-N 3.08Å; A884-R886 VanDerWaalsContact O-N 3.09Å; A884-N887 PolarHBondContact O-N 2.9Å; A884-E888 PolarHBondContact O-N 3.48Å; A884-F1089 HydrophobicContact CB-CD1 3.81Å; A884-F1089 HydrophobicContact CB-CE1 3.8Å
885	E	87.8	Confident	90	Very high	61 Å²	61	21.1 Å²	21.1	29%	0.285	11%	0.112	S	C	.	.	H	α-helix	trans	-56.5	-28.1	179.1	-172.8	176	-161.7	0	0	113.3	R877 A889	R877-E885 WeakPolarHBondContact CD-OE1 3.38Å; R877-E885 WeakPolarHBondContact CG-OE1 3.37Å; R877-E885 IonicContact CZ-OE1 3.12Å; R877-E885 IonicContact NE-OE1 2.65Å; R877-E885 IonicContact NH1-OE1 3.36Å; R877-E885 PolarHBondContact NH1-OE1 3.25Å; R877-E885 IonicContact NH1-OE2 3.52Å; E885-A889 PolarHBondContact O-N 3.19Å
886	R	92.8	Very high	90	Very high	13 Å²	13	22.6 Å²	22.6	5%	0.049	12%	0.121	C	C	.	.	H	α-helix	trans	-71.3	-48.4	173.3	-62.4	163.4	-170.4	171.7	0.6	111.2	E749 I867 C871 T878 G882 R883 A884 A889 L890	E749-R886 VanDerWaalsContact CD-NH1 3.32Å; E749-R886 IonicContact OE1-CZ 3.04Å; E749-R886 IonicContact OE1-NH1 3.7Å; E749-R886 PolarHBondContact OE1-NH1 3.16Å; E749-R886 IonicContact OE1-NH2 3.18Å; E749-R886 IonicContact OE2-CZ 3.31Å; E749-R886 IonicContact OE2-NH1 2.69Å; E749-R886 PolarHBondContact OE2-NH1 3.17Å; E749-R886 VanDerWaalsContact OE2-NH1 3.13Å; E749-R886 IonicContact OE2-NH2 2.77Å; E749-R886 PolarHBondContact OE2-NH2 3.05Å; I867-R886 HydrophobicContact CG2-CG 4.28Å; C871-R886 HydrophobicContact CB-CB 4.27Å; C871-R886 WeakPolarHBondContact CB-O 3.42Å; T878-R886 PolarHBondContact O-NH2 3.28Å; G882-R886 WeakPolarHBondContact O-CD 3.19Å; G882-R886 WeakPolarHBondContact O-CG 3.17Å; G882-R886 PolarHBondContact O-NE 3.4Å; G882-R886 VanDerWaalsContact O-NE 3.16Å; R883-R886 PolarHBondContact O-N 2.83Å; A884-R886 PolarHBondContact O-N 3.08Å; A884-R886 VanDerWaalsContact O-N 3.09Å; R886-A889 PolarHBondContact O-N 3.36Å; R886-L890 PolarHBondContact O-N 2.89Å; R886-L890 VanDerWaalsContact O-N 3.08Å
887	N	91.8	Very high	90	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-73.7	-32.9	-178.7	-67.9	-30.1	0	0	0	112.8	R883 A884 L890 L891 S1082 C1086	R883-N887 PolarHBondContact O-N 3.2Å; A884-N887 PolarHBondContact O-N 2.9Å; N887-L890 PolarHBondContact O-N 2.7Å; N887-L891 WeakPolarHBondContact O-CG 3.25Å; N887-L891 PolarHBondContact O-N 3.32Å; N887-S1082 VanDerWaalsContact ND2-C 3.29Å; N887-S1082 WeakPolarHBondContact ND2-CB 3.46Å; N887-S1082 PolarHBondContact ND2-O 3.02Å; N887-S1082 PolarHBondContact ND2-OG 2.81Å; N887-S1082 PolarHBondContact OD1-OG 2.71Å; N887-C1086 HydrophobicContact CB-CB 3.91Å; N887-C1086 VanDerWaalsContact CB-SG 3.57Å
888	E	92.8	Very high	90.3	Very high	49 Å²	49	27.2 Å²	27.2	23%	0.229	14%	0.144	C	C	.	.	H	α-helix	trans	-55.6	-55.2	168.2	-176	-172.2	157	0	0	109.7	A884 L890 L891 L892 R1093 F1094	A884-E888 PolarHBondContact O-N 3.48Å; E888-L890 VanDerWaalsContact C-N 3.31Å; E888-L890 PolarHBondContact O-N 2.99Å; E888-L891 PolarHBondContact O-N 2.94Å; E888-L891 VanDerWaalsContact O-N 3.13Å; E888-L892 HydrophobicContact CG-CD1 3.88Å; E888-L892 HydrophobicContact CG-CG 4.11Å; E888-L892 WeakPolarHBondContact O-CB 3.16Å; E888-L892 VanDerWaalsContact O-CG 3.27Å; E888-L892 WeakPolarHBondContact O-CG 3.46Å; E888-L892 PolarHBondContact O-N 2.89Å; E888-R1093 HydrophobicContact CG-CB 4.1Å; E888-R1093 WeakPolarHBondContact OE1-CD 3.47Å; E888-R1093 IonicContact OE1-CZ 3.45Å; E888-R1093 IonicContact OE1-NE 3.36Å; E888-R1093 IonicContact OE1-NH1 3.27Å; E888-R1093 PolarHBondContact OE1-NH1 2.76Å; E888-F1094 HydrophobicContact CG-CD2 4.22Å; E888-F1094 HydrophobicContact CG-CE2 3.99Å
889	A	94	Very high	90.3	Very high	11 Å²	11	28.4 Å²	28.4	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-57.8	-41.7	178.9	0	0	0	0	0	112.9	C871 N873 E885 R886 L891 L892 H893	C871-A889 CarbonylContact O-C 3.58Å; C871-A889 VanDerWaalsContact O-C 3.3Å; N873-A889 HydrophobicContact CB-CB 3.67Å; E885-A889 PolarHBondContact O-N 3.19Å; R886-A889 PolarHBondContact O-N 3.36Å; A889-L891 VanDerWaalsContact C-N 3.35Å; A889-L891 PolarHBondContact O-N 2.98Å; A889-L892 PolarHBondContact O-N 3.41Å; A889-H893 PolarHBondContact O-CD2 3.43Å; A889-H893 PolarHBondContact O-N 2.84Å
890	L	95.4	Very high	90.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-57.1	-47.7	176.1	176.5	63.6	0	0	0	111.5	C871 R886 N887 E888 A894 L1044 T1079 V1083	C871-L890 VanDerWaalsContact O-CA 3.3Å; C871-L890 WeakPolarHBondContact O-CA 3.14Å; C871-L890 PolarHBondContact O-N 2.72Å; C871-L890 VanDerWaalsContact O-N 3.15Å; R886-L890 PolarHBondContact O-N 2.89Å; R886-L890 VanDerWaalsContact O-N 3.08Å; N887-L890 PolarHBondContact O-N 2.7Å; E888-L890 VanDerWaalsContact C-N 3.31Å; E888-L890 PolarHBondContact O-N 2.99Å; L890-A894 WeakPolarHBondContact O-CB 3.39Å; L890-A894 PolarHBondContact O-N 2.92Å; L890-A894 VanDerWaalsContact O-N 3.1Å; L890-L1044 HydrophobicContact CD2-CD1 4.1Å; L890-T1079 HydrophobicContact CD2-CG2 3.95Å; L890-V1083 HydrophobicContact CD2-CG2 4.39Å
891	L	94.8	Very high	91	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-71.5	-39.7	179.3	-66.1	176.7	0	0	0	112	N887 E888 A889 H893 A894 F895 L1037 F1094	N887-L891 WeakPolarHBondContact O-CG 3.25Å; N887-L891 PolarHBondContact O-N 3.32Å; E888-L891 PolarHBondContact O-N 2.94Å; E888-L891 VanDerWaalsContact O-N 3.13Å; A889-L891 VanDerWaalsContact C-N 3.35Å; A889-L891 PolarHBondContact O-N 2.98Å; L891-H893 PolarHBondContact O-N 3.46Å; L891-A894 PolarHBondContact O-N 2.88Å; L891-F895 HydrophobicContact CB-CD2 4.14Å; L891-F895 HydrophobicContact CB-CE2 4.28Å; L891-F895 HydrophobicContact CD2-CE2 4.22Å; L891-F895 WeakPolarHBondContact O-CB 3.41Å; L891-F895 VanDerWaalsContact O-CD2 3.28Å; L891-F895 WeakPolarHBondContact O-CD2 3.37Å; L891-F895 PolarHBondContact O-N 2.94Å; L891-L1037 HydrophobicContact CD2-CD1 4.01Å; L891-F1094 HydrophobicContact CB-CD1 4.39Å; L891-F1094 HydrophobicContact CB-CD2 3.88Å; L891-F1094 HydrophobicContact CB-CE1 4.15Å; L891-F1094 HydrophobicContact CB-CE2 3.6Å; L891-F1094 HydrophobicContact CB-CG 4.26Å; L891-F1094 HydrophobicContact CB-CZ 3.74Å; L891-F1094 HydrophobicContact CD1-CB 3.84Å; L891-F1094 HydrophobicContact CD1-CD1 4.22Å; L891-F1094 HydrophobicContact CD1-CD2 3.84Å; L891-F1094 HydrophobicContact CD1-CE2 4.44Å; L891-F1094 HydrophobicContact CD1-CG 3.71Å
892	L	95.1	Very high	92	Very high	10 Å²	10	27.7 Å²	27.7	5%	0.052	15%	0.146	C	C	.	.	H	α-helix	trans	-56.9	-47.9	174.2	-70.4	173.9	0	0	0	111.4	E475 L479 E888 A889 T896 V902 F1094	E475-L892 HydrophobicContact CG-CD1 4.24Å; L479-L892 HydrophobicContact CD2-CB 4.17Å; E888-L892 HydrophobicContact CG-CD1 3.88Å; E888-L892 HydrophobicContact CG-CG 4.11Å; E888-L892 WeakPolarHBondContact O-CB 3.16Å; E888-L892 VanDerWaalsContact O-CG 3.27Å; E888-L892 WeakPolarHBondContact O-CG 3.46Å; E888-L892 PolarHBondContact O-N 2.89Å; A889-L892 PolarHBondContact O-N 3.41Å; L892-T896 WeakPolarHBondContact O-CB 3.22Å; L892-T896 PolarHBondContact O-N 3.33Å; L892-T896 PolarHBondContact O-OG1 2.79Å; L892-V902 HydrophobicContact CD2-CB 3.88Å; L892-V902 HydrophobicContact CD2-CG1 3.97Å; L892-V902 HydrophobicContact CD2-CG2 3.76Å; L892-F1094 HydrophobicContact CD2-CE2 4.03Å; L892-F1094 HydrophobicContact CD2-CZ 3.9Å; L892-F1094 HydrophobicContact CG-CE2 4.04Å; L892-F1094 HydrophobicContact CG-CZ 4.25Å
893	H	95.4	Very high	92.7	Very high	10 Å²	10	27.1 Å²	27.1	5%	0.046	14%	0.139	C	C	.	.	H	α-helix	trans	-60.9	-46.1	175.5	-83.9	-75	0	0	0	111.3	G872 A889 L891 Q897	G872-H893 PolarHBondContact O-NE2 3.24Å; A889-H893 PolarHBondContact O-CD2 3.43Å; A889-H893 PolarHBondContact O-N 2.84Å; L891-H893 PolarHBondContact O-N 3.46Å; H893-Q897 WeakPolarHBondContact O-CB 3.48Å; H893-Q897 PolarHBondContact O-N 2.85Å; H893-Q897 VanDerWaalsContact O-N 3.07Å
894	A	94.5	Very high	92.9	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-65.3	-52.9	-178.1	0	0	0	0	0	113.1	L890 L891 Q897 H898 E1040	L890-A894 WeakPolarHBondContact O-CB 3.39Å; L890-A894 PolarHBondContact O-N 2.92Å; L890-A894 VanDerWaalsContact O-N 3.1Å; L891-A894 PolarHBondContact O-N 2.88Å; A894-Q897 PolarHBondContact O-N 2.73Å; A894-H898 PolarHBondContact O-N 3.38Å; A894-H898 PolarHBondContact O-ND1 2.95Å; A894-E1040 HydrophobicContact CB-CG 3.59Å
895	F	95.4	Very high	93	Very high	1 Å²	1	26 Å²	26	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-64.4	-41.8	-179.8	-80.2	-68	0	0	0	112	F431 L891 Q897 H898 G899 Y900 V902 F977 T978 L1036 F1094	F431-F895 HydrophobicContact CE1-CD2 4.23Å; F431-F895 HydrophobicContact CE1-CE1 4.09Å; F431-F895 AromaticContact CE1-CE2 3.78Å; F431-F895 HydrophobicContact CE1-CE2 3.78Å; F431-F895 AromaticContact CE1-CZ 3.71Å; F431-F895 HydrophobicContact CE1-CZ 3.71Å; F431-F895 HydrophobicContact CE2-CD1 4.47Å; F431-F895 AromaticContact CZ-CD1 3.65Å; F431-F895 HydrophobicContact CZ-CD1 3.65Å; F431-F895 AromaticContact CZ-CD2 3.82Å; F431-F895 HydrophobicContact CZ-CD2 3.82Å; F431-F895 AromaticContact CZ-CE1 3.61Å; F431-F895 HydrophobicContact CZ-CE1 3.61Å; F431-F895 AromaticContact CZ-CE2 3.77Å; F431-F895 HydrophobicContact CZ-CE2 3.77Å; F431-F895 AromaticContact CZ-CG 3.78Å; F431-F895 HydrophobicContact CZ-CG 3.78Å; F431-F895 AromaticContact CZ-CZ 3.67Å; F431-F895 HydrophobicContact CZ-CZ 3.67Å; L891-F895 HydrophobicContact CB-CD2 4.14Å; L891-F895 HydrophobicContact CB-CE2 4.28Å; L891-F895 HydrophobicContact CD2-CE2 4.22Å; L891-F895 WeakPolarHBondContact O-CB 3.41Å; L891-F895 VanDerWaalsContact O-CD2 3.28Å; L891-F895 WeakPolarHBondContact O-CD2 3.37Å; L891-F895 PolarHBondContact O-N 2.94Å; F895-Q897 VanDerWaalsContact C-N 3.35Å; F895-Q897 PolarHBondContact O-N 3.43Å; F895-H898 PolarHBondContact O-N 3.46Å; F895-G899 PolarHBondContact O-N 3.37Å; F895-Y900 HydrophobicContact CD1-CD1 4.2Å; F895-Y900 AromaticContact CD1-CD2 3.98Å; F895-Y900 HydrophobicContact CD1-CD2 3.98Å; F895-Y900 HydrophobicContact CD1-CE2 4.5Å; F895-Y900 AromaticContact CD1-CG 3.82Å; F895-Y900 HydrophobicContact CD1-CG 3.82Å; F895-Y900 WeakPolarHBondContact O-CB 3.46Å; F895-Y900 PolarHBondContact O-N 3.18Å; F895-V902 HydrophobicContact CB-CG1 3.7Å; F895-F977 HydrophobicContact CE2-CD2 4.36Å; F895-F977 HydrophobicContact CZ-CB 4.41Å; F895-F977 AromaticContact CZ-CD2 3.84Å; F895-F977 HydrophobicContact CZ-CD2 3.84Å; F895-F977 HydrophobicContact CZ-CE2 4.47Å; F895-F977 HydrophobicContact CZ-CG 4.32Å; F895-T978 HydrophobicContact CE1-CG2 4.27Å; F895-L1036 HydrophobicContact CD1-CD2 3.62Å; F895-L1036 HydrophobicContact CE1-CB 4.14Å; F895-L1036 HydrophobicContact CE1-CD2 3.96Å; F895-L1036 HydrophobicContact CG-CD2 4.17Å; F895-L1036 HydrophobicContact CZ-CB 4.45Å; F895-F1094 AromaticContact CD2-CE1 3.73Å; F895-F1094 HydrophobicContact CD2-CE1 3.73Å; F895-F1094 HydrophobicContact CD2-CZ 4.2Å; F895-F1094 HydrophobicContact CE2-CD1 4.27Å; F895-F1094 AromaticContact CE2-CE1 3.91Å; F895-F1094 HydrophobicContact CE2-CE1 3.91Å
896	T	94.1	Very high	92.3	Very high	33 Å²	33	26.8 Å²	26.8	20%	0.202	15%	0.148	C	C	.	.	H	α-helix	trans	-64.1	-40.5	178	-56.9	0	0	0	0	111.8	L479 L892 H898 G899	L479-T896 HydrophobicContact CB-CG2 4.36Å; L892-T896 WeakPolarHBondContact O-CB 3.22Å; L892-T896 PolarHBondContact O-N 3.33Å; L892-T896 PolarHBondContact O-OG1 2.79Å; T896-H898 VanDerWaalsContact C-N 3.3Å; T896-H898 PolarHBondContact O-N 2.93Å; T896-G899 PolarHBondContact O-N 2.77Å; T896-G899 VanDerWaalsContact O-N 3.17Å
897	Q	92.9	Very high	90.7	Very high	107 Å²	107	29.5 Å²	29.5	50%	0.5	17%	0.166	S	C	.	.	H	α-helix	trans	-62.9	-33.7	178.7	-178.4	172.2	-16	0	0	112.8	H893 A894 F895 G899	H893-Q897 WeakPolarHBondContact O-CB 3.48Å; H893-Q897 PolarHBondContact O-N 2.85Å; H893-Q897 VanDerWaalsContact O-N 3.07Å; A894-Q897 PolarHBondContact O-N 2.73Å; F895-Q897 VanDerWaalsContact C-N 3.35Å; F895-Q897 PolarHBondContact O-N 3.43Å; Q897-G899 VanDerWaalsContact C-N 3.34Å
898	H	93.8	Very high	88.4	Confident	99 Å²	99	31.6 Å²	31.6	46%	0.458	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	17.2	176.8	-61.2	86.4	0	0	0	113.7	A894 F895 T896 Y900 L1036	A894-H898 PolarHBondContact O-N 3.38Å; A894-H898 PolarHBondContact O-ND1 2.95Å; F895-H898 PolarHBondContact O-N 3.46Å; T896-H898 VanDerWaalsContact C-N 3.3Å; T896-H898 PolarHBondContact O-N 2.93Å; H898-Y900 HydrophobicContact CB-CD2 4.09Å; H898-Y900 HydrophobicContact CB-CE2 4.12Å; H898-L1036 HydrophobicContact CB-CD2 3.88Å
899	G	94	Very high	85.6	Confident	29 Å²	29	37.1 Å²	37.1	30%	0.299	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	17.6	171.7	0	0	0	0	0	115.9	K427 R428 F895 T896 Q897	K427-G899 WeakPolarHBondContact CD-O 3.35Å; R428-G899 PolarHBondContact N-O 2.8Å; F895-G899 PolarHBondContact O-N 3.37Å; T896-G899 PolarHBondContact O-N 2.77Å; T896-G899 VanDerWaalsContact O-N 3.17Å; Q897-G899 VanDerWaalsContact C-N 3.34Å
900	Y	95.4	Very high	82.4	Confident	23 Å²	23	43 Å²	43	9%	0.09	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-78.5	160.3	172.8	-70.8	-102.3	0	0	0	112.1	K427 R428 A430 F895 H898 T978 L1036	K427-Y900 PolarHBondContact NZ-O 2.84Å; R428-Y900 HydrophobicContact CB-CD1 3.5Å; R428-Y900 VanDerWaalsContact CB-CD1 3.5Å; R428-Y900 HydrophobicContact CB-CD2 4.25Å; R428-Y900 HydrophobicContact CB-CE1 3.49Å; R428-Y900 VanDerWaalsContact CB-CE1 3.49Å; R428-Y900 HydrophobicContact CB-CE2 4.25Å; R428-Y900 HydrophobicContact CB-CG 3.88Å; R428-Y900 CarbonylContact O-C 3.56Å; R428-Y900 WeakPolarHBondContact O-CA 3.47Å; A430-Y900 HydrophobicContact CB-CD1 4.5Å; A430-Y900 HydrophobicContact CB-CE1 4.13Å; F895-Y900 HydrophobicContact CD1-CD1 4.2Å; F895-Y900 AromaticContact CD1-CD2 3.98Å; F895-Y900 HydrophobicContact CD1-CD2 3.98Å; F895-Y900 HydrophobicContact CD1-CE2 4.5Å; F895-Y900 AromaticContact CD1-CG 3.82Å; F895-Y900 HydrophobicContact CD1-CG 3.82Å; F895-Y900 WeakPolarHBondContact O-CB 3.46Å; F895-Y900 PolarHBondContact O-N 3.18Å; H898-Y900 HydrophobicContact CB-CD2 4.09Å; H898-Y900 HydrophobicContact CB-CE2 4.12Å; Y900-T978 HydrophobicContact CE1-CG2 3.86Å; Y900-T978 WeakPolarHBondContact OH-CG2 3.41Å; Y900-L1036 HydrophobicContact CD2-CD2 4.32Å; Y900-L1036 HydrophobicContact CE2-CD1 3.65Å; Y900-L1036 HydrophobicContact CE2-CD2 4.2Å
901	I	94.5	Very high	79.1	Confident	6 Å²	6	45.1 Å²	45.1	3%	0.031	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-91.2	125.7	153.3	-72	164.9	0	0	0	106.1	F385 K427 R428 Y429 F431 Y442 F467	F385-I901 HydrophobicContact CB-CD1 3.74Å; F385-I901 HydrophobicContact CD1-CD1 4.13Å; F385-I901 HydrophobicContact CD1-CG1 4.4Å; F385-I901 HydrophobicContact CD2-CD1 4.2Å; F385-I901 HydrophobicContact CD2-CG1 4.07Å; F385-I901 HydrophobicContact CE2-CG1 4.32Å; F385-I901 HydrophobicContact CG-CD1 3.78Å; F385-I901 HydrophobicContact CG-CG1 4.1Å; K427-I901 HydrophobicContact CB-CD1 3.71Å; K427-I901 HydrophobicContact CB-CG1 3.92Å; K427-I901 HydrophobicContact CD-CG1 4.03Å; K427-I901 HydrophobicContact CG-CD1 3.91Å; K427-I901 HydrophobicContact CG-CG1 3.85Å; R428-I901 PolarHBondContact O-N 2.84Å; Y429-I901 HydrophobicContact CD2-CG2 4.41Å; F431-I901 VanDerWaalsContact CE2-O 3.28Å; F431-I901 WeakPolarHBondContact CE2-O 3.33Å; Y442-I901 HydrophobicContact CD1-CD1 3.5Å; Y442-I901 VanDerWaalsContact CD1-CD1 3.5Å; Y442-I901 HydrophobicContact CD2-CD1 4.02Å; Y442-I901 HydrophobicContact CE1-CD1 3.38Å; Y442-I901 HydrophobicContact CE2-CD1 3.93Å; Y442-I901 HydrophobicContact CG-CD1 3.81Å; F467-I901 HydrophobicContact CB-CG2 3.8Å; F467-I901 HydrophobicContact CD1-CG2 4Å; F467-I901 HydrophobicContact CD2-CG2 4.25Å; F467-I901 HydrophobicContact CG-CG2 3.76Å
902	V	93.9	Very high	75.8	Confident	17 Å²	17	51.1 Å²	51.1	10%	0.103	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-82.9	159.9	175.4	-67.5	0	0	0	0	110.1	L892 F895 F1094	L892-V902 HydrophobicContact CD2-CB 3.88Å; L892-V902 HydrophobicContact CD2-CG1 3.97Å; L892-V902 HydrophobicContact CD2-CG2 3.76Å; F895-V902 HydrophobicContact CB-CG1 3.7Å; V902-F1094 HydrophobicContact CB-CZ 4.47Å; V902-F1094 HydrophobicContact CG1-CZ 4.33Å
903	P	91.1	Very high	72.6	Confident	4 Å²	4	59.7 Å²	59.7	3%	0.026	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-56.1	147.8	169.5	-23.5	35.1	0	0	0	111.1	F431 R1093 F1094	F431-P903 HydrophobicContact CB-CG 3.88Å; F431-P903 HydrophobicContact CD1-CG 3.89Å; F431-P903 HydrophobicContact CD2-CG 3.99Å; F431-P903 HydrophobicContact CE1-CG 4.43Å; F431-P903 HydrophobicContact CG-CG 3.64Å; P903-R1093 HydrophobicContact CB-CG 4.22Å; P903-R1093 VanDerWaalsContact O-CZ 3.3Å; P903-R1093 PolarHBondContact O-NE 3.3Å; P903-R1093 PolarHBondContact O-NH2 2.9Å; P903-F1094 HydrophobicContact CG-CD1 4.44Å; P903-F1094 HydrophobicContact CG-CE1 4.34Å
904	D	89.1	Confident	69.2	Low	33 Å²	33	63.6 Å²	63.6	18%	0.176	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-72.8	149.8	168.5	-92.5	-3	0	0	0	109.3	G468 T469 N470	G468-D904 VanDerWaalsContact CA-OD1 3.23Å; G468-D904 WeakPolarHBondContact CA-OD1 3.19Å; G468-D904 VanDerWaalsContact N-CG 3.28Å; G468-D904 PolarHBondContact N-OD1 2.78Å; G468-D904 PolarHBondContact N-OD2 2.79Å; T469-D904 PolarHBondContact N-OD2 2.93Å; T469-D904 VanDerWaalsContact N-OD2 3.16Å; T469-D904 PolarHBondContact OG1-OD2 2.93Å; N470-D904 VanDerWaalsContact OD1-CB 3.23Å; N470-D904 WeakPolarHBondContact OD1-CB 3.19Å; N470-D904 PolarHBondContact OD1-OD2 2.76Å
905	P	85	Confident	65.8	Low	31 Å²	31	70.6 Å²	70.6	20%	0.201	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-53.9	143.8	173.9	-26.7	34.2	0	0	0	112	N470 V907	N470-P905 PolarHBondContact ND2-O 2.94Å; N470-P905 WeakPolarHBondContact OD1-CD 3.26Å; P905-V907 PolarHBondContact O-N 3.33Å
906	P	73.1	Confident	62.5	Low	76 Å²	76	80.9 Å²	80.9	49%	0.494	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-61.1	131.1	179.7	24.1	-33.3	0	0	0	111.4
907	V	59.2	Low	59.2	Low	70 Å²	70	87.3 Å²	87.3	42%	0.424	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-101.1	116.3	175.4	-177.5	0	0	0	0	108	N470 P905 H909	N470-V907 WeakPolarHBondContact ND2-CG2 3.15Å; P905-V907 PolarHBondContact O-N 3.33Å; V907-H909 PolarHBondContact O-CD2 3.28Å; V907-H909 PolarHBondContact O-N 3.22Å
908	S	43.5	Very low	56.1	Low	48 Å²	48	86.6 Å²	86.6	34%	0.336	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-57.5	122	171.4	162.6	0	0	0	0	109.3	E57 R910	E57-S908 WeakPolarHBondContact OE1-CB 3.42Å; E57-S908 PolarHBondContact OE1-OG 2.99Å; S908-R910 PolarHBondContact O-N 3.07Å
909	H	32.9	Very low	53.1	Low	164 Å²	164	86.8 Å²	86.8	76%	0.759	46%	0.46	S	S	*	.			trans	-84.9	50.1	-163.9	-94.5	-72	0	0	0	112.8	E57 V907 G911	E57-H909 PolarHBondContact OE1-N 2.77Å; E57-H909 PolarHBondContact OE2-N 2.84Å; E57-H909 VanDerWaalsContact OE2-N 3.07Å; V907-H909 PolarHBondContact O-CD2 3.28Å; V907-H909 PolarHBondContact O-N 3.22Å; H909-G911 PolarHBondContact O-N 3.23Å
910	R	27.8	Very low	50.1	Low	135 Å²	135	92.6 Å²	92.6	51%	0.509	47%	0.473	S	S	.	.			trans	-73	108.9	173.9	-63.9	-168.9	-179.8	-163.7	3	111	S908 E919	S908-R910 PolarHBondContact O-N 3.07Å; R910-E919 WeakPolarHBondContact CD-OE2 3.48Å; R910-E919 IonicContact CZ-OE1 2.63Å; R910-E919 VanDerWaalsContact CZ-OE1 3.27Å; R910-E919 IonicContact CZ-OE2 3.69Å; R910-E919 IonicContact NE-OE2 3.75Å; R910-E919 IonicContact NH1-OE1 3.91Å; R910-E919 PolarHBondContact NH1-OE1 3.29Å; R910-E919 IonicContact NH1-OE2 3.67Å; R910-E919 PolarHBondContact NH1-OE2 3.45Å; R910-E919 IonicContact NH2-OE1 3.9Å
911	G	26	Very low	47.1	Very low	46 Å²	46	93.1 Å²	93.1	47%	0.474	48%	0.477	S	S	.	.			trans	-60.9	159.2	-173.4	0	0	0	0	0	115.8	H909 H913	H909-G911 PolarHBondContact O-N 3.23Å; G911-H913 PolarHBondContact O-N 3.2Å
912	P	25.1	Very low	44.1	Very low	130 Å²	130	93.9 Å²	93.9	84%	0.844	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	26.1	-160.4	31.7	-39	0	0	0	116.5
913	H	27.4	Very low	41.2	Very low	190 Å²	190	97.1 Å²	97.1	88%	0.88	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.1	4	-177.5	-79.2	-9.3	0	0	0	115.3	G911	G911-H913 PolarHBondContact O-N 3.2Å
914	S	24.4	Very low	38.4	Very low	92 Å²	92	100.8 Å²	100.8	64%	0.643	52%	0.519	S	S	*	.	S	Bend	trans	-72.7	139.7	159.3	64.4	0	0	0	0	110	R916	S914-R916 PolarHBondContact O-N 2.64Å
915	N	23	Very low	35.6	Very low	149 Å²	149	101.6 Å²	101.6	80%	0.797	52%	0.522	S	S	*	.			trans	-92.4	105.8	-170.1	-152.9	-5.2	0	0	0	110.2
916	R	25.5	Very low	32.9	Very low	216 Å²	216	103 Å²	103	82%	0.815	53%	0.526	S	S	*	.	S	Bend	trans	30.8	96.2	162.2	-59.8	176.4	180	177.2	0.5	116.3	S914	S914-R916 PolarHBondContact O-N 2.64Å
917	H	26.5	Very low	30.9	Very low	169 Å²	169	101.2 Å²	101.2	78%	0.782	52%	0.517	S	S	*	.				176.4	138.9	128.6	-104	-83.9	0	0	0	112.6
918	D	27.4	Very low	29.6	Very low	92 Å²	92	100.9 Å²	100.9	49%	0.492	52%	0.515	S	S	.	.			trans	59.4	47.3	146.9	-76	-63.9	0	0	0	123.8	K349	K349-D918 IonicContact NZ-OD1 2.8Å; K349-D918 PolarHBondContact NZ-OD1 2.88Å
919	E	31.1	Very low	28.9	Very low	103 Å²	103	105.8 Å²	105.8	48%	0.481	53%	0.533	S	S	.	.			trans	-132.7	102.4	165.4	-87.5	169	157.5	0	0	114.1	R910	R910-E919 WeakPolarHBondContact CD-OE2 3.48Å; R910-E919 IonicContact CZ-OE1 2.63Å; R910-E919 VanDerWaalsContact CZ-OE1 3.27Å; R910-E919 IonicContact CZ-OE2 3.69Å; R910-E919 IonicContact NE-OE2 3.75Å; R910-E919 IonicContact NH1-OE1 3.91Å; R910-E919 PolarHBondContact NH1-OE1 3.29Å; R910-E919 IonicContact NH1-OE2 3.67Å; R910-E919 PolarHBondContact NH1-OE2 3.45Å; R910-E919 IonicContact NH2-OE1 3.9Å
920	W	30.3	Very low	28.7	Very low	150 Å²	150	106.2 Å²	106.2	57%	0.568	54%	0.541	S	S	*	.	S	Bend	trans	-159.8	21.9	158.4	-159.5	-24.2	0	0	0	110.5	F348 N470	F348-W920 HydrophobicContact CE2-CB 3.92Å; F348-W920 HydrophobicContact CE2-CD2 4.35Å; F348-W920 HydrophobicContact CE2-CG 4.16Å; F348-W920 HydrophobicContact CZ-CB 3.89Å; F348-W920 HydrophobicContact CZ-CG 4.27Å; N470-W920 HydrophobicContact CB-CH2 4.13Å; N470-W920 HydrophobicContact CB-CZ2 3.78Å
921	D	32.2	Very low	28.6	Very low	35 Å²	35	102.9 Å²	102.9	19%	0.187	54%	0.542	C	S	.	.	S	Bend	trans	-131.8	4.5	177.6	-70.7	-69.5	0	0	0	111.8	F348 K349 H733 I923	F348-D921 WeakPolarHBondContact CE1-OD1 3.19Å; F348-D921 WeakPolarHBondContact CZ-OD2 3.43Å; K349-D921 WeakPolarHBondContact CE-OD2 3.35Å; K349-D921 IonicContact NZ-OD2 3.39Å; H733-D921 IonicContact NE2-OD1 3.72Å; D921-I923 VanDerWaalsContact C-N 3.33Å; D921-I923 PolarHBondContact O-N 3.31Å
922	G	31.1	Very low	28.8	Very low	21 Å²	21	104.3 Å²	104.3	22%	0.216	56%	0.557	C	S	.	*			trans	-77.4	-7.8	-163.9	0	0	0	0	0	116.5	Q924 E925	G922-Q924 PolarHBondContact O-N 3.02Å; G922-E925 PolarHBondContact O-N 3.26Å
923	I	32.6	Very low	29.1	Very low	85 Å²	85	101 Å²	101	44%	0.436	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	74.9	-178.5	-48.2	177.7	0	0	0	110	R732 D921	R732-I923 PolarHBondContact NH2-O 2.87Å; D921-I923 VanDerWaalsContact C-N 3.33Å; D921-I923 PolarHBondContact O-N 3.31Å
924	Q	34	Very low	29.5	Very low	82 Å²	82	94.9 Å²	94.9	38%	0.383	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-176.6	-1.7	146.3	-112.6	176.1	-6.8	0	0	115	R732 G922	R732-Q924 VanDerWaalsContact NH2-CD 3.3Å; G922-Q924 PolarHBondContact O-N 3.02Å
925	E	29	Very low	30.2	Very low	49 Å²	49	96.5 Å²	96.5	23%	0.229	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-158.2	-4.9	-175.6	-131.4	175.6	153.6	0	0	117.9	R727 S728 G922 V928	R727-E925 VanDerWaalsContact CB-OE2 3.32Å; R727-E925 WeakPolarHBondContact CB-OE2 3.16Å; R727-E925 WeakPolarHBondContact CD-OE1 3.12Å; R727-E925 WeakPolarHBondContact CG-OE1 3.5Å; R727-E925 IonicContact CZ-OE1 2.92Å; R727-E925 PolarHBondContact N-OE2 3.37Å; R727-E925 IonicContact NH1-OE1 3.26Å; R727-E925 PolarHBondContact NH1-OE1 3.26Å; S728-E925 WeakPolarHBondContact CB-OE2 3.46Å; S728-E925 PolarHBondContact N-OE2 3.37Å; S728-E925 PolarHBondContact OG-OE2 2.98Å; G922-E925 PolarHBondContact O-N 3.26Å; E925-V928 WeakPolarHBondContact O-CG2 3.35Å
926	Q	29.2	Very low	31.3	Very low	61 Å²	61	95.4 Å²	95.4	29%	0.285	50%	0.499	S	S	.	.	S	Bend	trans	-114.5	3.1	-170.4	-77.3	-163.3	-72.9	0	0	117.4	N725 S726	N725-Q926 VanDerWaalsContact O-CG 3.25Å; N725-Q926 WeakPolarHBondContact O-CG 3.35Å; N725-Q926 PolarHBondContact O-NE2 3.11Å; S726-Q926 PolarHBondContact OG-OE1 3.22Å
927	A	30.8	Very low	32.6	Very low	38 Å²	38	93.1 Å²	93.1	31%	0.314	50%	0.495	S	S	.	.	S	Bend	trans	-86.7	10.4	163.9	0	0	0	0	0	113	N55	N55-A927 HydrophobicContact CB-CB 4.02Å; N55-A927 VanDerWaalsContact OD1-CB 3.28Å; N55-A927 WeakPolarHBondContact OD1-CB 3.3Å
928	V	32.5	Very low	34	Very low	64 Å²	64	88.9 Å²	88.9	39%	0.388	48%	0.483	S	S	.	.	S	Bend	trans	-85.3	-25	-162.5	178.7	0	0	0	0	114.1	E925	E925-V928 WeakPolarHBondContact O-CG2 3.35Å
929	E	28.9	Very low	35.9	Very low	150 Å²	150	87.8 Å²	87.8	70%	0.701	49%	0.486	S	S	*	.	S	Bend	trans	-97	-12.8	-159.1	-62.2	-168.3	136.2	0	0	116.9
930	D	26.9	Very low	37.9	Very low	173 Å²	173	85.6 Å²	85.6	93%	0.925	47%	0.474	S	S	*	.	S	Bend	trans	-133.9	9.3	-172.7	-107.4	-34.9	0	0	0	116
931	A	26.7	Very low	40.2	Very low	65 Å²	65	80.6 Å²	80.6	54%	0.537	46%	0.46	S	S	.	.	S	Bend	trans	-108.7	147.5	179.9	0	0	0	0	0	113.9
932	G	30.4	Very low	42.6	Very low	76 Å²	76	80.5 Å²	80.5	78%	0.784	47%	0.467	S	S	*	.			trans	-61.3	139.5	-170.6	0	0	0	0	0	115.3	G934	G932-G934 PolarHBondContact O-N 2.9Å; G932-G934 VanDerWaalsContact O-N 3.11Å
933	T	30.1	Very low	45.1	Very low	62 Å²	62	81 Å²	81	38%	0.38	47%	0.472	S	S	.	.			trans	-80.2	94	-170.2	60.3	0	0	0	0	114.2	S1289	T933-S1289 PolarHBondContact OG1-OG 3.44Å
934	G	36.2	Very low	47.7	Very low	61 Å²	61	78.5 Å²	78.5	63%	0.629	46%	0.46	S	S	*	.			trans	-151.9	145	169	0	0	0	0	0	113.3	G932	G932-G934 PolarHBondContact O-N 2.9Å; G932-G934 VanDerWaalsContact O-N 3.11Å
935	R	39.4	Very low	50.4	Low	125 Å²	125	76.3 Å²	76.3	47%	0.472	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-70.2	129.2	169	-173.6	178.7	-176.9	-177	-0.7	107.8
936	R	46.2	Very low	53.3	Low	126 Å²	126	74.8 Å²	74.8	48%	0.475	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-64	146.8	-173.9	-76.5	172	159.3	-174.8	-12.3	111.1	D56 E57	D56-R936 PolarHBondContact O-NH1 2.98Å; D56-R936 PolarHBondContact O-NH2 2.8Å; D56-R936 VanDerWaalsContact O-NH2 3.08Å; E57-R936 PolarHBondContact O-NH2 3.04Å; E57-R936 VanDerWaalsContact O-NH2 3.12Å
937	K	53.1	Low	56.1	Low	168 Å²	168	77.5 Å²	77.5	73%	0.73	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-68.8	143.7	176	-73.9	-174.7	177.9	-177.4	0	109.3	A939	K937-A939 PolarHBondContact O-N 2.71Å
938	P	56	Low	59	Low	81 Å²	81	76 Å²	76	53%	0.526	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-61.7	128.1	178.5	25.6	-34.3	0	0	0	110.8	V27 Y940	V27-P938 HydrophobicContact CG1-CG 4.33Å; P938-Y940 VanDerWaalsContact C-N 3.28Å; P938-Y940 PolarHBondContact O-N 2.8Å
939	A	66.7	Low	61.9	Low	68 Å²	68	76.9 Å²	76.9	56%	0.562	44%	0.444	S	S	*	.	S	Bend	trans	-76.4	-11.4	-173.9	0	0	0	0	0	114.4	K937	K937-A939 PolarHBondContact O-N 2.71Å
940	Y	74.7	Confident	64.8	Low	57 Å²	57	75.3 Å²	75.3	22%	0.224	44%	0.435	C	S	.	.	S	Bend	trans	-158.3	164.1	176	60.7	-82.7	0	0	0	110.6	P938 G942 Y1084 A1100 A1101 T1104	P938-Y940 VanDerWaalsContact C-N 3.28Å; P938-Y940 PolarHBondContact O-N 2.8Å; Y940-G942 PolarHBondContact O-N 3.5Å; Y940-Y1084 WeakPolarHBondContact CE2-OH 3.21Å; Y940-Y1084 PolarHBondContact OH-OH 3.02Å; Y940-A1100 HydrophobicContact CE1-CB 4.05Å; Y940-A1100 HydrophobicContact CE2-CB 3.88Å; Y940-A1101 HydrophobicContact CD2-CB 4.27Å; Y940-A1101 HydrophobicContact CG-CB 4.33Å; Y940-T1104 HydrophobicContact CE2-CG2 4.06Å
941	T	76.8	Confident	67.9	Low	45 Å²	45	67.7 Å²	67.7	28%	0.276	40%	0.397	S	S	.	.			trans	-74.6	122.7	179.8	-55	0	0	0	0	110.9	Y23 T1104 R1108	Y23-T941 PolarHBondContact OH-OG1 3.47Å; T941-T1104 WeakPolarHBondContact O-CB 3.23Å; T941-T1104 PolarHBondContact O-OG1 2.92Å; T941-R1108 PolarHBondContact O-NH1 2.79Å
942	G	83.7	Confident	71	Confident	33 Å²	33	67.3 Å²	67.3	34%	0.34	38%	0.383	S	S	.	.			trans	-77.5	-152.8	179	0	0	0	0	0	115.3	Y940 R1108	Y940-G942 PolarHBondContact O-N 3.5Å; G942-R1108 WeakPolarHBondContact O-CD 3.43Å; G942-R1108 PolarHBondContact O-NH1 3.16Å
943	G	83.2	Confident	73.9	Confident	31 Å²	31	65.1 Å²	65.1	32%	0.32	35%	0.351	S	S	.	.			trans	-64.6	160.7	176.8	0	0	0	0	0	113.9
944	L	88.1	Confident	76.8	Confident	33 Å²	33	67.4 Å²	67.4	17%	0.173	36%	0.361	C	S	.	.			trans	-89.1	137.2	176.7	172.1	63.8	0	0	0	110.1	L946 R1108 L1111 M1112 T1130	L944-L946 HydrophobicContact CD2-CD2 3.84Å; L944-L946 HydrophobicContact CG-CD2 4.13Å; L944-R1108 HydrophobicContact CB-CB 3.98Å; L944-R1108 HydrophobicContact CB-CG 3.75Å; L944-L1111 HydrophobicContact CB-CD2 4.14Å; L944-L1111 HydrophobicContact CD2-CB 4.38Å; L944-L1111 HydrophobicContact CD2-CD2 4.15Å; L944-L1111 HydrophobicContact CD2-CG 4.45Å; L944-L1111 HydrophobicContact CG-CD2 4.13Å; L944-M1112 HydrophobicContact CD1-CE 4.28Å; L944-M1112 HydrophobicContact CD2-CE 3.7Å; L944-M1112 HydrophobicContact CD2-CG 3.65Å; L944-M1112 HydrophobicContact CD2-SD 3.69Å; L944-T1130 WeakPolarHBondContact O-CA 3.31Å; L944-T1130 PolarHBondContact O-N 3.17Å
945	V	89.7	Confident	79.5	Confident	37 Å²	37	67.7 Å²	67.7	22%	0.224	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-121.9	117.7	167.1	-172	0	0	0	0	107.8	Y1127 K1179	V945-Y1127 HydrophobicContact CG1-CE2 3.73Å; V945-Y1127 WeakPolarHBondContact CG1-OH 3.5Å; V945-K1179 HydrophobicContact CB-CD 4.39Å; V945-K1179 HydrophobicContact CG1-CB 4.04Å; V945-K1179 HydrophobicContact CG1-CD 3.99Å; V945-K1179 HydrophobicContact CG1-CG 3.79Å; V945-K1179 WeakPolarHBondContact O-CE 3.31Å; V945-K1179 PolarHBondContact O-NZ 3.08Å
946	L	90.8	Very high	82.2	Confident	16 Å²	16	63.2 Å²	63.2	8%	0.084	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-66.8	153.3	178.2	-58.9	-178.5	0	0	0	110.3	L944 P948 M1112 R1115 V1125 G1128 K1179	L944-L946 HydrophobicContact CD2-CD2 3.84Å; L944-L946 HydrophobicContact CG-CD2 4.13Å; L946-P948 WeakPolarHBondContact O-CD 3.4Å; L946-M1112 HydrophobicContact CD2-SD 4.05Å; L946-R1115 HydrophobicContact CD1-CB 4.5Å; L946-V1125 HydrophobicContact CD1-CG1 4.06Å; L946-G1128 PolarHBondContact N-O 2.9Å; L946-K1179 WeakPolarHBondContact O-CE 3.33Å
947	E	88	Confident	84.6	Confident	118 Å²	118	57.2 Å²	57.2	55%	0.551	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-72.8	122.4	172.9	-164.2	60.7	-141.8	0	0	109.4	K1179	E947-K1179 WeakPolarHBondContact OE2-CE 3.43Å; E947-K1179 IonicContact OE2-NZ 3.69Å; E947-K1179 PolarHBondContact OE2-NZ 2.78Å
948	P	90.8	Very high	86.7	Confident	8 Å²	8	49.2 Å²	49.2	5%	0.052	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-69.8	136.7	-178.4	26.9	-35.9	0	0	0	112	L946 K950 I1126 Y1127 L1176 K1179	L946-P948 WeakPolarHBondContact O-CD 3.4Å; P948-K950 VanDerWaalsContact C-N 3.28Å; P948-K950 HydrophobicContact CG-CG 4.41Å; P948-K950 PolarHBondContact O-N 3.49Å; P948-I1126 WeakPolarHBondContact CA-O 3.22Å; P948-Y1127 HydrophobicContact CB-CD2 3.74Å; P948-Y1127 HydrophobicContact CB-CE2 4.39Å; P948-Y1127 HydrophobicContact CB-CG 4.48Å; P948-Y1127 HydrophobicContact CG-CD2 4.42Å; P948-L1176 HydrophobicContact CB-CD1 3.83Å; P948-L1176 HydrophobicContact CB-CD2 3.71Å; P948-L1176 HydrophobicContact CB-CG 3.76Å; P948-K1179 HydrophobicContact CG-CG 4.33Å
949	K	93.5	Very high	88.6	Confident	82 Å²	82	45.7 Å²	45.7	36%	0.357	25%	0.248	S	C	.	.			trans	-71.4	87.9	161.8	-65.5	179.8	-175.2	157.4	0	107.9	G951 Y953 E1119 E1124 V1125 I1126 L1176	K949-G951 PolarHBondContact O-N 3.05Å; K949-Y953 WeakPolarHBondContact CB-OH 3.26Å; K949-Y953 PolarHBondContact O-OH 3.49Å; K949-E1119 IonicContact NZ-OE1 3.84Å; K949-E1124 HydrophobicContact CD-CG 4.24Å; K949-E1124 WeakPolarHBondContact CD-OE1 3.45Å; K949-E1124 IonicContact NZ-OE1 2.67Å; K949-V1125 WeakPolarHBondContact CE-O 3.47Å; K949-V1125 PolarHBondContact NZ-O 3.36Å; K949-I1126 HydrophobicContact CB-CB 4.37Å; K949-I1126 HydrophobicContact CD-CG2 4.48Å; K949-I1126 PolarHBondContact N-O 3.13Å; K949-L1176 WeakPolarHBondContact O-CD2 3.46Å
950	K	90.5	Very high	90	Very high	117 Å²	117	42.5 Å²	42.5	51%	0.509	22%	0.221	S	C	.	.			trans	-58.8	128.5	-175.3	-56.2	172.6	-171.2	156.9	0	109.8	P948 L1176 L1177	P948-K950 VanDerWaalsContact C-N 3.28Å; P948-K950 HydrophobicContact CG-CG 4.41Å; P948-K950 PolarHBondContact O-N 3.49Å; K950-L1176 CarbonylContact C-O 3.57Å; K950-L1176 WeakPolarHBondContact CA-O 3.38Å; K950-L1177 WeakPolarHBondContact CG-O 3.49Å
951	G	90.7	Very high	90.9	Very high	12 Å²	12	41.5 Å²	41.5	12%	0.124	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	179.1	-173.9	0	0	0	0	0	115.2	K949 L1176	K949-G951 PolarHBondContact O-N 3.05Å; G951-L1176 PolarHBondContact N-O 2.92Å; G951-L1176 PolarHBondContact O-N 2.71Å
952	F	91.9	Very high	91.7	Very high	58 Å²	58	39.4 Å²	39.4	25%	0.254	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	123	169.6	178.3	-93.4	0	0	0	109.5	D954 M1174 L1175 L1241 L1242	F952-D954 HydrophobicContact CE1-CB 4.12Å; F952-M1174 WeakPolarHBondContact CA-O 3.35Å; F952-L1175 HydrophobicContact CB-CD1 4.34Å; F952-L1175 HydrophobicContact CD2-CB 4.28Å; F952-L1175 HydrophobicContact CD2-CD1 4.2Å; F952-L1241 VanDerWaalsContact CE2-O 3.29Å; F952-L1241 WeakPolarHBondContact CE2-O 3.49Å; F952-L1241 VanDerWaalsContact CZ-O 3.3Å; F952-L1241 WeakPolarHBondContact CZ-O 3.15Å; F952-L1242 HydrophobicContact CE2-CD2 4.27Å
953	Y	93.1	Very high	91.9	Very high	30 Å²	30	40.7 Å²	40.7	12%	0.118	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.7	-177.1	-64.8	-91.1	0	0	0	109.8	K949 I957 I1126 A1173 M1174	K949-Y953 WeakPolarHBondContact CB-OH 3.26Å; K949-Y953 PolarHBondContact O-OH 3.49Å; Y953-I957 HydrophobicContact CD1-CD1 3.97Å; Y953-I957 HydrophobicContact CG-CD1 4.03Å; Y953-I1126 HydrophobicContact CD2-CD1 4.04Å; Y953-I1126 HydrophobicContact CE1-CD1 4.3Å; Y953-I1126 HydrophobicContact CE1-CG2 3.8Å; Y953-I1126 HydrophobicContact CE2-CD1 3.79Å; Y953-I1126 HydrophobicContact CG-CD1 4.41Å; Y953-I1126 WeakPolarHBondContact OH-CG2 3.4Å; Y953-A1173 CarbonylContact O-C 3.58Å; Y953-A1173 VanDerWaalsContact O-CA 3.27Å; Y953-A1173 WeakPolarHBondContact O-CA 3.32Å; Y953-M1174 PolarHBondContact N-O 3.1Å; Y953-M1174 PolarHBondContact O-N 3.17Å
954	D	90.2	Very high	92.1	Very high	109 Å²	109	40.1 Å²	40.1	58%	0.583	20%	0.197	S	C	*	.			trans	-104.1	16.1	-177.4	62	-19.6	0	0	0	113.2	F952	F952-D954 HydrophobicContact CE1-CB 4.12Å
955	K	92.7	Very high	92.2	Very high	68 Å²	68	38.6 Å²	38.6	30%	0.296	19%	0.189	S	C	.	.	S	Bend	trans	-131.7	166.5	-176.3	-51.1	-179.6	-167.2	176.6	0	110	I957 N1138 T1140	K955-I957 PolarHBondContact O-N 3.34Å; K955-N1138 VanDerWaalsContact CD-C 3.49Å; K955-N1138 HydrophobicContact CD-CB 4.49Å; K955-N1138 WeakPolarHBondContact CD-O 3.49Å; K955-N1138 PolarHBondContact NZ-OD1 2.87Å; K955-T1140 HydrophobicContact CG-CG2 4.44Å
956	Y	95.8	Very high	92.4	Very high	31 Å²	31	37.8 Å²	37.8	12%	0.122	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-64.3	121.6	-178.7	-73.1	-63.7	0	0	0	112.5	T1137 T1139 T1140 L1142 A1145 V1170 Y1171 A1172 V1187	Y956-T1137 WeakPolarHBondContact O-CB 3.34Å; Y956-T1137 WeakPolarHBondContact O-CG2 3.35Å; Y956-T1137 PolarHBondContact O-N 3.39Å; Y956-T1137 PolarHBondContact O-OG1 2.96Å; Y956-T1139 WeakPolarHBondContact CD2-O 3.38Å; Y956-T1139 PolarHBondContact N-O 2.91Å; Y956-T1140 WeakPolarHBondContact CE2-O 3.35Å; Y956-L1142 HydrophobicContact CD1-CD1 4.3Å; Y956-L1142 HydrophobicContact CE1-CB 4.49Å; Y956-L1142 HydrophobicContact CE1-CD1 4.1Å; Y956-L1142 HydrophobicContact CE2-CB 3.85Å; Y956-A1145 HydrophobicContact CD2-CB 4.34Å; Y956-A1145 HydrophobicContact CG-CB 4.25Å; Y956-V1170 HydrophobicContact CD1-CG1 3.71Å; Y956-V1170 HydrophobicContact CG-CG1 4.22Å; Y956-Y1171 VanDerWaalsContact CA-O 3.31Å; Y956-Y1171 WeakPolarHBondContact CA-O 3.37Å; Y956-A1172 HydrophobicContact CD1-CB 4.24Å; Y956-A1172 HydrophobicContact CE1-CB 3.73Å; Y956-V1187 HydrophobicContact CE1-CG2 3.98Å
957	I	97.3	Very high	92.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	131.6	167	-51.6	-55.1	0	0	0	108.1	Y953 K955 I1126 M1134 V1135 N1136 V1170 Y1171 M1174	Y953-I957 HydrophobicContact CD1-CD1 3.97Å; Y953-I957 HydrophobicContact CG-CD1 4.03Å; K955-I957 PolarHBondContact O-N 3.34Å; I957-I1126 HydrophobicContact CD1-CD1 3.87Å; I957-I1126 HydrophobicContact CG1-CD1 4.13Å; I957-I1126 HydrophobicContact CG2-CD1 3.93Å; I957-I1126 HydrophobicContact CG2-CG1 4.48Å; I957-M1134 HydrophobicContact CG2-CB 4.14Å; I957-V1135 WeakPolarHBondContact CA-O 3.25Å; I957-N1136 HydrophobicContact CD1-CB 3.8Å; I957-V1170 CarbonylContact O-C 3.46Å; I957-V1170 WeakPolarHBondContact O-CA 3.43Å; I957-V1170 WeakPolarHBondContact O-CG1 3.36Å; I957-Y1171 PolarHBondContact N-O 3.27Å; I957-Y1171 PolarHBondContact O-N 3.23Å; I957-M1174 HydrophobicContact CG1-CB 4.21Å; I957-M1174 HydrophobicContact CG1-SD 4.37Å; I957-M1174 HydrophobicContact CG2-SD 4.32Å
958	L	96.9	Very high	92.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	133.6	168.7	-71.8	163.3	0	0	0	109.5	L960 M1134 V1135 T1137 I1148 I1152 T1167 V1170	L958-L960 HydrophobicContact CB-CD2 4.46Å; L958-L960 HydrophobicContact CB-CG 4.45Å; L958-M1134 WeakPolarHBondContact O-CA 3.16Å; L958-V1135 HydrophobicContact CB-CB 4.43Å; L958-V1135 PolarHBondContact N-O 3.35Å; L958-V1135 PolarHBondContact O-N 3.46Å; L958-T1137 HydrophobicContact CD1-CG2 3.56Å; L958-T1137 HydrophobicContact CG-CG2 3.61Å; L958-I1148 HydrophobicContact CD1-CB 4.25Å; L958-I1148 HydrophobicContact CD1-CG2 3.85Å; L958-I1152 HydrophobicContact CD1-CD1 4.23Å; L958-T1167 HydrophobicContact CD2-CG2 4.29Å; L958-V1170 HydrophobicContact CD2-CG2 4.17Å
959	L	96	Very high	92.8	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.037	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	113.8	162.9	176.9	60.4	0	0	0	107.8	M1134 D1168 G1169 Y1171	L959-M1134 HydrophobicContact CD1-CE 3.84Å; L959-M1134 HydrophobicContact CD1-CG 3.83Å; L959-D1168 HydrophobicContact CD2-CB 4.47Å; L959-D1168 WeakPolarHBondContact CD2-OD2 3.41Å; L959-D1168 HydrophobicContact CG-CB 4.35Å; L959-D1168 PolarHBondContact O-N 3.39Å; L959-G1169 PolarHBondContact N-O 2.82Å; L959-G1169 PolarHBondContact O-N 2.95Å; L959-Y1171 HydrophobicContact CB-CE2 4.25Å; L959-Y1171 HydrophobicContact CD2-CE2 4.16Å
960	L	95.8	Very high	92.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.6	174.6	-52.2	177.2	0	0	0	108.4	L958 S1132 I1133 I1152 L1165 D1166 T1167	L958-L960 HydrophobicContact CB-CD2 4.46Å; L958-L960 HydrophobicContact CB-CG 4.45Å; L960-S1132 CarbonylContact O-C 3.54Å; L960-S1132 WeakPolarHBondContact O-CA 3.12Å; L960-I1133 HydrophobicContact CB-CG2 3.88Å; L960-I1133 PolarHBondContact N-O 3.4Å; L960-I1133 PolarHBondContact O-N 2.99Å; L960-I1152 HydrophobicContact CD1-CB 3.86Å; L960-I1152 HydrophobicContact CD1-CD1 3.88Å; L960-I1152 HydrophobicContact CD1-CG1 4.49Å; L960-I1152 HydrophobicContact CD1-CG2 3.46Å; L960-I1152 VanDerWaalsContact CD1-CG2 3.46Å; L960-L1165 HydrophobicContact CB-CD1 4.23Å; L960-L1165 HydrophobicContact CB-CD2 3.99Å; L960-L1165 HydrophobicContact CB-CG 4.16Å; L960-L1165 HydrophobicContact CD1-CD2 4.05Å; L960-D1166 VanDerWaalsContact CA-O 3.3Å; L960-D1166 WeakPolarHBondContact CA-O 3.31Å; L960-T1167 HydrophobicContact CD2-CG2 4.05Å; L960-T1167 WeakPolarHBondContact CD2-OG1 3.34Å
961	D	94.1	Very high	92.8	Very high	36 Å²	36	22.9 Å²	22.9	19%	0.193	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	149.4	-174.2	-177.8	49.4	0	0	0	112.3	D1131 L1165 D1166 D1168	D961-D1131 VanDerWaalsContact OD1-C 3.3Å; D961-D1131 WeakPolarHBondContact OD1-CB 3.4Å; D961-L1165 WeakPolarHBondContact O-CA 3.45Å; D961-D1166 PolarHBondContact N-O 3.19Å; D961-D1166 PolarHBondContact O-N 3.1Å; D961-D1168 HydrophobicContact CB-CB 4.11Å
962	F	93.2	Very high	92.9	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.009	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	116.9	179.4	-82.6	-65.5	0	0	0	111.7	S964 L965 V1110 T1114 D1131 V1156 Y1160 L1163 L1165	F962-S964 PolarHBondContact O-N 3.2Å; F962-L965 HydrophobicContact CB-CB 4.06Å; F962-L965 HydrophobicContact CB-CD1 3.85Å; F962-L965 HydrophobicContact CD2-CD1 3.98Å; F962-L965 HydrophobicContact CG-CD1 3.95Å; F962-L965 PolarHBondContact O-N 2.94Å; F962-V1110 HydrophobicContact CD2-CG1 4.38Å; F962-V1110 HydrophobicContact CE1-CG1 4.48Å; F962-V1110 HydrophobicContact CE2-CG1 3.69Å; F962-V1110 HydrophobicContact CZ-CG1 3.75Å; F962-T1114 HydrophobicContact CE2-CG2 4.36Å; F962-T1114 HydrophobicContact CZ-CG2 4.32Å; F962-T1114 WeakPolarHBondContact CZ-OG1 3.33Å; F962-D1131 HydrophobicContact CB-CB 4.25Å; F962-D1131 VanDerWaalsContact CD2-O 3.31Å; F962-D1131 WeakPolarHBondContact CD2-O 3.38Å; F962-D1131 PolarHBondContact N-O 3.33Å; F962-V1156 HydrophobicContact CE1-CG1 4.08Å; F962-V1156 HydrophobicContact CZ-CG1 3.96Å; F962-Y1160 HydrophobicContact CZ-CE2 4.48Å; F962-L1163 HydrophobicContact CB-CD1 4.23Å; F962-L1163 HydrophobicContact CD1-CD1 3.64Å; F962-L1163 HydrophobicContact CD1-CD2 3.92Å; F962-L1163 HydrophobicContact CD1-CG 3.59Å; F962-L1163 HydrophobicContact CE1-CD1 4.29Å; F962-L1163 HydrophobicContact CE1-CD2 3.72Å; F962-L1163 HydrophobicContact CE1-CG 3.73Å; F962-L1163 HydrophobicContact CG-CD1 4.15Å; F962-L1163 HydrophobicContact CG-CG 4.48Å; F962-L1163 HydrophobicContact CZ-CD2 4.27Å; F962-L1165 HydrophobicContact CD1-CB 3.92Å; F962-L1165 HydrophobicContact CD1-CD1 3.81Å; F962-L1165 HydrophobicContact CD2-CD1 3.84Å; F962-L1165 HydrophobicContact CE1-CB 3.73Å; F962-L1165 HydrophobicContact CE1-CD1 3.85Å; F962-L1165 HydrophobicContact CE1-CG 4.38Å; F962-L1165 HydrophobicContact CE2-CD1 3.86Å; F962-L1165 HydrophobicContact CG-CD1 3.81Å; F962-L1165 HydrophobicContact CZ-CB 4.39Å; F962-L1165 HydrophobicContact CZ-CD1 3.87Å
963	N	88.5	Confident	92.9	Very high	59 Å²	59	19.7 Å²	19.7	32%	0.316	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	99.7	-178.1	-84	-85.6	0	0	0	112.6	S968 E1164 D1166	N963-S968 PolarHBondContact O-OG 3.07Å; N963-E1164 PolarHBondContact N-O 2.97Å; N963-E1164 PolarHBondContact ND2-O 2.86Å; N963-D1166 WeakPolarHBondContact ND2-CB 3.31Å
964	S	86.6	Confident	92.9	Very high	20 Å²	20	18.8 Å²	18.8	14%	0.14	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	62.6	-176.2	-73.4	0	0	0	0	112.3	F962 Y966 P967 S968 N1081	F962-S964 PolarHBondContact O-N 3.2Å; S964-Y966 PolarHBondContact O-N 3.41Å; S964-P967 WeakPolarHBondContact O-CD 3.48Å; S964-S968 WeakPolarHBondContact O-CB 3.3Å; S964-S968 PolarHBondContact O-N 2.78Å; S964-S968 PolarHBondContact O-OG 3.22Å; S964-N1081 PolarHBondContact OG-OD1 3.44Å
965	L	91.2	Very high	92.9	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-41.1	-60.6	-172.9	179.2	71.2	0	0	0	114.9	F962 S968 I969 V1110 T1130 D1131 L1163	F962-L965 HydrophobicContact CB-CB 4.06Å; F962-L965 HydrophobicContact CB-CD1 3.85Å; F962-L965 HydrophobicContact CD2-CD1 3.98Å; F962-L965 HydrophobicContact CG-CD1 3.95Å; F962-L965 PolarHBondContact O-N 2.94Å; L965-S968 CarbonylContact O-C 3.59Å; L965-S968 PolarHBondContact O-N 2.92Å; L965-S968 VanDerWaalsContact O-N 3.11Å; L965-I969 HydrophobicContact CD1-CD1 3.65Å; L965-I969 HydrophobicContact CD1-CG1 4.07Å; L965-I969 HydrophobicContact CD2-CD1 4.39Å; L965-I969 HydrophobicContact CG-CD1 3.79Å; L965-I969 HydrophobicContact CG-CG1 4.4Å; L965-I969 WeakPolarHBondContact O-CB 3.39Å; L965-I969 WeakPolarHBondContact O-CG1 3.04Å; L965-I969 PolarHBondContact O-N 3.32Å; L965-V1110 HydrophobicContact CD1-CG1 4.28Å; L965-T1130 WeakPolarHBondContact CD2-O 3.37Å; L965-D1131 HydrophobicContact CB-CB 3.68Å; L965-D1131 HydrophobicContact CD2-CB 3.85Å; L965-D1131 HydrophobicContact CG-CB 4.31Å; L965-L1163 HydrophobicContact CD1-CD1 3.97Å; L965-L1163 HydrophobicContact CD1-CD2 4.33Å
966	Y	93.2	Very high	92.9	Very high	19 Å²	19	10.4 Å²	10.4	8%	0.075	5%	0.054	C	C	.	.	H	α-helix	trans	-64.6	-47.5	-175.6	-60.1	-27.6	0	0	0	113.4	Y44 S964 S968 I969 I970 Y1084 V1103 T1104 T1130	Y44-Y966 HydrophobicContact CE2-CD2 4.25Å; S964-Y966 PolarHBondContact O-N 3.41Å; Y966-S968 PolarHBondContact O-N 2.98Å; Y966-I969 PolarHBondContact O-N 2.96Å; Y966-I970 VanDerWaalsContact O-CG1 3.3Å; Y966-I970 WeakPolarHBondContact O-CG1 3.19Å; Y966-I970 PolarHBondContact O-N 3.39Å; Y966-Y1084 AromaticContact CD2-CD1 3.71Å; Y966-Y1084 HydrophobicContact CD2-CD1 3.71Å; Y966-Y1084 HydrophobicContact CD2-CD2 4.06Å; Y966-Y1084 AromaticContact CD2-CE1 3.84Å; Y966-Y1084 HydrophobicContact CD2-CE1 3.84Å; Y966-Y1084 HydrophobicContact CD2-CE2 4.19Å; Y966-Y1084 AromaticContact CD2-CG 3.81Å; Y966-Y1084 HydrophobicContact CD2-CG 3.81Å; Y966-Y1084 HydrophobicContact CE2-CD1 4.2Å; Y966-Y1084 AromaticContact CE2-CE1 3.86Å; Y966-Y1084 HydrophobicContact CE2-CE1 3.86Å; Y966-Y1084 HydrophobicContact CE2-CE2 4.37Å; Y966-Y1084 AromaticContact CE2-CZ 3.95Å; Y966-Y1084 HydrophobicContact CG-CD2 4.36Å; Y966-Y1084 HydrophobicContact CG-CG 4.34Å; Y966-V1103 HydrophobicContact CD1-CG1 3.75Å; Y966-V1103 HydrophobicContact CG-CG1 3.84Å; Y966-T1104 HydrophobicContact CE1-CG2 4.39Å; Y966-T1130 WeakPolarHBondContact OH-CG2 3.34Å
967	P	91.1	Very high	92.7	Very high	2 Å²	2	9.1 Å²	9.1	1%	0.013	5%	0.049	C	C	.	.	H	α-helix	trans	-52.8	-34	167.7	-31	36.3	0	0	0	115	S964 Q971 I1041 A1080	S964-P967 WeakPolarHBondContact O-CD 3.48Å; P967-Q971 WeakPolarHBondContact O-CG 3.48Å; P967-Q971 PolarHBondContact O-NE2 3.31Å; P967-I1041 HydrophobicContact CB-CG2 3.78Å; P967-A1080 WeakPolarHBondContact CG-O 3.43Å
968	S	92.3	Very high	92.3	Very high	11 Å²	11	11.1 Å²	11.1	8%	0.077	6%	0.061	C	C	.	.	H	α-helix	trans	-78	-42.1	178.6	-65.6	0	0	0	0	112.1	N963 S964 L965 Y966 I970 Q971 E972	N963-S968 PolarHBondContact O-OG 3.07Å; S964-S968 WeakPolarHBondContact O-CB 3.3Å; S964-S968 PolarHBondContact O-N 2.78Å; S964-S968 PolarHBondContact O-OG 3.22Å; L965-S968 CarbonylContact O-C 3.59Å; L965-S968 PolarHBondContact O-N 2.92Å; L965-S968 VanDerWaalsContact O-N 3.11Å; Y966-S968 PolarHBondContact O-N 2.98Å; S968-I970 VanDerWaalsContact C-N 3.34Å; S968-I970 PolarHBondContact O-N 2.73Å; S968-Q971 PolarHBondContact O-N 3.19Å; S968-Q971 VanDerWaalsContact O-N 3.12Å; S968-E972 WeakPolarHBondContact O-CB 3.44Å; S968-E972 PolarHBondContact O-N 3.23Å
969	I	93.6	Very high	91.9	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-58.4	-42.9	173.1	-77.6	178.7	0	0	0	111.7	L965 Y966 Q971 E972 F973 I975 V1103 L1106 G1107	L965-I969 HydrophobicContact CD1-CD1 3.65Å; L965-I969 HydrophobicContact CD1-CG1 4.07Å; L965-I969 HydrophobicContact CD2-CD1 4.39Å; L965-I969 HydrophobicContact CG-CD1 3.79Å; L965-I969 HydrophobicContact CG-CG1 4.4Å; L965-I969 WeakPolarHBondContact O-CB 3.39Å; L965-I969 WeakPolarHBondContact O-CG1 3.04Å; L965-I969 PolarHBondContact O-N 3.32Å; Y966-I969 PolarHBondContact O-N 2.96Å; I969-Q971 PolarHBondContact O-N 3.4Å; I969-E972 PolarHBondContact O-N 2.89Å; I969-F973 HydrophobicContact CG2-CD2 4.05Å; I969-F973 PolarHBondContact O-N 3.14Å; I969-F973 VanDerWaalsContact O-N 3.08Å; I969-I975 HydrophobicContact CG2-CD1 3.81Å; I969-V1103 HydrophobicContact CG2-CG1 4.25Å; I969-L1106 HydrophobicContact CD1-CB 4.39Å; I969-L1106 HydrophobicContact CG2-CB 3.92Å; I969-L1106 HydrophobicContact CG2-CD1 4.12Å; I969-G1107 VanDerWaalsContact CD1-CA 3.46Å
970	I	93.3	Very high	91.3	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-59.4	-37.9	177.3	-69.6	164.6	0	0	0	111	Y966 S968 N974 I975 L1037 P1038 I1041 V1103	Y966-I970 VanDerWaalsContact O-CG1 3.3Å; Y966-I970 WeakPolarHBondContact O-CG1 3.19Å; Y966-I970 PolarHBondContact O-N 3.39Å; S968-I970 VanDerWaalsContact C-N 3.34Å; S968-I970 PolarHBondContact O-N 2.73Å; I970-N974 CarbonylContact O-C 3.49Å; I970-N974 WeakPolarHBondContact O-CA 3.44Å; I970-N974 PolarHBondContact O-N 2.94Å; I970-I975 HydrophobicContact CG2-CB 4.47Å; I970-I975 WeakPolarHBondContact CG2-O 3.37Å; I970-I975 PolarHBondContact O-N 3.07Å; I970-L1037 HydrophobicContact CG2-CD2 4.27Å; I970-L1037 HydrophobicContact CG2-CG 4.13Å; I970-P1038 HydrophobicContact CG2-CG 4Å; I970-P1038 WeakPolarHBondContact O-CG 3.33Å; I970-I1041 HydrophobicContact CB-CD1 4.12Å; I970-I1041 HydrophobicContact CD1-CD1 3.86Å; I970-I1041 HydrophobicContact CG2-CD1 3.71Å; I970-V1103 HydrophobicContact CD1-CG2 4.2Å; I970-V1103 HydrophobicContact CG1-CG1 4.41Å; I970-V1103 HydrophobicContact CG1-CG2 3.66Å
971	Q	92.5	Very high	90.5	Very high	14 Å²	14	16.4 Å²	16.4	7%	0.065	9%	0.091	C	C	.	.	H	α-helix	trans	-79.1	-36.6	177.1	-68.9	171.5	85.9	0	0	113.8	P967 S968 I969 I1041 R1042 L1162	P967-Q971 WeakPolarHBondContact O-CG 3.48Å; P967-Q971 PolarHBondContact O-NE2 3.31Å; S968-Q971 PolarHBondContact O-N 3.19Å; S968-Q971 VanDerWaalsContact O-N 3.12Å; I969-Q971 PolarHBondContact O-N 3.4Å; Q971-I1041 HydrophobicContact CG-CB 4.49Å; Q971-I1041 HydrophobicContact CG-CG2 4.2Å; Q971-R1042 VanDerWaalsContact OE1-CA 3.28Å; Q971-R1042 VanDerWaalsContact OE1-CB 3.3Å; Q971-L1162 HydrophobicContact CB-CD1 3.93Å
972	E	91.4	Very high	89.5	Confident	3 Å²	3	16 Å²	16	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-55.3	-178.5	-172.9	63.8	-152.3	0	0	110.5	S968 I969 R1161 L1162 L1163	S968-E972 WeakPolarHBondContact O-CB 3.44Å; S968-E972 PolarHBondContact O-N 3.23Å; I969-E972 PolarHBondContact O-N 2.89Å; E972-R1161 PolarHBondContact O-NH2 3.25Å; E972-R1161 WeakPolarHBondContact OE1-CB 3.35Å; E972-R1161 PolarHBondContact OE1-N 2.78Å; E972-R1161 PolarHBondContact OE2-N 2.87Å; E972-L1162 WeakPolarHBondContact OE2-CA 3.31Å; E972-L1162 VanDerWaalsContact OE2-CB 3.27Å; E972-L1162 WeakPolarHBondContact OE2-CB 3.2Å; E972-L1162 PolarHBondContact OE2-N 3.34Å; E972-L1163 PolarHBondContact OE2-N 3.14Å
973	F	91.8	Very high	88.3	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	12.1	-176.5	-58.8	-83.6	0	0	0	113.3	I969 I975 L1004 I1005 V1008 P1029 L1106	I969-F973 HydrophobicContact CG2-CD2 4.05Å; I969-F973 PolarHBondContact O-N 3.14Å; I969-F973 VanDerWaalsContact O-N 3.08Å; F973-I975 VanDerWaalsContact C-N 3.35Å; F973-I975 HydrophobicContact CB-CD1 4.22Å; F973-I975 HydrophobicContact CB-CG1 3.96Å; F973-I975 PolarHBondContact O-N 2.84Å; F973-L1004 HydrophobicContact CD1-CB 3.96Å; F973-L1004 HydrophobicContact CE1-CB 4.21Å; F973-I1005 HydrophobicContact CE1-CG1 4.21Å; F973-I1005 HydrophobicContact CZ-CG1 4.11Å; F973-V1008 HydrophobicContact CD1-CG2 3.84Å; F973-V1008 HydrophobicContact CE1-CB 4.17Å; F973-V1008 HydrophobicContact CE1-CG2 3.52Å; F973-V1008 HydrophobicContact CZ-CG2 4.37Å; F973-P1029 WeakPolarHBondContact O-CB 3.18Å; F973-L1106 HydrophobicContact CB-CD1 4.14Å; F973-L1106 HydrophobicContact CD1-CD2 4.16Å; F973-L1106 HydrophobicContact CD2-CD1 3.94Å; F973-L1106 HydrophobicContact CD2-CD2 4.27Å; F973-L1106 HydrophobicContact CE1-CD2 4Å; F973-L1106 HydrophobicContact CE2-CB 4.47Å; F973-L1106 HydrophobicContact CE2-CD2 4.12Å; F973-L1106 HydrophobicContact CG-CD1 3.97Å; F973-L1106 HydrophobicContact CG-CD2 4.29Å; F973-L1106 HydrophobicContact CZ-CD2 3.99Å
974	N	92.7	Very high	87.3	Confident	11 Å²	11	17.4 Å²	17.4	6%	0.059	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	44.4	176.9	-165.9	22.2	0	0	0	114.6	I970 C976 T979 P1029 Q1032 E1033 P1034 G1035	I970-N974 CarbonylContact O-C 3.49Å; I970-N974 WeakPolarHBondContact O-CA 3.44Å; I970-N974 PolarHBondContact O-N 2.94Å; N974-C976 PolarHBondContact O-N 2.81Å; N974-T979 WeakPolarHBondContact O-CB 3.42Å; N974-T979 PolarHBondContact O-OG1 2.91Å; N974-P1029 HydrophobicContact CB-CB 4.28Å; N974-P1029 WeakPolarHBondContact CB-O 3.35Å; N974-P1029 PolarHBondContact ND2-O 3.27Å; N974-Q1032 PolarHBondContact ND2-O 3.02Å; N974-E1033 PolarHBondContact ND2-O 3.32Å; N974-P1034 WeakPolarHBondContact OD1-CA 3.4Å; N974-G1035 PolarHBondContact OD1-N 2.75Å
975	I	92	Very high	86	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.088	C	C	.	.			trans	-79.2	113.4	-171.1	-54.3	171.4	0	0	0	110.3	I969 I970 F973 V980 P1038 L1099 L1102 V1103 L1106	I969-I975 HydrophobicContact CG2-CD1 3.81Å; I970-I975 HydrophobicContact CG2-CB 4.47Å; I970-I975 WeakPolarHBondContact CG2-O 3.37Å; I970-I975 PolarHBondContact O-N 3.07Å; F973-I975 VanDerWaalsContact C-N 3.35Å; F973-I975 HydrophobicContact CB-CD1 4.22Å; F973-I975 HydrophobicContact CB-CG1 3.96Å; F973-I975 PolarHBondContact O-N 2.84Å; I975-V980 HydrophobicContact CG2-CG2 4.22Å; I975-P1038 WeakPolarHBondContact O-CD 3.21Å; I975-P1038 WeakPolarHBondContact O-CG 3.44Å; I975-L1099 HydrophobicContact CG2-CD2 4.23Å; I975-L1102 HydrophobicContact CG2-CD2 4.33Å; I975-V1103 HydrophobicContact CD1-CG2 3.72Å; I975-V1103 HydrophobicContact CG2-CG2 4.2Å; I975-L1106 HydrophobicContact CD1-CD1 3.56Å; I975-L1106 HydrophobicContact CG1-CD1 4.47Å
976	C	92	Very high	84.4	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.099	C	C	.	.			trans	-149.1	155.3	179.8	-167.1	0	0	0	0	111.3	N974 T978 T979 V980 L1037 P1038	N974-C976 PolarHBondContact O-N 2.81Å; C976-T978 PolarHBondContact O-N 3.4Å; C976-T978 PolarHBondContact SG-N 2.8Å; C976-T978 PolarHBondContact SG-OG1 3.43Å; C976-T979 HydrophobicContact CB-CG2 4.12Å; C976-T979 WeakPolarHBondContact CB-OG1 3.46Å; C976-T979 PolarHBondContact N-OG1 3.24Å; C976-T979 PolarHBondContact O-N 3.18Å; C976-T979 VanDerWaalsContact O-N 3.1Å; C976-T979 PolarHBondContact O-OG1 3.07Å; C976-V980 PolarHBondContact O-N 3.21Å; C976-V980 VanDerWaalsContact O-N 3.13Å; C976-L1037 HydrophobicContact CB-CB 4.37Å; C976-L1037 PolarHBondContact SG-N 3.12Å; C976-P1038 HydrophobicContact CB-CG 4.33Å
977	F	90.9	Very high	82.4	Confident	5 Å²	5	20 Å²	20	2%	0.022	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.5	-31.7	159.8	-61.3	-88.8	0	0	0	113.2	A430 F431 F895 V985 L1037 L1087 F1094 A1096 L1099	A430-F977 HydrophobicContact CB-CB 4.31Å; F431-F977 HydrophobicContact CD1-CB 4.46Å; F431-F977 AromaticContact CD1-CD1 3.52Å; F431-F977 HydrophobicContact CD1-CD1 3.52Å; F431-F977 AromaticContact CD1-CE1 3.87Å; F431-F977 HydrophobicContact CD1-CE1 3.87Å; F431-F977 HydrophobicContact CD1-CG 4.06Å; F431-F977 HydrophobicContact CE1-CB 4.32Å; F431-F977 AromaticContact CE1-CD1 3.85Å; F431-F977 HydrophobicContact CE1-CD1 3.85Å; F431-F977 HydrophobicContact CE1-CD2 4.38Å; F431-F977 HydrophobicContact CE1-CE1 4.2Å; F431-F977 AromaticContact CE1-CG 3.94Å; F431-F977 HydrophobicContact CE1-CG 3.94Å; F895-F977 HydrophobicContact CE2-CD2 4.36Å; F895-F977 HydrophobicContact CZ-CB 4.41Å; F895-F977 AromaticContact CZ-CD2 3.84Å; F895-F977 HydrophobicContact CZ-CD2 3.84Å; F895-F977 HydrophobicContact CZ-CE2 4.47Å; F895-F977 HydrophobicContact CZ-CG 4.32Å; F977-V985 HydrophobicContact CD1-CG1 3.96Å; F977-V985 HydrophobicContact CE1-CG1 4.45Å; F977-L1037 HydrophobicContact CD2-CD2 4.47Å; F977-L1037 HydrophobicContact CE2-CD2 4.27Å; F977-L1087 HydrophobicContact CE2-CD2 3.77Å; F977-L1087 HydrophobicContact CZ-CD2 3.59Å; F977-F1094 HydrophobicContact CZ-CB 4.08Å; F977-F1094 HydrophobicContact CZ-CD1 4.4Å; F977-A1096 HydrophobicContact CE1-CB 3.74Å; F977-A1096 HydrophobicContact CZ-CB 4.17Å; F977-L1099 HydrophobicContact CD1-CD1 4.1Å; F977-L1099 HydrophobicContact CD2-CD1 4.37Å; F977-L1099 HydrophobicContact CE1-CD1 4.26Å; F977-L1099 HydrophobicContact CG-CD1 4.16Å; F977-L1099 HydrophobicContact CZ-CD1 4.45Å
978	T	89.4	Confident	80	Confident	41 Å²	41	25.4 Å²	25.4	25%	0.252	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	4.6	-174	68.2	0	0	0	0	114.6	A430 F895 Y900 C976 L1036	A430-T978 HydrophobicContact CB-CG2 3.86Å; F895-T978 HydrophobicContact CE1-CG2 4.27Å; Y900-T978 HydrophobicContact CE1-CG2 3.86Å; Y900-T978 WeakPolarHBondContact OH-CG2 3.41Å; C976-T978 PolarHBondContact O-N 3.4Å; C976-T978 PolarHBondContact SG-N 2.8Å; C976-T978 PolarHBondContact SG-OG1 3.43Å; T978-L1036 HydrophobicContact CG2-CD1 4.44Å
979	T	87.8	Confident	77.4	Confident	11 Å²	11	27.6 Å²	27.6	7%	0.067	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.9	-23.5	-173	56.9	0	0	0	0	114	N974 C976 Q1032	N974-T979 WeakPolarHBondContact O-CB 3.42Å; N974-T979 PolarHBondContact O-OG1 2.91Å; C976-T979 HydrophobicContact CB-CG2 4.12Å; C976-T979 WeakPolarHBondContact CB-OG1 3.46Å; C976-T979 PolarHBondContact N-OG1 3.24Å; C976-T979 PolarHBondContact O-N 3.18Å; C976-T979 VanDerWaalsContact O-N 3.1Å; C976-T979 PolarHBondContact O-OG1 3.07Å; T979-Q1032 PolarHBondContact O-NE2 3.43Å; T979-Q1032 VanDerWaalsContact O-NE2 3.13Å
980	V	84.7	Confident	74.7	Confident	17 Å²	17	32.3 Å²	32.3	10%	0.103	20%	0.195	C	C	.	.	S	Bend	trans	-95.1	148.3	173.8	-176.7	0	0	0	0	109.4	I975 C976 L984 P1029 L1099 L1102	I975-V980 HydrophobicContact CG2-CG2 4.22Å; C976-V980 PolarHBondContact O-N 3.21Å; C976-V980 VanDerWaalsContact O-N 3.13Å; V980-L984 HydrophobicContact CG1-CB 4.01Å; V980-L984 HydrophobicContact CG1-CD1 4.18Å; V980-L984 HydrophobicContact CG1-CD2 4.39Å; V980-L984 HydrophobicContact CG1-CG 4.43Å; V980-P1029 HydrophobicContact CG2-CG 3.99Å; V980-L1099 HydrophobicContact CB-CD2 3.78Å; V980-L1099 HydrophobicContact CG1-CD2 3.89Å; V980-L1099 HydrophobicContact CG2-CD2 3.86Å; V980-L1102 HydrophobicContact CG1-CD2 4.34Å; V980-L1102 HydrophobicContact CG2-CD2 4.2Å
981	D	78.3	Confident	72	Confident	91 Å²	91	39.5 Å²	39.5	49%	0.487	23%	0.234	S	C	.	.			trans	-62.7	142.8	179.6	-155.9	-22.7	0	0	0	111.8	D983 L984	D981-D983 VanDerWaalsContact C-N 3.27Å; D981-D983 PolarHBondContact O-N 3.46Å; D981-L984 HydrophobicContact CB-CD1 4.49Å; D981-L984 PolarHBondContact O-N 3.47Å
982	R	72.3	Confident	69.3	Low	27 Å²	27	44.7 Å²	44.7	10%	0.102	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-69.4	-22	-170.7	-65.9	-157.7	-165.8	170.1	13	114.1	Y429 Y433 V436 E438 L984 V985 A986	Y429-R982 PolarHBondContact O-NH2 3.09Å; Y433-R982 PolarHBondContact O-NH1 2.85Å; V436-R982 VanDerWaalsContact O-CZ 3.25Å; V436-R982 PolarHBondContact O-NH1 3.35Å; V436-R982 PolarHBondContact O-NH2 3.34Å; V436-R982 VanDerWaalsContact O-NH2 3.12Å; E438-R982 VanDerWaalsContact CA-NH2 3.34Å; R982-L984 PolarHBondContact O-N 2.82Å; R982-V985 PolarHBondContact O-N 2.55Å; R982-A986 PolarHBondContact O-N 3.1Å
983	D	69.1	Low	66.9	Low	71 Å²	71	52.9 Å²	52.9	38%	0.38	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-64.3	-13.7	171.1	-79	-50.2	0	0	0	112.6	D981 K992 L995	D981-D983 VanDerWaalsContact C-N 3.27Å; D981-D983 PolarHBondContact O-N 3.46Å; D983-K992 IonicContact OD1-NZ 3.43Å; D983-K992 PolarHBondContact OD1-NZ 3.27Å; D983-L995 HydrophobicContact CB-CD1 3.63Å
984	L	67.5	Low	64.8	Low	20 Å²	20	58.7 Å²	58.7	11%	0.105	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-92.8	-13.1	165.5	-74.7	99.5	0	0	0	114.1	V980 D981 R982 L995 L997 I1000 G1098	V980-L984 HydrophobicContact CG1-CB 4.01Å; V980-L984 HydrophobicContact CG1-CD1 4.18Å; V980-L984 HydrophobicContact CG1-CD2 4.39Å; V980-L984 HydrophobicContact CG1-CG 4.43Å; D981-L984 HydrophobicContact CB-CD1 4.49Å; D981-L984 PolarHBondContact O-N 3.47Å; R982-L984 PolarHBondContact O-N 2.82Å; L984-L995 HydrophobicContact CD1-CD1 3.84Å; L984-L995 HydrophobicContact CG-CD1 4.31Å; L984-L997 HydrophobicContact CD2-CD1 3.83Å; L984-I1000 HydrophobicContact CD1-CD1 4.16Å; L984-I1000 HydrophobicContact CD2-CD1 4.23Å; L984-G1098 WeakPolarHBondContact O-CA 3.39Å; L984-G1098 PolarHBondContact O-N 3.06Å
985	V	58.5	Low	62.9	Low	3 Å²	3	62 Å²	62	2%	0.018	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-39.8	179.7	-177.2	0	0	0	0	110.6	F977 R982 T987 A1096 L1099	F977-V985 HydrophobicContact CD1-CG1 3.96Å; F977-V985 HydrophobicContact CE1-CG1 4.45Å; R982-V985 PolarHBondContact O-N 2.55Å; V985-T987 PolarHBondContact O-N 3.49Å; V985-A1096 HydrophobicContact CG1-CB 4.46Å; V985-L1099 HydrophobicContact CG2-CD1 4.35Å; V985-L1099 HydrophobicContact CG2-CD2 4.3Å; V985-L1099 HydrophobicContact CG2-CG 4.32Å
986	A	59	Low	61.8	Low	27 Å²	27	65.5 Å²	65.5	22%	0.223	37%	0.368	C	S	.	.			trans	-63.6	123.5	179.9	0	0	0	0	0	112.1	R982 T988	R982-A986 PolarHBondContact O-N 3.1Å; A986-T988 VanDerWaalsContact C-N 3.35Å
987	T	51.3	Low	60.9	Low	65 Å²	65	67.3 Å²	67.3	40%	0.399	38%	0.377	S	S	.	.			trans	-87.4	-2.6	177.8	44.3	0	0	0	0	113.6	V985 R1097	V985-T987 PolarHBondContact O-N 3.49Å; T987-R1097 HydrophobicContact CG2-CB 4.44Å; T987-R1097 HydrophobicContact CG2-CG 4.16Å
988	T	40.7	Very low	60.1	Low	115 Å²	115	72 Å²	72	71%	0.706	40%	0.403	S	S	*	.			trans	-116.5	49.7	-160.1	45.5	0	0	0	0	114.3	A986	A986-T988 VanDerWaalsContact C-N 3.35Å
989	S	36.8	Very low	59.5	Low	57 Å²	57	72.6 Å²	72.6	40%	0.399	41%	0.407	S	S	.	.			trans	-150	102.5	158.9	62.7	0	0	0	0	112.3	D991	S989-D991 PolarHBondContact O-N 3.42Å
990	S	37.1	Very low	59.1	Low	99 Å²	99	74 Å²	74	69%	0.692	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-24	165.1	43.6	0	0	0	0	113.4
991	D	35.7	Very low	59	Low	152 Å²	152	73.6 Å²	73.6	81%	0.813	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	4.7	-161.1	-61.6	7.5	0	0	0	114.1	S989	S989-D991 PolarHBondContact O-N 3.42Å
992	K	37.1	Very low	59.2	Low	122 Å²	122	73.2 Å²	73.2	53%	0.53	41%	0.412	S	S	.	.	S	Bend	trans	-99.4	141.6	173.1	-72.2	-176.8	-178.8	168	0	109.8	D983	D983-K992 IonicContact OD1-NZ 3.43Å; D983-K992 PolarHBondContact OD1-NZ 3.27Å
993	E	40	Very low	59.6	Low	176 Å²	176	73 Å²	73	82%	0.822	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-54.5	140.8	170.6	-72.6	-170.5	155.8	0	0	110.6	L995	E993-L995 PolarHBondContact O-N 2.84Å
994	P	47.3	Very low	60.2	Low	121 Å²	121	69.7 Å²	69.7	79%	0.786	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.2	124.9	175.5	25.1	-33.3	0	0	0	109.6	D996	P994-D996 PolarHBondContact O-N 3.3Å
995	L	54	Low	60.9	Low	80 Å²	80	69.5 Å²	69.5	42%	0.419	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-54.6	128.1	163.9	-90.6	158.2	0	0	0	108	D983 L984 E993 L997	D983-L995 HydrophobicContact CB-CD1 3.63Å; L984-L995 HydrophobicContact CD1-CD1 3.84Å; L984-L995 HydrophobicContact CG-CD1 4.31Å; E993-L995 PolarHBondContact O-N 2.84Å; L995-L997 VanDerWaalsContact C-N 3.27Å; L995-L997 PolarHBondContact O-N 2.82Å
996	D	67.9	Low	62	Low	76 Å²	76	70.6 Å²	70.6	41%	0.406	40%	0.404	S	S	.	.			trans	-66.1	88.2	-176.4	-179.2	-3.8	0	0	0	110.1	P994 D998 T999 I1000	P994-D996 PolarHBondContact O-N 3.3Å; D996-D998 VanDerWaalsContact C-N 3.29Å; D996-D998 PolarHBondContact O-N 2.85Å; D996-D998 PolarHBondContact OD1-N 2.83Å; D996-T999 VanDerWaalsContact CG-OG1 3.23Å; D996-T999 PolarHBondContact O-N 3.23Å; D996-T999 PolarHBondContact OD1-N 2.89Å; D996-T999 VanDerWaalsContact OD2-CB 3.23Å; D996-T999 WeakPolarHBondContact OD2-CB 3.41Å; D996-T999 PolarHBondContact OD2-OG1 2.95Å; D996-I1000 WeakPolarHBondContact O-CG1 3.43Å; D996-I1000 PolarHBondContact O-N 2.7Å; D996-I1000 VanDerWaalsContact O-N 3.17Å
997	L	73.7	Confident	62.9	Low	37 Å²	37	71.8 Å²	71.8	19%	0.194	41%	0.409	C	S	.	.	H	α-helix	trans	-67.6	-33.3	-173.5	-173.2	65.9	0	0	0	111.1	L984 L995 I1000 V1001 A1101 L1102	L984-L997 HydrophobicContact CD2-CD1 3.83Å; L995-L997 VanDerWaalsContact C-N 3.27Å; L995-L997 PolarHBondContact O-N 2.82Å; L997-I1000 WeakPolarHBondContact O-CB 3.21Å; L997-I1000 PolarHBondContact O-N 2.74Å; L997-V1001 VanDerWaalsContact O-CG2 3.27Å; L997-V1001 WeakPolarHBondContact O-CG2 3.38Å; L997-V1001 PolarHBondContact O-N 2.86Å; L997-A1101 HydrophobicContact CD2-CB 3.8Å; L997-L1102 HydrophobicContact CD1-CB 4.07Å; L997-L1102 HydrophobicContact CD1-CD1 3.92Å
998	D	74.9	Confident	64	Low	104 Å²	104	70.4 Å²	70.4	56%	0.556	40%	0.4	S	S	*	.	H	α-helix	trans	-71.5	-40.5	178.8	-69.6	-22	0	0	0	110.2	D996 I1000 V1001 T1002	D996-D998 VanDerWaalsContact C-N 3.29Å; D996-D998 PolarHBondContact O-N 2.85Å; D996-D998 PolarHBondContact OD1-N 2.83Å; D998-I1000 VanDerWaalsContact C-N 3.28Å; D998-I1000 PolarHBondContact O-N 3.49Å; D998-V1001 PolarHBondContact O-N 2.86Å; D998-T1002 WeakPolarHBondContact O-CB 3.48Å; D998-T1002 PolarHBondContact O-N 3.3Å; D998-T1002 PolarHBondContact O-OG1 3.01Å; D998-T1002 VanDerWaalsContact O-OG1 3.13Å
999	T	76.7	Confident	65.7	Low	54 Å²	54	67.8 Å²	67.8	33%	0.331	38%	0.38	S	S	.	.	H	α-helix	trans	-57.6	-39.1	168.3	-75.9	0	0	0	0	112.2	D996 T1003 V1017	D996-T999 VanDerWaalsContact CG-OG1 3.23Å; D996-T999 PolarHBondContact O-N 3.23Å; D996-T999 PolarHBondContact OD1-N 2.89Å; D996-T999 VanDerWaalsContact OD2-CB 3.23Å; D996-T999 WeakPolarHBondContact OD2-CB 3.41Å; D996-T999 PolarHBondContact OD2-OG1 2.95Å; T999-T1003 WeakPolarHBondContact O-CB 3.4Å; T999-T1003 PolarHBondContact O-N 3.27Å; T999-T1003 PolarHBondContact O-OG1 3.45Å; T999-V1017 HydrophobicContact CG2-CG1 4.35Å; T999-V1017 HydrophobicContact CG2-CG2 4.13Å
1000	I	78.5	Confident	67.1	Low	41 Å²	41	67.2 Å²	67.2	21%	0.21	38%	0.382	C	S	.	.	H	α-helix	trans	-65.8	-46.4	175.7	-65.4	168.7	0	0	0	110.8	L984 D996 L997 D998 T1003 L1004 L1102	L984-I1000 HydrophobicContact CD1-CD1 4.16Å; L984-I1000 HydrophobicContact CD2-CD1 4.23Å; D996-I1000 WeakPolarHBondContact O-CG1 3.43Å; D996-I1000 PolarHBondContact O-N 2.7Å; D996-I1000 VanDerWaalsContact O-N 3.17Å; L997-I1000 WeakPolarHBondContact O-CB 3.21Å; L997-I1000 PolarHBondContact O-N 2.74Å; D998-I1000 VanDerWaalsContact C-N 3.28Å; D998-I1000 PolarHBondContact O-N 3.49Å; I1000-T1003 PolarHBondContact O-N 2.65Å; I1000-L1004 HydrophobicContact CG2-CD1 3.97Å; I1000-L1004 HydrophobicContact CG2-CG 4.47Å; I1000-L1004 WeakPolarHBondContact O-CB 3.39Å; I1000-L1004 WeakPolarHBondContact O-CG 3.41Å; I1000-L1004 PolarHBondContact O-N 3.35Å; I1000-L1102 HydrophobicContact CG2-CD1 3.98Å
1001	V	82.5	Confident	68.1	Low	7 Å²	7	68 Å²	68	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-59.4	-48.6	177.7	167.1	0	0	0	0	111.2	L997 D998 T1003 L1004 I1005 L1102 L1106 A1109	L997-V1001 VanDerWaalsContact O-CG2 3.27Å; L997-V1001 WeakPolarHBondContact O-CG2 3.38Å; L997-V1001 PolarHBondContact O-N 2.86Å; D998-V1001 PolarHBondContact O-N 2.86Å; V1001-T1003 PolarHBondContact O-N 2.91Å; V1001-L1004 PolarHBondContact O-N 2.77Å; V1001-I1005 HydrophobicContact CG1-CD1 4.07Å; V1001-I1005 WeakPolarHBondContact O-CB 3.37Å; V1001-I1005 PolarHBondContact O-N 2.87Å; V1001-L1102 HydrophobicContact CG2-CD1 3.98Å; V1001-L1106 HydrophobicContact CG1-CD2 4.18Å; V1001-L1106 HydrophobicContact CG2-CD2 4.5Å; V1001-L1106 HydrophobicContact CG2-CG 4.28Å; V1001-A1109 HydrophobicContact CG1-CB 3.73Å
1002	T	82.9	Confident	68.4	Low	84 Å²	84	66.2 Å²	66.2	52%	0.515	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-42.7	177.2	-61	0	0	0	0	111.7	D998 I1005 A1006	D998-T1002 WeakPolarHBondContact O-CB 3.48Å; D998-T1002 PolarHBondContact O-N 3.3Å; D998-T1002 PolarHBondContact O-OG1 3.01Å; D998-T1002 VanDerWaalsContact O-OG1 3.13Å; T1002-I1005 PolarHBondContact O-N 2.93Å; T1002-A1006 WeakPolarHBondContact O-CB 3.47Å; T1002-A1006 PolarHBondContact O-N 2.79Å
1003	T	80.7	Confident	68.6	Low	23 Å²	23	67.6 Å²	67.6	14%	0.141	39%	0.392	C	S	.	.	H	α-helix	trans	-64	-43.3	178.6	-55.4	0	0	0	0	111.7	T999 I1000 V1001 T1007 L1028	T999-T1003 WeakPolarHBondContact O-CB 3.4Å; T999-T1003 PolarHBondContact O-N 3.27Å; T999-T1003 PolarHBondContact O-OG1 3.45Å; I1000-T1003 PolarHBondContact O-N 2.65Å; V1001-T1003 PolarHBondContact O-N 2.91Å; T1003-T1007 WeakPolarHBondContact O-CB 3.19Å; T1003-T1007 PolarHBondContact O-N 3.5Å; T1003-T1007 PolarHBondContact O-OG1 2.67Å; T1003-L1028 HydrophobicContact CG2-CD1 4.24Å; T1003-L1028 HydrophobicContact CG2-CD2 3.93Å
1004	L	82.1	Confident	68.6	Low	1 Å²	1	64.2 Å²	64.2	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-62.1	-42.9	176.6	-76.5	171.3	0	0	0	112.3	F973 I1000 V1001 T1007 V1008 L1028 V1030 L1102 L1106	F973-L1004 HydrophobicContact CD1-CB 3.96Å; F973-L1004 HydrophobicContact CE1-CB 4.21Å; I1000-L1004 HydrophobicContact CG2-CD1 3.97Å; I1000-L1004 HydrophobicContact CG2-CG 4.47Å; I1000-L1004 WeakPolarHBondContact O-CB 3.39Å; I1000-L1004 WeakPolarHBondContact O-CG 3.41Å; I1000-L1004 PolarHBondContact O-N 3.35Å; V1001-L1004 PolarHBondContact O-N 2.77Å; L1004-T1007 WeakPolarHBondContact O-CB 3.23Å; L1004-T1007 PolarHBondContact O-N 2.74Å; L1004-V1008 PolarHBondContact O-N 3.31Å; L1004-V1008 VanDerWaalsContact O-N 3.14Å; L1004-L1028 HydrophobicContact CD2-CD2 4.37Å; L1004-V1030 HydrophobicContact CD2-CG2 3.89Å; L1004-L1102 HydrophobicContact CD1-CD1 4.08Å; L1004-L1106 HydrophobicContact CB-CD2 4.04Å; L1004-L1106 HydrophobicContact CD1-CD1 4.09Å; L1004-L1106 HydrophobicContact CD1-CD2 4.16Å
1005	I	82.4	Confident	68.4	Low	15 Å²	15	64.1 Å²	64.1	8%	0.077	38%	0.379	C	S	.	.	H	α-helix	trans	-69	-44.6	-179.7	-78.5	174.3	0	0	0	111.7	F973 V1001 T1002 T1007 V1008 H1009 L1106 A1109 N1113	F973-I1005 HydrophobicContact CE1-CG1 4.21Å; F973-I1005 HydrophobicContact CZ-CG1 4.11Å; V1001-I1005 HydrophobicContact CG1-CD1 4.07Å; V1001-I1005 WeakPolarHBondContact O-CB 3.37Å; V1001-I1005 PolarHBondContact O-N 2.87Å; T1002-I1005 PolarHBondContact O-N 2.93Å; I1005-T1007 PolarHBondContact O-N 3.07Å; I1005-V1008 PolarHBondContact O-N 3.15Å; I1005-H1009 WeakPolarHBondContact CG2-NE2 3.5Å; I1005-H1009 PolarHBondContact O-N 3.25Å; I1005-L1106 HydrophobicContact CD1-CD2 4.17Å; I1005-L1106 HydrophobicContact CG1-CD2 4Å; I1005-A1109 HydrophobicContact CD1-CB 3.31Å; I1005-N1113 WeakPolarHBondContact CG2-ND2 3.49Å
1006	A	80.3	Confident	67.6	Low	26 Å²	26	64.6 Å²	64.6	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-59.9	-35.3	174.2	0	0	0	0	0	112.2	T1002 G1010 D1011	T1002-A1006 WeakPolarHBondContact O-CB 3.47Å; T1002-A1006 PolarHBondContact O-N 2.79Å; A1006-G1010 PolarHBondContact O-N 2.96Å; A1006-D1011 PolarHBondContact O-N 3.25Å; A1006-D1011 VanDerWaalsContact O-N 3.11Å
1007	T	78.1	Confident	66.3	Low	53 Å²	53	63.4 Å²	63.4	33%	0.325	39%	0.385	S	S	.	.	H	α-helix	trans	-65.9	-41.1	176.4	-55.8	0	0	0	0	112.1	T1003 L1004 I1005 G1010 L1028	T1003-T1007 WeakPolarHBondContact O-CB 3.19Å; T1003-T1007 PolarHBondContact O-N 3.5Å; T1003-T1007 PolarHBondContact O-OG1 2.67Å; L1004-T1007 WeakPolarHBondContact O-CB 3.23Å; L1004-T1007 PolarHBondContact O-N 2.74Å; I1005-T1007 PolarHBondContact O-N 3.07Å; T1007-G1010 PolarHBondContact O-N 3.35Å; T1007-L1028 HydrophobicContact CG2-CD1 4.11Å; T1007-L1028 WeakPolarHBondContact OG1-CD1 3.32Å
1008	V	75.8	Confident	64.2	Low	36 Å²	36	66.5 Å²	66.5	22%	0.218	41%	0.409	C	S	.	.	H	α-helix	trans	-74.3	-38.7	179.1	172.4	0	0	0	0	112.2	F973 L1004 I1005 G1010 Y1160	F973-V1008 HydrophobicContact CD1-CG2 3.84Å; F973-V1008 HydrophobicContact CE1-CB 4.17Å; F973-V1008 HydrophobicContact CE1-CG2 3.52Å; F973-V1008 HydrophobicContact CZ-CG2 4.37Å; L1004-V1008 PolarHBondContact O-N 3.31Å; L1004-V1008 VanDerWaalsContact O-N 3.14Å; I1005-V1008 PolarHBondContact O-N 3.15Å; V1008-G1010 PolarHBondContact O-N 2.94Å; V1008-Y1160 HydrophobicContact CG1-CD1 4.24Å
1009	H	75.9	Confident	62.1	Low	60 Å²	60	68.4 Å²	68.4	28%	0.278	41%	0.412	S	S	.	.	H	α-helix	trans	-70.9	-11.5	175.4	-66.4	-28.3	0	0	0	113.7	I1005 N1113 H1159 Y1160	I1005-H1009 WeakPolarHBondContact CG2-NE2 3.5Å; I1005-H1009 PolarHBondContact O-N 3.25Å; H1009-N1113 PolarHBondContact NE2-ND2 3.36Å; H1009-H1159 WeakPolarHBondContact CE1-CB 3.37Å; H1009-H1159 AromaticContact ND1-CD2 3.96Å; H1009-Y1160 AromaticContact CE1-CD1 3.84Å; H1009-Y1160 AromaticContact CE1-CE1 3.01Å; H1009-Y1160 WeakPolarHBondContact CE1-CE1 3.44Å; H1009-Y1160 AromaticContact CE1-CE2 3.96Å; H1009-Y1160 AromaticContact CE1-CZ 3.08Å; H1009-Y1160 PolarHBondContact CE1-OH 2.8Å
1010	G	65.4	Low	59.8	Low	44 Å²	44	70.9 Å²	70.9	45%	0.454	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	9.5	176.3	0	0	0	0	0	115	A1006 T1007 V1008 S1012	A1006-G1010 PolarHBondContact O-N 2.96Å; T1007-G1010 PolarHBondContact O-N 3.35Å; V1008-G1010 PolarHBondContact O-N 2.94Å; G1010-S1012 PolarHBondContact O-N 2.99Å; G1010-S1012 PolarHBondContact O-OG 2.93Å
1011	D	59.1	Low	57.6	Low	116 Å²	116	76.3 Å²	76.3	62%	0.62	46%	0.462	S	S	*	.			trans	-68.9	74.6	178.6	-84.4	-44	0	0	0	111.2	A1006 N1013	A1006-D1011 PolarHBondContact O-N 3.25Å; A1006-D1011 VanDerWaalsContact O-N 3.11Å; D1011-N1013 PolarHBondContact O-N 3.1Å
1012	S	42.1	Very low	55.2	Low	115 Å²	115	83.2 Å²	83.2	80%	0.804	50%	0.498	S	S	*	.			trans	-73.9	20.9	-169.9	-57.2	0	0	0	0	114.1	G1010 S1014	G1010-S1012 PolarHBondContact O-N 2.99Å; G1010-S1012 PolarHBondContact O-OG 2.93Å; S1012-S1014 PolarHBondContact O-N 2.96Å
1013	N	39.7	Very low	52.9	Low	150 Å²	150	87.6 Å²	87.6	80%	0.802	52%	0.519	S	S	*	.	S	Bend	trans	-73.9	108	170.7	-119.9	-6.2	0	0	0	107.5	D1011 I1015	D1011-N1013 PolarHBondContact O-N 3.1Å; N1013-I1015 PolarHBondContact O-N 3.11Å
1014	S	40.1	Very low	51.1	Low	105 Å²	105	94.3 Å²	94.3	73%	0.734	55%	0.546	S	S	*	.			trans	-67.5	89.3	-161	60.6	0	0	0	0	113.8	S1012 S1016	S1012-S1014 PolarHBondContact O-N 2.96Å; S1014-S1016 PolarHBondContact O-N 2.75Å
1015	I	43.5	Very low	49.4	Very low	120 Å²	120	103.7 Å²	103.7	62%	0.615	59%	0.586	S	S	*	*			trans	-72.9	76.9	159.3	-56.9	-179.1	0	0	0	107.2	N1013 V1017	N1013-I1015 PolarHBondContact O-N 3.11Å; I1015-V1017 HydrophobicContact CG2-CG2 4.12Å; I1015-V1017 PolarHBondContact O-N 3.39Å; I1015-V1017 VanDerWaalsContact O-N 3.09Å
1016	S	38.6	Very low	48	Very low	89 Å²	89	107.9 Å²	107.9	62%	0.622	61%	0.608	S	S	*	*			trans	-68.7	104.2	165.5	57.3	0	0	0	0	107.7	S1014 S1018	S1014-S1016 PolarHBondContact O-N 2.75Å; S1016-S1018 PolarHBondContact O-N 2.82Å; S1016-S1018 PolarHBondContact O-OG 2.92Å
1017	V	40.5	Very low	46.8	Very low	52 Å²	52	116.6 Å²	116.6	32%	0.315	64%	0.635	S	S	.	*			trans	-70.6	74.3	174.2	-175.3	0	0	0	0	109	T999 I1015 K1019 I1026	T999-V1017 HydrophobicContact CG2-CG1 4.35Å; T999-V1017 HydrophobicContact CG2-CG2 4.13Å; I1015-V1017 HydrophobicContact CG2-CG2 4.12Å; I1015-V1017 PolarHBondContact O-N 3.39Å; I1015-V1017 VanDerWaalsContact O-N 3.09Å; V1017-K1019 PolarHBondContact O-N 3.03Å; V1017-I1026 HydrophobicContact CB-CD1 4.35Å; V1017-I1026 HydrophobicContact CG1-CD1 4.09Å
1018	S	29	Very low	46.1	Very low	102 Å²	102	115.6 Å²	115.6	71%	0.713	63%	0.628	S	S	*	*			trans	-83.2	80.7	173.1	44.4	0	0	0	0	109.2	S1016	S1016-S1018 PolarHBondContact O-N 2.82Å; S1016-S1018 PolarHBondContact O-OG 2.92Å
1019	K	31	Very low	46	Very low	143 Å²	143	114.5 Å²	114.5	62%	0.622	62%	0.622	S	S	*	*			trans	-61.3	139.4	159.1	-81.3	-165.9	173.1	-171.4	0	108.7	V1017	V1017-K1019 PolarHBondContact O-N 3.03Å
1020	S	28.5	Very low	45.9	Very low	107 Å²	107	113.3 Å²	113.3	75%	0.748	62%	0.618	S	S	*	*	S	Bend	trans	-60.8	143.5	-175.9	47.9	0	0	0	0	112.9	N1022	S1020-N1022 PolarHBondContact O-N 3.33Å
1021	D	31.8	Very low	46.2	Very low	155 Å²	155	117.4 Å²	117.4	83%	0.829	63%	0.63	S	S	*	*	S	Bend	trans	56.6	48.4	160.8	-60.4	-8.8	0	0	0	117.2
1022	N	31.2	Very low	47.2	Very low	152 Å²	152	115 Å²	115	81%	0.813	62%	0.615	S	S	*	*	S	Bend	trans	-170.8	147.5	131.1	-102.7	-69	0	0	0	112	S1020 K1024	S1020-N1022 PolarHBondContact O-N 3.33Å; N1022-K1024 PolarHBondContact O-N 3.08Å
1023	D	34.6	Very low	49.2	Very low	176 Å²	176	117.6 Å²	117.6	94%	0.941	62%	0.615	S	S	*	*			trans	-74.4	54.2	-176.3	-80.2	-53.5	0	0	0	114.7
1024	K	43.3	Very low	51.3	Low	163 Å²	163	114.1 Å²	114.1	71%	0.709	60%	0.6	S	S	*	*			trans	-96.7	82.6	164	-84.7	-165.5	171.3	-167.5	0	110.2	N1022 I1026	N1022-K1024 PolarHBondContact O-N 3.08Å; K1024-I1026 PolarHBondContact O-N 3.48Å
1025	K	47.5	Very low	53.7	Low	198 Å²	198	109.2 Å²	109.2	86%	0.861	57%	0.566	S	S	*	*			trans	-62.5	107.6	169	-171.6	179.6	-176	-176.7	0	109.2	R1027	K1025-R1027 PolarHBondContact O-N 3.15Å
1026	I	51.8	Low	56	Low	104 Å²	104	104.4 Å²	104.4	53%	0.533	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-54.9	120.7	-179	-58	174.3	0	0	0	108.9	V1017 K1024	V1017-I1026 HydrophobicContact CB-CD1 4.35Å; V1017-I1026 HydrophobicContact CG1-CD1 4.09Å; K1024-I1026 PolarHBondContact O-N 3.48Å
1027	R	55.3	Low	58.6	Low	208 Å²	208	100.2 Å²	100.2	79%	0.785	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-84.5	122.4	173.7	-72.5	-177	174.4	179.7	-2	108.5	K1025	K1025-R1027 PolarHBondContact O-N 3.15Å
1028	L	63.6	Low	61.1	Low	33 Å²	33	97.8 Å²	97.8	17%	0.173	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-74.8	138	175.6	-62.2	175.4	0	0	0	109.4	T1003 L1004 T1007 V1030 D1031 Q1032	T1003-L1028 HydrophobicContact CG2-CD1 4.24Å; T1003-L1028 HydrophobicContact CG2-CD2 3.93Å; L1004-L1028 HydrophobicContact CD2-CD2 4.37Å; T1007-L1028 HydrophobicContact CG2-CD1 4.11Å; T1007-L1028 WeakPolarHBondContact OG1-CD1 3.32Å; L1028-V1030 PolarHBondContact O-N 2.93Å; L1028-D1031 PolarHBondContact O-N 3.23Å; L1028-Q1032 PolarHBondContact O-NE2 2.8Å; L1028-Q1032 VanDerWaalsContact O-NE2 3.11Å
1029	P	73.2	Confident	64.2	Low	13 Å²	13	95 Å²	95	8%	0.084	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-55.1	-30.4	174.2	-30.3	34.6	0	0	0	114.8	F973 N974 V980 D1031 Q1032	F973-P1029 WeakPolarHBondContact O-CB 3.18Å; N974-P1029 HydrophobicContact CB-CB 4.28Å; N974-P1029 WeakPolarHBondContact CB-O 3.35Å; N974-P1029 PolarHBondContact ND2-O 3.27Å; V980-P1029 HydrophobicContact CG2-CG 3.99Å; P1029-D1031 VanDerWaalsContact C-N 3.3Å; P1029-D1031 PolarHBondContact O-N 3.45Å; P1029-Q1032 WeakPolarHBondContact O-CB 3.44Å; P1029-Q1032 PolarHBondContact O-N 3.22Å
1030	V	73.7	Confident	67.2	Low	34 Å²	34	88.8 Å²	88.8	21%	0.206	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-66.8	-29.8	-173.5	-166.4	0	0	0	0	112.7	L1004 L1028 Q1032	L1004-V1030 HydrophobicContact CD2-CG2 3.89Å; L1028-V1030 PolarHBondContact O-N 2.93Å; V1030-Q1032 VanDerWaalsContact C-N 3.28Å; V1030-Q1032 PolarHBondContact O-N 2.64Å
1031	D	72.7	Confident	70.2	Confident	130 Å²	130	83.8 Å²	83.8	70%	0.695	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-81.9	-2.8	179.7	-60.1	-39.2	0	0	0	113.6	L1028 P1029	L1028-D1031 PolarHBondContact O-N 3.23Å; P1029-D1031 VanDerWaalsContact C-N 3.3Å; P1029-D1031 PolarHBondContact O-N 3.45Å
1032	Q	79.4	Confident	73.2	Confident	65 Å²	65	79.7 Å²	79.7	30%	0.304	39%	0.391	S	S	.	.	S	Bend	trans	-102.1	165.2	-171.9	-59.7	177.2	54.6	0	0	111.9	N974 T979 L1028 P1029 V1030	N974-Q1032 PolarHBondContact ND2-O 3.02Å; T979-Q1032 PolarHBondContact O-NE2 3.43Å; T979-Q1032 VanDerWaalsContact O-NE2 3.13Å; L1028-Q1032 PolarHBondContact O-NE2 2.8Å; L1028-Q1032 VanDerWaalsContact O-NE2 3.11Å; P1029-Q1032 WeakPolarHBondContact O-CB 3.44Å; P1029-Q1032 PolarHBondContact O-N 3.22Å; V1030-Q1032 VanDerWaalsContact C-N 3.28Å; V1030-Q1032 PolarHBondContact O-N 2.64Å
1033	E	83.9	Confident	76.1	Confident	171 Å²	171	76.4 Å²	76.4	80%	0.799	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-59.4	151.8	169.8	-68.4	-170.8	157.4	0	0	111.3	N974 G1035	N974-E1033 PolarHBondContact ND2-O 3.32Å; E1033-G1035 PolarHBondContact O-N 3.23Å
1034	P	85.1	Confident	79	Confident	76 Å²	76	68.1 Å²	68.1	49%	0.494	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-58.3	120.2	179.5	-25.1	35.2	0	0	0	112.4	N974	N974-P1034 WeakPolarHBondContact OD1-CA 3.4Å
1035	G	89.8	Confident	81.2	Confident	2 Å²	2	62 Å²	62	2%	0.021	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-63.9	158.3	174.5	0	0	0	0	0	112.2	N974 E1033 L1037 P1038 A1039	N974-G1035 PolarHBondContact OD1-N 2.75Å; E1033-G1035 PolarHBondContact O-N 3.23Å; G1035-L1037 VanDerWaalsContact C-N 3.29Å; G1035-L1037 PolarHBondContact O-N 2.82Å; G1035-P1038 VanDerWaalsContact O-CD 3.25Å; G1035-P1038 WeakPolarHBondContact O-CD 3.22Å; G1035-A1039 WeakPolarHBondContact O-CB 3.46Å; G1035-A1039 PolarHBondContact O-N 2.86Å
1036	L	92	Very high	83.3	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.099	28%	0.282	C	S	.	.	H	α-helix	trans	-57.2	-40.2	-177.6	-87.9	83.1	0	0	0	113.6	F895 H898 Y900 T978 A1039 E1040	F895-L1036 HydrophobicContact CD1-CD2 3.62Å; F895-L1036 HydrophobicContact CE1-CB 4.14Å; F895-L1036 HydrophobicContact CE1-CD2 3.96Å; F895-L1036 HydrophobicContact CG-CD2 4.17Å; F895-L1036 HydrophobicContact CZ-CB 4.45Å; H898-L1036 HydrophobicContact CB-CD2 3.88Å; Y900-L1036 HydrophobicContact CD2-CD2 4.32Å; Y900-L1036 HydrophobicContact CE2-CD1 3.65Å; Y900-L1036 HydrophobicContact CE2-CD2 4.2Å; T978-L1036 HydrophobicContact CG2-CD1 4.44Å; L1036-A1039 PolarHBondContact O-N 2.75Å; L1036-E1040 WeakPolarHBondContact O-CB 3.45Å; L1036-E1040 PolarHBondContact O-N 2.89Å
1037	L	93.1	Very high	85.3	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-50.9	-179.5	176.3	71	0	0	0	111.5	L891 I970 C976 F977 G1035 A1039 E1040 I1041 V1083 L1087	L891-L1037 HydrophobicContact CD2-CD1 4.01Å; I970-L1037 HydrophobicContact CG2-CD2 4.27Å; I970-L1037 HydrophobicContact CG2-CG 4.13Å; C976-L1037 HydrophobicContact CB-CB 4.37Å; C976-L1037 PolarHBondContact SG-N 3.12Å; F977-L1037 HydrophobicContact CD2-CD2 4.47Å; F977-L1037 HydrophobicContact CE2-CD2 4.27Å; G1035-L1037 VanDerWaalsContact C-N 3.29Å; G1035-L1037 PolarHBondContact O-N 2.82Å; L1037-A1039 VanDerWaalsContact C-N 3.32Å; L1037-A1039 PolarHBondContact O-N 2.81Å; L1037-E1040 PolarHBondContact O-N 3.05Å; L1037-I1041 HydrophobicContact CD1-CD1 4.16Å; L1037-I1041 HydrophobicContact CG-CD1 4.27Å; L1037-I1041 WeakPolarHBondContact O-CG1 3.33Å; L1037-I1041 PolarHBondContact O-N 3.34Å; L1037-V1083 HydrophobicContact CD1-CG1 3.54Å; L1037-L1087 HydrophobicContact CD2-CD1 4.07Å; L1037-L1087 HydrophobicContact CD2-CD2 4.33Å
1038	P	93.2	Very high	87.1	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-52	-43.6	166.3	-30.5	34.3	0	0	0	114.3	I970 I975 C976 G1035 R1042	I970-P1038 HydrophobicContact CG2-CG 4Å; I970-P1038 WeakPolarHBondContact O-CG 3.33Å; I975-P1038 WeakPolarHBondContact O-CD 3.21Å; I975-P1038 WeakPolarHBondContact O-CG 3.44Å; C976-P1038 HydrophobicContact CB-CG 4.33Å; G1035-P1038 VanDerWaalsContact O-CD 3.25Å; G1035-P1038 WeakPolarHBondContact O-CD 3.22Å; P1038-R1042 VanDerWaalsContact O-CB 3.29Å; P1038-R1042 WeakPolarHBondContact O-CB 3.45Å; P1038-R1042 PolarHBondContact O-N 3.42Å
1039	A	93.3	Very high	88.4	Confident	43 Å²	43	49.1 Å²	49.1	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-67.8	-42.6	-177.8	0	0	0	0	0	113	G1035 L1036 L1037 R1042 R1043	G1035-A1039 WeakPolarHBondContact O-CB 3.46Å; G1035-A1039 PolarHBondContact O-N 2.86Å; L1036-A1039 PolarHBondContact O-N 2.75Å; L1037-A1039 VanDerWaalsContact C-N 3.32Å; L1037-A1039 PolarHBondContact O-N 2.81Å; A1039-R1042 PolarHBondContact O-N 3.11Å; A1039-R1043 WeakPolarHBondContact O-CB 3.47Å; A1039-R1043 PolarHBondContact O-N 3.29Å
1040	E	93.7	Very high	89.3	Confident	14 Å²	14	54 Å²	54	7%	0.065	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-40.3	175.6	-80.6	-69.2	162.5	0	0	112	A894 L1036 L1037 R1043 L1044	A894-E1040 HydrophobicContact CB-CG 3.59Å; L1036-E1040 WeakPolarHBondContact O-CB 3.45Å; L1036-E1040 PolarHBondContact O-N 2.89Å; L1037-E1040 PolarHBondContact O-N 3.05Å; E1040-R1043 WeakPolarHBondContact O-CB 3.36Å; E1040-R1043 PolarHBondContact O-N 3.39Å; E1040-R1043 IonicContact OE1-NE 3.58Å; E1040-R1043 IonicContact OE2-CZ 2.7Å; E1040-R1043 IonicContact OE2-NE 3.65Å; E1040-R1043 PolarHBondContact OE2-NE 3.42Å; E1040-R1043 IonicContact OE2-NH2 3.39Å; E1040-R1043 PolarHBondContact OE2-NH2 2.89Å; E1040-L1044 WeakPolarHBondContact O-CG 3.43Å; E1040-L1044 PolarHBondContact O-N 2.88Å
1041	I	93.3	Very high	90.3	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-43.9	173.7	-67.2	172	0	0	0	110.5	P967 I970 Q971 L1037 R1043 L1044 V1045 V1083	P967-I1041 HydrophobicContact CB-CG2 3.78Å; I970-I1041 HydrophobicContact CB-CD1 4.12Å; I970-I1041 HydrophobicContact CD1-CD1 3.86Å; I970-I1041 HydrophobicContact CG2-CD1 3.71Å; Q971-I1041 HydrophobicContact CG-CB 4.49Å; Q971-I1041 HydrophobicContact CG-CG2 4.2Å; L1037-I1041 HydrophobicContact CD1-CD1 4.16Å; L1037-I1041 HydrophobicContact CG-CD1 4.27Å; L1037-I1041 WeakPolarHBondContact O-CG1 3.33Å; L1037-I1041 PolarHBondContact O-N 3.34Å; I1041-R1043 PolarHBondContact O-N 3.05Å; I1041-L1044 WeakPolarHBondContact O-CB 3.49Å; I1041-L1044 PolarHBondContact O-N 2.81Å; I1041-L1044 VanDerWaalsContact O-N 3.15Å; I1041-V1045 HydrophobicContact CG2-CG2 4.34Å; I1041-V1045 WeakPolarHBondContact O-CG2 3.38Å; I1041-V1045 PolarHBondContact O-N 2.98Å; I1041-V1083 HydrophobicContact CD1-CB 4.36Å; I1041-V1083 HydrophobicContact CD1-CG1 4.03Å; I1041-V1083 HydrophobicContact CG1-CB 4.46Å; I1041-V1083 HydrophobicContact CG1-CG1 4.25Å; I1041-V1083 HydrophobicContact CG1-CG2 4.44Å
1042	R	92.9	Very high	91.2	Very high	69 Å²	69	51.3 Å²	51.3	26%	0.26	25%	0.248	S	C	.	.	H	α-helix	trans	-56.5	-48.6	174.5	-176	174.3	-61.9	163.2	3.9	111.4	Q971 P1038 A1039 L1044 V1045 E1046	Q971-R1042 VanDerWaalsContact OE1-CA 3.28Å; Q971-R1042 VanDerWaalsContact OE1-CB 3.3Å; P1038-R1042 VanDerWaalsContact O-CB 3.29Å; P1038-R1042 WeakPolarHBondContact O-CB 3.45Å; P1038-R1042 PolarHBondContact O-N 3.42Å; A1039-R1042 PolarHBondContact O-N 3.11Å; R1042-L1044 VanDerWaalsContact C-N 3.27Å; R1042-L1044 PolarHBondContact O-N 3.14Å; R1042-V1045 PolarHBondContact O-N 2.72Å; R1042-V1045 VanDerWaalsContact O-N 3.08Å; R1042-E1046 WeakPolarHBondContact CD-OE1 3.22Å; R1042-E1046 VanDerWaalsContact CG-CD 3.44Å; R1042-E1046 HydrophobicContact CG-CG 4.12Å; R1042-E1046 VanDerWaalsContact CG-OE1 3.23Å; R1042-E1046 WeakPolarHBondContact CG-OE1 3.36Å; R1042-E1046 WeakPolarHBondContact O-CB 3.47Å; R1042-E1046 WeakPolarHBondContact O-CG 3.21Å; R1042-E1046 PolarHBondContact O-N 2.97Å
1043	R	93.9	Very high	91.7	Very high	84 Å²	84	54.9 Å²	54.9	32%	0.317	26%	0.263	S	S	.	.	H	α-helix	trans	-54.9	-40.2	175.9	-171.7	-175.4	67.7	74.2	0	112.4	A1039 E1040 I1041 S1047	A1039-R1043 WeakPolarHBondContact O-CB 3.47Å; A1039-R1043 PolarHBondContact O-N 3.29Å; E1040-R1043 WeakPolarHBondContact O-CB 3.36Å; E1040-R1043 PolarHBondContact O-N 3.39Å; E1040-R1043 IonicContact OE1-NE 3.58Å; E1040-R1043 IonicContact OE2-CZ 2.7Å; E1040-R1043 IonicContact OE2-NE 3.65Å; E1040-R1043 PolarHBondContact OE2-NE 3.42Å; E1040-R1043 IonicContact OE2-NH2 3.39Å; E1040-R1043 PolarHBondContact OE2-NH2 2.89Å; I1041-R1043 PolarHBondContact O-N 3.05Å; R1043-S1047 VanDerWaalsContact O-CB 3.24Å; R1043-S1047 WeakPolarHBondContact O-CB 3.5Å; R1043-S1047 PolarHBondContact O-N 3.09Å; R1043-S1047 VanDerWaalsContact O-N 3.08Å; R1043-S1047 PolarHBondContact O-OG 3.41Å
1044	L	93.7	Very high	92.1	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-69	-43.3	175.5	-65.2	175.5	0	0	0	112.4	I870 L890 E1040 I1041 R1042 R1048 L1076 T1079 A1080	I870-L1044 HydrophobicContact CG2-CD2 3.43Å; I870-L1044 VanDerWaalsContact CG2-CD2 3.43Å; L890-L1044 HydrophobicContact CD2-CD1 4.1Å; E1040-L1044 WeakPolarHBondContact O-CG 3.43Å; E1040-L1044 PolarHBondContact O-N 2.88Å; I1041-L1044 WeakPolarHBondContact O-CB 3.49Å; I1041-L1044 PolarHBondContact O-N 2.81Å; I1041-L1044 VanDerWaalsContact O-N 3.15Å; R1042-L1044 VanDerWaalsContact C-N 3.27Å; R1042-L1044 PolarHBondContact O-N 3.14Å; L1044-R1048 WeakPolarHBondContact O-CB 3.4Å; L1044-R1048 PolarHBondContact O-N 2.92Å; L1044-L1076 HydrophobicContact CD2-CD2 3.82Å; L1044-T1079 HydrophobicContact CD1-CG2 3.96Å; L1044-A1080 HydrophobicContact CB-CB 4.09Å; L1044-A1080 HydrophobicContact CD1-CB 4.03Å
1045	V	90.6	Very high	92.2	Very high	36 Å²	36	47.9 Å²	47.9	22%	0.218	23%	0.226	C	C	.	.	H	α-helix	trans	-68.1	-42.7	-179.7	172.3	0	0	0	0	111.4	I1041 R1042 R1048 K1049	I1041-V1045 HydrophobicContact CG2-CG2 4.34Å; I1041-V1045 WeakPolarHBondContact O-CG2 3.38Å; I1041-V1045 PolarHBondContact O-N 2.98Å; R1042-V1045 PolarHBondContact O-N 2.72Å; R1042-V1045 VanDerWaalsContact O-N 3.08Å; V1045-R1048 CarbonylContact O-C 3.59Å; V1045-R1048 WeakPolarHBondContact O-CB 3.35Å; V1045-R1048 PolarHBondContact O-N 2.72Å; V1045-R1048 VanDerWaalsContact O-N 3.15Å; V1045-K1049 PolarHBondContact O-N 2.99Å
1046	E	91.9	Very high	92	Very high	104 Å²	104	51.5 Å²	51.5	49%	0.486	26%	0.256	S	S	.	.	H	α-helix	trans	-64.9	-47.5	175.7	-72.4	171.2	169.8	0	0	111.1	R1042 R1048 K1049 E1050	R1042-E1046 WeakPolarHBondContact CD-OE1 3.22Å; R1042-E1046 VanDerWaalsContact CG-CD 3.44Å; R1042-E1046 HydrophobicContact CG-CG 4.12Å; R1042-E1046 VanDerWaalsContact CG-OE1 3.23Å; R1042-E1046 WeakPolarHBondContact CG-OE1 3.36Å; R1042-E1046 WeakPolarHBondContact O-CB 3.47Å; R1042-E1046 WeakPolarHBondContact O-CG 3.21Å; R1042-E1046 PolarHBondContact O-N 2.97Å; E1046-R1048 PolarHBondContact O-N 3.42Å; E1046-R1048 VanDerWaalsContact O-N 3.13Å; E1046-K1049 CarbonylContact O-C 3.58Å; E1046-K1049 WeakPolarHBondContact O-CA 3.21Å; E1046-K1049 PolarHBondContact O-N 2.86Å; E1046-E1050 PolarHBondContact O-N 2.95Å
1047	S	93.5	Very high	91.7	Very high	24 Å²	24	56.8 Å²	56.8	17%	0.168	29%	0.285	C	S	.	.	H	α-helix	trans	-53.4	-35	171	-63.8	0	0	0	0	112.2	R1043 V1051	R1043-S1047 VanDerWaalsContact O-CB 3.24Å; R1043-S1047 WeakPolarHBondContact O-CB 3.5Å; R1043-S1047 PolarHBondContact O-N 3.09Å; R1043-S1047 VanDerWaalsContact O-N 3.08Å; R1043-S1047 PolarHBondContact O-OG 3.41Å; S1047-V1051 VanDerWaalsContact O-CG2 3.29Å; S1047-V1051 WeakPolarHBondContact O-CG2 3.36Å; S1047-V1051 PolarHBondContact O-N 3.33Å
1048	R	93.3	Very high	91.2	Very high	45 Å²	45	57.4 Å²	57.4	17%	0.17	29%	0.288	C	S	.	.	H	α-helix	trans	-76	-39.1	177.1	-169.8	-179.2	172.2	-136.3	-2.7	111.9	L1044 V1045 E1046 E1050 V1051 K1052 Q1073 L1076	L1044-R1048 WeakPolarHBondContact O-CB 3.4Å; L1044-R1048 PolarHBondContact O-N 2.92Å; V1045-R1048 CarbonylContact O-C 3.59Å; V1045-R1048 WeakPolarHBondContact O-CB 3.35Å; V1045-R1048 PolarHBondContact O-N 2.72Å; V1045-R1048 VanDerWaalsContact O-N 3.15Å; E1046-R1048 PolarHBondContact O-N 3.42Å; E1046-R1048 VanDerWaalsContact O-N 3.13Å; R1048-E1050 VanDerWaalsContact C-N 3.31Å; R1048-V1051 PolarHBondContact O-N 2.96Å; R1048-K1052 WeakPolarHBondContact O-CB 3.34Å; R1048-K1052 WeakPolarHBondContact O-CG 3.11Å; R1048-K1052 PolarHBondContact O-N 3.12Å; R1048-Q1073 HydrophobicContact CG-CB 4.31Å; R1048-Q1073 VanDerWaalsContact NE-OE1 3.07Å; R1048-L1076 HydrophobicContact CB-CB 4.05Å; R1048-L1076 HydrophobicContact CB-CD1 4.21Å; R1048-L1076 HydrophobicContact CG-CB 4.3Å
1049	K	90.1	Very high	90.1	Very high	99 Å²	99	62 Å²	62	43%	0.43	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-38.8	172.4	-73.1	-173.8	175	-170.8	0	110.1	V1045 E1046 K1053 E1164	V1045-K1049 PolarHBondContact O-N 2.99Å; E1046-K1049 CarbonylContact O-C 3.58Å; E1046-K1049 WeakPolarHBondContact O-CA 3.21Å; E1046-K1049 PolarHBondContact O-N 2.86Å; K1049-K1053 WeakPolarHBondContact O-CG 3.43Å; K1049-K1053 PolarHBondContact O-N 3.21Å; K1049-K1053 VanDerWaalsContact O-N 3.17Å; K1049-E1164 IonicContact NZ-OE1 2.88Å; K1049-E1164 PolarHBondContact NZ-OE1 3.05Å; K1049-E1164 IonicContact NZ-OE2 3.49Å; K1049-E1164 PolarHBondContact NZ-OE2 3.41Å
1050	E	93.5	Very high	88.8	Confident	116 Å²	116	65.8 Å²	65.8	54%	0.542	34%	0.344	S	S	.	.	H	α-helix	trans	-64.8	-52.1	172.5	-70.6	-177.4	163.5	0	0	113.6	E1046 R1048 K1052 K1053 L1054	E1046-E1050 PolarHBondContact O-N 2.95Å; R1048-E1050 VanDerWaalsContact C-N 3.31Å; E1050-K1052 PolarHBondContact O-N 2.94Å; E1050-K1053 WeakPolarHBondContact O-CA 3.31Å; E1050-K1053 WeakPolarHBondContact O-CB 3.41Å; E1050-K1053 PolarHBondContact O-N 2.9Å; E1050-L1054 PolarHBondContact O-N 3.08Å
1051	V	92.9	Very high	87.2	Confident	4 Å²	4	68.4 Å²	68.4	2%	0.024	38%	0.376	C	S	.	.	H	α-helix	trans	-62.7	-33.5	-180	173.8	0	0	0	0	111.3	S1047 R1048 L1054 L1055 W1069 R1072 Q1073 L1076	S1047-V1051 VanDerWaalsContact O-CG2 3.29Å; S1047-V1051 WeakPolarHBondContact O-CG2 3.36Å; S1047-V1051 PolarHBondContact O-N 3.33Å; R1048-V1051 PolarHBondContact O-N 2.96Å; V1051-L1054 PolarHBondContact O-N 2.94Å; V1051-L1055 WeakPolarHBondContact O-CB 3.38Å; V1051-L1055 PolarHBondContact O-N 3.33Å; V1051-W1069 HydrophobicContact CG1-CB 4Å; V1051-W1069 HydrophobicContact CG1-CD2 4.45Å; V1051-W1069 HydrophobicContact CG1-CE3 3.94Å; V1051-W1069 VanDerWaalsContact CG1-O 3.3Å; V1051-W1069 WeakPolarHBondContact CG1-O 3.34Å; V1051-W1069 HydrophobicContact CG2-CE3 4.25Å; V1051-W1069 HydrophobicContact CG2-CZ3 4.44Å; V1051-R1072 HydrophobicContact CG1-CB 4.33Å; V1051-R1072 HydrophobicContact CG2-CG 4.08Å; V1051-Q1073 HydrophobicContact CG1-CB 3.94Å; V1051-L1076 HydrophobicContact CG2-CD1 4.32Å
1052	K	91.4	Very high	86.5	Confident	102 Å²	102	71.9 Å²	71.9	44%	0.443	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-40.6	169.7	-81	-173.2	172.9	-170.9	0	112.6	R1048 E1050 L1055 A1056	R1048-K1052 WeakPolarHBondContact O-CB 3.34Å; R1048-K1052 WeakPolarHBondContact O-CG 3.11Å; R1048-K1052 PolarHBondContact O-N 3.12Å; E1050-K1052 PolarHBondContact O-N 2.94Å; K1052-L1055 PolarHBondContact O-N 3.32Å; K1052-A1056 PolarHBondContact O-N 3.44Å
1053	K	91.6	Very high	85.7	Confident	140 Å²	140	70.8 Å²	70.8	61%	0.609	40%	0.4	S	S	*	.	H	α-helix	trans	-62.8	-45.1	173.9	-68.8	168.3	-176.8	176.9	0	111.4	K1049 E1050 L1055 A1056 N1057	K1049-K1053 WeakPolarHBondContact O-CG 3.43Å; K1049-K1053 PolarHBondContact O-N 3.21Å; K1049-K1053 VanDerWaalsContact O-N 3.17Å; E1050-K1053 WeakPolarHBondContact O-CA 3.31Å; E1050-K1053 WeakPolarHBondContact O-CB 3.41Å; E1050-K1053 PolarHBondContact O-N 2.9Å; K1053-L1055 PolarHBondContact O-N 2.88Å; K1053-A1056 PolarHBondContact O-N 3.3Å; K1053-N1057 VanDerWaalsContact O-CG 3.31Å; K1053-N1057 PolarHBondContact O-N 3.19Å
1054	L	90.9	Very high	85	Confident	75 Å²	75	68.6 Å²	68.6	39%	0.393	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-43.1	176.2	-65.9	174.2	0	0	0	111.8	E1050 V1051 A1056 N1057 T1058 W1069	E1050-L1054 PolarHBondContact O-N 3.08Å; V1051-L1054 PolarHBondContact O-N 2.94Å; L1054-A1056 VanDerWaalsContact C-N 3.33Å; L1054-A1056 PolarHBondContact O-N 3.29Å; L1054-N1057 CarbonylContact O-C 3.48Å; L1054-N1057 PolarHBondContact O-N 3.13Å; L1054-T1058 PolarHBondContact O-N 3.03Å; L1054-T1058 PolarHBondContact O-OG1 2.67Å; L1054-W1069 HydrophobicContact CB-CD2 4.39Å; L1054-W1069 HydrophobicContact CD1-CD2 4.48Å; L1054-W1069 HydrophobicContact CD1-CE3 4.41Å; L1054-W1069 HydrophobicContact CD1-CH2 3.77Å; L1054-W1069 HydrophobicContact CD1-CZ2 3.81Å; L1054-W1069 HydrophobicContact CD1-CZ3 4.07Å
1055	L	88	Confident	84.5	Confident	25 Å²	25	72.3 Å²	72.3	13%	0.131	42%	0.417	C	S	.	.	H	α-helix	trans	-62.9	-35.8	176.4	-175.3	74.5	0	0	0	113.1	V1051 K1052 K1053 R1066 W1069 N1070	V1051-L1055 WeakPolarHBondContact O-CB 3.38Å; V1051-L1055 PolarHBondContact O-N 3.33Å; K1052-L1055 PolarHBondContact O-N 3.32Å; K1053-L1055 PolarHBondContact O-N 2.88Å; L1055-R1066 HydrophobicContact CD1-CG 3.67Å; L1055-R1066 PolarHBondContact O-NH1 3.42Å; L1055-W1069 HydrophobicContact CB-CB 4.34Å; L1055-W1069 HydrophobicContact CD1-CB 3.95Å; L1055-N1070 VanDerWaalsContact CD1-OD1 3.31Å; L1055-N1070 WeakPolarHBondContact CD1-OD1 3.43Å; L1055-N1070 WeakPolarHBondContact CD2-OD1 3.29Å
1056	A	85.9	Confident	84.3	Confident	78 Å²	78	75.4 Å²	75.4	65%	0.645	43%	0.425	S	S	*	.	H	α-helix	trans	-70	-39.1	174.5	0	0	0	0	0	112	K1052 K1053 L1054 T1058	K1052-A1056 PolarHBondContact O-N 3.44Å; K1053-A1056 PolarHBondContact O-N 3.3Å; L1054-A1056 VanDerWaalsContact C-N 3.33Å; L1054-A1056 PolarHBondContact O-N 3.29Å; A1056-T1058 VanDerWaalsContact C-N 3.32Å; A1056-T1058 PolarHBondContact O-N 3.26Å
1057	N	85.8	Confident	83.9	Confident	131 Å²	131	71.4 Å²	71.4	70%	0.701	41%	0.41	S	S	*	.	H	α-helix	trans	-78	-12.5	178.1	-65.9	-3.7	0	0	0	113.7	K1053 L1054 S1059	K1053-N1057 VanDerWaalsContact O-CG 3.31Å; K1053-N1057 PolarHBondContact O-N 3.19Å; L1054-N1057 CarbonylContact O-C 3.48Å; L1054-N1057 PolarHBondContact O-N 3.13Å; N1057-S1059 PolarHBondContact O-N 2.76Å
1058	T	82.4	Confident	83.5	Confident	14 Å²	14	72.8 Å²	72.8	9%	0.086	41%	0.413	C	S	.	.	S	Bend	trans	-75.7	104.7	-178.9	-58.3	0	0	0	0	110.8	L1054 A1056 Q1065 R1066	L1054-T1058 PolarHBondContact O-N 3.03Å; L1054-T1058 PolarHBondContact O-OG1 2.67Å; A1056-T1058 VanDerWaalsContact C-N 3.32Å; A1056-T1058 PolarHBondContact O-N 3.26Å; T1058-Q1065 HydrophobicContact CG2-CG 4.41Å; T1058-R1066 HydrophobicContact CG2-CB 4.25Å; T1058-R1066 PolarHBondContact O-NH1 2.87Å
1059	S	70.6	Confident	83.4	Confident	96 Å²	96	72.9 Å²	72.9	67%	0.671	41%	0.414	S	S	*	.			trans	-49.4	141.9	174.2	-61.5	0	0	0	0	113.2	N1057 G1061 D1062	N1057-S1059 PolarHBondContact O-N 2.76Å; S1059-G1061 PolarHBondContact O-N 2.62Å; S1059-D1062 PolarHBondContact O-N 2.96Å
1060	S	65	Low	83.3	Confident	123 Å²	123	71.4 Å²	71.4	86%	0.86	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-7.4	-174.2	-46.3	0	0	0	0	116.6
1061	G	61.2	Low	83.1	Confident	70 Å²	70	66.3 Å²	66.3	72%	0.722	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-26.9	177.6	0	0	0	0	0	114.8	S1059 A1063	S1059-G1061 PolarHBondContact O-N 2.62Å; G1061-A1063 PolarHBondContact O-N 3.41Å
1062	D	77.8	Confident	83.1	Confident	73 Å²	73	70.8 Å²	70.8	39%	0.39	40%	0.404	S	S	.	.			trans	-99.7	77.9	178.9	-163.7	-19.9	0	0	0	111.6	S1059 A1064 Q1065 R1066	S1059-D1062 PolarHBondContact O-N 2.96Å; D1062-A1064 PolarHBondContact O-N 3.42Å; D1062-A1064 PolarHBondContact OD1-N 3.32Å; D1062-Q1065 HydrophobicContact CB-CB 4.2Å; D1062-Q1065 WeakPolarHBondContact OD1-CB 3.4Å; D1062-Q1065 PolarHBondContact OD1-N 3.16Å; D1062-Q1065 WeakPolarHBondContact OD2-CB 3.45Å; D1062-R1066 VanDerWaalsContact O-CB 3.32Å; D1062-R1066 WeakPolarHBondContact O-CB 3.44Å; D1062-R1066 PolarHBondContact O-N 3.33Å; D1062-R1066 VanDerWaalsContact O-N 3.08Å
1063	A	76.6	Confident	83.2	Confident	47 Å²	47	67.9 Å²	67.9	39%	0.388	39%	0.392	S	S	.	.	H	α-helix	trans	-62.2	-26.8	174	0	0	0	0	0	112.8	G1061 A1067	G1061-A1063 PolarHBondContact O-N 3.41Å; A1063-A1067 WeakPolarHBondContact O-CB 3.37Å; A1063-A1067 PolarHBondContact O-N 3.08Å
1064	A	78	Confident	83.1	Confident	37 Å²	37	62.7 Å²	62.7	31%	0.306	38%	0.375	S	S	.	.	H	α-helix	trans	-74.6	-49.1	-176.6	0	0	0	0	0	111.4	P584 D1062 R1066 A1067 Q1068	P584-A1064 HydrophobicContact CG-CB 3.82Å; D1062-A1064 PolarHBondContact O-N 3.42Å; D1062-A1064 PolarHBondContact OD1-N 3.32Å; A1064-R1066 VanDerWaalsContact C-N 3.34Å; A1064-A1067 PolarHBondContact O-N 2.94Å; A1064-Q1068 PolarHBondContact O-N 3.31Å
1065	Q	83.9	Confident	83.2	Confident	80 Å²	80	59.1 Å²	59.1	37%	0.374	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-39.9	173	179.9	168	86.4	0	0	111.4	T1058 D1062 A1067 Q1068 W1069	T1058-Q1065 HydrophobicContact CG2-CG 4.41Å; D1062-Q1065 HydrophobicContact CB-CB 4.2Å; D1062-Q1065 WeakPolarHBondContact OD1-CB 3.4Å; D1062-Q1065 PolarHBondContact OD1-N 3.16Å; D1062-Q1065 WeakPolarHBondContact OD2-CB 3.45Å; Q1065-A1067 VanDerWaalsContact C-N 3.34Å; Q1065-A1067 PolarHBondContact O-N 3.47Å; Q1065-Q1068 WeakPolarHBondContact O-CB 3.42Å; Q1065-Q1068 PolarHBondContact O-N 2.86Å; Q1065-Q1068 VanDerWaalsContact O-N 3.16Å; Q1065-W1069 VanDerWaalsContact CG-NE1 3.26Å; Q1065-W1069 PolarHBondContact O-N 2.85Å
1066	R	85.4	Confident	83.5	Confident	100 Å²	100	58.1 Å²	58.1	38%	0.377	35%	0.351	S	S	.	.	H	α-helix	trans	-59.5	-42.5	175.8	-166.3	175.9	-173.8	75.3	8.8	112.3	L1055 T1058 D1062 A1064 N1070	L1055-R1066 HydrophobicContact CD1-CG 3.67Å; L1055-R1066 PolarHBondContact O-NH1 3.42Å; T1058-R1066 HydrophobicContact CG2-CB 4.25Å; T1058-R1066 PolarHBondContact O-NH1 2.87Å; D1062-R1066 VanDerWaalsContact O-CB 3.32Å; D1062-R1066 WeakPolarHBondContact O-CB 3.44Å; D1062-R1066 PolarHBondContact O-N 3.33Å; D1062-R1066 VanDerWaalsContact O-N 3.08Å; A1064-R1066 VanDerWaalsContact C-N 3.34Å; R1066-N1070 PolarHBondContact O-N 3.02Å
1067	A	83.4	Confident	83.7	Confident	21 Å²	21	56.1 Å²	56.1	17%	0.174	33%	0.328	C	S	.	.	H	α-helix	trans	-67.7	-35.8	175.3	0	0	0	0	0	112.7	P584 A1063 A1064 Q1065 T1071	P584-A1067 HydrophobicContact CG-CB 4.2Å; A1063-A1067 WeakPolarHBondContact O-CB 3.37Å; A1063-A1067 PolarHBondContact O-N 3.08Å; A1064-A1067 PolarHBondContact O-N 2.94Å; Q1065-A1067 VanDerWaalsContact C-N 3.34Å; Q1065-A1067 PolarHBondContact O-N 3.47Å; A1067-T1071 WeakPolarHBondContact O-CB 3.39Å; A1067-T1071 PolarHBondContact O-N 3.31Å; A1067-T1071 PolarHBondContact O-OG1 3.3Å
1068	Q	86.3	Confident	83.9	Confident	53 Å²	53	52.5 Å²	52.5	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-45.8	175.1	-167.1	-175	48.6	0	0	111.6	D582 A1064 Q1065 T1071 R1072	D582-Q1068 PolarHBondContact O-NE2 2.86Å; A1064-Q1068 PolarHBondContact O-N 3.31Å; Q1065-Q1068 WeakPolarHBondContact O-CB 3.42Å; Q1065-Q1068 PolarHBondContact O-N 2.86Å; Q1065-Q1068 VanDerWaalsContact O-N 3.16Å; Q1068-T1071 WeakPolarHBondContact O-CB 3.24Å; Q1068-T1071 PolarHBondContact O-N 3.49Å; Q1068-R1072 PolarHBondContact O-N 2.77Å
1069	W	90.1	Very high	84.3	Confident	46 Å²	46	52 Å²	52	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-39.1	176.1	-65.6	136	0	0	0	113	V1051 L1054 L1055 Q1065 T1071 R1072 Q1073	V1051-W1069 HydrophobicContact CG1-CB 4Å; V1051-W1069 HydrophobicContact CG1-CD2 4.45Å; V1051-W1069 HydrophobicContact CG1-CE3 3.94Å; V1051-W1069 VanDerWaalsContact CG1-O 3.3Å; V1051-W1069 WeakPolarHBondContact CG1-O 3.34Å; V1051-W1069 HydrophobicContact CG2-CE3 4.25Å; V1051-W1069 HydrophobicContact CG2-CZ3 4.44Å; L1054-W1069 HydrophobicContact CB-CD2 4.39Å; L1054-W1069 HydrophobicContact CD1-CD2 4.48Å; L1054-W1069 HydrophobicContact CD1-CE3 4.41Å; L1054-W1069 HydrophobicContact CD1-CH2 3.77Å; L1054-W1069 HydrophobicContact CD1-CZ2 3.81Å; L1054-W1069 HydrophobicContact CD1-CZ3 4.07Å; L1055-W1069 HydrophobicContact CB-CB 4.34Å; L1055-W1069 HydrophobicContact CD1-CB 3.95Å; Q1065-W1069 VanDerWaalsContact CG-NE1 3.26Å; Q1065-W1069 PolarHBondContact O-N 2.85Å; W1069-T1071 VanDerWaalsContact C-N 3.34Å; W1069-T1071 PolarHBondContact O-N 3.28Å; W1069-R1072 PolarHBondContact O-N 3.31Å; W1069-Q1073 PolarHBondContact O-N 3.1Å
1070	N	89.6	Confident	85.2	Confident	68 Å²	68	47.7 Å²	47.7	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-57.4	-46.4	171.4	-85.8	-10.1	0	0	0	111.9	L1055 R1066 R1072 Q1073 A1074	L1055-N1070 VanDerWaalsContact CD1-OD1 3.31Å; L1055-N1070 WeakPolarHBondContact CD1-OD1 3.43Å; L1055-N1070 WeakPolarHBondContact CD2-OD1 3.29Å; R1066-N1070 PolarHBondContact O-N 3.02Å; N1070-R1072 VanDerWaalsContact C-N 3.34Å; N1070-R1072 PolarHBondContact O-N 2.94Å; N1070-Q1073 PolarHBondContact O-N 3.09Å; N1070-A1074 WeakPolarHBondContact O-CB 3.48Å; N1070-A1074 PolarHBondContact O-N 3.46Å
1071	T	89.3	Confident	86.3	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.055	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-45.7	176.9	-54	0	0	0	0	111.1	Q859 P862 L863 Q866 A1067 Q1068 W1069 A1074 A1075	Q859-T1071 PolarHBondContact NE2-OG1 3.44Å; P862-T1071 HydrophobicContact CB-CG2 3.94Å; L863-T1071 HydrophobicContact CB-CG2 4.01Å; L863-T1071 HydrophobicContact CD1-CG2 4.23Å; Q866-T1071 HydrophobicContact CG-CG2 4.11Å; A1067-T1071 WeakPolarHBondContact O-CB 3.39Å; A1067-T1071 PolarHBondContact O-N 3.31Å; A1067-T1071 PolarHBondContact O-OG1 3.3Å; Q1068-T1071 WeakPolarHBondContact O-CB 3.24Å; Q1068-T1071 PolarHBondContact O-N 3.49Å; W1069-T1071 VanDerWaalsContact C-N 3.34Å; W1069-T1071 PolarHBondContact O-N 3.28Å; T1071-A1074 PolarHBondContact O-N 3.36Å; T1071-A1075 PolarHBondContact O-N 3.49Å
1072	R	92.1	Very high	87.6	Confident	99 Å²	99	40.5 Å²	40.5	37%	0.374	21%	0.213	S	C	.	.	H	α-helix	trans	-68.3	-39.9	-179.4	-174.6	173.1	170.3	136.7	-7.8	113.1	Q866 V1051 Q1068 W1069 N1070 A1074 A1075 L1076	Q866-R1072 HydrophobicContact CG-CB 4.41Å; V1051-R1072 HydrophobicContact CG1-CB 4.33Å; V1051-R1072 HydrophobicContact CG2-CG 4.08Å; Q1068-R1072 PolarHBondContact O-N 2.77Å; W1069-R1072 PolarHBondContact O-N 3.31Å; N1070-R1072 VanDerWaalsContact C-N 3.34Å; N1070-R1072 PolarHBondContact O-N 2.94Å; R1072-A1074 VanDerWaalsContact C-N 3.31Å; R1072-A1074 PolarHBondContact O-N 2.88Å; R1072-A1075 PolarHBondContact O-N 3.06Å; R1072-L1076 HydrophobicContact CG-CD1 4.19Å; R1072-L1076 WeakPolarHBondContact O-CG 3.45Å; R1072-L1076 PolarHBondContact O-N 3.04Å
1073	Q	93	Very high	88.1	Confident	41 Å²	41	37.2 Å²	37.2	19%	0.192	20%	0.195	C	C	.	.	H	α-helix	trans	-69.4	-31.1	176.5	87.4	75.4	41.8	0	0	112.2	R1048 V1051 W1069 N1070 K1077	R1048-Q1073 HydrophobicContact CG-CB 4.31Å; R1048-Q1073 VanDerWaalsContact NE-OE1 3.07Å; V1051-Q1073 HydrophobicContact CG1-CB 3.94Å; W1069-Q1073 PolarHBondContact O-N 3.1Å; N1070-Q1073 PolarHBondContact O-N 3.09Å; Q1073-K1077 PolarHBondContact O-N 3.37Å
1074	A	91	Very high	88.6	Confident	30 Å²	30	36 Å²	36	25%	0.248	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-47.2	173.5	0	0	0	0	0	111.3	L863 N1070 T1071 R1072 L1076 K1077 L1078	L863-A1074 HydrophobicContact CD1-CB 4.23Å; N1070-A1074 WeakPolarHBondContact O-CB 3.48Å; N1070-A1074 PolarHBondContact O-N 3.46Å; T1071-A1074 PolarHBondContact O-N 3.36Å; R1072-A1074 VanDerWaalsContact C-N 3.31Å; R1072-A1074 PolarHBondContact O-N 2.88Å; A1074-L1076 VanDerWaalsContact C-N 3.29Å; A1074-L1076 PolarHBondContact O-N 3.1Å; A1074-K1077 PolarHBondContact O-N 2.87Å; A1074-L1078 WeakPolarHBondContact O-CB 3.3Å; A1074-L1078 WeakPolarHBondContact O-CG 3.34Å; A1074-L1078 PolarHBondContact O-N 2.94Å
1075	A	92.4	Very high	89	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.3	-43.7	173.9	0	0	0	0	0	112.2	L863 Q866 I867 I870 T1071 R1072 T1079	L863-A1075 HydrophobicContact CD1-CB 3.94Å; Q866-A1075 HydrophobicContact CB-CB 3.64Å; I867-A1075 HydrophobicContact CG1-CB 3.73Å; I870-A1075 HydrophobicContact CD1-CB 3.71Å; T1071-A1075 PolarHBondContact O-N 3.49Å; R1072-A1075 PolarHBondContact O-N 3.06Å; A1075-T1079 WeakPolarHBondContact O-CB 3.43Å; A1075-T1079 PolarHBondContact O-N 3.41Å; A1075-T1079 PolarHBondContact O-OG1 2.89Å
1076	L	93.7	Very high	89.2	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-41.2	177	-71.5	164.4	0	0	0	112.7	I870 L1044 R1048 V1051 R1072 A1074 A1080	I870-L1076 HydrophobicContact CD1-CD2 3.72Å; I870-L1076 HydrophobicContact CD1-CG 3.86Å; I870-L1076 HydrophobicContact CG1-CD2 4.16Å; L1044-L1076 HydrophobicContact CD2-CD2 3.82Å; R1048-L1076 HydrophobicContact CB-CB 4.05Å; R1048-L1076 HydrophobicContact CB-CD1 4.21Å; R1048-L1076 HydrophobicContact CG-CB 4.3Å; V1051-L1076 HydrophobicContact CG2-CD1 4.32Å; R1072-L1076 HydrophobicContact CG-CD1 4.19Å; R1072-L1076 WeakPolarHBondContact O-CG 3.45Å; R1072-L1076 PolarHBondContact O-N 3.04Å; A1074-L1076 VanDerWaalsContact C-N 3.29Å; A1074-L1076 PolarHBondContact O-N 3.1Å; L1076-A1080 VanDerWaalsContact O-CB 3.29Å; L1076-A1080 WeakPolarHBondContact O-CB 3.42Å; L1076-A1080 PolarHBondContact O-N 3.19Å
1077	K	91.1	Very high	89.3	Confident	36 Å²	36	26.9 Å²	26.9	16%	0.157	14%	0.142	C	C	.	.	H	α-helix	trans	-63.5	-51.7	175.3	-163.2	-169	-173.6	-166.4	0	111.3	G42 D43 Q1073 A1074 T1079 A1080 N1081	G42-K1077 VanDerWaalsContact C-NZ 3.3Å; G42-K1077 VanDerWaalsContact O-CE 3.31Å; G42-K1077 WeakPolarHBondContact O-CE 3.43Å; G42-K1077 PolarHBondContact O-NZ 3.35Å; D43-K1077 VanDerWaalsContact OD1-CE 3.27Å; D43-K1077 WeakPolarHBondContact OD1-CE 3.35Å; D43-K1077 IonicContact OD1-NZ 2.66Å; D43-K1077 PolarHBondContact OD1-NZ 3.12Å; D43-K1077 IonicContact OD2-NZ 3.52Å; D43-K1077 PolarHBondContact OD2-NZ 3.33Å; Q1073-K1077 PolarHBondContact O-N 3.37Å; A1074-K1077 PolarHBondContact O-N 2.87Å; K1077-T1079 VanDerWaalsContact C-N 3.31Å; K1077-T1079 PolarHBondContact O-N 2.89Å; K1077-A1080 PolarHBondContact O-N 3.1Å; K1077-N1081 WeakPolarHBondContact CE-ND2 3.3Å; K1077-N1081 WeakPolarHBondContact O-CB 3.32Å; K1077-N1081 PolarHBondContact O-N 2.94Å
1078	L	88.4	Confident	89.4	Confident	54 Å²	54	26.5 Å²	26.5	28%	0.283	14%	0.14	S	C	.	.	H	α-helix	trans	-57.2	-45.6	-178.4	-72	170.9	0	0	0	111.3	L863 I867 A1074 S1082	L863-L1078 HydrophobicContact CD2-CD1 4.37Å; I867-L1078 HydrophobicContact CD1-CD1 4.37Å; A1074-L1078 WeakPolarHBondContact O-CB 3.3Å; A1074-L1078 WeakPolarHBondContact O-CG 3.34Å; A1074-L1078 PolarHBondContact O-N 2.94Å; L1078-S1082 VanDerWaalsContact O-CB 3.27Å; L1078-S1082 WeakPolarHBondContact O-CB 3.03Å; L1078-S1082 PolarHBondContact O-N 2.87Å; L1078-S1082 VanDerWaalsContact O-N 3.15Å; L1078-S1082 PolarHBondContact O-OG 3.24Å; L1078-S1082 VanDerWaalsContact O-OG 3.08Å
1079	T	91.7	Very high	89.1	Confident	4 Å²	4	25.1 Å²	25.1	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-61.3	-58.5	177	-49.6	0	0	0	0	110.4	I870 L890 L1044 A1075 K1077 N1081 S1082 V1083	I870-T1079 HydrophobicContact CG2-CG2 4.02Å; L890-T1079 HydrophobicContact CD2-CG2 3.95Å; L1044-T1079 HydrophobicContact CD1-CG2 3.96Å; A1075-T1079 WeakPolarHBondContact O-CB 3.43Å; A1075-T1079 PolarHBondContact O-N 3.41Å; A1075-T1079 PolarHBondContact O-OG1 2.89Å; K1077-T1079 VanDerWaalsContact C-N 3.31Å; K1077-T1079 PolarHBondContact O-N 2.89Å; T1079-N1081 PolarHBondContact O-N 3.46Å; T1079-S1082 PolarHBondContact O-N 3.16Å; T1079-S1082 PolarHBondContact O-OG 3.08Å; T1079-V1083 WeakPolarHBondContact O-CG2 3.47Å; T1079-V1083 PolarHBondContact O-N 2.95Å
1080	A	89.9	Confident	88.5	Confident	5 Å²	5	25.3 Å²	25.3	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-58.5	-44.8	-174.6	0	0	0	0	0	113.1	P967 L1044 L1076 K1077 S1082 V1083	P967-A1080 WeakPolarHBondContact CG-O 3.43Å; L1044-A1080 HydrophobicContact CB-CB 4.09Å; L1044-A1080 HydrophobicContact CD1-CB 4.03Å; L1076-A1080 VanDerWaalsContact O-CB 3.29Å; L1076-A1080 WeakPolarHBondContact O-CB 3.42Å; L1076-A1080 PolarHBondContact O-N 3.19Å; K1077-A1080 PolarHBondContact O-N 3.1Å; A1080-S1082 VanDerWaalsContact C-N 3.33Å; A1080-S1082 PolarHBondContact O-N 2.79Å; A1080-V1083 PolarHBondContact O-N 3.29Å
1081	N	86.8	Confident	87.9	Confident	14 Å²	14	23.7 Å²	23.7	8%	0.075	14%	0.141	C	C	.	.	H	α-helix	trans	-60.3	-43.4	175.5	-80.3	7.2	0	0	0	111.3	G42 D43 Y44 S964 K1077 T1079 V1083	G42-N1081 PolarHBondContact O-ND2 3.31Å; D43-N1081 PolarHBondContact OD1-ND2 2.77Å; Y44-N1081 PolarHBondContact OH-O 3.45Å; S964-N1081 PolarHBondContact OG-OD1 3.44Å; K1077-N1081 WeakPolarHBondContact CE-ND2 3.3Å; K1077-N1081 WeakPolarHBondContact O-CB 3.32Å; K1077-N1081 PolarHBondContact O-N 2.94Å; T1079-N1081 PolarHBondContact O-N 3.46Å; N1081-V1083 VanDerWaalsContact C-N 3.25Å; N1081-V1083 PolarHBondContact O-N 3.39Å
1082	S	88.7	Confident	87.7	Confident	29 Å²	29	23.8 Å²	23.8	20%	0.203	14%	0.142	C	C	.	.	H	α-helix	trans	-70.4	-13.6	-174.4	70.9	0	0	0	0	115.4	N887 L1078 T1079 A1080 Y1084 G1085 C1086	N887-S1082 VanDerWaalsContact ND2-C 3.29Å; N887-S1082 WeakPolarHBondContact ND2-CB 3.46Å; N887-S1082 PolarHBondContact ND2-O 3.02Å; N887-S1082 PolarHBondContact ND2-OG 2.81Å; N887-S1082 PolarHBondContact OD1-OG 2.71Å; L1078-S1082 VanDerWaalsContact O-CB 3.27Å; L1078-S1082 WeakPolarHBondContact O-CB 3.03Å; L1078-S1082 PolarHBondContact O-N 2.87Å; L1078-S1082 VanDerWaalsContact O-N 3.15Å; L1078-S1082 PolarHBondContact O-OG 3.24Å; L1078-S1082 VanDerWaalsContact O-OG 3.08Å; T1079-S1082 PolarHBondContact O-N 3.16Å; T1079-S1082 PolarHBondContact O-OG 3.08Å; A1080-S1082 VanDerWaalsContact C-N 3.33Å; A1080-S1082 PolarHBondContact O-N 2.79Å; S1082-Y1084 PolarHBondContact O-N 3.28Å; S1082-G1085 PolarHBondContact O-N 3.22Å; S1082-G1085 VanDerWaalsContact O-N 3.17Å; S1082-C1086 PolarHBondContact O-N 2.86Å
1083	V	88.9	Confident	87.5	Confident	3 Å²	3	19.8 Å²	19.8	2%	0.018	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-42.6	-176.3	-179.1	0	0	0	0	112.3	L890 L1037 I1041 T1079 A1080 N1081 G1085 C1086	L890-V1083 HydrophobicContact CD2-CG2 4.39Å; L1037-V1083 HydrophobicContact CD1-CG1 3.54Å; I1041-V1083 HydrophobicContact CD1-CB 4.36Å; I1041-V1083 HydrophobicContact CD1-CG1 4.03Å; I1041-V1083 HydrophobicContact CG1-CB 4.46Å; I1041-V1083 HydrophobicContact CG1-CG1 4.25Å; I1041-V1083 HydrophobicContact CG1-CG2 4.44Å; T1079-V1083 WeakPolarHBondContact O-CG2 3.47Å; T1079-V1083 PolarHBondContact O-N 2.95Å; A1080-V1083 PolarHBondContact O-N 3.29Å; N1081-V1083 VanDerWaalsContact C-N 3.25Å; N1081-V1083 PolarHBondContact O-N 3.39Å; V1083-G1085 VanDerWaalsContact C-N 3.31Å; V1083-G1085 PolarHBondContact O-N 3.34Å; V1083-C1086 WeakPolarHBondContact O-CB 3.48Å; V1083-C1086 PolarHBondContact O-N 2.8Å; V1083-C1086 VanDerWaalsContact O-N 3.12Å
1084	Y	87.9	Confident	87.4	Confident	22 Å²	22	17.9 Å²	17.9	9%	0.086	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-40.3	177.2	152.4	-87.2	0	0	0	112.2	Y44 Y940 Y966 S1082 C1086 L1087 G1088 A1100 V1103 T1104	Y44-Y1084 AromaticContact CE1-CD1 3.94Å; Y44-Y1084 HydrophobicContact CE1-CD1 3.94Å; Y44-Y1084 HydrophobicContact CE1-CE1 4.25Å; Y44-Y1084 AromaticContact CZ-CD1 3.88Å; Y44-Y1084 WeakPolarHBondContact OH-CD1 3.18Å; Y940-Y1084 WeakPolarHBondContact CE2-OH 3.21Å; Y940-Y1084 PolarHBondContact OH-OH 3.02Å; Y966-Y1084 AromaticContact CD2-CD1 3.71Å; Y966-Y1084 HydrophobicContact CD2-CD1 3.71Å; Y966-Y1084 HydrophobicContact CD2-CD2 4.06Å; Y966-Y1084 AromaticContact CD2-CE1 3.84Å; Y966-Y1084 HydrophobicContact CD2-CE1 3.84Å; Y966-Y1084 HydrophobicContact CD2-CE2 4.19Å; Y966-Y1084 AromaticContact CD2-CG 3.81Å; Y966-Y1084 HydrophobicContact CD2-CG 3.81Å; Y966-Y1084 HydrophobicContact CE2-CD1 4.2Å; Y966-Y1084 AromaticContact CE2-CE1 3.86Å; Y966-Y1084 HydrophobicContact CE2-CE1 3.86Å; Y966-Y1084 HydrophobicContact CE2-CE2 4.37Å; Y966-Y1084 AromaticContact CE2-CZ 3.95Å; Y966-Y1084 HydrophobicContact CG-CD2 4.36Å; Y966-Y1084 HydrophobicContact CG-CG 4.34Å; S1082-Y1084 PolarHBondContact O-N 3.28Å; Y1084-C1086 PolarHBondContact O-N 2.97Å; Y1084-L1087 WeakPolarHBondContact O-CB 3.37Å; Y1084-L1087 PolarHBondContact O-N 2.92Å; Y1084-G1088 PolarHBondContact O-N 3Å; Y1084-A1100 HydrophobicContact CE2-CB 4.2Å; Y1084-V1103 HydrophobicContact CD2-CB 4.2Å; Y1084-V1103 HydrophobicContact CD2-CG1 3.78Å; Y1084-V1103 HydrophobicContact CE2-CB 4.35Å; Y1084-V1103 HydrophobicContact CE2-CG1 4.14Å; Y1084-T1104 HydrophobicContact CE2-CG2 3.91Å; Y1084-T1104 WeakPolarHBondContact OH-CG2 3.44Å
1085	G	86.3	Confident	87.3	Confident	22 Å²	22	17.8 Å²	17.8	23%	0.227	12%	0.116	C	C	.	.	H	α-helix	trans	-61.4	-27.3	179	0	0	0	0	0	112.9	S1082 V1083 L1087 G1088 F1089	S1082-G1085 PolarHBondContact O-N 3.22Å; S1082-G1085 VanDerWaalsContact O-N 3.17Å; V1083-G1085 VanDerWaalsContact C-N 3.31Å; V1083-G1085 PolarHBondContact O-N 3.34Å; G1085-L1087 PolarHBondContact O-N 2.99Å; G1085-G1088 PolarHBondContact O-N 3.26Å; G1085-F1089 WeakPolarHBondContact O-CB 3.29Å; G1085-F1089 PolarHBondContact O-N 2.85Å; G1085-F1089 VanDerWaalsContact O-N 3.1Å
1086	C	87.1	Confident	87.1	Confident	3 Å²	3	17.8 Å²	17.8	2%	0.02	12%	0.116	C	C	.	.	H	α-helix	trans	-66.8	-23	174.1	-149.6	0	0	0	0	113.2	N887 S1082 V1083 Y1084 S1092	N887-C1086 HydrophobicContact CB-CB 3.91Å; N887-C1086 VanDerWaalsContact CB-SG 3.57Å; S1082-C1086 PolarHBondContact O-N 2.86Å; V1083-C1086 WeakPolarHBondContact O-CB 3.48Å; V1083-C1086 PolarHBondContact O-N 2.8Å; V1083-C1086 VanDerWaalsContact O-N 3.12Å; Y1084-C1086 PolarHBondContact O-N 2.97Å; C1086-S1092 WeakPolarHBondContact O-CB 3.3Å; C1086-S1092 PolarHBondContact O-OG 3.12Å; C1086-S1092 PolarHBondContact SG-OG 3.28Å; C1086-S1092 VanDerWaalsContact SG-OG 3.32Å
1087	L	88	Confident	86.7	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-85	-36.5	178.3	-51.1	175.8	0	0	0	111.9	F977 L1037 Y1084 G1085 A1096 A1100	F977-L1087 HydrophobicContact CE2-CD2 3.77Å; F977-L1087 HydrophobicContact CZ-CD2 3.59Å; L1037-L1087 HydrophobicContact CD2-CD1 4.07Å; L1037-L1087 HydrophobicContact CD2-CD2 4.33Å; Y1084-L1087 WeakPolarHBondContact O-CB 3.37Å; Y1084-L1087 PolarHBondContact O-N 2.92Å; G1085-L1087 PolarHBondContact O-N 2.99Å; L1087-A1096 CarbonylContact O-C 3.47Å; L1087-A1096 PolarHBondContact O-N 3Å; L1087-A1100 HydrophobicContact CB-CB 4.22Å
1088	G	84.2	Confident	86.4	Confident	13 Å²	13	22 Å²	22	13%	0.134	14%	0.137	C	C	.	.	H	α-helix	trans	-78.6	-33.1	180	0	0	0	0	0	114	Y1084 G1085 A1090	Y1084-G1088 PolarHBondContact O-N 3Å; G1085-G1088 PolarHBondContact O-N 3.26Å; G1088-A1090 PolarHBondContact O-N 3.45Å
1089	F	80.5	Confident	86.4	Confident	24 Å²	24	19.4 Å²	19.4	11%	0.105	12%	0.124	C	C	.	.			trans	-66.2	127.5	-176.9	171.7	-143.8	0	0	0	112.5	F52 A884 G1085 A1091 S1092 C1095	F52-F1089 HydrophobicContact CB-CD2 3.55Å; F52-F1089 HydrophobicContact CB-CE1 4.4Å; F52-F1089 HydrophobicContact CB-CE2 3.46Å; F52-F1089 VanDerWaalsContact CB-CE2 3.46Å; F52-F1089 HydrophobicContact CB-CG 4.12Å; F52-F1089 HydrophobicContact CB-CZ 3.88Å; F52-F1089 AromaticContact CD1-CD1 3.67Å; F52-F1089 HydrophobicContact CD1-CD1 3.67Å; F52-F1089 HydrophobicContact CD1-CD2 4.25Å; F52-F1089 AromaticContact CD1-CE1 3.59Å; F52-F1089 HydrophobicContact CD1-CE1 3.59Å; F52-F1089 HydrophobicContact CD1-CE2 4.23Å; F52-F1089 HydrophobicContact CD1-CG 4.01Å; F52-F1089 AromaticContact CD1-CZ 3.88Å; F52-F1089 HydrophobicContact CD1-CZ 3.88Å; F52-F1089 HydrophobicContact CD2-CG 4.47Å; F52-F1089 HydrophobicContact CE1-CD1 4.09Å; F52-F1089 HydrophobicContact CE1-CE1 4.24Å; F52-F1089 HydrophobicContact CG-CD1 4.12Å; F52-F1089 AromaticContact CG-CD2 3.92Å; F52-F1089 HydrophobicContact CG-CD2 3.92Å; F52-F1089 HydrophobicContact CG-CE1 4.24Å; F52-F1089 HydrophobicContact CG-CE2 4.1Å; F52-F1089 AromaticContact CG-CG 3.96Å; F52-F1089 HydrophobicContact CG-CG 3.96Å; F52-F1089 HydrophobicContact CG-CZ 4.21Å; F52-F1089 WeakPolarHBondContact O-CE2 3.48Å; A884-F1089 HydrophobicContact CB-CD1 3.81Å; A884-F1089 HydrophobicContact CB-CE1 3.8Å; G1085-F1089 WeakPolarHBondContact O-CB 3.29Å; G1085-F1089 PolarHBondContact O-N 2.85Å; G1085-F1089 VanDerWaalsContact O-N 3.1Å; F1089-A1091 HydrophobicContact CE1-CB 4.32Å; F1089-A1091 HydrophobicContact CE2-CB 3.8Å; F1089-A1091 HydrophobicContact CZ-CB 3.57Å; F1089-S1092 WeakPolarHBondContact O-CB 3.44Å; F1089-S1092 PolarHBondContact O-N 2.96Å; F1089-C1095 VanDerWaalsContact O-CB 3.32Å; F1089-C1095 WeakPolarHBondContact O-CB 3.35Å; F1089-C1095 PolarHBondContact O-SG 2.81Å
1090	A	77.1	Confident	86.3	Confident	50 Å²	50	19.2 Å²	19.2	41%	0.413	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-47.1	-174.6	0	0	0	0	0	114.9	G1088 S1092	G1088-A1090 PolarHBondContact O-N 3.45Å; A1090-S1092 PolarHBondContact O-N 2.79Å
1091	A	77.2	Confident	86.2	Confident	35 Å²	35	19.7 Å²	19.7	29%	0.289	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	18.8	178.4	0	0	0	0	0	113	F1089	F1089-A1091 HydrophobicContact CE1-CB 4.32Å; F1089-A1091 HydrophobicContact CE2-CB 3.8Å; F1089-A1091 HydrophobicContact CZ-CB 3.57Å
1092	S	85.7	Confident	86.3	Confident	11 Å²	11	19.1 Å²	19.1	8%	0.077	12%	0.123	C	C	.	.			trans	-74.2	131.4	164.6	178.5	0	0	0	0	110.3	C1086 F1089 A1090 F1094 C1095	C1086-S1092 WeakPolarHBondContact O-CB 3.3Å; C1086-S1092 PolarHBondContact O-OG 3.12Å; C1086-S1092 PolarHBondContact SG-OG 3.28Å; C1086-S1092 VanDerWaalsContact SG-OG 3.32Å; F1089-S1092 WeakPolarHBondContact O-CB 3.44Å; F1089-S1092 PolarHBondContact O-N 2.96Å; A1090-S1092 PolarHBondContact O-N 2.79Å; S1092-F1094 PolarHBondContact O-N 3.33Å; S1092-F1094 VanDerWaalsContact O-N 3.1Å; S1092-F1094 PolarHBondContact OG-N 3.34Å; S1092-F1094 VanDerWaalsContact OG-N 3.17Å; S1092-C1095 VanDerWaalsContact O-CB 3.3Å; S1092-C1095 WeakPolarHBondContact O-CB 3.34Å; S1092-C1095 PolarHBondContact O-N 3.08Å
1093	R	88.3	Confident	86.5	Confident	14 Å²	14	17.7 Å²	17.7	5%	0.053	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.7	170.1	-171.7	177.3	178.9	179.6	-4.5	113.8	E475 E888 P903	E475-R1093 IonicContact OE1-CZ 2.72Å; E475-R1093 IonicContact OE1-NH1 2.64Å; E475-R1093 PolarHBondContact OE1-NH1 3.39Å; E475-R1093 VanDerWaalsContact OE1-NH1 3.13Å; E475-R1093 IonicContact OE1-NH2 2.67Å; E475-R1093 PolarHBondContact OE1-NH2 2.93Å; E475-R1093 IonicContact OE2-CZ 3.51Å; E475-R1093 IonicContact OE2-NH1 3.53Å; E475-R1093 PolarHBondContact OE2-NH1 3.25Å; E475-R1093 IonicContact OE2-NH2 2.67Å; E888-R1093 HydrophobicContact CG-CB 4.1Å; E888-R1093 WeakPolarHBondContact OE1-CD 3.47Å; E888-R1093 IonicContact OE1-CZ 3.45Å; E888-R1093 IonicContact OE1-NE 3.36Å; E888-R1093 IonicContact OE1-NH1 3.27Å; E888-R1093 PolarHBondContact OE1-NH1 2.76Å; P903-R1093 HydrophobicContact CB-CG 4.22Å; P903-R1093 VanDerWaalsContact O-CZ 3.3Å; P903-R1093 PolarHBondContact O-NE 3.3Å; P903-R1093 PolarHBondContact O-NH2 2.9Å
1094	F	91.2	Very high	86.6	Confident	2 Å²	2	17.6 Å²	17.6	1%	0.009	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	33	173.9	-65.6	-81.9	0	0	0	111.7	F431 E888 L891 L892 F895 V902 P903 F977 S1092 A1096	F431-F1094 HydrophobicContact CD1-CD1 4.26Å; F431-F1094 HydrophobicContact CD1-CE1 4.48Å; F431-F1094 AromaticContact CE1-CD1 3.76Å; F431-F1094 HydrophobicContact CE1-CD1 3.76Å; F431-F1094 AromaticContact CE1-CE1 3.72Å; F431-F1094 HydrophobicContact CE1-CE1 3.72Å; F431-F1094 HydrophobicContact CZ-CD1 4.49Å; F431-F1094 AromaticContact CZ-CE1 4Å; F431-F1094 HydrophobicContact CZ-CE1 4Å; E888-F1094 HydrophobicContact CG-CD2 4.22Å; E888-F1094 HydrophobicContact CG-CE2 3.99Å; L891-F1094 HydrophobicContact CB-CD1 4.39Å; L891-F1094 HydrophobicContact CB-CD2 3.88Å; L891-F1094 HydrophobicContact CB-CE1 4.15Å; L891-F1094 HydrophobicContact CB-CE2 3.6Å; L891-F1094 HydrophobicContact CB-CG 4.26Å; L891-F1094 HydrophobicContact CB-CZ 3.74Å; L891-F1094 HydrophobicContact CD1-CB 3.84Å; L891-F1094 HydrophobicContact CD1-CD1 4.22Å; L891-F1094 HydrophobicContact CD1-CD2 3.84Å; L891-F1094 HydrophobicContact CD1-CE2 4.44Å; L891-F1094 HydrophobicContact CD1-CG 3.71Å; L892-F1094 HydrophobicContact CD2-CE2 4.03Å; L892-F1094 HydrophobicContact CD2-CZ 3.9Å; L892-F1094 HydrophobicContact CG-CE2 4.04Å; L892-F1094 HydrophobicContact CG-CZ 4.25Å; F895-F1094 AromaticContact CD2-CE1 3.73Å; F895-F1094 HydrophobicContact CD2-CE1 3.73Å; F895-F1094 HydrophobicContact CD2-CZ 4.2Å; F895-F1094 HydrophobicContact CE2-CD1 4.27Å; F895-F1094 AromaticContact CE2-CE1 3.91Å; F895-F1094 HydrophobicContact CE2-CE1 3.91Å; V902-F1094 HydrophobicContact CB-CZ 4.47Å; V902-F1094 HydrophobicContact CG1-CZ 4.33Å; P903-F1094 HydrophobicContact CG-CD1 4.44Å; P903-F1094 HydrophobicContact CG-CE1 4.34Å; F977-F1094 HydrophobicContact CZ-CB 4.08Å; F977-F1094 HydrophobicContact CZ-CD1 4.4Å; S1092-F1094 PolarHBondContact O-N 3.33Å; S1092-F1094 VanDerWaalsContact O-N 3.1Å; S1092-F1094 PolarHBondContact OG-N 3.34Å; S1092-F1094 VanDerWaalsContact OG-N 3.17Å; F1094-A1096 PolarHBondContact O-N 3.18Å
1095	C	88.4	Confident	86.7	Confident	28 Å²	28	16.7 Å²	16.7	19%	0.189	11%	0.11	C	C	.	.			trans	-60.6	129.4	172.7	-170.1	0	0	0	0	110.6	F1089 S1092	F1089-C1095 VanDerWaalsContact O-CB 3.32Å; F1089-C1095 WeakPolarHBondContact O-CB 3.35Å; F1089-C1095 PolarHBondContact O-SG 2.81Å; S1092-C1095 VanDerWaalsContact O-CB 3.3Å; S1092-C1095 WeakPolarHBondContact O-CB 3.34Å; S1092-C1095 PolarHBondContact O-N 3.08Å
1096	A	88.4	Confident	87	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.099	C	C	.	.			trans	-149.6	77.9	177.7	0	0	0	0	0	109.1	F977 V985 L1087 F1094 G1098 L1099 A1100	F977-A1096 HydrophobicContact CE1-CB 3.74Å; F977-A1096 HydrophobicContact CZ-CB 4.17Å; V985-A1096 HydrophobicContact CG1-CB 4.46Å; L1087-A1096 CarbonylContact O-C 3.47Å; L1087-A1096 PolarHBondContact O-N 3Å; F1094-A1096 PolarHBondContact O-N 3.18Å; A1096-G1098 VanDerWaalsContact C-N 3.29Å; A1096-G1098 PolarHBondContact O-N 3.17Å; A1096-L1099 HydrophobicContact CB-CB 4.01Å; A1096-L1099 HydrophobicContact CB-CD1 3.74Å; A1096-L1099 HydrophobicContact CB-CG 3.87Å; A1096-L1099 WeakPolarHBondContact O-CB 3.37Å; A1096-L1099 PolarHBondContact O-N 3.22Å; A1096-A1100 PolarHBondContact O-N 3.3Å
1097	R	84.6	Confident	87.2	Confident	107 Å²	107	15.6 Å²	15.6	40%	0.404	10%	0.099	S	C	.	.	H	α-helix	trans	-56.2	-39	-171.3	-66.6	-177.7	-177.9	163.7	2.4	113.3	T987 A1100 A1101	T987-R1097 HydrophobicContact CG2-CB 4.44Å; T987-R1097 HydrophobicContact CG2-CG 4.16Å; R1097-A1100 PolarHBondContact O-N 2.99Å; R1097-A1101 WeakPolarHBondContact O-CB 3.15Å; R1097-A1101 PolarHBondContact O-N 3.07Å
1098	G	84.7	Confident	87.4	Confident	22 Å²	22	18 Å²	18	23%	0.227	11%	0.108	C	C	.	.	H	α-helix	trans	-69.2	-31.7	177	0	0	0	0	0	113.6	L984 A1096 L1102	L984-G1098 WeakPolarHBondContact O-CA 3.39Å; L984-G1098 PolarHBondContact O-N 3.06Å; A1096-G1098 VanDerWaalsContact C-N 3.29Å; A1096-G1098 PolarHBondContact O-N 3.17Å; G1098-L1102 VanDerWaalsContact O-CB 3.31Å; G1098-L1102 WeakPolarHBondContact O-CB 3.48Å; G1098-L1102 PolarHBondContact O-N 2.9Å
1099	L	89.3	Confident	87.8	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.6	-41.7	170.5	-61	-174.8	0	0	0	111.3	I975 F977 V980 V985 A1096 L1102 V1103	I975-L1099 HydrophobicContact CG2-CD2 4.23Å; F977-L1099 HydrophobicContact CD1-CD1 4.1Å; F977-L1099 HydrophobicContact CD2-CD1 4.37Å; F977-L1099 HydrophobicContact CE1-CD1 4.26Å; F977-L1099 HydrophobicContact CG-CD1 4.16Å; F977-L1099 HydrophobicContact CZ-CD1 4.45Å; V980-L1099 HydrophobicContact CB-CD2 3.78Å; V980-L1099 HydrophobicContact CG1-CD2 3.89Å; V980-L1099 HydrophobicContact CG2-CD2 3.86Å; V985-L1099 HydrophobicContact CG2-CD1 4.35Å; V985-L1099 HydrophobicContact CG2-CD2 4.3Å; V985-L1099 HydrophobicContact CG2-CG 4.32Å; A1096-L1099 HydrophobicContact CB-CB 4.01Å; A1096-L1099 HydrophobicContact CB-CD1 3.74Å; A1096-L1099 HydrophobicContact CB-CG 3.87Å; A1096-L1099 WeakPolarHBondContact O-CB 3.37Å; A1096-L1099 PolarHBondContact O-N 3.22Å; L1099-L1102 PolarHBondContact O-N 2.95Å; L1099-V1103 WeakPolarHBondContact O-CG2 3.46Å; L1099-V1103 PolarHBondContact O-N 3.43Å
1100	A	89.2	Confident	88.4	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.3	-39.4	175.9	0	0	0	0	0	112.3	Y940 Y1084 L1087 A1096 R1097 T1104	Y940-A1100 HydrophobicContact CE1-CB 4.05Å; Y940-A1100 HydrophobicContact CE2-CB 3.88Å; Y1084-A1100 HydrophobicContact CE2-CB 4.2Å; L1087-A1100 HydrophobicContact CB-CB 4.22Å; A1096-A1100 PolarHBondContact O-N 3.3Å; R1097-A1100 PolarHBondContact O-N 2.99Å; A1100-T1104 PolarHBondContact O-N 3.14Å; A1100-T1104 VanDerWaalsContact O-N 3.08Å; A1100-T1104 PolarHBondContact O-OG1 2.91Å
1101	A	87.3	Confident	89.1	Confident	14 Å²	14	15 Å²	15	12%	0.116	9%	0.087	C	C	.	.	H	α-helix	trans	-65.6	-37.2	173.3	0	0	0	0	0	112.6	Y940 L997 R1097 T1104 G1105	Y940-A1101 HydrophobicContact CD2-CB 4.27Å; Y940-A1101 HydrophobicContact CG-CB 4.33Å; L997-A1101 HydrophobicContact CD2-CB 3.8Å; R1097-A1101 WeakPolarHBondContact O-CB 3.15Å; R1097-A1101 PolarHBondContact O-N 3.07Å; A1101-T1104 WeakPolarHBondContact CA-OG1 3.38Å; A1101-T1104 PolarHBondContact O-OG1 2.69Å; A1101-G1105 PolarHBondContact O-N 3.06Å
1102	L	89.8	Confident	89.9	Confident	2 Å²	2	15.2 Å²	15.2	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-67.6	-45.4	175.2	-179.4	60.5	0	0	0	112	I975 V980 L997 I1000 V1001 L1004 G1098 L1099 T1104 G1105 L1106	I975-L1102 HydrophobicContact CG2-CD2 4.33Å; V980-L1102 HydrophobicContact CG1-CD2 4.34Å; V980-L1102 HydrophobicContact CG2-CD2 4.2Å; L997-L1102 HydrophobicContact CD1-CB 4.07Å; L997-L1102 HydrophobicContact CD1-CD1 3.92Å; I1000-L1102 HydrophobicContact CG2-CD1 3.98Å; V1001-L1102 HydrophobicContact CG2-CD1 3.98Å; L1004-L1102 HydrophobicContact CD1-CD1 4.08Å; G1098-L1102 VanDerWaalsContact O-CB 3.31Å; G1098-L1102 WeakPolarHBondContact O-CB 3.48Å; G1098-L1102 PolarHBondContact O-N 2.9Å; L1099-L1102 PolarHBondContact O-N 2.95Å; L1102-T1104 VanDerWaalsContact C-N 3.34Å; L1102-T1104 PolarHBondContact O-N 2.85Å; L1102-G1105 PolarHBondContact O-N 3.41Å; L1102-L1106 HydrophobicContact CD1-CD1 4.1Å; L1102-L1106 HydrophobicContact CD1-CG 4.38Å; L1102-L1106 HydrophobicContact CG-CD1 4.09Å; L1102-L1106 WeakPolarHBondContact O-CG 3.27Å; L1102-L1106 PolarHBondContact O-N 2.97Å
1103	V	91.9	Very high	90.1	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.7	-44.5	176.6	171	0	0	0	0	111.3	Y966 I969 I970 I975 Y1084 L1099 G1107	Y966-V1103 HydrophobicContact CD1-CG1 3.75Å; Y966-V1103 HydrophobicContact CG-CG1 3.84Å; I969-V1103 HydrophobicContact CG2-CG1 4.25Å; I970-V1103 HydrophobicContact CD1-CG2 4.2Å; I970-V1103 HydrophobicContact CG1-CG1 4.41Å; I970-V1103 HydrophobicContact CG1-CG2 3.66Å; I975-V1103 HydrophobicContact CD1-CG2 3.72Å; I975-V1103 HydrophobicContact CG2-CG2 4.2Å; Y1084-V1103 HydrophobicContact CD2-CB 4.2Å; Y1084-V1103 HydrophobicContact CD2-CG1 3.78Å; Y1084-V1103 HydrophobicContact CE2-CB 4.35Å; Y1084-V1103 HydrophobicContact CE2-CG1 4.14Å; L1099-V1103 WeakPolarHBondContact O-CG2 3.46Å; L1099-V1103 PolarHBondContact O-N 3.43Å; V1103-G1107 PolarHBondContact O-N 3.38Å
1104	T	91.4	Very high	90.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-70.3	-38.8	176.3	49.4	0	0	0	0	112.4	Y940 T941 Y966 Y1084 A1100 A1101 L1102 G1107 R1108	Y940-T1104 HydrophobicContact CE2-CG2 4.06Å; T941-T1104 WeakPolarHBondContact O-CB 3.23Å; T941-T1104 PolarHBondContact O-OG1 2.92Å; Y966-T1104 HydrophobicContact CE1-CG2 4.39Å; Y1084-T1104 HydrophobicContact CE2-CG2 3.91Å; Y1084-T1104 WeakPolarHBondContact OH-CG2 3.44Å; A1100-T1104 PolarHBondContact O-N 3.14Å; A1100-T1104 VanDerWaalsContact O-N 3.08Å; A1100-T1104 PolarHBondContact O-OG1 2.91Å; A1101-T1104 WeakPolarHBondContact CA-OG1 3.38Å; A1101-T1104 PolarHBondContact O-OG1 2.69Å; L1102-T1104 VanDerWaalsContact C-N 3.34Å; L1102-T1104 PolarHBondContact O-N 2.85Å; T1104-G1107 WeakPolarHBondContact O-CA 3.42Å; T1104-G1107 PolarHBondContact O-N 2.78Å; T1104-G1107 VanDerWaalsContact O-N 3.1Å; T1104-R1108 WeakPolarHBondContact O-CG 3.41Å; T1104-R1108 PolarHBondContact O-N 2.9Å
1105	G	90.3	Very high	90.6	Very high	3 Å²	3	18.8 Å²	18.8	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-56.3	-49.9	174.2	0	0	0	0	0	112.7	A1101 L1102 G1107 R1108 A1109	A1101-G1105 PolarHBondContact O-N 3.06Å; L1102-G1105 PolarHBondContact O-N 3.41Å; G1105-G1107 VanDerWaalsContact C-N 3.32Å; G1105-G1107 PolarHBondContact O-N 2.88Å; G1105-R1108 PolarHBondContact O-N 2.8Å; G1105-A1109 PolarHBondContact O-N 3.3Å; G1105-A1109 VanDerWaalsContact O-N 3.09Å
1106	L	91.9	Very high	90.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.2	-40.9	172.5	-70.7	161.8	0	0	0	111.6	I969 F973 I975 V1001 L1004 I1005 L1102 R1108 A1109 V1110	I969-L1106 HydrophobicContact CD1-CB 4.39Å; I969-L1106 HydrophobicContact CG2-CB 3.92Å; I969-L1106 HydrophobicContact CG2-CD1 4.12Å; F973-L1106 HydrophobicContact CB-CD1 4.14Å; F973-L1106 HydrophobicContact CD1-CD2 4.16Å; F973-L1106 HydrophobicContact CD2-CD1 3.94Å; F973-L1106 HydrophobicContact CD2-CD2 4.27Å; F973-L1106 HydrophobicContact CE1-CD2 4Å; F973-L1106 HydrophobicContact CE2-CB 4.47Å; F973-L1106 HydrophobicContact CE2-CD2 4.12Å; F973-L1106 HydrophobicContact CG-CD1 3.97Å; F973-L1106 HydrophobicContact CG-CD2 4.29Å; F973-L1106 HydrophobicContact CZ-CD2 3.99Å; I975-L1106 HydrophobicContact CD1-CD1 3.56Å; I975-L1106 HydrophobicContact CG1-CD1 4.47Å; V1001-L1106 HydrophobicContact CG1-CD2 4.18Å; V1001-L1106 HydrophobicContact CG2-CD2 4.5Å; V1001-L1106 HydrophobicContact CG2-CG 4.28Å; L1004-L1106 HydrophobicContact CB-CD2 4.04Å; L1004-L1106 HydrophobicContact CD1-CD1 4.09Å; L1004-L1106 HydrophobicContact CD1-CD2 4.16Å; I1005-L1106 HydrophobicContact CD1-CD2 4.17Å; I1005-L1106 HydrophobicContact CG1-CD2 4Å; L1102-L1106 HydrophobicContact CD1-CD1 4.1Å; L1102-L1106 HydrophobicContact CD1-CG 4.38Å; L1102-L1106 HydrophobicContact CG-CD1 4.09Å; L1102-L1106 WeakPolarHBondContact O-CG 3.27Å; L1102-L1106 PolarHBondContact O-N 2.97Å; L1106-R1108 PolarHBondContact O-N 3.14Å; L1106-A1109 PolarHBondContact O-N 2.93Å; L1106-V1110 VanDerWaalsContact O-CB 3.32Å; L1106-V1110 WeakPolarHBondContact O-CB 3.38Å; L1106-V1110 VanDerWaalsContact O-CG2 3.25Å; L1106-V1110 WeakPolarHBondContact O-CG2 3.36Å; L1106-V1110 PolarHBondContact O-N 2.97Å
1107	G	92.8	Very high	91.1	Very high	3 Å²	3	22 Å²	22	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	-59.5	-45.2	175.4	0	0	0	0	0	113.6	I969 V1103 T1104 G1105 A1109 L1111	I969-G1107 VanDerWaalsContact CD1-CA 3.46Å; V1103-G1107 PolarHBondContact O-N 3.38Å; T1104-G1107 WeakPolarHBondContact O-CA 3.42Å; T1104-G1107 PolarHBondContact O-N 2.78Å; T1104-G1107 VanDerWaalsContact O-N 3.1Å; G1105-G1107 VanDerWaalsContact C-N 3.32Å; G1105-G1107 PolarHBondContact O-N 2.88Å; G1107-A1109 PolarHBondContact O-N 3.12Å; G1107-L1111 PolarHBondContact O-N 3.26Å
1108	R	92.1	Very high	91.6	Very high	49 Å²	49	16.9 Å²	16.9	19%	0.185	9%	0.093	C	C	.	.	H	α-helix	trans	-60.8	-45	175.8	-62.8	-167.1	-68.2	-79.7	-0.5	111.6	T941 G942 L944 T1104 G1105 L1106 L1111 M1112	T941-R1108 PolarHBondContact O-NH1 2.79Å; G942-R1108 WeakPolarHBondContact O-CD 3.43Å; G942-R1108 PolarHBondContact O-NH1 3.16Å; L944-R1108 HydrophobicContact CB-CB 3.98Å; L944-R1108 HydrophobicContact CB-CG 3.75Å; T1104-R1108 WeakPolarHBondContact O-CG 3.41Å; T1104-R1108 PolarHBondContact O-N 2.9Å; G1105-R1108 PolarHBondContact O-N 2.8Å; L1106-R1108 PolarHBondContact O-N 3.14Å; R1108-L1111 PolarHBondContact O-N 2.77Å; R1108-M1112 WeakPolarHBondContact O-CG 3.05Å; R1108-M1112 PolarHBondContact O-N 2.89Å
1109	A	91.7	Very high	92	Very high	24 Å²	24	19.3 Å²	19.3	20%	0.198	10%	0.099	C	C	.	.	H	α-helix	trans	-72.9	-36.1	-178.1	0	0	0	0	0	112.9	V1001 I1005 G1105 L1106 G1107 L1111 M1112 N1113	V1001-A1109 HydrophobicContact CG1-CB 3.73Å; I1005-A1109 HydrophobicContact CD1-CB 3.31Å; G1105-A1109 PolarHBondContact O-N 3.3Å; G1105-A1109 VanDerWaalsContact O-N 3.09Å; L1106-A1109 PolarHBondContact O-N 2.93Å; G1107-A1109 PolarHBondContact O-N 3.12Å; A1109-L1111 VanDerWaalsContact C-N 3.35Å; A1109-L1111 PolarHBondContact O-N 3.06Å; A1109-M1112 PolarHBondContact O-N 3.44Å; A1109-N1113 WeakPolarHBondContact O-CB 3.34Å; A1109-N1113 PolarHBondContact O-N 2.94Å; A1109-N1113 PolarHBondContact O-ND2 3.31Å; A1109-N1113 PolarHBondContact O-OD1 2.9Å
1110	V	93.1	Very high	92.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-44	169.7	162.1	0	0	0	0	111.1	F962 L965 L1106 T1114 Y1160 L1163	F962-V1110 HydrophobicContact CD2-CG1 4.38Å; F962-V1110 HydrophobicContact CE1-CG1 4.48Å; F962-V1110 HydrophobicContact CE2-CG1 3.69Å; F962-V1110 HydrophobicContact CZ-CG1 3.75Å; L965-V1110 HydrophobicContact CD1-CG1 4.28Å; L1106-V1110 VanDerWaalsContact O-CB 3.32Å; L1106-V1110 WeakPolarHBondContact O-CB 3.38Å; L1106-V1110 VanDerWaalsContact O-CG2 3.25Å; L1106-V1110 WeakPolarHBondContact O-CG2 3.36Å; L1106-V1110 PolarHBondContact O-N 2.97Å; V1110-T1114 WeakPolarHBondContact O-CB 3.44Å; V1110-T1114 PolarHBondContact O-N 3.45Å; V1110-T1114 PolarHBondContact O-OG1 3.42Å; V1110-Y1160 HydrophobicContact CG2-CE1 4.18Å; V1110-L1163 HydrophobicContact CG1-CD2 3.74Å; V1110-L1163 HydrophobicContact CG2-CD2 4.4Å
1111	L	92.8	Very high	92.5	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-67.1	-40.3	177.9	-172.9	64	0	0	0	112.1	L944 G1107 R1108 A1109 T1114 R1115 I1133	L944-L1111 HydrophobicContact CB-CD2 4.14Å; L944-L1111 HydrophobicContact CD2-CB 4.38Å; L944-L1111 HydrophobicContact CD2-CD2 4.15Å; L944-L1111 HydrophobicContact CD2-CG 4.45Å; L944-L1111 HydrophobicContact CG-CD2 4.13Å; G1107-L1111 PolarHBondContact O-N 3.26Å; R1108-L1111 PolarHBondContact O-N 2.77Å; A1109-L1111 VanDerWaalsContact C-N 3.35Å; A1109-L1111 PolarHBondContact O-N 3.06Å; L1111-T1114 PolarHBondContact O-N 3.29Å; L1111-R1115 PolarHBondContact O-N 3.38Å; L1111-I1133 HydrophobicContact CD1-CB 4.4Å
1112	M	92.4	Very high	92.8	Very high	40 Å²	40	34.1 Å²	34.1	20%	0.197	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-50.1	173.3	-72.7	-60.7	-157.1	0	0	112.1	L944 L946 R1108 A1109 T1114 R1115 D1116	L944-M1112 HydrophobicContact CD1-CE 4.28Å; L944-M1112 HydrophobicContact CD2-CE 3.7Å; L944-M1112 HydrophobicContact CD2-CG 3.65Å; L944-M1112 HydrophobicContact CD2-SD 3.69Å; L946-M1112 HydrophobicContact CD2-SD 4.05Å; R1108-M1112 WeakPolarHBondContact O-CG 3.05Å; R1108-M1112 PolarHBondContact O-N 2.89Å; A1109-M1112 PolarHBondContact O-N 3.44Å; M1112-T1114 PolarHBondContact O-N 3.35Å; M1112-R1115 WeakPolarHBondContact O-CB 3.46Å; M1112-R1115 PolarHBondContact O-N 2.88Å; M1112-R1115 VanDerWaalsContact O-N 3.1Å; M1112-R1115 VanDerWaalsContact SD-CZ 3.58Å; M1112-R1115 PolarHBondContact SD-NH1 3.28Å; M1112-D1116 VanDerWaalsContact O-CG 3.26Å; M1112-D1116 PolarHBondContact O-N 2.72Å
1113	N	91.6	Very high	92.9	Very high	46 Å²	46	35.4 Å²	35.4	25%	0.246	18%	0.182	C	C	.	.	H	α-helix	trans	-55.7	-37.1	175.4	-69.8	-10.3	0	0	0	111.9	I1005 H1009 A1109 D1116 L1117	I1005-N1113 WeakPolarHBondContact CG2-ND2 3.49Å; H1009-N1113 PolarHBondContact NE2-ND2 3.36Å; A1109-N1113 WeakPolarHBondContact O-CB 3.34Å; A1109-N1113 PolarHBondContact O-N 2.94Å; A1109-N1113 PolarHBondContact O-ND2 3.31Å; A1109-N1113 PolarHBondContact O-OD1 2.9Å; N1113-D1116 PolarHBondContact O-N 2.52Å; N1113-L1117 WeakPolarHBondContact O-CB 3.46Å; N1113-L1117 PolarHBondContact O-N 3.01Å
1114	T	94.5	Very high	93.1	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-71.6	-39.6	178.9	-55.7	0	0	0	0	111.8	F962 V1110 L1111 M1112 V1118 I1133 V1156	F962-T1114 HydrophobicContact CE2-CG2 4.36Å; F962-T1114 HydrophobicContact CZ-CG2 4.32Å; F962-T1114 WeakPolarHBondContact CZ-OG1 3.33Å; V1110-T1114 WeakPolarHBondContact O-CB 3.44Å; V1110-T1114 PolarHBondContact O-N 3.45Å; V1110-T1114 PolarHBondContact O-OG1 3.42Å; L1111-T1114 PolarHBondContact O-N 3.29Å; M1112-T1114 PolarHBondContact O-N 3.35Å; T1114-V1118 VanDerWaalsContact O-CG2 3.28Å; T1114-V1118 WeakPolarHBondContact O-CG2 3.31Å; T1114-V1118 PolarHBondContact O-N 3.36Å; T1114-V1118 VanDerWaalsContact O-N 3.17Å; T1114-I1133 HydrophobicContact CG2-CD1 4.21Å; T1114-I1133 HydrophobicContact CG2-CG2 4.36Å; T1114-V1156 HydrophobicContact CG2-CG1 4.31Å; T1114-V1156 HydrophobicContact CG2-CG2 4.02Å
1115	R	94	Very high	93.3	Very high	53 Å²	53	38.7 Å²	38.7	20%	0.2	20%	0.198	C	C	.	.	H	α-helix	trans	-56.6	-53.6	168.2	175.8	-159.2	67.2	-172.3	-5	110	L946 L1111 M1112 L1117 V1118 E1119 V1125 I1133	L946-R1115 HydrophobicContact CD1-CB 4.5Å; L1111-R1115 PolarHBondContact O-N 3.38Å; M1112-R1115 WeakPolarHBondContact O-CB 3.46Å; M1112-R1115 PolarHBondContact O-N 2.88Å; M1112-R1115 VanDerWaalsContact O-N 3.1Å; M1112-R1115 VanDerWaalsContact SD-CZ 3.58Å; M1112-R1115 PolarHBondContact SD-NH1 3.28Å; R1115-L1117 VanDerWaalsContact C-N 3.33Å; R1115-L1117 PolarHBondContact O-N 2.76Å; R1115-V1118 PolarHBondContact O-N 3.36Å; R1115-V1118 VanDerWaalsContact O-N 3.08Å; R1115-E1119 HydrophobicContact CG-CG 4.3Å; R1115-E1119 PolarHBondContact O-N 2.72Å; R1115-V1125 HydrophobicContact CG-CB 4.35Å; R1115-V1125 HydrophobicContact CG-CG1 4.41Å; R1115-V1125 HydrophobicContact CG-CG2 4.16Å; R1115-I1133 HydrophobicContact CB-CD1 4.34Å
1116	D	94.1	Very high	93.5	Very high	55 Å²	55	38.7 Å²	38.7	29%	0.294	20%	0.197	S	C	.	.	H	α-helix	trans	-64.2	-38.9	-172.3	-64.6	-17.5	0	0	0	111.6	M1112 N1113 N1120	M1112-D1116 VanDerWaalsContact O-CG 3.26Å; M1112-D1116 PolarHBondContact O-N 2.72Å; N1113-D1116 PolarHBondContact O-N 2.52Å; D1116-N1120 WeakPolarHBondContact O-CB 3.22Å; D1116-N1120 VanDerWaalsContact O-CG 3.28Å; D1116-N1120 PolarHBondContact O-N 3.04Å; D1116-N1120 PolarHBondContact O-ND2 3.15Å
1117	L	93.8	Very high	93.7	Very high	40 Å²	40	38.7 Å²	38.7	21%	0.209	20%	0.197	C	C	.	.	H	α-helix	trans	-63.1	-42.7	173.2	-175	60.7	0	0	0	112	N1113 R1115 M1121 E1155 V1156	N1113-L1117 WeakPolarHBondContact O-CB 3.46Å; N1113-L1117 PolarHBondContact O-N 3.01Å; R1115-L1117 VanDerWaalsContact C-N 3.33Å; R1115-L1117 PolarHBondContact O-N 2.76Å; L1117-M1121 HydrophobicContact CG-SD 4.45Å; L1117-M1121 VanDerWaalsContact O-CG 3.24Å; L1117-M1121 WeakPolarHBondContact O-CG 3.41Å; L1117-M1121 PolarHBondContact O-N 2.84Å; L1117-M1121 VanDerWaalsContact O-N 3.1Å; L1117-E1155 HydrophobicContact CD1-CG 4.36Å; L1117-E1155 HydrophobicContact CD2-CB 4.41Å; L1117-E1155 HydrophobicContact CD2-CG 4.35Å; L1117-V1156 HydrophobicContact CD2-CG2 3.99Å
1118	V	95.1	Very high	93.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.3	-42.4	179	171.7	0	0	0	0	112.1	T1114 R1115 M1121 M1123 V1125 V1135 I1152	T1114-V1118 VanDerWaalsContact O-CG2 3.28Å; T1114-V1118 WeakPolarHBondContact O-CG2 3.31Å; T1114-V1118 PolarHBondContact O-N 3.36Å; T1114-V1118 VanDerWaalsContact O-N 3.17Å; R1115-V1118 PolarHBondContact O-N 3.36Å; R1115-V1118 VanDerWaalsContact O-N 3.08Å; V1118-M1121 WeakPolarHBondContact O-CB 3.18Å; V1118-M1121 PolarHBondContact O-N 3.28Å; V1118-M1121 VanDerWaalsContact O-N 3.16Å; V1118-M1123 HydrophobicContact CG1-CB 3.86Å; V1118-M1123 PolarHBondContact O-N 3.45Å; V1118-V1125 HydrophobicContact CB-CG2 3.96Å; V1118-V1125 HydrophobicContact CG1-CG2 3.65Å; V1118-V1135 HydrophobicContact CG1-CG1 3.89Å; V1118-V1135 HydrophobicContact CG1-CG2 3.93Å; V1118-I1152 HydrophobicContact CG2-CG2 3.67Å
1119	E	94	Very high	93.6	Very high	74 Å²	74	36.9 Å²	36.9	35%	0.346	19%	0.19	S	C	.	.	H	α-helix	trans	-69.7	-36.1	178.2	-65.1	-166	133.3	0	0	111.5	K949 R1115 M1121 N1122 M1123 V1125	K949-E1119 IonicContact NZ-OE1 3.84Å; R1115-E1119 HydrophobicContact CG-CG 4.3Å; R1115-E1119 PolarHBondContact O-N 2.72Å; E1119-M1121 VanDerWaalsContact C-N 3.25Å; E1119-M1121 PolarHBondContact O-N 3.36Å; E1119-N1122 WeakPolarHBondContact O-CA 3.27Å; E1119-N1122 PolarHBondContact O-N 3.38Å; E1119-M1123 WeakPolarHBondContact CA-O 3.48Å; E1119-V1125 HydrophobicContact CG-CB 4.25Å; E1119-V1125 HydrophobicContact CG-CG2 3.82Å
1120	N	94.9	Very high	93.4	Very high	132 Å²	132	37 Å²	37	71%	0.706	19%	0.188	S	C	*	.	H	α-helix	trans	-64.2	-25.4	169.7	-80.7	-54.5	0	0	0	113.6	D1116 N1122	D1116-N1120 WeakPolarHBondContact O-CB 3.22Å; D1116-N1120 VanDerWaalsContact O-CG 3.28Å; D1116-N1120 PolarHBondContact O-N 3.04Å; D1116-N1120 PolarHBondContact O-ND2 3.15Å; N1120-N1122 PolarHBondContact O-N 2.88Å
1121	M	92.7	Very high	93.3	Very high	35 Å²	35	38.6 Å²	38.6	17%	0.172	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	13.7	170	-64.8	168.8	81.2	0	0	113.2	L1117 V1118 E1119 M1123 K1151 E1155	L1117-M1121 HydrophobicContact CG-SD 4.45Å; L1117-M1121 VanDerWaalsContact O-CG 3.24Å; L1117-M1121 WeakPolarHBondContact O-CG 3.41Å; L1117-M1121 PolarHBondContact O-N 2.84Å; L1117-M1121 VanDerWaalsContact O-N 3.1Å; V1118-M1121 WeakPolarHBondContact O-CB 3.18Å; V1118-M1121 PolarHBondContact O-N 3.28Å; V1118-M1121 VanDerWaalsContact O-N 3.16Å; E1119-M1121 VanDerWaalsContact C-N 3.25Å; E1119-M1121 PolarHBondContact O-N 3.36Å; M1121-M1123 VanDerWaalsContact C-N 3.33Å; M1121-M1123 HydrophobicContact CB-CE 3.45Å; M1121-M1123 VanDerWaalsContact CB-CE 3.45Å; M1121-M1123 HydrophobicContact CE-CE 4.03Å; M1121-M1123 HydrophobicContact CG-CE 4.35Å; M1121-M1123 PolarHBondContact O-N 3.13Å; M1121-M1123 HydrophobicContact SD-CE 4.05Å; M1121-K1151 HydrophobicContact CE-CD 3.87Å; M1121-K1151 HydrophobicContact CE-CG 3.93Å; M1121-E1155 HydrophobicContact CE-CB 4.01Å; M1121-E1155 HydrophobicContact CE-CG 4.29Å; M1121-E1155 HydrophobicContact SD-CB 4.04Å; M1121-E1155 HydrophobicContact SD-CG 4.16Å
1122	N	93.4	Very high	93.4	Very high	158 Å²	158	39.3 Å²	39.3	85%	0.845	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	33.5	-177.7	-56.5	122.3	0	0	0	114.7	E1119 N1120	E1119-N1122 WeakPolarHBondContact O-CA 3.27Å; E1119-N1122 PolarHBondContact O-N 3.38Å; N1120-N1122 PolarHBondContact O-N 2.88Å
1123	M	93.2	Very high	93.5	Very high	28 Å²	28	37.4 Å²	37.4	14%	0.138	19%	0.193	C	C	.	.			trans	-112.6	142.7	175.3	-70.1	175.5	-70.8	0	0	111.2	V1118 E1119 M1121 V1125 V1135 I1148 I1152	V1118-M1123 HydrophobicContact CG1-CB 3.86Å; V1118-M1123 PolarHBondContact O-N 3.45Å; E1119-M1123 WeakPolarHBondContact CA-O 3.48Å; M1121-M1123 VanDerWaalsContact C-N 3.33Å; M1121-M1123 HydrophobicContact CB-CE 3.45Å; M1121-M1123 VanDerWaalsContact CB-CE 3.45Å; M1121-M1123 HydrophobicContact CE-CE 4.03Å; M1121-M1123 HydrophobicContact CG-CE 4.35Å; M1121-M1123 PolarHBondContact O-N 3.13Å; M1121-M1123 HydrophobicContact SD-CE 4.05Å; M1123-V1125 PolarHBondContact O-N 3.39Å; M1123-V1135 HydrophobicContact CB-CG1 3.88Å; M1123-I1148 HydrophobicContact SD-CG2 3.37Å; M1123-I1148 WeakPolarHBondContact SD-CG2 3.47Å; M1123-I1152 HydrophobicContact CE-CD1 3.91Å; M1123-I1152 HydrophobicContact CE-CG1 3.48Å; M1123-I1152 VanDerWaalsContact CE-CG1 3.48Å; M1123-I1152 HydrophobicContact SD-CD1 3.86Å; M1123-I1152 HydrophobicContact SD-CG1 4.02Å
1124	E	94.4	Very high	93.8	Very high	63 Å²	63	35.3 Å²	35.3	29%	0.294	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	112.7	-176.4	-179.5	-177	-145.3	0	0	111	K949 I1126 V1135 N1136	K949-E1124 HydrophobicContact CD-CG 4.24Å; K949-E1124 WeakPolarHBondContact CD-OE1 3.45Å; K949-E1124 IonicContact NZ-OE1 2.67Å; E1124-I1126 HydrophobicContact CG-CG2 3.84Å; E1124-V1135 WeakPolarHBondContact O-CA 3.3Å; E1124-N1136 HydrophobicContact CB-CB 4.24Å; E1124-N1136 PolarHBondContact O-N 3.48Å; E1124-N1136 PolarHBondContact OE2-ND2 2.76Å
1125	V	96.3	Very high	93.9	Very high	7 Å²	7	35.2 Å²	35.2	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.5	162.2	-179.2	0	0	0	0	108.1	L946 K949 R1115 V1118 E1119 M1123 I1133	L946-V1125 HydrophobicContact CD1-CG1 4.06Å; K949-V1125 WeakPolarHBondContact CE-O 3.47Å; K949-V1125 PolarHBondContact NZ-O 3.36Å; R1115-V1125 HydrophobicContact CG-CB 4.35Å; R1115-V1125 HydrophobicContact CG-CG1 4.41Å; R1115-V1125 HydrophobicContact CG-CG2 4.16Å; V1118-V1125 HydrophobicContact CB-CG2 3.96Å; V1118-V1125 HydrophobicContact CG1-CG2 3.65Å; E1119-V1125 HydrophobicContact CG-CB 4.25Å; E1119-V1125 HydrophobicContact CG-CG2 3.82Å; M1123-V1125 PolarHBondContact O-N 3.39Å; V1125-I1133 HydrophobicContact CG1-CD1 3.94Å; V1125-I1133 HydrophobicContact CG1-CG1 3.78Å; V1125-I1133 HydrophobicContact CG2-CD1 3.84Å; V1125-I1133 HydrophobicContact CG2-CG1 4.33Å
1126	I	95.7	Very high	94	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-24.2	-180	63.1	162.6	0	0	0	113.1	P948 K949 Y953 I957 E1124 M1134 N1136 M1174 L1176	P948-I1126 WeakPolarHBondContact CA-O 3.22Å; K949-I1126 HydrophobicContact CB-CB 4.37Å; K949-I1126 HydrophobicContact CD-CG2 4.48Å; K949-I1126 PolarHBondContact N-O 3.13Å; Y953-I1126 HydrophobicContact CD2-CD1 4.04Å; Y953-I1126 HydrophobicContact CE1-CD1 4.3Å; Y953-I1126 HydrophobicContact CE1-CG2 3.8Å; Y953-I1126 HydrophobicContact CE2-CD1 3.79Å; Y953-I1126 HydrophobicContact CG-CD1 4.41Å; Y953-I1126 WeakPolarHBondContact OH-CG2 3.4Å; I957-I1126 HydrophobicContact CD1-CD1 3.87Å; I957-I1126 HydrophobicContact CG1-CD1 4.13Å; I957-I1126 HydrophobicContact CG2-CD1 3.93Å; I957-I1126 HydrophobicContact CG2-CG1 4.48Å; E1124-I1126 HydrophobicContact CG-CG2 3.84Å; I1126-M1134 HydrophobicContact CG1-CB 3.97Å; I1126-M1134 WeakPolarHBondContact CG1-O 3.35Å; I1126-M1134 PolarHBondContact N-O 3.48Å; I1126-N1136 HydrophobicContact CG2-CB 3.75Å; I1126-M1174 HydrophobicContact CD1-SD 4.17Å; I1126-L1176 HydrophobicContact CD1-CD2 4.36Å
1127	Y	95.6	Very high	94.1	Very high	1 Å²	1	31 Å²	31	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	164.2	178.2	-177	-117	0	0	0	110.2	V945 P948 D1129 M1134 L1176 K1179 K1180	V945-Y1127 HydrophobicContact CG1-CE2 3.73Å; V945-Y1127 WeakPolarHBondContact CG1-OH 3.5Å; P948-Y1127 HydrophobicContact CB-CD2 3.74Å; P948-Y1127 HydrophobicContact CB-CE2 4.39Å; P948-Y1127 HydrophobicContact CB-CG 4.48Å; P948-Y1127 HydrophobicContact CG-CD2 4.42Å; Y1127-D1129 HydrophobicContact CE1-CB 3.72Å; Y1127-D1129 PolarHBondContact OH-OD2 3.37Å; Y1127-M1134 HydrophobicContact CD1-CE 3.87Å; Y1127-M1134 HydrophobicContact CD1-CG 4.48Å; Y1127-M1134 HydrophobicContact CD1-SD 3.76Å; Y1127-M1134 HydrophobicContact CE1-CE 4.33Å; Y1127-M1134 HydrophobicContact CG-SD 4.48Å; Y1127-M1134 PolarHBondContact O-N 2.68Å; Y1127-L1176 HydrophobicContact CG-CD1 4.45Å; Y1127-K1179 HydrophobicContact CE2-CG 4.38Å; Y1127-K1180 WeakPolarHBondContact OH-CA 3.46Å; Y1127-K1180 VanDerWaalsContact OH-CG 3.28Å; Y1127-K1180 WeakPolarHBondContact OH-CG 3.38Å; Y1127-K1180 PolarHBondContact OH-N 3.15Å
1128	G	92	Very high	94.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	146.5	170.4	0	0	0	0	0	110.4	L946 S1132	L946-G1128 PolarHBondContact N-O 2.9Å; G1128-S1132 CarbonylContact C-O 3.37Å; G1128-S1132 WeakPolarHBondContact CA-O 3.32Å
1129	D	90	Very high	94	Very high	13 Å²	13	35.2 Å²	35.2	7%	0.07	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	108.4	-171.3	-178.8	4.4	0	0	0	110.2	Y1127 D1131 S1132 K1180	Y1127-D1129 HydrophobicContact CE1-CB 3.72Å; Y1127-D1129 PolarHBondContact OH-OD2 3.37Å; D1129-D1131 VanDerWaalsContact C-N 3.26Å; D1129-D1131 PolarHBondContact O-N 3.17Å; D1129-S1132 PolarHBondContact N-O 3.01Å; D1129-S1132 PolarHBondContact O-N 3.24Å; D1129-S1132 PolarHBondContact O-OG 2.68Å; D1129-K1180 VanDerWaalsContact OD1-CE 3.25Å; D1129-K1180 WeakPolarHBondContact OD1-CE 3.43Å; D1129-K1180 IonicContact OD1-NZ 3.06Å; D1129-K1180 PolarHBondContact OD1-NZ 3.2Å; D1129-K1180 WeakPolarHBondContact OD2-CE 3.34Å; D1129-K1180 VanDerWaalsContact OD2-CG 3.26Å; D1129-K1180 WeakPolarHBondContact OD2-CG 3.32Å; D1129-K1180 IonicContact OD2-NZ 2.93Å; D1129-K1180 PolarHBondContact OD2-NZ 3.46Å
1130	T	87.3	Confident	93.8	Very high	27 Å²	27	37.2 Å²	37.2	17%	0.166	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	-73.3	174.7	-50.9	0	0	0	0	114.3	L944 L965 Y966	L944-T1130 WeakPolarHBondContact O-CA 3.31Å; L944-T1130 PolarHBondContact O-N 3.17Å; L965-T1130 WeakPolarHBondContact CD2-O 3.37Å; Y966-T1130 WeakPolarHBondContact OH-CG2 3.34Å
1131	D	91.5	Very high	93.7	Very high	33 Å²	33	34.3 Å²	34.3	18%	0.176	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-19.4	-178.6	32.2	18.9	0	0	0	113.4	D961 F962 L965 D1129	D961-D1131 VanDerWaalsContact OD1-C 3.3Å; D961-D1131 WeakPolarHBondContact OD1-CB 3.4Å; F962-D1131 HydrophobicContact CB-CB 4.25Å; F962-D1131 VanDerWaalsContact CD2-O 3.31Å; F962-D1131 WeakPolarHBondContact CD2-O 3.38Å; F962-D1131 PolarHBondContact N-O 3.33Å; L965-D1131 HydrophobicContact CB-CB 3.68Å; L965-D1131 HydrophobicContact CD2-CB 3.85Å; L965-D1131 HydrophobicContact CG-CB 4.31Å; D1129-D1131 VanDerWaalsContact C-N 3.26Å; D1129-D1131 PolarHBondContact O-N 3.17Å
1132	S	94.4	Very high	93.6	Very high	17 Å²	17	32.8 Å²	32.8	12%	0.119	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	147.5	-177.2	67.3	0	0	0	0	114.1	L960 G1128 D1129	L960-S1132 CarbonylContact O-C 3.54Å; L960-S1132 WeakPolarHBondContact O-CA 3.12Å; G1128-S1132 CarbonylContact C-O 3.37Å; G1128-S1132 WeakPolarHBondContact CA-O 3.32Å; D1129-S1132 PolarHBondContact N-O 3.01Å; D1129-S1132 PolarHBondContact O-N 3.24Å; D1129-S1132 PolarHBondContact O-OG 2.68Å
1133	I	95.5	Very high	93.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.1	173.6	-167.2	170.2	0	0	0	110.9	L960 L1111 T1114 R1115 V1125	L960-I1133 HydrophobicContact CB-CG2 3.88Å; L960-I1133 PolarHBondContact N-O 3.4Å; L960-I1133 PolarHBondContact O-N 2.99Å; L1111-I1133 HydrophobicContact CD1-CB 4.4Å; T1114-I1133 HydrophobicContact CG2-CD1 4.21Å; T1114-I1133 HydrophobicContact CG2-CG2 4.36Å; R1115-I1133 HydrophobicContact CB-CD1 4.34Å; V1125-I1133 HydrophobicContact CG1-CD1 3.94Å; V1125-I1133 HydrophobicContact CG1-CG1 3.78Å; V1125-I1133 HydrophobicContact CG2-CD1 3.84Å; V1125-I1133 HydrophobicContact CG2-CG1 4.33Å
1134	M	97	Very high	93.6	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.9	-176	-64.4	-176.6	-169.4	0	0	111.2	I957 L958 L959 I1126 Y1127 M1174 Y1182	I957-M1134 HydrophobicContact CG2-CB 4.14Å; L958-M1134 WeakPolarHBondContact O-CA 3.16Å; L959-M1134 HydrophobicContact CD1-CE 3.84Å; L959-M1134 HydrophobicContact CD1-CG 3.83Å; I1126-M1134 HydrophobicContact CG1-CB 3.97Å; I1126-M1134 WeakPolarHBondContact CG1-O 3.35Å; I1126-M1134 PolarHBondContact N-O 3.48Å; Y1127-M1134 HydrophobicContact CD1-CE 3.87Å; Y1127-M1134 HydrophobicContact CD1-CG 4.48Å; Y1127-M1134 HydrophobicContact CD1-SD 3.76Å; Y1127-M1134 HydrophobicContact CE1-CE 4.33Å; Y1127-M1134 HydrophobicContact CG-SD 4.48Å; Y1127-M1134 PolarHBondContact O-N 2.68Å; M1134-M1174 HydrophobicContact CE-CE 4.49Å; M1134-M1174 HydrophobicContact SD-CE 3.49Å; M1134-M1174 WeakPolarHBondContact SD-CE 3.34Å; M1134-M1174 HydrophobicContact SD-SD 4.12Å; M1134-Y1182 HydrophobicContact CE-CE1 3.88Å; M1134-Y1182 HydrophobicContact CE-CE2 4.27Å; M1134-Y1182 WeakPolarHBondContact CE-OH 3.34Å
1135	V	97	Very high	93.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	123.8	-170.2	-171.2	0	0	0	0	111	I957 L958 V1118 M1123 E1124 T1137 I1152	I957-V1135 WeakPolarHBondContact CA-O 3.25Å; L958-V1135 HydrophobicContact CB-CB 4.43Å; L958-V1135 PolarHBondContact N-O 3.35Å; L958-V1135 PolarHBondContact O-N 3.46Å; V1118-V1135 HydrophobicContact CG1-CG1 3.89Å; V1118-V1135 HydrophobicContact CG1-CG2 3.93Å; M1123-V1135 HydrophobicContact CB-CG1 3.88Å; E1124-V1135 WeakPolarHBondContact O-CA 3.3Å; V1135-T1137 PolarHBondContact O-N 3.04Å; V1135-I1152 HydrophobicContact CB-CD1 4.45Å; V1135-I1152 HydrophobicContact CG1-CD1 4.18Å; V1135-I1152 HydrophobicContact CG2-CD1 4.31Å
1136	N	96.4	Very high	93.5	Very high	10 Å²	10	25.3 Å²	25.3	5%	0.053	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	108.1	176.1	174.5	14	0	0	0	110.4	I957 E1124 I1126 N1138	I957-N1136 HydrophobicContact CD1-CB 3.8Å; E1124-N1136 HydrophobicContact CB-CB 4.24Å; E1124-N1136 PolarHBondContact O-N 3.48Å; E1124-N1136 PolarHBondContact OE2-ND2 2.76Å; I1126-N1136 HydrophobicContact CG2-CB 3.75Å; N1136-N1138 PolarHBondContact ND2-ND2 3Å; N1136-N1138 VanDerWaalsContact ND2-ND2 3.15Å; N1136-N1138 PolarHBondContact O-N 3.23Å; N1136-N1138 WeakPolarHBondContact OD1-CA 3.32Å; N1136-N1138 PolarHBondContact OD1-N 2.9Å
1137	T	95.1	Very high	93.4	Very high	11 Å²	11	28.3 Å²	28.3	7%	0.067	17%	0.174	C	C	.	.			trans	-72.8	-9.2	179.4	70.1	0	0	0	0	113.7	Y956 L958 V1135 T1139 A1145 I1148	Y956-T1137 WeakPolarHBondContact O-CB 3.34Å; Y956-T1137 WeakPolarHBondContact O-CG2 3.35Å; Y956-T1137 PolarHBondContact O-N 3.39Å; Y956-T1137 PolarHBondContact O-OG1 2.96Å; L958-T1137 HydrophobicContact CD1-CG2 3.56Å; L958-T1137 HydrophobicContact CG-CG2 3.61Å; V1135-T1137 PolarHBondContact O-N 3.04Å; T1137-T1139 WeakPolarHBondContact O-CB 3.41Å; T1137-T1139 PolarHBondContact O-N 3.49Å; T1137-T1139 PolarHBondContact O-OG1 3.19Å; T1137-T1139 PolarHBondContact OG1-N 3.13Å; T1137-A1145 HydrophobicContact CG2-CB 4.05Å; T1137-I1148 HydrophobicContact CG2-CD1 4.45Å; T1137-I1148 HydrophobicContact CG2-CG2 4.48Å
1138	N	93.8	Very high	93.3	Very high	86 Å²	86	30.2 Å²	30.2	46%	0.46	18%	0.183	S	C	.	.			trans	51.2	21	-171.9	-92	-66.8	0	0	0	115.3	K955 N1136	K955-N1138 VanDerWaalsContact CD-C 3.49Å; K955-N1138 HydrophobicContact CD-CB 4.49Å; K955-N1138 WeakPolarHBondContact CD-O 3.49Å; K955-N1138 PolarHBondContact NZ-OD1 2.87Å; N1136-N1138 PolarHBondContact ND2-ND2 3Å; N1136-N1138 VanDerWaalsContact ND2-ND2 3.15Å; N1136-N1138 PolarHBondContact O-N 3.23Å; N1136-N1138 WeakPolarHBondContact OD1-CA 3.32Å; N1136-N1138 PolarHBondContact OD1-N 2.9Å
1139	T	93.7	Very high	93.4	Very high	42 Å²	42	30.2 Å²	30.2	26%	0.258	18%	0.183	S	C	.	.			trans	-127.2	147	-166.5	-63.9	0	0	0	0	112.2	Y956 T1137 D1141 A1144	Y956-T1139 WeakPolarHBondContact CD2-O 3.38Å; Y956-T1139 PolarHBondContact N-O 2.91Å; T1137-T1139 WeakPolarHBondContact O-CB 3.41Å; T1137-T1139 PolarHBondContact O-N 3.49Å; T1137-T1139 PolarHBondContact O-OG1 3.19Å; T1137-T1139 PolarHBondContact OG1-N 3.13Å; T1139-D1141 HydrophobicContact CG2-CB 4.2Å; T1139-A1144 HydrophobicContact CG2-CB 3.86Å
1140	T	90.6	Very high	93.6	Very high	116 Å²	116	33 Å²	33	71%	0.712	20%	0.196	S	C	*	.	S	Bend	trans	-108.2	3.7	179.1	52.9	0	0	0	0	113.9	K955 Y956	K955-T1140 HydrophobicContact CG-CG2 4.44Å; Y956-T1140 WeakPolarHBondContact CE2-O 3.35Å
1141	D	91.5	Very high	94	Very high	71 Å²	71	37 Å²	37	38%	0.38	21%	0.211	S	C	.	.			trans	-99.2	126.9	166.9	170.2	37.4	0	0	0	111.2	T1139 L1143 A1144 A1145	T1139-D1141 HydrophobicContact CG2-CB 4.2Å; D1141-L1143 VanDerWaalsContact C-N 3.35Å; D1141-L1143 PolarHBondContact OD1-N 2.84Å; D1141-L1143 WeakPolarHBondContact OD2-CB 3.22Å; D1141-A1144 HydrophobicContact CB-CB 4.2Å; D1141-A1144 VanDerWaalsContact OD2-CB 3.31Å; D1141-A1144 WeakPolarHBondContact OD2-CB 3.45Å; D1141-A1144 PolarHBondContact OD2-N 3.35Å; D1141-A1145 WeakPolarHBondContact O-CB 3.19Å; D1141-A1145 PolarHBondContact O-N 3.1Å
1142	L	91.7	Very high	94.2	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-72.1	-27.5	178.9	-177.6	56.6	0	0	0	112.4	Y956 L1146 V1170 V1187 P1190 W1193 V1210	Y956-L1142 HydrophobicContact CD1-CD1 4.3Å; Y956-L1142 HydrophobicContact CE1-CB 4.49Å; Y956-L1142 HydrophobicContact CE1-CD1 4.1Å; Y956-L1142 HydrophobicContact CE2-CB 3.85Å; L1142-L1146 HydrophobicContact CD1-CD1 4.22Å; L1142-L1146 HydrophobicContact CD1-CG 4.2Å; L1142-L1146 HydrophobicContact CG-CD1 4.14Å; L1142-L1146 WeakPolarHBondContact O-CB 3.46Å; L1142-L1146 WeakPolarHBondContact O-CG 3.31Å; L1142-L1146 PolarHBondContact O-N 3.17Å; L1142-V1170 HydrophobicContact CD1-CB 4.21Å; L1142-V1170 HydrophobicContact CD1-CG1 3.88Å; L1142-V1170 HydrophobicContact CD1-CG2 4.26Å; L1142-V1187 HydrophobicContact CD2-CG1 3.9Å; L1142-P1190 HydrophobicContact CD1-CB 4.45Å; L1142-W1193 HydrophobicContact CB-CZ3 4.15Å; L1142-W1193 HydrophobicContact CD2-CD2 4.25Å; L1142-W1193 HydrophobicContact CD2-CE3 3.61Å; L1142-W1193 HydrophobicContact CD2-CZ3 3.9Å; L1142-W1193 HydrophobicContact CG-CE3 4.32Å; L1142-W1193 HydrophobicContact CG-CZ3 4.31Å; L1142-V1210 HydrophobicContact CD2-CG1 4.28Å; L1142-V1210 HydrophobicContact CD2-CG2 4.24Å
1143	L	92.1	Very high	94.2	Very high	36 Å²	36	37.8 Å²	37.8	19%	0.188	21%	0.209	C	C	.	.	H	α-helix	trans	-70.7	-44.4	178.1	-60.9	178.6	0	0	0	111.1	D1141 A1147 W1193 A1194 K1198 I1201	D1141-L1143 VanDerWaalsContact C-N 3.35Å; D1141-L1143 PolarHBondContact OD1-N 2.84Å; D1141-L1143 WeakPolarHBondContact OD2-CB 3.22Å; L1143-A1147 WeakPolarHBondContact O-CB 3.21Å; L1143-A1147 PolarHBondContact O-N 2.79Å; L1143-W1193 HydrophobicContact CD2-CZ3 4.22Å; L1143-W1193 HydrophobicContact CG-CZ3 4.46Å; L1143-A1194 HydrophobicContact CD2-CB 3.59Å; L1143-K1198 HydrophobicContact CD2-CG 4.36Å; L1143-I1201 HydrophobicContact CD1-CD1 3.97Å
1144	A	93.1	Very high	94.2	Very high	36 Å²	36	42.6 Å²	42.6	30%	0.298	23%	0.232	S	C	.	.	H	α-helix	trans	-63.2	-43.8	171	0	0	0	0	0	112.3	T1139 D1141 L1146 A1147 I1148	T1139-A1144 HydrophobicContact CG2-CB 3.86Å; D1141-A1144 HydrophobicContact CB-CB 4.2Å; D1141-A1144 VanDerWaalsContact OD2-CB 3.31Å; D1141-A1144 WeakPolarHBondContact OD2-CB 3.45Å; D1141-A1144 PolarHBondContact OD2-N 3.35Å; A1144-L1146 PolarHBondContact O-N 3.06Å; A1144-A1147 PolarHBondContact O-N 3Å; A1144-I1148 WeakPolarHBondContact O-CG1 3.28Å; A1144-I1148 PolarHBondContact O-N 2.85Å
1145	A	94.6	Very high	94	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.6	-46.3	176.1	0	0	0	0	0	112.2	Y956 T1137 D1141 A1147 I1148 G1149	Y956-A1145 HydrophobicContact CD2-CB 4.34Å; Y956-A1145 HydrophobicContact CG-CB 4.25Å; T1137-A1145 HydrophobicContact CG2-CB 4.05Å; D1141-A1145 WeakPolarHBondContact O-CB 3.19Å; D1141-A1145 PolarHBondContact O-N 3.1Å; A1145-A1147 PolarHBondContact O-N 3.42Å; A1145-I1148 WeakPolarHBondContact O-CB 3.45Å; A1145-I1148 PolarHBondContact O-N 2.97Å; A1145-G1149 PolarHBondContact O-N 2.94Å
1146	L	94.5	Very high	93.9	Very high	26 Å²	26	45.5 Å²	45.5	14%	0.136	25%	0.245	C	C	.	.	H	α-helix	trans	-67.2	-32.7	176.5	-72.8	167.4	0	0	0	113.2	L1142 A1144 I1148 G1149 E1150 V1170 P1190 A1194	L1142-L1146 HydrophobicContact CD1-CD1 4.22Å; L1142-L1146 HydrophobicContact CD1-CG 4.2Å; L1142-L1146 HydrophobicContact CG-CD1 4.14Å; L1142-L1146 WeakPolarHBondContact O-CB 3.46Å; L1142-L1146 WeakPolarHBondContact O-CG 3.31Å; L1142-L1146 PolarHBondContact O-N 3.17Å; A1144-L1146 PolarHBondContact O-N 3.06Å; L1146-I1148 VanDerWaalsContact C-N 3.32Å; L1146-G1149 PolarHBondContact O-N 3.49Å; L1146-E1150 PolarHBondContact O-N 3.43Å; L1146-V1170 HydrophobicContact CD2-CG2 3.86Å; L1146-P1190 HydrophobicContact CD1-CB 4.26Å; L1146-P1190 HydrophobicContact CD2-CB 4.26Å; L1146-A1194 HydrophobicContact CD1-CB 3.56Å
1147	A	93.9	Very high	93.8	Very high	65 Å²	65	46.9 Å²	46.9	54%	0.537	25%	0.252	S	S	.	.	H	α-helix	trans	-67.7	-32.7	173.3	0	0	0	0	0	112.4	L1143 A1144 A1145 K1151	L1143-A1147 WeakPolarHBondContact O-CB 3.21Å; L1143-A1147 PolarHBondContact O-N 2.79Å; A1144-A1147 PolarHBondContact O-N 3Å; A1145-A1147 PolarHBondContact O-N 3.42Å; A1147-K1151 WeakPolarHBondContact O-CB 3.24Å; A1147-K1151 PolarHBondContact O-N 2.89Å; A1147-K1151 VanDerWaalsContact O-N 3.14Å
1148	I	94.5	Very high	93.7	Very high	41 Å²	41	52.6 Å²	52.6	21%	0.21	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-45.6	171.7	-68.9	163.9	0	0	0	110.6	L958 M1123 T1137 A1144 A1145 L1146 E1150 K1151 I1152	L958-I1148 HydrophobicContact CD1-CB 4.25Å; L958-I1148 HydrophobicContact CD1-CG2 3.85Å; M1123-I1148 HydrophobicContact SD-CG2 3.37Å; M1123-I1148 WeakPolarHBondContact SD-CG2 3.47Å; T1137-I1148 HydrophobicContact CG2-CD1 4.45Å; T1137-I1148 HydrophobicContact CG2-CG2 4.48Å; A1144-I1148 WeakPolarHBondContact O-CG1 3.28Å; A1144-I1148 PolarHBondContact O-N 2.85Å; A1145-I1148 WeakPolarHBondContact O-CB 3.45Å; A1145-I1148 PolarHBondContact O-N 2.97Å; L1146-I1148 VanDerWaalsContact C-N 3.32Å; I1148-E1150 PolarHBondContact O-N 3.31Å; I1148-K1151 WeakPolarHBondContact O-CB 3.42Å; I1148-K1151 PolarHBondContact O-N 3.46Å; I1148-K1151 VanDerWaalsContact O-N 3.15Å; I1148-I1152 HydrophobicContact CG2-CD1 4.09Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.38Å; I1148-I1152 PolarHBondContact O-N 3.23Å
1149	G	94.2	Very high	93.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-48	176.8	0	0	0	0	0	112.6	A1145 L1146 K1151 I1152 R1153	A1145-G1149 PolarHBondContact O-N 2.94Å; L1146-G1149 PolarHBondContact O-N 3.49Å; G1149-K1151 VanDerWaalsContact C-N 3.3Å; G1149-K1151 PolarHBondContact O-N 2.29Å; G1149-I1152 PolarHBondContact O-N 3.47Å; G1149-R1153 WeakPolarHBondContact O-CB 3.32Å; G1149-R1153 PolarHBondContact O-N 2.64Å
1150	E	94.1	Very high	93.2	Very high	71 Å²	71	50.7 Å²	50.7	33%	0.332	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-36.6	175.2	179.1	59.2	-166.2	0	0	112.4	L1146 I1148 R1153 Q1154	L1146-E1150 PolarHBondContact O-N 3.43Å; I1148-E1150 PolarHBondContact O-N 3.31Å; E1150-R1153 VanDerWaalsContact CD-NH2 3.3Å; E1150-R1153 PolarHBondContact O-N 3.44Å; E1150-R1153 IonicContact OE1-CZ 2.79Å; E1150-R1153 IonicContact OE1-NE 3.71Å; E1150-R1153 IonicContact OE1-NH2 2.73Å; E1150-R1153 PolarHBondContact OE1-NH2 3.18Å; E1150-R1153 IonicContact OE2-CZ 2.71Å; E1150-R1153 IonicContact OE2-NE 3.52Å; E1150-R1153 PolarHBondContact OE2-NE 2.93Å; E1150-R1153 IonicContact OE2-NH2 2.85Å; E1150-R1153 PolarHBondContact OE2-NH2 3.12Å; E1150-Q1154 WeakPolarHBondContact O-CB 3.27Å; E1150-Q1154 VanDerWaalsContact O-CG 3.28Å; E1150-Q1154 WeakPolarHBondContact O-CG 3.44Å; E1150-Q1154 PolarHBondContact O-N 3.49Å; E1150-Q1154 PolarHBondContact OE1-NE2 3.38Å
1151	K	95.3	Very high	93.1	Very high	113 Å²	113	52.9 Å²	52.9	49%	0.491	26%	0.256	S	S	.	.	H	α-helix	trans	-64.8	-43.9	175.1	-169.9	-161.3	174.8	-161.5	0	112	M1121 A1147 I1148 G1149 E1155	M1121-K1151 HydrophobicContact CE-CD 3.87Å; M1121-K1151 HydrophobicContact CE-CG 3.93Å; A1147-K1151 WeakPolarHBondContact O-CB 3.24Å; A1147-K1151 PolarHBondContact O-N 2.89Å; A1147-K1151 VanDerWaalsContact O-N 3.14Å; I1148-K1151 WeakPolarHBondContact O-CB 3.42Å; I1148-K1151 PolarHBondContact O-N 3.46Å; I1148-K1151 VanDerWaalsContact O-N 3.15Å; G1149-K1151 VanDerWaalsContact C-N 3.3Å; G1149-K1151 PolarHBondContact O-N 2.29Å; K1151-E1155 PolarHBondContact O-N 3.02Å
1152	I	95.5	Very high	92.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-49.4	176	-63.2	161.5	0	0	0	109.7	L958 L960 V1118 M1123 V1135 I1148 G1149 Q1154 E1155 V1156 L1165	L958-I1152 HydrophobicContact CD1-CD1 4.23Å; L960-I1152 HydrophobicContact CD1-CB 3.86Å; L960-I1152 HydrophobicContact CD1-CD1 3.88Å; L960-I1152 HydrophobicContact CD1-CG1 4.49Å; L960-I1152 HydrophobicContact CD1-CG2 3.46Å; L960-I1152 VanDerWaalsContact CD1-CG2 3.46Å; V1118-I1152 HydrophobicContact CG2-CG2 3.67Å; M1123-I1152 HydrophobicContact CE-CD1 3.91Å; M1123-I1152 HydrophobicContact CE-CG1 3.48Å; M1123-I1152 VanDerWaalsContact CE-CG1 3.48Å; M1123-I1152 HydrophobicContact SD-CD1 3.86Å; M1123-I1152 HydrophobicContact SD-CG1 4.02Å; V1135-I1152 HydrophobicContact CB-CD1 4.45Å; V1135-I1152 HydrophobicContact CG1-CD1 4.18Å; V1135-I1152 HydrophobicContact CG2-CD1 4.31Å; I1148-I1152 HydrophobicContact CG2-CD1 4.09Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.38Å; I1148-I1152 PolarHBondContact O-N 3.23Å; G1149-I1152 PolarHBondContact O-N 3.47Å; I1152-Q1154 VanDerWaalsContact C-N 3.29Å; I1152-Q1154 PolarHBondContact O-N 3.37Å; I1152-E1155 PolarHBondContact O-N 3.32Å; I1152-V1156 HydrophobicContact CG2-CG2 3.97Å; I1152-V1156 WeakPolarHBondContact O-CG2 3.38Å; I1152-V1156 PolarHBondContact O-N 2.68Å; I1152-L1165 HydrophobicContact CG2-CD2 4.34Å
1153	R	94.7	Very high	92.8	Very high	66 Å²	66	52.2 Å²	52.2	25%	0.249	25%	0.252	C	S	.	.	H	α-helix	trans	-55.5	-42.6	179.6	-161.2	-168.3	66.4	74.2	6.4	112	G1149 E1150 N1157 L1165 D1166	G1149-R1153 WeakPolarHBondContact O-CB 3.32Å; G1149-R1153 PolarHBondContact O-N 2.64Å; E1150-R1153 VanDerWaalsContact CD-NH2 3.3Å; E1150-R1153 PolarHBondContact O-N 3.44Å; E1150-R1153 IonicContact OE1-CZ 2.79Å; E1150-R1153 IonicContact OE1-NE 3.71Å; E1150-R1153 IonicContact OE1-NH2 2.73Å; E1150-R1153 PolarHBondContact OE1-NH2 3.18Å; E1150-R1153 IonicContact OE2-CZ 2.71Å; E1150-R1153 IonicContact OE2-NE 3.52Å; E1150-R1153 PolarHBondContact OE2-NE 2.93Å; E1150-R1153 IonicContact OE2-NH2 2.85Å; E1150-R1153 PolarHBondContact OE2-NH2 3.12Å; R1153-N1157 VanDerWaalsContact O-CB 3.24Å; R1153-N1157 WeakPolarHBondContact O-CB 3.33Å; R1153-N1157 PolarHBondContact O-N 2.94Å; R1153-N1157 VanDerWaalsContact O-N 3.14Å; R1153-L1165 WeakPolarHBondContact CG-O 3.49Å; R1153-D1166 WeakPolarHBondContact CD-OD1 3.3Å
1154	Q	94.7	Very high	92.8	Very high	101 Å²	101	54.4 Å²	54.4	47%	0.472	26%	0.262	S	S	.	.	H	α-helix	trans	-69.1	-27.2	175.5	-75.9	-178.9	17.4	0	0	114.1	E1150 I1152 K1158	E1150-Q1154 WeakPolarHBondContact O-CB 3.27Å; E1150-Q1154 VanDerWaalsContact O-CG 3.28Å; E1150-Q1154 WeakPolarHBondContact O-CG 3.44Å; E1150-Q1154 PolarHBondContact O-N 3.49Å; E1150-Q1154 PolarHBondContact OE1-NE2 3.38Å; I1152-Q1154 VanDerWaalsContact C-N 3.29Å; I1152-Q1154 PolarHBondContact O-N 3.37Å; Q1154-K1158 VanDerWaalsContact O-CD 3.31Å; Q1154-K1158 WeakPolarHBondContact O-CD 3.49Å; Q1154-K1158 WeakPolarHBondContact O-CE 3.48Å; Q1154-K1158 VanDerWaalsContact O-CG 3.28Å; Q1154-K1158 WeakPolarHBondContact O-CG 3.27Å
1155	E	93.9	Very high	92.8	Very high	61 Å²	61	52.8 Å²	52.8	29%	0.285	25%	0.248	S	C	.	.	H	α-helix	trans	-84.8	-44.8	179.1	-147.3	62.1	-129	0	0	111.8	L1117 M1121 K1151 I1152 K1158 H1159	L1117-E1155 HydrophobicContact CD1-CG 4.36Å; L1117-E1155 HydrophobicContact CD2-CB 4.41Å; L1117-E1155 HydrophobicContact CD2-CG 4.35Å; M1121-E1155 HydrophobicContact CE-CB 4.01Å; M1121-E1155 HydrophobicContact CE-CG 4.29Å; M1121-E1155 HydrophobicContact SD-CB 4.04Å; M1121-E1155 HydrophobicContact SD-CG 4.16Å; K1151-E1155 PolarHBondContact O-N 3.02Å; I1152-E1155 PolarHBondContact O-N 3.32Å; E1155-K1158 PolarHBondContact O-N 2.82Å; E1155-K1158 WeakPolarHBondContact OE1-CD 3.46Å; E1155-K1158 IonicContact OE1-NZ 3.02Å; E1155-K1158 PolarHBondContact OE1-NZ 3.38Å; E1155-K1158 IonicContact OE2-NZ 3.98Å; E1155-K1158 PolarHBondContact OE2-NZ 3.5Å; E1155-H1159 PolarHBondContact O-CE1 2.76Å; E1155-H1159 PolarHBondContact O-ND1 3.44Å
1156	V	93.7	Very high	92.7	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-46.9	176.8	178.2	0	0	0	0	110.5	F962 T1114 L1117 I1152 K1158 H1159 Y1160 L1165	F962-V1156 HydrophobicContact CE1-CG1 4.08Å; F962-V1156 HydrophobicContact CZ-CG1 3.96Å; T1114-V1156 HydrophobicContact CG2-CG1 4.31Å; T1114-V1156 HydrophobicContact CG2-CG2 4.02Å; L1117-V1156 HydrophobicContact CD2-CG2 3.99Å; I1152-V1156 HydrophobicContact CG2-CG2 3.97Å; I1152-V1156 WeakPolarHBondContact O-CG2 3.38Å; I1152-V1156 PolarHBondContact O-N 2.68Å; V1156-K1158 PolarHBondContact O-N 2.98Å; V1156-H1159 WeakPolarHBondContact O-CB 3.46Å; V1156-H1159 PolarHBondContact O-N 3.15Å; V1156-Y1160 HydrophobicContact CG1-CD2 4.47Å; V1156-Y1160 HydrophobicContact CG1-CE2 4.11Å; V1156-L1165 HydrophobicContact CB-CB 4.48Å; V1156-L1165 HydrophobicContact CB-CD2 4.04Å; V1156-L1165 HydrophobicContact CG1-CB 4.07Å; V1156-L1165 HydrophobicContact CG1-CD2 4.08Å; V1156-L1165 HydrophobicContact CG2-CD2 3.94Å
1157	N	94.1	Very high	92.6	Very high	38 Å²	38	56.9 Å²	56.9	20%	0.203	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	4.5	-175.6	-61.3	0.9	0	0	0	114.3	R1153 L1165	R1153-N1157 VanDerWaalsContact O-CB 3.24Å; R1153-N1157 WeakPolarHBondContact O-CB 3.33Å; R1153-N1157 PolarHBondContact O-N 2.94Å; R1153-N1157 VanDerWaalsContact O-N 3.14Å; N1157-L1165 PolarHBondContact ND2-O 3.17Å; N1157-L1165 VanDerWaalsContact OD1-CB 3.24Å; N1157-L1165 WeakPolarHBondContact OD1-CB 3.39Å; N1157-L1165 PolarHBondContact OD1-N 3.38Å
1158	K	92.5	Very high	92.4	Very high	132 Å²	132	58.8 Å²	58.8	57%	0.574	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-24.2	164.9	-71.3	159.9	-174.7	169.9	0	112.8	Q1154 E1155 V1156 Y1160	Q1154-K1158 VanDerWaalsContact O-CD 3.31Å; Q1154-K1158 WeakPolarHBondContact O-CD 3.49Å; Q1154-K1158 WeakPolarHBondContact O-CE 3.48Å; Q1154-K1158 VanDerWaalsContact O-CG 3.28Å; Q1154-K1158 WeakPolarHBondContact O-CG 3.27Å; E1155-K1158 PolarHBondContact O-N 2.82Å; E1155-K1158 WeakPolarHBondContact OE1-CD 3.46Å; E1155-K1158 IonicContact OE1-NZ 3.02Å; E1155-K1158 PolarHBondContact OE1-NZ 3.38Å; E1155-K1158 IonicContact OE2-NZ 3.98Å; E1155-K1158 PolarHBondContact OE2-NZ 3.5Å; V1156-K1158 PolarHBondContact O-N 2.98Å; K1158-Y1160 VanDerWaalsContact C-N 3.34Å
1159	H	88.4	Confident	92.3	Very high	68 Å²	68	57.2 Å²	57.2	32%	0.315	27%	0.266	S	S	.	.	S	Bend	trans	-85.8	-6.3	-172.8	-67.3	80.7	0	0	0	113.1	H1009 E1155 V1156	H1009-H1159 WeakPolarHBondContact CE1-CB 3.37Å; H1009-H1159 AromaticContact ND1-CD2 3.96Å; E1155-H1159 PolarHBondContact O-CE1 2.76Å; E1155-H1159 PolarHBondContact O-ND1 3.44Å; V1156-H1159 WeakPolarHBondContact O-CB 3.46Å; V1156-H1159 PolarHBondContact O-N 3.15Å
1160	Y	90.5	Very high	92.4	Very high	20 Å²	20	57.2 Å²	57.2	8%	0.078	27%	0.266	C	S	.	.			trans	-139.2	154.5	-177.4	-49.7	-69	0	0	0	110.6	F962 V1008 H1009 V1110 V1156 K1158 L1163	F962-Y1160 HydrophobicContact CZ-CE2 4.48Å; V1008-Y1160 HydrophobicContact CG1-CD1 4.24Å; H1009-Y1160 AromaticContact CE1-CD1 3.84Å; H1009-Y1160 AromaticContact CE1-CE1 3.01Å; H1009-Y1160 WeakPolarHBondContact CE1-CE1 3.44Å; H1009-Y1160 AromaticContact CE1-CE2 3.96Å; H1009-Y1160 AromaticContact CE1-CZ 3.08Å; H1009-Y1160 PolarHBondContact CE1-OH 2.8Å; V1110-Y1160 HydrophobicContact CG2-CE1 4.18Å; V1156-Y1160 HydrophobicContact CG1-CD2 4.47Å; V1156-Y1160 HydrophobicContact CG1-CE2 4.11Å; K1158-Y1160 VanDerWaalsContact C-N 3.34Å; Y1160-L1163 HydrophobicContact CD1-CD2 4.41Å; Y1160-L1163 HydrophobicContact CD2-CB 4.46Å; Y1160-L1163 HydrophobicContact CD2-CD2 4.06Å; Y1160-L1163 HydrophobicContact CD2-CG 4.49Å; Y1160-L1163 HydrophobicContact CE2-CD2 4.23Å; Y1160-L1163 HydrophobicContact CG-CB 4.15Å; Y1160-L1163 HydrophobicContact CG-CD2 4.16Å
1161	R	87.6	Confident	92.5	Very high	161 Å²	161	54 Å²	54	61%	0.608	25%	0.251	S	S	*	.	S	Bend	trans	-92.5	-36.8	-174.6	178.4	-179.6	54.6	177.8	-7.5	114	E972	E972-R1161 PolarHBondContact O-NH2 3.25Å; E972-R1161 WeakPolarHBondContact OE1-CB 3.35Å; E972-R1161 PolarHBondContact OE1-N 2.78Å; E972-R1161 PolarHBondContact OE2-N 2.87Å
1162	L	87.8	Confident	92.4	Very high	58 Å²	58	49.8 Å²	49.8	30%	0.304	24%	0.237	S	C	.	.	S	Bend	trans	-127.5	-22.5	-174.3	-54.4	175.9	0	0	0	112.6	Q971 E972 E1164	Q971-L1162 HydrophobicContact CB-CD1 3.93Å; E972-L1162 WeakPolarHBondContact OE2-CA 3.31Å; E972-L1162 VanDerWaalsContact OE2-CB 3.27Å; E972-L1162 WeakPolarHBondContact OE2-CB 3.2Å; E972-L1162 PolarHBondContact OE2-N 3.34Å; L1162-E1164 PolarHBondContact O-N 3.09Å
1163	L	90.2	Very high	92.3	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	24%	0.242	C	C	.	.			trans	-75.9	110.6	175.8	-178.3	66	0	0	0	110.6	F962 L965 E972 V1110 Y1160	F962-L1163 HydrophobicContact CB-CD1 4.23Å; F962-L1163 HydrophobicContact CD1-CD1 3.64Å; F962-L1163 HydrophobicContact CD1-CD2 3.92Å; F962-L1163 HydrophobicContact CD1-CG 3.59Å; F962-L1163 HydrophobicContact CE1-CD1 4.29Å; F962-L1163 HydrophobicContact CE1-CD2 3.72Å; F962-L1163 HydrophobicContact CE1-CG 3.73Å; F962-L1163 HydrophobicContact CG-CD1 4.15Å; F962-L1163 HydrophobicContact CG-CG 4.48Å; F962-L1163 HydrophobicContact CZ-CD2 4.27Å; L965-L1163 HydrophobicContact CD1-CD1 3.97Å; L965-L1163 HydrophobicContact CD1-CD2 4.33Å; E972-L1163 PolarHBondContact OE2-N 3.14Å; V1110-L1163 HydrophobicContact CG1-CD2 3.74Å; V1110-L1163 HydrophobicContact CG2-CD2 4.4Å; Y1160-L1163 HydrophobicContact CD1-CD2 4.41Å; Y1160-L1163 HydrophobicContact CD2-CB 4.46Å; Y1160-L1163 HydrophobicContact CD2-CD2 4.06Å; Y1160-L1163 HydrophobicContact CD2-CG 4.49Å; Y1160-L1163 HydrophobicContact CE2-CD2 4.23Å; Y1160-L1163 HydrophobicContact CG-CB 4.15Å; Y1160-L1163 HydrophobicContact CG-CD2 4.16Å
1164	E	91.6	Very high	92.2	Very high	82 Å²	82	47.2 Å²	47.2	38%	0.383	23%	0.23	S	C	.	.			trans	-106.3	108.3	-177	-66.7	165.1	-171.2	0	0	110.7	N963 K1049 L1162	N963-E1164 PolarHBondContact N-O 2.97Å; N963-E1164 PolarHBondContact ND2-O 2.86Å; K1049-E1164 IonicContact NZ-OE1 2.88Å; K1049-E1164 PolarHBondContact NZ-OE1 3.05Å; K1049-E1164 IonicContact NZ-OE2 3.49Å; K1049-E1164 PolarHBondContact NZ-OE2 3.41Å; L1162-E1164 PolarHBondContact O-N 3.09Å
1165	L	93.4	Very high	92.2	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	142.9	160.8	-166.5	77.9	0	0	0	109	L960 D961 F962 I1152 R1153 V1156 N1157	L960-L1165 HydrophobicContact CB-CD1 4.23Å; L960-L1165 HydrophobicContact CB-CD2 3.99Å; L960-L1165 HydrophobicContact CB-CG 4.16Å; L960-L1165 HydrophobicContact CD1-CD2 4.05Å; D961-L1165 WeakPolarHBondContact O-CA 3.45Å; F962-L1165 HydrophobicContact CD1-CB 3.92Å; F962-L1165 HydrophobicContact CD1-CD1 3.81Å; F962-L1165 HydrophobicContact CD2-CD1 3.84Å; F962-L1165 HydrophobicContact CE1-CB 3.73Å; F962-L1165 HydrophobicContact CE1-CD1 3.85Å; F962-L1165 HydrophobicContact CE1-CG 4.38Å; F962-L1165 HydrophobicContact CE2-CD1 3.86Å; F962-L1165 HydrophobicContact CG-CD1 3.81Å; F962-L1165 HydrophobicContact CZ-CB 4.39Å; F962-L1165 HydrophobicContact CZ-CD1 3.87Å; I1152-L1165 HydrophobicContact CG2-CD2 4.34Å; R1153-L1165 WeakPolarHBondContact CG-O 3.49Å; V1156-L1165 HydrophobicContact CB-CB 4.48Å; V1156-L1165 HydrophobicContact CB-CD2 4.04Å; V1156-L1165 HydrophobicContact CG1-CB 4.07Å; V1156-L1165 HydrophobicContact CG1-CD2 4.08Å; V1156-L1165 HydrophobicContact CG2-CD2 3.94Å; N1157-L1165 PolarHBondContact ND2-O 3.17Å; N1157-L1165 VanDerWaalsContact OD1-CB 3.24Å; N1157-L1165 WeakPolarHBondContact OD1-CB 3.39Å; N1157-L1165 PolarHBondContact OD1-N 3.38Å
1166	D	92.1	Very high	92.2	Very high	78 Å²	78	39.5 Å²	39.5	42%	0.417	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	168.9	174.6	-154.5	-3.2	0	0	0	111.9	L960 D961 N963 R1153 D1168	L960-D1166 VanDerWaalsContact CA-O 3.3Å; L960-D1166 WeakPolarHBondContact CA-O 3.31Å; D961-D1166 PolarHBondContact N-O 3.19Å; D961-D1166 PolarHBondContact O-N 3.1Å; N963-D1166 WeakPolarHBondContact ND2-CB 3.31Å; R1153-D1166 WeakPolarHBondContact CD-OD1 3.3Å; D1166-D1168 PolarHBondContact O-N 2.77Å
1167	T	91.4	Very high	91.8	Very high	35 Å²	35	40.8 Å²	40.8	22%	0.215	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	96.8	175.7	-53.5	0	0	0	0	110.3	L958 L960	L958-T1167 HydrophobicContact CD2-CG2 4.29Å; L960-T1167 HydrophobicContact CD2-CG2 4.05Å; L960-T1167 WeakPolarHBondContact CD2-OG1 3.34Å
1168	D	89.8	Confident	91.4	Very high	105 Å²	105	40.3 Å²	40.3	56%	0.561	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	-45.4	176.5	-179.8	63.6	0	0	0	111.6	L959 D961 D1166	L959-D1168 HydrophobicContact CD2-CB 4.47Å; L959-D1168 WeakPolarHBondContact CD2-OD2 3.41Å; L959-D1168 HydrophobicContact CG-CB 4.35Å; L959-D1168 PolarHBondContact O-N 3.39Å; D961-D1168 HydrophobicContact CB-CB 4.11Å; D1166-D1168 PolarHBondContact O-N 2.77Å
1169	G	92.9	Very high	91	Very high	7 Å²	7	37.4 Å²	37.4	7%	0.072	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	165.7	-172.2	0	0	0	0	0	115.6	L959	L959-G1169 PolarHBondContact N-O 2.82Å; L959-G1169 PolarHBondContact O-N 2.95Å
1170	V	95.7	Very high	90.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.8	167.9	-165	0	0	0	0	108.2	Y956 I957 L958 L1142 L1146 V1187 P1190	Y956-V1170 HydrophobicContact CD1-CG1 3.71Å; Y956-V1170 HydrophobicContact CG-CG1 4.22Å; I957-V1170 CarbonylContact O-C 3.46Å; I957-V1170 WeakPolarHBondContact O-CA 3.43Å; I957-V1170 WeakPolarHBondContact O-CG1 3.36Å; L958-V1170 HydrophobicContact CD2-CG2 4.17Å; L1142-V1170 HydrophobicContact CD1-CB 4.21Å; L1142-V1170 HydrophobicContact CD1-CG1 3.88Å; L1142-V1170 HydrophobicContact CD1-CG2 4.26Å; L1146-V1170 HydrophobicContact CD2-CG2 3.86Å; V1170-V1187 WeakPolarHBondContact O-CB 3.49Å; V1170-V1187 WeakPolarHBondContact O-CG2 3.47Å; V1170-V1187 PolarHBondContact O-N 3.04Å; V1170-P1190 HydrophobicContact CG2-CB 4.08Å; V1170-P1190 HydrophobicContact CG2-CG 4.08Å
1171	Y	96.1	Very high	90.6	Very high	3 Å²	3	37.2 Å²	37.2	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.1	176.7	-62	-50.8	0	0	0	110.3	Y956 I957 L959 M1174 Y1182 A1184 L1185 E1215	Y956-Y1171 VanDerWaalsContact CA-O 3.31Å; Y956-Y1171 WeakPolarHBondContact CA-O 3.37Å; I957-Y1171 PolarHBondContact N-O 3.27Å; I957-Y1171 PolarHBondContact O-N 3.23Å; L959-Y1171 HydrophobicContact CB-CE2 4.25Å; L959-Y1171 HydrophobicContact CD2-CE2 4.16Å; Y1171-M1174 HydrophobicContact CD2-SD 4.14Å; Y1171-Y1182 HydrophobicContact CE2-CE2 4.06Å; Y1171-Y1182 PolarHBondContact OH-OH 3.21Å; Y1171-A1184 HydrophobicContact CD1-CB 3.36Å; Y1171-A1184 HydrophobicContact CD2-CB 4.02Å; Y1171-A1184 HydrophobicContact CE1-CB 3.72Å; Y1171-A1184 HydrophobicContact CE2-CB 4.3Å; Y1171-A1184 HydrophobicContact CG-CB 3.54Å; Y1171-L1185 CarbonylContact C-O 3.39Å; Y1171-L1185 WeakPolarHBondContact CA-O 3.2Å; Y1171-E1215 WeakPolarHBondContact CE1-OE2 3.36Å; Y1171-E1215 PolarHBondContact OH-OE2 3.4Å
1172	A	93.6	Very high	90.8	Very high	25 Å²	25	29.9 Å²	29.9	21%	0.207	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-28.1	179.2	0	0	0	0	0	113.5	Y956 L1185 V1187 T1212	Y956-A1172 HydrophobicContact CD1-CB 4.24Å; Y956-A1172 HydrophobicContact CE1-CB 3.73Å; A1172-L1185 HydrophobicContact CB-CB 4.2Å; A1172-L1185 PolarHBondContact N-O 2.98Å; A1172-V1187 HydrophobicContact CB-CG2 4.25Å; A1172-T1212 HydrophobicContact CB-CG2 4.2Å
1173	A	93.2	Very high	91.1	Very high	12 Å²	12	27.1 Å²	27.1	10%	0.099	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	150.7	169.4	0	0	0	0	0	108.4	Y953 A1184 L1185 L1242	Y953-A1173 CarbonylContact O-C 3.58Å; Y953-A1173 VanDerWaalsContact O-CA 3.27Å; Y953-A1173 WeakPolarHBondContact O-CA 3.32Å; A1173-A1184 CarbonylContact O-C 3.49Å; A1173-A1184 VanDerWaalsContact O-CA 3.27Å; A1173-A1184 WeakPolarHBondContact O-CA 3.29Å; A1173-L1185 PolarHBondContact O-N 3.27Å; A1173-L1242 HydrophobicContact CB-CD2 4.05Å
1174	M	94	Very high	91.3	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	135.6	-176.2	-177.8	174.2	178.6	0	0	112.4	F952 Y953 I957 I1126 M1134 Y1171 L1176 Y1182 A1183 A1184	F952-M1174 WeakPolarHBondContact CA-O 3.35Å; Y953-M1174 PolarHBondContact N-O 3.1Å; Y953-M1174 PolarHBondContact O-N 3.17Å; I957-M1174 HydrophobicContact CG1-CB 4.21Å; I957-M1174 HydrophobicContact CG1-SD 4.37Å; I957-M1174 HydrophobicContact CG2-SD 4.32Å; I1126-M1174 HydrophobicContact CD1-SD 4.17Å; M1134-M1174 HydrophobicContact CE-CE 4.49Å; M1134-M1174 HydrophobicContact SD-CE 3.49Å; M1134-M1174 WeakPolarHBondContact SD-CE 3.34Å; M1134-M1174 HydrophobicContact SD-SD 4.12Å; Y1171-M1174 HydrophobicContact CD2-SD 4.14Å; M1174-L1176 HydrophobicContact CE-CB 4.06Å; M1174-L1176 HydrophobicContact CE-CD1 4.03Å; M1174-L1176 HydrophobicContact CE-CD2 4.37Å; M1174-L1176 HydrophobicContact CE-CG 4.38Å; M1174-Y1182 HydrophobicContact CE-CD1 4.45Å; M1174-Y1182 HydrophobicContact CE-CD2 3.67Å; M1174-Y1182 HydrophobicContact CE-CE2 4.29Å; M1174-Y1182 HydrophobicContact CE-CG 3.75Å; M1174-A1183 CarbonylContact C-O 3.54Å; M1174-A1183 WeakPolarHBondContact CA-O 3.31Å; M1174-A1184 HydrophobicContact CB-CB 4.29Å; M1174-A1184 HydrophobicContact CG-CB 4.25Å
1175	L	93.6	Very high	91.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	112.2	170.4	176.9	72	0	0	0	108.4	F952 L1177 Y1182 A1183 L1241 L1385 P1388 I1389	F952-L1175 HydrophobicContact CB-CD1 4.34Å; F952-L1175 HydrophobicContact CD2-CB 4.28Å; F952-L1175 HydrophobicContact CD2-CD1 4.2Å; L1175-L1177 HydrophobicContact CD1-CD2 3.81Å; L1175-L1177 HydrophobicContact CD2-CD2 4.09Å; L1175-L1177 HydrophobicContact CG-CD2 3.71Å; L1175-L1177 HydrophobicContact CG-CG 4.26Å; L1175-Y1182 CarbonylContact O-C 3.32Å; L1175-Y1182 WeakPolarHBondContact O-CA 3.25Å; L1175-Y1182 VanDerWaalsContact O-CB 3.31Å; L1175-Y1182 WeakPolarHBondContact O-CB 3.48Å; L1175-A1183 PolarHBondContact N-O 2.82Å; L1175-A1183 PolarHBondContact O-N 2.96Å; L1175-L1241 HydrophobicContact CD2-CD1 3.62Å; L1175-L1385 HydrophobicContact CD2-CD2 4.49Å; L1175-P1388 HydrophobicContact CD1-CG 4.44Å; L1175-I1389 HydrophobicContact CD1-CD1 4.38Å
1176	L	93.3	Very high	91.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	114.8	-177.2	177.8	56.5	0	0	0	109.6	P948 K949 K950 G951 I1126 Y1127 M1174	P948-L1176 HydrophobicContact CB-CD1 3.83Å; P948-L1176 HydrophobicContact CB-CD2 3.71Å; P948-L1176 HydrophobicContact CB-CG 3.76Å; K949-L1176 WeakPolarHBondContact O-CD2 3.46Å; K950-L1176 CarbonylContact C-O 3.57Å; K950-L1176 WeakPolarHBondContact CA-O 3.38Å; G951-L1176 PolarHBondContact N-O 2.92Å; G951-L1176 PolarHBondContact O-N 2.71Å; I1126-L1176 HydrophobicContact CD1-CD2 4.36Å; Y1127-L1176 HydrophobicContact CG-CD1 4.45Å; M1174-L1176 HydrophobicContact CE-CB 4.06Å; M1174-L1176 HydrophobicContact CE-CD1 4.03Å; M1174-L1176 HydrophobicContact CE-CD2 4.37Å; M1174-L1176 HydrophobicContact CE-CG 4.38Å
1177	L	86.2	Confident	91.6	Very high	28 Å²	28	21.8 Å²	21.8	15%	0.147	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-43.6	-170.5	-55.5	-176.3	0	0	0	113.5	K950 L1175 K1181 L1219 L1385 P1388	K950-L1177 WeakPolarHBondContact CG-O 3.49Å; L1175-L1177 HydrophobicContact CD1-CD2 3.81Å; L1175-L1177 HydrophobicContact CD2-CD2 4.09Å; L1175-L1177 HydrophobicContact CG-CD2 3.71Å; L1175-L1177 HydrophobicContact CG-CG 4.26Å; L1177-K1181 HydrophobicContact CB-CB 4.5Å; L1177-K1181 PolarHBondContact N-O 2.7Å; L1177-L1219 HydrophobicContact CD1-CD2 3.59Å; L1177-L1219 HydrophobicContact CG-CD2 4.38Å; L1177-L1385 HydrophobicContact CD1-CD2 4.14Å; L1177-P1388 HydrophobicContact CD2-CG 3.55Å
1178	A	85.6	Confident	91.6	Very high	29 Å²	29	23.3 Å²	23.3	24%	0.24	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	177.5	-178.2	0	0	0	0	0	109.9	K1180 K1181	A1178-K1180 PolarHBondContact O-N 3.04Å; A1178-K1181 HydrophobicContact CB-CB 4.24Å; A1178-K1181 HydrophobicContact CB-CD 4.21Å; A1178-K1181 PolarHBondContact N-O 3.08Å; A1178-K1181 PolarHBondContact O-N 3.36Å
1179	K	84.8	Confident	91.4	Very high	71 Å²	71	22.7 Å²	22.7	31%	0.309	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	123.7	177.1	-76.1	177.4	155.9	149.3	0	110.5	I36 V945 L946 E947 P948 Y1127 K1181	I36-K1179 VanDerWaalsContact CD1-O 3.29Å; I36-K1179 WeakPolarHBondContact CD1-O 3.44Å; V945-K1179 HydrophobicContact CB-CD 4.39Å; V945-K1179 HydrophobicContact CG1-CB 4.04Å; V945-K1179 HydrophobicContact CG1-CD 3.99Å; V945-K1179 HydrophobicContact CG1-CG 3.79Å; V945-K1179 WeakPolarHBondContact O-CE 3.31Å; V945-K1179 PolarHBondContact O-NZ 3.08Å; L946-K1179 WeakPolarHBondContact O-CE 3.33Å; E947-K1179 WeakPolarHBondContact OE2-CE 3.43Å; E947-K1179 IonicContact OE2-NZ 3.69Å; E947-K1179 PolarHBondContact OE2-NZ 2.78Å; P948-K1179 HydrophobicContact CG-CG 4.33Å; Y1127-K1179 HydrophobicContact CE2-CG 4.38Å; K1179-K1181 PolarHBondContact O-N 3.16Å; K1179-K1181 VanDerWaalsContact O-N 3.08Å
1180	K	83.1	Confident	91.1	Very high	24 Å²	24	23.2 Å²	23.2	10%	0.104	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	7.9	-174.7	-50.3	-176.6	164	-91.8	0	116.3	I36 Y1127 D1129 A1178 K1217	I36-K1180 HydrophobicContact CB-CB 3.57Å; I36-K1180 HydrophobicContact CB-CD 3.68Å; I36-K1180 HydrophobicContact CB-CG 4.22Å; I36-K1180 HydrophobicContact CD1-CB 3.78Å; I36-K1180 HydrophobicContact CG1-CB 4.29Å; I36-K1180 HydrophobicContact CG2-CB 3.35Å; I36-K1180 HydrophobicContact CG2-CD 4.21Å; I36-K1180 HydrophobicContact CG2-CG 4.39Å; I36-K1180 WeakPolarHBondContact CG2-O 3.5Å; Y1127-K1180 WeakPolarHBondContact OH-CA 3.46Å; Y1127-K1180 VanDerWaalsContact OH-CG 3.28Å; Y1127-K1180 WeakPolarHBondContact OH-CG 3.38Å; Y1127-K1180 PolarHBondContact OH-N 3.15Å; D1129-K1180 VanDerWaalsContact OD1-CE 3.25Å; D1129-K1180 WeakPolarHBondContact OD1-CE 3.43Å; D1129-K1180 IonicContact OD1-NZ 3.06Å; D1129-K1180 PolarHBondContact OD1-NZ 3.2Å; D1129-K1180 WeakPolarHBondContact OD2-CE 3.34Å; D1129-K1180 VanDerWaalsContact OD2-CG 3.26Å; D1129-K1180 WeakPolarHBondContact OD2-CG 3.32Å; D1129-K1180 IonicContact OD2-NZ 2.93Å; D1129-K1180 PolarHBondContact OD2-NZ 3.46Å; A1178-K1180 PolarHBondContact O-N 3.04Å; K1180-K1217 CarbonylContact O-C 3.57Å
1181	K	86.3	Confident	90.6	Very high	59 Å²	59	27.8 Å²	27.8	26%	0.257	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	96.9	-176.1	-61.1	179.8	-160.6	166.3	0	110.5	D33 I36 L1177 A1178 K1179 K1217 L1219	D33-K1181 IonicContact OD1-NZ 3.32Å; D33-K1181 PolarHBondContact OD1-NZ 2.92Å; I36-K1181 HydrophobicContact CD1-CD 4.25Å; I36-K1181 HydrophobicContact CD1-CG 3.89Å; L1177-K1181 HydrophobicContact CB-CB 4.5Å; L1177-K1181 PolarHBondContact N-O 2.7Å; A1178-K1181 HydrophobicContact CB-CB 4.24Å; A1178-K1181 HydrophobicContact CB-CD 4.21Å; A1178-K1181 PolarHBondContact N-O 3.08Å; A1178-K1181 PolarHBondContact O-N 3.36Å; K1179-K1181 PolarHBondContact O-N 3.16Å; K1179-K1181 VanDerWaalsContact O-N 3.08Å; K1181-K1217 WeakPolarHBondContact CA-O 3.38Å; K1181-L1219 HydrophobicContact CB-CD2 4.19Å
1182	Y	92.4	Very high	90	Very high	8 Å²	8	33.9 Å²	33.9	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	162	-177.1	70.5	-89.5	0	0	0	114.4	M1134 Y1171 M1174 L1175 A1184 M1216 K1217	M1134-Y1182 HydrophobicContact CE-CE1 3.88Å; M1134-Y1182 HydrophobicContact CE-CE2 4.27Å; M1134-Y1182 WeakPolarHBondContact CE-OH 3.34Å; Y1171-Y1182 HydrophobicContact CE2-CE2 4.06Å; Y1171-Y1182 PolarHBondContact OH-OH 3.21Å; M1174-Y1182 HydrophobicContact CE-CD1 4.45Å; M1174-Y1182 HydrophobicContact CE-CD2 3.67Å; M1174-Y1182 HydrophobicContact CE-CE2 4.29Å; M1174-Y1182 HydrophobicContact CE-CG 3.75Å; L1175-Y1182 CarbonylContact O-C 3.32Å; L1175-Y1182 WeakPolarHBondContact O-CA 3.25Å; L1175-Y1182 VanDerWaalsContact O-CB 3.31Å; L1175-Y1182 WeakPolarHBondContact O-CB 3.48Å; Y1182-A1184 HydrophobicContact CD2-CB 4.47Å; Y1182-M1216 CarbonylContact O-C 3.39Å; Y1182-M1216 WeakPolarHBondContact O-CA 3.5Å; Y1182-K1217 HydrophobicContact CD1-CB 4.09Å; Y1182-K1217 HydrophobicContact CE1-CB 3.79Å; Y1182-K1217 HydrophobicContact CE1-CD 3.86Å; Y1182-K1217 HydrophobicContact CE1-CG 4.05Å; Y1182-K1217 HydrophobicContact CE2-CG 4.34Å; Y1182-K1217 PolarHBondContact N-O 2.86Å; Y1182-K1217 PolarHBondContact O-N 3.46Å; Y1182-K1217 VanDerWaalsContact O-O 3.11Å; Y1182-K1217 VanDerWaalsContact OH-CD 3.31Å; Y1182-K1217 WeakPolarHBondContact OH-CD 3.45Å; Y1182-K1217 VanDerWaalsContact OH-CE 3.23Å; Y1182-K1217 WeakPolarHBondContact OH-CE 3.01Å; Y1182-K1217 PolarHBondContact OH-NZ 2.91Å
1183	A	93.6	Very high	89.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	148	165.4	0	0	0	0	0	110.7	M1174 L1175 E1215 M1216 L1219 V1238 L1242	M1174-A1183 CarbonylContact C-O 3.54Å; M1174-A1183 WeakPolarHBondContact CA-O 3.31Å; L1175-A1183 PolarHBondContact N-O 2.82Å; L1175-A1183 PolarHBondContact O-N 2.96Å; A1183-E1215 CarbonylContact C-O 3.46Å; A1183-E1215 VanDerWaalsContact CA-O 3.28Å; A1183-E1215 WeakPolarHBondContact CA-O 3.05Å; A1183-M1216 HydrophobicContact CB-CB 4.48Å; A1183-M1216 HydrophobicContact CB-CG 3.9Å; A1183-L1219 HydrophobicContact CB-CD1 3.78Å; A1183-V1238 HydrophobicContact CB-CG1 3.59Å; A1183-L1242 HydrophobicContact CB-CD1 4.29Å
1184	A	94.8	Very high	89.3	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	163	-174.8	0	0	0	0	0	113.4	Y1171 A1173 M1174 Y1182 E1215	Y1171-A1184 HydrophobicContact CD1-CB 3.36Å; Y1171-A1184 HydrophobicContact CD2-CB 4.02Å; Y1171-A1184 HydrophobicContact CE1-CB 3.72Å; Y1171-A1184 HydrophobicContact CE2-CB 4.3Å; Y1171-A1184 HydrophobicContact CG-CB 3.54Å; A1173-A1184 CarbonylContact O-C 3.49Å; A1173-A1184 VanDerWaalsContact O-CA 3.27Å; A1173-A1184 WeakPolarHBondContact O-CA 3.29Å; M1174-A1184 HydrophobicContact CB-CB 4.29Å; M1174-A1184 HydrophobicContact CG-CB 4.25Å; Y1182-A1184 HydrophobicContact CD2-CB 4.47Å; A1184-E1215 PolarHBondContact N-O 3.18Å; A1184-E1215 PolarHBondContact O-N 2.88Å
1185	L	94.5	Very high	88.9	Confident	30 Å²	30	38.2 Å²	38.2	16%	0.157	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	92.8	168	-71.4	-175.2	0	0	0	110.6	Y1171 A1172 A1173 T1212 K1213 Q1214 L1242	Y1171-L1185 CarbonylContact C-O 3.39Å; Y1171-L1185 WeakPolarHBondContact CA-O 3.2Å; A1172-L1185 HydrophobicContact CB-CB 4.2Å; A1172-L1185 PolarHBondContact N-O 2.98Å; A1173-L1185 PolarHBondContact O-N 3.27Å; L1185-T1212 HydrophobicContact CB-CG2 4.27Å; L1185-K1213 CarbonylContact C-O 3.56Å; L1185-Q1214 HydrophobicContact CD2-CB 4.28Å; L1185-L1242 HydrophobicContact CD1-CB 4.32Å; L1185-L1242 WeakPolarHBondContact CD1-O 3.46Å; L1185-L1242 HydrophobicContact CD2-CB 4.18Å; L1185-L1242 HydrophobicContact CD2-CD1 4.25Å; L1185-L1242 HydrophobicContact CG-CB 4.03Å; L1185-L1242 HydrophobicContact CG-CD1 4.28Å; L1185-L1242 HydrophobicContact CG-CD2 4.42Å; L1185-L1242 HydrophobicContact CG-CG 4.48Å
1186	S	94.6	Very high	88.5	Confident	16 Å²	16	40.5 Å²	40.5	11%	0.112	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	128.9	175.5	-173.2	0	0	0	0	111.4	T1212 K1213 E1215	S1186-T1212 CarbonylContact O-C 3.25Å; S1186-T1212 WeakPolarHBondContact O-CA 3.4Å; S1186-K1213 PolarHBondContact N-O 3.06Å; S1186-K1213 PolarHBondContact O-N 2.93Å; S1186-E1215 WeakPolarHBondContact CB-OE1 3.27Å; S1186-E1215 WeakPolarHBondContact CB-OE2 3.3Å; S1186-E1215 PolarHBondContact OG-OE1 2.84Å; S1186-E1215 VanDerWaalsContact OG-OE1 3.06Å
1187	V	94	Very high	88.1	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	125	174.9	175.3	0	0	0	0	109.7	Y956 L1142 V1170 A1172 N1189 P1190 V1210 T1212	Y956-V1187 HydrophobicContact CE1-CG2 3.98Å; L1142-V1187 HydrophobicContact CD2-CG1 3.9Å; V1170-V1187 WeakPolarHBondContact O-CB 3.49Å; V1170-V1187 WeakPolarHBondContact O-CG2 3.47Å; V1170-V1187 PolarHBondContact O-N 3.04Å; A1172-V1187 HydrophobicContact CB-CG2 4.25Å; V1187-N1189 PolarHBondContact O-N 3.43Å; V1187-P1190 HydrophobicContact CB-CB 4.35Å; V1187-P1190 HydrophobicContact CG1-CB 3.82Å; V1187-P1190 WeakPolarHBondContact O-CD 3.43Å; V1187-V1210 HydrophobicContact CB-CG1 4.4Å; V1187-V1210 HydrophobicContact CG1-CG1 3.62Å; V1187-V1210 HydrophobicContact CG2-CG1 4.01Å; V1187-T1212 HydrophobicContact CG2-CG2 4.39Å
1188	I	91	Very high	88	Confident	68 Å²	68	44.9 Å²	44.9	35%	0.349	24%	0.238	S	C	.	.	S	Bend	trans	-77.6	120.9	-178.8	-56.8	174.6	0	0	0	109.9	C1211 K1213	I1188-C1211 HydrophobicContact CB-CB 4.43Å; I1188-C1211 WeakPolarHBondContact CB-O 2.98Å; I1188-C1211 HydrophobicContact CD1-CB 4.24Å; I1188-C1211 WeakPolarHBondContact CG1-O 3.41Å; I1188-C1211 PolarHBondContact N-O 3.06Å; I1188-K1213 HydrophobicContact CD1-CB 4.23Å; I1188-K1213 HydrophobicContact CG1-CB 4.12Å
1189	N	87	Confident	88	Confident	91 Å²	91	47.8 Å²	47.8	49%	0.487	25%	0.249	S	C	.	.	S	Bend	trans	50.5	57.4	177.8	-60.2	1.2	0	0	0	114	V1187 V1191 Q1192 W1193	V1187-N1189 PolarHBondContact O-N 3.43Å; N1189-V1191 VanDerWaalsContact C-N 3.31Å; N1189-V1191 PolarHBondContact O-N 3.11Å; N1189-Q1192 HydrophobicContact CB-CB 4.07Å; N1189-Q1192 HydrophobicContact CB-CG 4.17Å; N1189-Q1192 PolarHBondContact ND2-OE1 3.47Å; N1189-Q1192 PolarHBondContact O-N 3.07Å; N1189-W1193 PolarHBondContact O-N 3.16Å
1190	P	86.3	Confident	88	Confident	18 Å²	18	45.6 Å²	45.6	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-37.8	-167.9	24.7	-33.7	0	0	0	112.9	L1142 L1146 V1170 V1187 W1193 A1194	L1142-P1190 HydrophobicContact CD1-CB 4.45Å; L1146-P1190 HydrophobicContact CD1-CB 4.26Å; L1146-P1190 HydrophobicContact CD2-CB 4.26Å; V1170-P1190 HydrophobicContact CG2-CB 4.08Å; V1170-P1190 HydrophobicContact CG2-CG 4.08Å; V1187-P1190 HydrophobicContact CB-CB 4.35Å; V1187-P1190 HydrophobicContact CG1-CB 3.82Å; V1187-P1190 WeakPolarHBondContact O-CD 3.43Å; P1190-W1193 PolarHBondContact O-N 3.27Å; P1190-A1194 VanDerWaalsContact O-CB 3.25Å; P1190-A1194 WeakPolarHBondContact O-CB 3.18Å; P1190-A1194 PolarHBondContact O-N 3.04Å
1191	V	84.3	Confident	88	Confident	96 Å²	96	48.5 Å²	48.5	58%	0.582	26%	0.259	S	S	*	.	H	α-helix	trans	-66.4	-38.3	177.3	-176.3	0	0	0	0	112.2	N1189 A1194 T1195	N1189-V1191 VanDerWaalsContact C-N 3.31Å; N1189-V1191 PolarHBondContact O-N 3.11Å; V1191-A1194 PolarHBondContact O-N 3.17Å; V1191-T1195 PolarHBondContact O-N 3.43Å; V1191-T1195 PolarHBondContact O-OG1 3.4Å; V1191-T1195 VanDerWaalsContact O-OG1 3.11Å
1192	Q	84.4	Confident	88	Confident	132 Å²	132	52.4 Å²	52.4	62%	0.617	28%	0.282	S	S	*	.	H	α-helix	trans	-69.5	-44.1	177.6	-62.5	178.9	-1.6	0	0	110.8	N1189 A1194 T1195 A1196	N1189-Q1192 HydrophobicContact CB-CB 4.07Å; N1189-Q1192 HydrophobicContact CB-CG 4.17Å; N1189-Q1192 PolarHBondContact ND2-OE1 3.47Å; N1189-Q1192 PolarHBondContact O-N 3.07Å; Q1192-A1194 VanDerWaalsContact C-N 3.34Å; Q1192-A1194 PolarHBondContact O-N 2.88Å; Q1192-T1195 PolarHBondContact O-N 2.73Å; Q1192-A1196 PolarHBondContact O-N 2.78Å
1193	W	88.1	Confident	87.7	Confident	44 Å²	44	58.2 Å²	58.2	17%	0.167	31%	0.31	C	S	.	.	H	α-helix	trans	-59.4	-45.1	173.6	-177.5	94.5	0	0	0	111	L1142 L1143 N1189 P1190 T1195 A1196 A1197 P1207 Q1208 V1210	L1142-W1193 HydrophobicContact CB-CZ3 4.15Å; L1142-W1193 HydrophobicContact CD2-CD2 4.25Å; L1142-W1193 HydrophobicContact CD2-CE3 3.61Å; L1142-W1193 HydrophobicContact CD2-CZ3 3.9Å; L1142-W1193 HydrophobicContact CG-CE3 4.32Å; L1142-W1193 HydrophobicContact CG-CZ3 4.31Å; L1143-W1193 HydrophobicContact CD2-CZ3 4.22Å; L1143-W1193 HydrophobicContact CG-CZ3 4.46Å; N1189-W1193 PolarHBondContact O-N 3.16Å; P1190-W1193 PolarHBondContact O-N 3.27Å; W1193-T1195 PolarHBondContact O-N 3.13Å; W1193-A1196 PolarHBondContact O-N 2.83Å; W1193-A1197 HydrophobicContact CD2-CB 4.31Å; W1193-A1197 HydrophobicContact CE3-CB 4.01Å; W1193-A1197 HydrophobicContact CH2-CB 3.82Å; W1193-A1197 HydrophobicContact CZ2-CB 4.12Å; W1193-A1197 HydrophobicContact CZ3-CB 3.75Å; W1193-A1197 VanDerWaalsContact O-CB 3.28Å; W1193-A1197 WeakPolarHBondContact O-CB 3.29Å; W1193-A1197 PolarHBondContact O-N 3.3Å; W1193-P1207 HydrophobicContact CH2-CB 4.28Å; W1193-P1207 HydrophobicContact CZ2-CB 3.81Å; W1193-Q1208 WeakPolarHBondContact CZ2-O 3.14Å; W1193-Q1208 PolarHBondContact NE1-O 3.41Å; W1193-V1210 HydrophobicContact CD2-CG2 4.19Å; W1193-V1210 HydrophobicContact CH2-CG2 4.12Å; W1193-V1210 HydrophobicContact CZ2-CG2 3.61Å
1194	A	83.6	Confident	87	Confident	6 Å²	6	61.7 Å²	61.7	5%	0.05	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-38.4	179.2	0	0	0	0	0	113	L1143 L1146 P1190 V1191 Q1192 K1198	L1143-A1194 HydrophobicContact CD2-CB 3.59Å; L1146-A1194 HydrophobicContact CD1-CB 3.56Å; P1190-A1194 VanDerWaalsContact O-CB 3.25Å; P1190-A1194 WeakPolarHBondContact O-CB 3.18Å; P1190-A1194 PolarHBondContact O-N 3.04Å; V1191-A1194 PolarHBondContact O-N 3.17Å; Q1192-A1194 VanDerWaalsContact C-N 3.34Å; Q1192-A1194 PolarHBondContact O-N 2.88Å; A1194-K1198 WeakPolarHBondContact O-CB 3.39Å; A1194-K1198 VanDerWaalsContact O-CG 3.27Å; A1194-K1198 WeakPolarHBondContact O-CG 3.23Å; A1194-K1198 PolarHBondContact O-N 3.21Å
1195	T	84.8	Confident	86.4	Confident	78 Å²	78	66.5 Å²	66.5	48%	0.479	37%	0.371	S	S	.	.	H	α-helix	trans	-65.2	-45.7	173.5	-63.1	0	0	0	0	111.4	V1191 Q1192 W1193 K1198 I1199	V1191-T1195 PolarHBondContact O-N 3.43Å; V1191-T1195 PolarHBondContact O-OG1 3.4Å; V1191-T1195 VanDerWaalsContact O-OG1 3.11Å; Q1192-T1195 PolarHBondContact O-N 2.73Å; W1193-T1195 PolarHBondContact O-N 3.13Å; T1195-K1198 PolarHBondContact O-N 3.39Å; T1195-I1199 HydrophobicContact CG2-CD1 4.24Å; T1195-I1199 WeakPolarHBondContact O-CG1 3.38Å; T1195-I1199 PolarHBondContact O-N 3.48Å; T1195-I1199 VanDerWaalsContact O-N 3.16Å
1196	A	84.9	Confident	85.6	Confident	48 Å²	48	71.2 Å²	71.2	40%	0.397	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-44.1	175.9	0	0	0	0	0	112	Q1192 W1193 K1198 I1199 S1200	Q1192-A1196 PolarHBondContact O-N 2.78Å; W1193-A1196 PolarHBondContact O-N 2.83Å; A1196-K1198 PolarHBondContact O-N 3Å; A1196-I1199 WeakPolarHBondContact O-CB 3.4Å; A1196-I1199 PolarHBondContact O-N 3.21Å; A1196-I1199 VanDerWaalsContact O-N 3.15Å; A1196-S1200 PolarHBondContact O-N 2.96Å; A1196-S1200 PolarHBondContact O-OG 3.46Å
1197	A	84.8	Confident	84.8	Confident	2 Å²	2	72.9 Å²	72.9	2%	0.017	41%	0.412	C	S	.	.	H	α-helix	trans	-61	-44.2	177.8	0	0	0	0	0	112	W1193 I1199 S1200 I1201 P1207	W1193-A1197 HydrophobicContact CD2-CB 4.31Å; W1193-A1197 HydrophobicContact CE3-CB 4.01Å; W1193-A1197 HydrophobicContact CH2-CB 3.82Å; W1193-A1197 HydrophobicContact CZ2-CB 4.12Å; W1193-A1197 HydrophobicContact CZ3-CB 3.75Å; W1193-A1197 VanDerWaalsContact O-CB 3.28Å; W1193-A1197 WeakPolarHBondContact O-CB 3.29Å; W1193-A1197 PolarHBondContact O-N 3.3Å; A1197-I1199 VanDerWaalsContact C-N 3.3Å; A1197-I1199 PolarHBondContact O-N 2.57Å; A1197-S1200 PolarHBondContact O-N 3.49Å; A1197-I1201 WeakPolarHBondContact O-CB 3.43Å; A1197-I1201 WeakPolarHBondContact O-CD1 3.36Å; A1197-I1201 WeakPolarHBondContact O-CG1 3.43Å; A1197-I1201 PolarHBondContact O-N 3.18Å; A1197-P1207 HydrophobicContact CB-CB 4.01Å; A1197-P1207 HydrophobicContact CB-CG 4.26Å
1198	K	85.1	Confident	84.1	Confident	117 Å²	117	80.1 Å²	80.1	51%	0.509	45%	0.445	S	S	.	.	H	α-helix	trans	-58.7	-40.5	173.5	-75.2	171.4	-177.6	178.1	0	112	L1143 A1194 T1195 A1196 N1202	L1143-K1198 HydrophobicContact CD2-CG 4.36Å; A1194-K1198 WeakPolarHBondContact O-CB 3.39Å; A1194-K1198 VanDerWaalsContact O-CG 3.27Å; A1194-K1198 WeakPolarHBondContact O-CG 3.23Å; A1194-K1198 PolarHBondContact O-N 3.21Å; T1195-K1198 PolarHBondContact O-N 3.39Å; A1196-K1198 PolarHBondContact O-N 3Å; K1198-N1202 WeakPolarHBondContact O-CB 3.15Å; K1198-N1202 PolarHBondContact O-N 3.15Å; K1198-N1202 PolarHBondContact O-ND2 2.83Å
1199	I	86.1	Confident	83.7	Confident	90 Å²	90	82.9 Å²	82.9	46%	0.462	47%	0.465	S	S	.	.	H	α-helix	trans	-65.8	-47.1	175.7	-65.8	164.4	0	0	0	110.8	T1195 A1196 A1197 N1202 Q1203	T1195-I1199 HydrophobicContact CG2-CD1 4.24Å; T1195-I1199 WeakPolarHBondContact O-CG1 3.38Å; T1195-I1199 PolarHBondContact O-N 3.48Å; T1195-I1199 VanDerWaalsContact O-N 3.16Å; A1196-I1199 WeakPolarHBondContact O-CB 3.4Å; A1196-I1199 PolarHBondContact O-N 3.21Å; A1196-I1199 VanDerWaalsContact O-N 3.15Å; A1197-I1199 VanDerWaalsContact C-N 3.3Å; A1197-I1199 PolarHBondContact O-N 2.57Å; I1199-N1202 PolarHBondContact O-N 3.32Å; I1199-Q1203 VanDerWaalsContact O-CG 3.31Å; I1199-Q1203 WeakPolarHBondContact O-CG 3.23Å; I1199-Q1203 PolarHBondContact O-N 2.85Å; I1199-Q1203 VanDerWaalsContact O-N 3.1Å
1200	S	84.2	Confident	83.6	Confident	26 Å²	26	80.3 Å²	80.3	18%	0.182	45%	0.453	C	S	.	.	H	α-helix	trans	-60.9	-46.2	177.5	-61.5	0	0	0	0	112.4	A1196 A1197 N1202 Q1203 G1204 L1205	A1196-S1200 PolarHBondContact O-N 2.96Å; A1196-S1200 PolarHBondContact O-OG 3.46Å; A1197-S1200 PolarHBondContact O-N 3.49Å; S1200-N1202 PolarHBondContact O-N 3.42Å; S1200-Q1203 CarbonylContact O-C 3.59Å; S1200-Q1203 WeakPolarHBondContact O-CA 3.35Å; S1200-Q1203 WeakPolarHBondContact O-CB 3.48Å; S1200-Q1203 PolarHBondContact O-N 3.41Å; S1200-G1204 PolarHBondContact O-N 3.48Å; S1200-G1204 VanDerWaalsContact O-N 3.09Å; S1200-L1205 CarbonylContact C-O 3.57Å; S1200-L1205 PolarHBondContact O-N 3.4Å
1201	I	84.1	Confident	83.7	Confident	85 Å²	85	83.3 Å²	83.3	44%	0.436	47%	0.473	S	S	.	.	H	α-helix	trans	-60.7	-45	178.3	-69.4	163.1	0	0	0	110.6	L1143 A1197 Q1203 G1204 P1207	L1143-I1201 HydrophobicContact CD1-CD1 3.97Å; A1197-I1201 WeakPolarHBondContact O-CB 3.43Å; A1197-I1201 WeakPolarHBondContact O-CD1 3.36Å; A1197-I1201 WeakPolarHBondContact O-CG1 3.43Å; A1197-I1201 PolarHBondContact O-N 3.18Å; I1201-Q1203 PolarHBondContact O-N 2.82Å; I1201-G1204 PolarHBondContact O-N 3.01Å; I1201-P1207 HydrophobicContact CD1-CG 4.05Å; I1201-P1207 HydrophobicContact CG1-CG 3.95Å
1202	N	84.9	Confident	84	Confident	141 Å²	141	81.7 Å²	81.7	75%	0.754	46%	0.464	S	S	*	.	H	α-helix	trans	-65	-18.8	175.4	-71.4	-11.4	0	0	0	113.5	K1198 I1199 S1200	K1198-N1202 WeakPolarHBondContact O-CB 3.15Å; K1198-N1202 PolarHBondContact O-N 3.15Å; K1198-N1202 PolarHBondContact O-ND2 2.83Å; I1199-N1202 PolarHBondContact O-N 3.32Å; S1200-N1202 PolarHBondContact O-N 3.42Å
1203	Q	86.8	Confident	84.3	Confident	129 Å²	129	79.7 Å²	79.7	60%	0.603	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	2.9	173.8	-69.1	173.9	-0.7	0	0	113.2	I1199 S1200 I1201 L1205	I1199-Q1203 VanDerWaalsContact O-CG 3.31Å; I1199-Q1203 WeakPolarHBondContact O-CG 3.23Å; I1199-Q1203 PolarHBondContact O-N 2.85Å; I1199-Q1203 VanDerWaalsContact O-N 3.1Å; S1200-Q1203 CarbonylContact O-C 3.59Å; S1200-Q1203 WeakPolarHBondContact O-CA 3.35Å; S1200-Q1203 WeakPolarHBondContact O-CB 3.48Å; S1200-Q1203 PolarHBondContact O-N 3.41Å; I1201-Q1203 PolarHBondContact O-N 2.82Å; Q1203-L1205 VanDerWaalsContact C-N 3.27Å; Q1203-L1205 HydrophobicContact CB-CD1 4.2Å; Q1203-L1205 HydrophobicContact CB-CG 4.37Å; Q1203-L1205 PolarHBondContact O-N 3.01Å
1204	G	79.3	Confident	84.5	Confident	74 Å²	74	80.9 Å²	80.9	76%	0.763	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	14.8	-176.9	0	0	0	0	0	114.9	S1200 I1201	S1200-G1204 PolarHBondContact O-N 3.48Å; S1200-G1204 VanDerWaalsContact O-N 3.09Å; I1201-G1204 PolarHBondContact O-N 3.01Å
1205	L	81.5	Confident	84.8	Confident	101 Å²	101	81.6 Å²	81.6	53%	0.529	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-96.7	144.6	180	-66.5	169.5	0	0	0	111.2	S1200 Q1203	S1200-L1205 CarbonylContact C-O 3.57Å; S1200-L1205 PolarHBondContact O-N 3.4Å; Q1203-L1205 VanDerWaalsContact C-N 3.27Å; Q1203-L1205 HydrophobicContact CB-CD1 4.2Å; Q1203-L1205 HydrophobicContact CB-CG 4.37Å; Q1203-L1205 PolarHBondContact O-N 3.01Å
1206	T	78.5	Confident	85	Confident	129 Å²	129	79.9 Å²	79.9	79%	0.791	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-64.9	132.8	171.8	50.1	0	0	0	0	110.7
1207	P	77.7	Confident	84.9	Confident	51 Å²	51	78.9 Å²	78.9	33%	0.331	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-55.4	153.9	172.9	-25.8	34.7	0	0	0	112.9	W1193 A1197 I1201	W1193-P1207 HydrophobicContact CH2-CB 4.28Å; W1193-P1207 HydrophobicContact CZ2-CB 3.81Å; A1197-P1207 HydrophobicContact CB-CB 4.01Å; A1197-P1207 HydrophobicContact CB-CG 4.26Å; I1201-P1207 HydrophobicContact CD1-CG 4.05Å; I1201-P1207 HydrophobicContact CG1-CG 3.95Å
1208	Q	78.6	Confident	84.7	Confident	156 Å²	156	79.3 Å²	79.3	73%	0.729	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-65.4	152.7	169.1	-71.7	-172.3	-15.4	0	0	110.9	W1193 V1210	W1193-Q1208 WeakPolarHBondContact CZ2-O 3.14Å; W1193-Q1208 PolarHBondContact NE1-O 3.41Å; Q1208-V1210 PolarHBondContact O-N 3.43Å
1209	V	82	Confident	84.6	Confident	127 Å²	127	74 Å²	74	77%	0.77	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-60.4	134.5	175.5	-177.8	0	0	0	0	110.1	C1211	V1209-C1211 PolarHBondContact O-N 3.47Å
1210	V	85.5	Confident	84.3	Confident	37 Å²	37	71.1 Å²	71.1	22%	0.224	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-64.2	124.4	175.1	-178.1	0	0	0	0	109.1	L1142 V1187 W1193 Q1208	L1142-V1210 HydrophobicContact CD2-CG1 4.28Å; L1142-V1210 HydrophobicContact CD2-CG2 4.24Å; V1187-V1210 HydrophobicContact CB-CG1 4.4Å; V1187-V1210 HydrophobicContact CG1-CG1 3.62Å; V1187-V1210 HydrophobicContact CG2-CG1 4.01Å; W1193-V1210 HydrophobicContact CD2-CG2 4.19Å; W1193-V1210 HydrophobicContact CH2-CG2 4.12Å; W1193-V1210 HydrophobicContact CZ2-CG2 3.61Å; Q1208-V1210 PolarHBondContact O-N 3.43Å
1211	C	88	Confident	84.4	Confident	80 Å²	80	70 Å²	70	54%	0.541	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-90.4	126.2	176.2	-69.9	0	0	0	0	110.1	I1188 V1209	I1188-C1211 HydrophobicContact CB-CB 4.43Å; I1188-C1211 WeakPolarHBondContact CB-O 2.98Å; I1188-C1211 HydrophobicContact CD1-CB 4.24Å; I1188-C1211 WeakPolarHBondContact CG1-O 3.41Å; I1188-C1211 PolarHBondContact N-O 3.06Å; V1209-C1211 PolarHBondContact O-N 3.47Å
1212	T	90.6	Very high	84.1	Confident	63 Å²	63	68 Å²	68	39%	0.387	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	156.1	178.2	51.8	0	0	0	0	113	A1172 L1185 S1186 V1187	A1172-T1212 HydrophobicContact CB-CG2 4.2Å; L1185-T1212 HydrophobicContact CB-CG2 4.27Å; S1186-T1212 CarbonylContact O-C 3.25Å; S1186-T1212 WeakPolarHBondContact O-CA 3.4Å; V1187-T1212 HydrophobicContact CG2-CG2 4.39Å
1213	K	91.4	Very high	83.7	Confident	89 Å²	89	64.9 Å²	64.9	39%	0.387	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.6	171.7	168.9	-169.4	161.9	-146.5	0	107.2	E40 L1185 S1186 I1188 E1215	E40-K1213 IonicContact OE1-NZ 3.8Å; E40-K1213 PolarHBondContact OE1-NZ 2.92Å; L1185-K1213 CarbonylContact C-O 3.56Å; S1186-K1213 PolarHBondContact N-O 3.06Å; S1186-K1213 PolarHBondContact O-N 2.93Å; I1188-K1213 HydrophobicContact CD1-CB 4.23Å; I1188-K1213 HydrophobicContact CG1-CB 4.12Å; K1213-E1215 HydrophobicContact CD-CG 4.2Å; K1213-E1215 VanDerWaalsContact CD-OE1 3.3Å; K1213-E1215 WeakPolarHBondContact CD-OE1 3.49Å; K1213-E1215 WeakPolarHBondContact CE-OE1 3.42Å; K1213-E1215 HydrophobicContact CG-CG 4.31Å; K1213-E1215 IonicContact NZ-OE1 3.33Å; K1213-E1215 PolarHBondContact NZ-OE1 3.03Å
1214	Q	91.1	Very high	83.2	Confident	69 Å²	69	60.7 Å²	60.7	32%	0.322	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	126	172	-177.9	178.1	-17	0	0	109.6	L1185 M1216 L1242	L1185-Q1214 HydrophobicContact CD2-CB 4.28Å; Q1214-M1216 HydrophobicContact CG-CE 4.39Å; Q1214-M1216 HydrophobicContact CG-CG 4.33Å; Q1214-M1216 HydrophobicContact CG-SD 4.46Å; Q1214-M1216 PolarHBondContact NE2-SD 3.02Å; Q1214-L1242 HydrophobicContact CG-CD1 4.14Å
1215	E	90.4	Very high	83.1	Confident	22 Å²	22	58.9 Å²	58.9	10%	0.103	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.5	175.1	-78.2	164.2	-157	0	0	109.7	Y1171 A1183 A1184 S1186 K1213	Y1171-E1215 WeakPolarHBondContact CE1-OE2 3.36Å; Y1171-E1215 PolarHBondContact OH-OE2 3.4Å; A1183-E1215 CarbonylContact C-O 3.46Å; A1183-E1215 VanDerWaalsContact CA-O 3.28Å; A1183-E1215 WeakPolarHBondContact CA-O 3.05Å; A1184-E1215 PolarHBondContact N-O 3.18Å; A1184-E1215 PolarHBondContact O-N 2.88Å; S1186-E1215 WeakPolarHBondContact CB-OE1 3.27Å; S1186-E1215 WeakPolarHBondContact CB-OE2 3.3Å; S1186-E1215 PolarHBondContact OG-OE1 2.84Å; S1186-E1215 VanDerWaalsContact OG-OE1 3.06Å; K1213-E1215 HydrophobicContact CD-CG 4.2Å; K1213-E1215 VanDerWaalsContact CD-OE1 3.3Å; K1213-E1215 WeakPolarHBondContact CD-OE1 3.49Å; K1213-E1215 WeakPolarHBondContact CE-OE1 3.42Å; K1213-E1215 HydrophobicContact CG-CG 4.31Å; K1213-E1215 IonicContact NZ-OE1 3.33Å; K1213-E1215 PolarHBondContact NZ-OE1 3.03Å
1216	M	88.7	Confident	83.4	Confident	41 Å²	41	55.8 Å²	55.8	20%	0.202	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	109.6	-172.8	-65.4	170.2	-74.2	0	0	106.9	D39 Y1182 A1183 Q1214 L1219 I1221 V1222 V1238	D39-M1216 VanDerWaalsContact OD2-O 3.12Å; Y1182-M1216 CarbonylContact O-C 3.39Å; Y1182-M1216 WeakPolarHBondContact O-CA 3.5Å; A1183-M1216 HydrophobicContact CB-CB 4.48Å; A1183-M1216 HydrophobicContact CB-CG 3.9Å; Q1214-M1216 HydrophobicContact CG-CE 4.39Å; Q1214-M1216 HydrophobicContact CG-CG 4.33Å; Q1214-M1216 HydrophobicContact CG-SD 4.46Å; Q1214-M1216 PolarHBondContact NE2-SD 3.02Å; M1216-L1219 HydrophobicContact CB-CD1 4.35Å; M1216-I1221 HydrophobicContact CG-CD1 4.4Å; M1216-I1221 HydrophobicContact SD-CD1 3.5Å; M1216-I1221 VanDerWaalsContact SD-CD1 3.5Å; M1216-I1221 HydrophobicContact SD-CG1 4.31Å; M1216-V1222 HydrophobicContact CB-CG2 3.87Å; M1216-V1222 VanDerWaalsContact O-CG2 3.28Å; M1216-V1222 WeakPolarHBondContact O-CG2 3.29Å; M1216-V1238 HydrophobicContact CG-CG1 4.38Å; M1216-V1238 HydrophobicContact SD-CG1 4.36Å
1217	K	84.4	Confident	84	Confident	28 Å²	28	49.7 Å²	49.7	12%	0.122	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.6	179.5	-61.5	-156.9	-171.4	171.9	0	111.1	D38 K1180 K1181 Y1182 L1219	D38-K1217 WeakPolarHBondContact OD1-CD 3.37Å; D38-K1217 VanDerWaalsContact OD1-CE 3.3Å; D38-K1217 WeakPolarHBondContact OD1-CE 3.46Å; D38-K1217 IonicContact OD1-NZ 2.77Å; D38-K1217 PolarHBondContact OD1-NZ 3.08Å; K1180-K1217 CarbonylContact O-C 3.57Å; K1181-K1217 WeakPolarHBondContact CA-O 3.38Å; Y1182-K1217 HydrophobicContact CD1-CB 4.09Å; Y1182-K1217 HydrophobicContact CE1-CB 3.79Å; Y1182-K1217 HydrophobicContact CE1-CD 3.86Å; Y1182-K1217 HydrophobicContact CE1-CG 4.05Å; Y1182-K1217 HydrophobicContact CE2-CG 4.34Å; Y1182-K1217 PolarHBondContact N-O 2.86Å; Y1182-K1217 PolarHBondContact O-N 3.46Å; Y1182-K1217 VanDerWaalsContact O-O 3.11Å; Y1182-K1217 VanDerWaalsContact OH-CD 3.31Å; Y1182-K1217 WeakPolarHBondContact OH-CD 3.45Å; Y1182-K1217 VanDerWaalsContact OH-CE 3.23Å; Y1182-K1217 WeakPolarHBondContact OH-CE 3.01Å; Y1182-K1217 PolarHBondContact OH-NZ 2.91Å; K1217-L1219 PolarHBondContact O-N 2.86Å
1218	G	79.8	Confident	84.6	Confident	10 Å²	10	48.4 Å²	48.4	10%	0.103	25%	0.254	C	S	.	.	S	Bend	trans	64.9	-4.6	172.9	0	0	0	0	0	118.1
1219	L	82.2	Confident	85.3	Confident	5 Å²	5	41.2 Å²	41.2	3%	0.026	22%	0.22	C	C	.	.			trans	-69.2	153.4	179.4	-59.1	-176.7	0	0	0	111.9	L1177 K1181 A1183 M1216 K1217 I1221 V1222 R1223 V1238 L1385	L1177-L1219 HydrophobicContact CD1-CD2 3.59Å; L1177-L1219 HydrophobicContact CG-CD2 4.38Å; K1181-L1219 HydrophobicContact CB-CD2 4.19Å; A1183-L1219 HydrophobicContact CB-CD1 3.78Å; M1216-L1219 HydrophobicContact CB-CD1 4.35Å; K1217-L1219 PolarHBondContact O-N 2.86Å; L1219-I1221 HydrophobicContact CB-CD1 4.48Å; L1219-I1221 HydrophobicContact CB-CG1 3.81Å; L1219-I1221 HydrophobicContact CD1-CD1 4.04Å; L1219-I1221 HydrophobicContact CD1-CG1 4.27Å; L1219-I1221 PolarHBondContact O-N 3.01Å; L1219-V1222 HydrophobicContact CB-CG2 4.22Å; L1219-V1222 WeakPolarHBondContact O-CB 3.35Å; L1219-V1222 PolarHBondContact O-N 2.86Å; L1219-R1223 PolarHBondContact O-N 3.46Å; L1219-V1238 HydrophobicContact CD1-CG2 4.41Å; L1219-L1385 HydrophobicContact CD1-CD2 4.02Å; L1219-L1385 HydrophobicContact CD2-CD2 4.46Å
1220	D	81.3	Confident	85.7	Confident	31 Å²	31	35.2 Å²	35.2	17%	0.166	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-33.3	175.3	-62.1	-50.3	0	0	0	113	V1222 R1223 W1226 V1381 R1384	D1220-V1222 PolarHBondContact O-N 3.12Å; D1220-R1223 PolarHBondContact O-N 3.34Å; D1220-W1226 HydrophobicContact CB-CD2 4.23Å; D1220-W1226 HydrophobicContact CB-CG 4.2Å; D1220-W1226 PolarHBondContact OD1-NE1 2.83Å; D1220-W1226 VanDerWaalsContact OD1-NE1 3.16Å; D1220-V1381 HydrophobicContact CB-CB 4.44Å; D1220-V1381 HydrophobicContact CB-CG1 4.15Å; D1220-V1381 HydrophobicContact CB-CG2 3.7Å; D1220-R1384 IonicContact OD1-CZ 2.71Å; D1220-R1384 IonicContact OD1-NH2 3.26Å; D1220-R1384 PolarHBondContact OD1-NH2 3.16Å; D1220-R1384 IonicContact OD2-CZ 2.77Å; D1220-R1384 VanDerWaalsContact OD2-CZ 3.22Å; D1220-R1384 IonicContact OD2-NE 3.74Å; D1220-R1384 PolarHBondContact OD2-NE 3.08Å; D1220-R1384 IonicContact OD2-NH2 2.69Å; D1220-R1384 PolarHBondContact OD2-NH2 2.94Å
1221	I	84.8	Confident	86	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-9	178.9	66.4	179.5	0	0	0	114.9	M1216 L1219 I1231 R1235 V1238 V1381	M1216-I1221 HydrophobicContact CG-CD1 4.4Å; M1216-I1221 HydrophobicContact SD-CD1 3.5Å; M1216-I1221 VanDerWaalsContact SD-CD1 3.5Å; M1216-I1221 HydrophobicContact SD-CG1 4.31Å; L1219-I1221 HydrophobicContact CB-CD1 4.48Å; L1219-I1221 HydrophobicContact CB-CG1 3.81Å; L1219-I1221 HydrophobicContact CD1-CD1 4.04Å; L1219-I1221 HydrophobicContact CD1-CG1 4.27Å; L1219-I1221 PolarHBondContact O-N 3.01Å; I1221-I1231 HydrophobicContact CB-CG2 4.38Å; I1221-I1231 VanDerWaalsContact O-CG2 3.26Å; I1221-I1231 WeakPolarHBondContact O-CG2 3.39Å; I1221-R1235 HydrophobicContact CB-CG 4.36Å; I1221-R1235 HydrophobicContact CD1-CG 4.18Å; I1221-V1238 HydrophobicContact CD1-CB 4.35Å; I1221-V1238 HydrophobicContact CD1-CG2 3.69Å; I1221-V1381 HydrophobicContact CG2-CG1 3.78Å
1222	V	78.8	Confident	86.2	Confident	43 Å²	43	31.4 Å²	31.4	26%	0.261	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-32.9	175.2	-172.1	0	0	0	0	110	D39 M1216 L1219 D1220	D39-V1222 WeakPolarHBondContact OD1-CG1 3.46Å; M1216-V1222 HydrophobicContact CB-CG2 3.87Å; M1216-V1222 VanDerWaalsContact O-CG2 3.28Å; M1216-V1222 WeakPolarHBondContact O-CG2 3.29Å; L1219-V1222 HydrophobicContact CB-CG2 4.22Å; L1219-V1222 WeakPolarHBondContact O-CB 3.35Å; L1219-V1222 PolarHBondContact O-N 2.86Å; D1220-V1222 PolarHBondContact O-N 3.12Å
1223	R	76.8	Confident	86.4	Confident	76 Å²	76	28.4 Å²	28.4	29%	0.287	14%	0.141	S	C	.	.	S	Bend	trans	-63.1	162.3	174.1	-62	-179.5	62.6	104.4	-3.6	111.8	D34 L1219 D1220 D1225 I1231	D34-R1223 IonicContact OD2-CZ 3.56Å; D34-R1223 IonicContact OD2-NH1 3.8Å; D34-R1223 PolarHBondContact OD2-NH1 2.79Å; D34-R1223 VanDerWaalsContact OD2-NH1 3.07Å; D34-R1223 IonicContact OD2-NH2 2.88Å; D34-R1223 PolarHBondContact OD2-NH2 3.45Å; L1219-R1223 PolarHBondContact O-N 3.46Å; D1220-R1223 PolarHBondContact O-N 3.34Å; R1223-D1225 VanDerWaalsContact CB-OD1 3.28Å; R1223-D1225 WeakPolarHBondContact CB-OD1 3.49Å; R1223-D1225 IonicContact CZ-OD1 3.52Å; R1223-D1225 IonicContact CZ-OD2 3.91Å; R1223-D1225 IonicContact NE-OD1 3.35Å; R1223-D1225 PolarHBondContact NE-OD1 2.9Å; R1223-D1225 IonicContact NE-OD2 2.79Å; R1223-D1225 IonicContact NH2-OD1 3.4Å; R1223-D1225 IonicContact NH2-OD2 2.57Å; R1223-D1225 PolarHBondContact NH2-OD2 3.26Å; R1223-I1231 WeakPolarHBondContact O-CD1 3.42Å
1224	R	75.6	Confident	86.5	Confident	41 Å²	41	24.1 Å²	24.1	16%	0.155	12%	0.122	C	C	.	.	S	Bend	trans	-103.4	-16	-176.7	53	-179.5	159.8	-171	-11.1	114.2	D47 R754 W1226 T1278 M1280	D47-R1224 IonicContact OD2-NH2 3.54Å; D47-R1224 PolarHBondContact OD2-NH2 3.07Å; R754-R1224 HydrophobicContact CB-CB 4.4Å; R754-R1224 HydrophobicContact CG-CB 4.21Å; R754-R1224 WeakPolarHBondContact O-CD 3.4Å; R754-R1224 PolarHBondContact O-NH1 3.37Å; R1224-W1226 VanDerWaalsContact C-N 3.28Å; R1224-W1226 PolarHBondContact O-N 2.94Å; R1224-T1278 CarbonylContact C-O 3.51Å; R1224-T1278 CarbonylContact O-C 3.25Å; R1224-T1278 WeakPolarHBondContact O-CB 3.49Å; R1224-T1278 PolarHBondContact O-N 2.9Å; R1224-M1280 VanDerWaalsContact NH2-CE 3.33Å
1225	D	78.2	Confident	86.6	Confident	37 Å²	37	26.4 Å²	26.4	20%	0.198	13%	0.128	C	C	.	.	S	Bend	trans	-87.4	11.4	-179.5	58.6	-20.7	0	0	0	114.2	R1223 I1277	R1223-D1225 VanDerWaalsContact CB-OD1 3.28Å; R1223-D1225 WeakPolarHBondContact CB-OD1 3.49Å; R1223-D1225 IonicContact CZ-OD1 3.52Å; R1223-D1225 IonicContact CZ-OD2 3.91Å; R1223-D1225 IonicContact NE-OD1 3.35Å; R1223-D1225 PolarHBondContact NE-OD1 2.9Å; R1223-D1225 IonicContact NE-OD2 2.79Å; R1223-D1225 IonicContact NH2-OD1 3.4Å; R1223-D1225 IonicContact NH2-OD2 2.57Å; R1223-D1225 PolarHBondContact NH2-OD2 3.26Å; D1225-I1277 VanDerWaalsContact O-CG2 3.29Å; D1225-I1277 WeakPolarHBondContact O-CG2 3.41Å
1226	W	86.6	Confident	86.8	Confident	36 Å²	36	30 Å²	30	14%	0.136	14%	0.141	C	C	.	.	S	Bend	trans	-108.6	149.7	165.4	-65.4	87.9	0	0	0	110	D1220 R1224 A1230 I1231 H1376 P1380 V1381	D1220-W1226 HydrophobicContact CB-CD2 4.23Å; D1220-W1226 HydrophobicContact CB-CG 4.2Å; D1220-W1226 PolarHBondContact OD1-NE1 2.83Å; D1220-W1226 VanDerWaalsContact OD1-NE1 3.16Å; R1224-W1226 VanDerWaalsContact C-N 3.28Å; R1224-W1226 PolarHBondContact O-N 2.94Å; W1226-A1230 HydrophobicContact CB-CB 4.46Å; W1226-I1231 HydrophobicContact CB-CD1 4.35Å; W1226-I1231 HydrophobicContact CB-CG1 4.1Å; W1226-I1231 WeakPolarHBondContact O-CD1 3.35Å; W1226-H1376 WeakPolarHBondContact CZ3-O 3.44Å; W1226-P1380 HydrophobicContact CH2-CB 4.08Å; W1226-P1380 HydrophobicContact CZ3-CB 4.3Å; W1226-P1380 HydrophobicContact CZ3-CG 4.43Å; W1226-V1381 HydrophobicContact CD2-CG2 3.74Å; W1226-V1381 HydrophobicContact CE3-CG2 3.39Å; W1226-V1381 HydrophobicContact CG-CG2 4.43Å; W1226-V1381 HydrophobicContact CH2-CG2 4.25Å; W1226-V1381 HydrophobicContact CZ3-CG2 3.66Å
1227	S	91.6	Very high	87	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.132	C	C	.	.			trans	-65.3	151	-178.7	82.5	0	0	0	0	112.4	L1229 A1230 I1231 I1276	S1227-L1229 PolarHBondContact O-N 2.82Å; S1227-L1229 VanDerWaalsContact O-N 3.08Å; S1227-A1230 PolarHBondContact O-N 2.86Å; S1227-A1230 PolarHBondContact OG-N 3.18Å; S1227-I1231 WeakPolarHBondContact O-CG1 3.37Å; S1227-I1231 PolarHBondContact O-N 3.06Å; S1227-I1276 VanDerWaalsContact CA-O 3.32Å; S1227-I1276 WeakPolarHBondContact CA-O 3.48Å
1228	A	89.4	Confident	87.4	Confident	25 Å²	25	26.8 Å²	26.8	21%	0.207	13%	0.126	C	C	.	.	H	α-helix	trans	-52.6	-33.1	176.2	0	0	0	0	0	112.7	I1231 S1232 E1274 I1276	A1228-I1231 PolarHBondContact O-N 3.34Å; A1228-S1232 VanDerWaalsContact O-CB 3.28Å; A1228-S1232 WeakPolarHBondContact O-CB 3.35Å; A1228-S1232 PolarHBondContact O-N 3.47Å; A1228-S1232 PolarHBondContact O-OG 3.04Å; A1228-E1274 PolarHBondContact N-O 3.38Å; A1228-I1276 PolarHBondContact N-O 3.31Å
1229	L	93.5	Very high	88	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.021	14%	0.14	C	C	.	.	H	α-helix	trans	-66.3	-46.9	173.3	-173.7	58.2	0	0	0	114.1	S1227 I1231 S1232 V1233 T1261 V1265 L1270 E1274 F1275 I1378	S1227-L1229 PolarHBondContact O-N 2.82Å; S1227-L1229 VanDerWaalsContact O-N 3.08Å; L1229-I1231 PolarHBondContact O-N 3.11Å; L1229-S1232 WeakPolarHBondContact CA-OG 3.43Å; L1229-S1232 PolarHBondContact O-N 2.84Å; L1229-S1232 PolarHBondContact O-OG 3.48Å; L1229-V1233 HydrophobicContact CD1-CG2 4.16Å; L1229-V1233 WeakPolarHBondContact O-CB 3.47Å; L1229-V1233 VanDerWaalsContact O-CG2 3.26Å; L1229-V1233 WeakPolarHBondContact O-CG2 3.22Å; L1229-V1233 PolarHBondContact O-N 3.38Å; L1229-T1261 HydrophobicContact CD1-CG2 4.08Å; L1229-V1265 HydrophobicContact CD2-CG2 3.63Å; L1229-L1270 HydrophobicContact CD1-CD1 3.83Å; L1229-L1270 HydrophobicContact CD2-CD1 3.93Å; L1229-E1274 WeakPolarHBondContact CA-OE2 3.46Å; L1229-E1274 HydrophobicContact CB-CB 4.14Å; L1229-E1274 WeakPolarHBondContact CB-O 3.38Å; L1229-E1274 PolarHBondContact N-O 2.84Å; L1229-E1274 PolarHBondContact N-OE2 3.07Å; L1229-F1275 HydrophobicContact CD2-CD1 4.5Å; L1229-F1275 HydrophobicContact CD2-CE1 3.97Å; L1229-F1275 HydrophobicContact CD2-CZ 4.39Å; L1229-I1378 HydrophobicContact CD2-CD1 3.92Å; L1229-I1378 HydrophobicContact CG-CD1 4.02Å; L1229-I1378 HydrophobicContact CG-CG1 4.49Å
1230	A	91.9	Very high	88.4	Confident	2 Å²	2	28.7 Å²	28.7	2%	0.017	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-36.4	176.4	0	0	0	0	0	110.8	W1226 S1227 G1234 Q1377 V1381	W1226-A1230 HydrophobicContact CB-CB 4.46Å; S1227-A1230 PolarHBondContact O-N 2.86Å; S1227-A1230 PolarHBondContact OG-N 3.18Å; A1230-G1234 PolarHBondContact O-N 3.2Å; A1230-Q1377 HydrophobicContact CB-CB 4.11Å; A1230-Q1377 WeakPolarHBondContact CB-O 3.49Å; A1230-V1381 HydrophobicContact CB-CG2 4.37Å
1231	I	90.7	Very high	88.9	Confident	5 Å²	5	27.4 Å²	27.4	3%	0.026	13%	0.134	C	C	.	.	H	α-helix	trans	-68.5	-42.6	174.4	-61.7	174	0	0	0	111.3	I1221 R1223 W1226 S1227 A1228 L1229 R1235	I1221-I1231 HydrophobicContact CB-CG2 4.38Å; I1221-I1231 VanDerWaalsContact O-CG2 3.26Å; I1221-I1231 WeakPolarHBondContact O-CG2 3.39Å; R1223-I1231 WeakPolarHBondContact O-CD1 3.42Å; W1226-I1231 HydrophobicContact CB-CD1 4.35Å; W1226-I1231 HydrophobicContact CB-CG1 4.1Å; W1226-I1231 WeakPolarHBondContact O-CD1 3.35Å; S1227-I1231 WeakPolarHBondContact O-CG1 3.37Å; S1227-I1231 PolarHBondContact O-N 3.06Å; A1228-I1231 PolarHBondContact O-N 3.34Å; L1229-I1231 PolarHBondContact O-N 3.11Å; I1231-R1235 HydrophobicContact CG2-CG 4.47Å; I1231-R1235 WeakPolarHBondContact O-CB 3.46Å; I1231-R1235 WeakPolarHBondContact O-CG 3.47Å; I1231-R1235 PolarHBondContact O-N 2.76Å
1232	S	92.8	Very high	89.2	Confident	31 Å²	31	27.8 Å²	27.8	22%	0.217	14%	0.136	C	C	.	.	H	α-helix	trans	-70.9	-40.8	-178.3	74.2	0	0	0	0	111.9	A1228 L1229 R1236 E1274	A1228-S1232 VanDerWaalsContact O-CB 3.28Å; A1228-S1232 WeakPolarHBondContact O-CB 3.35Å; A1228-S1232 PolarHBondContact O-N 3.47Å; A1228-S1232 PolarHBondContact O-OG 3.04Å; L1229-S1232 WeakPolarHBondContact CA-OG 3.43Å; L1229-S1232 PolarHBondContact O-N 2.84Å; L1229-S1232 PolarHBondContact O-OG 3.48Å; S1232-R1236 WeakPolarHBondContact O-CG 3.29Å; S1232-R1236 PolarHBondContact O-N 3.38Å; S1232-E1274 PolarHBondContact OG-OE2 3.03Å; S1232-E1274 VanDerWaalsContact OG-OE2 3.06Å
1233	V	95	Very high	89.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-53	170.8	175.8	0	0	0	0	110.9	L1229 R1235 R1236 C1237 L1258 T1261 I1378 V1382	L1229-V1233 HydrophobicContact CD1-CG2 4.16Å; L1229-V1233 WeakPolarHBondContact O-CB 3.47Å; L1229-V1233 VanDerWaalsContact O-CG2 3.26Å; L1229-V1233 WeakPolarHBondContact O-CG2 3.22Å; L1229-V1233 PolarHBondContact O-N 3.38Å; V1233-R1235 VanDerWaalsContact C-N 3.27Å; V1233-R1235 PolarHBondContact O-N 2.81Å; V1233-R1236 WeakPolarHBondContact O-CA 3.17Å; V1233-R1236 WeakPolarHBondContact O-CB 3.24Å; V1233-R1236 PolarHBondContact O-N 2.79Å; V1233-C1237 PolarHBondContact O-N 3.4Å; V1233-C1237 PolarHBondContact O-SG 3.42Å; V1233-C1237 VanDerWaalsContact O-SG 3.42Å; V1233-L1258 HydrophobicContact CG1-CD2 4.12Å; V1233-T1261 HydrophobicContact CG2-CG2 3.77Å; V1233-I1378 HydrophobicContact CG1-CG2 4.07Å; V1233-V1382 HydrophobicContact CG1-CG2 3.97Å
1234	G	92.9	Very high	90	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-32.8	-177.2	0	0	0	0	0	113.3	A1230 C1237 V1238	A1230-G1234 PolarHBondContact O-N 3.2Å; G1234-C1237 WeakPolarHBondContact O-CB 3.24Å; G1234-C1237 PolarHBondContact O-N 3.09Å; G1234-V1238 WeakPolarHBondContact O-CG2 3.34Å; G1234-V1238 PolarHBondContact O-N 2.9Å
1235	R	93.7	Very high	90.5	Very high	117 Å²	117	29.7 Å²	29.7	44%	0.442	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-39.9	170.1	-77.1	171.8	-178.2	-164.2	-2.4	112.7	I1221 I1231 V1233 V1238 A1239	I1221-R1235 HydrophobicContact CB-CG 4.36Å; I1221-R1235 HydrophobicContact CD1-CG 4.18Å; I1231-R1235 HydrophobicContact CG2-CG 4.47Å; I1231-R1235 WeakPolarHBondContact O-CB 3.46Å; I1231-R1235 WeakPolarHBondContact O-CG 3.47Å; I1231-R1235 PolarHBondContact O-N 2.76Å; V1233-R1235 VanDerWaalsContact C-N 3.27Å; V1233-R1235 PolarHBondContact O-N 2.81Å; R1235-V1238 PolarHBondContact O-N 3.16Å; R1235-A1239 VanDerWaalsContact O-CB 3.32Å; R1235-A1239 WeakPolarHBondContact O-CB 3.49Å; R1235-A1239 PolarHBondContact O-N 2.94Å
1236	R	93.8	Very high	91	Very high	98 Å²	98	31.7 Å²	31.7	37%	0.37	19%	0.188	S	C	.	.	H	α-helix	trans	-65.3	-38.9	173	-66.5	-168.2	-49.8	-96.4	14.6	111.6	S1232 V1233 A1239 A1240 D1257 T1261	S1232-R1236 WeakPolarHBondContact O-CG 3.29Å; S1232-R1236 PolarHBondContact O-N 3.38Å; V1233-R1236 WeakPolarHBondContact O-CA 3.17Å; V1233-R1236 WeakPolarHBondContact O-CB 3.24Å; V1233-R1236 PolarHBondContact O-N 2.79Å; R1236-A1239 PolarHBondContact O-N 3.25Å; R1236-A1240 PolarHBondContact O-N 3.13Å; R1236-D1257 IonicContact CZ-OD1 2.77Å; R1236-D1257 IonicContact CZ-OD2 3.4Å; R1236-D1257 IonicContact NE-OD1 3.22Å; R1236-D1257 PolarHBondContact NE-OD1 3.47Å; R1236-D1257 IonicContact NE-OD2 2.73Å; R1236-D1257 PolarHBondContact NE-OD2 3.3Å; R1236-D1257 VanDerWaalsContact NH2-CG 3.28Å; R1236-D1257 IonicContact NH2-OD1 3.16Å; R1236-D1257 PolarHBondContact NH2-OD1 2.78Å; R1236-D1257 IonicContact NH2-OD2 3.72Å; R1236-D1257 PolarHBondContact NH2-OD2 3.08Å; R1236-D1257 VanDerWaalsContact NH2-OD2 3.08Å; R1236-T1261 PolarHBondContact NH2-OG1 3.34Å
1237	C	93.1	Very high	90.9	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-58.9	-55	171.8	-60.6	0	0	0	0	111.3	V1233 G1234 A1239 A1240 L1241 I1254 L1385	V1233-C1237 PolarHBondContact O-N 3.4Å; V1233-C1237 PolarHBondContact O-SG 3.42Å; V1233-C1237 VanDerWaalsContact O-SG 3.42Å; G1234-C1237 WeakPolarHBondContact O-CB 3.24Å; G1234-C1237 PolarHBondContact O-N 3.09Å; C1237-A1239 VanDerWaalsContact C-N 3.31Å; C1237-A1239 PolarHBondContact O-N 3.11Å; C1237-A1240 WeakPolarHBondContact O-CA 3.42Å; C1237-A1240 WeakPolarHBondContact O-CB 3.29Å; C1237-A1240 PolarHBondContact O-N 3.27Å; C1237-L1241 WeakPolarHBondContact O-CG 3.23Å; C1237-L1241 PolarHBondContact O-N 2.89Å; C1237-I1254 HydrophobicContact CB-CD1 4.44Å; C1237-L1385 HydrophobicContact CB-CD1 4.1Å
1238	V	92.3	Very high	90.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-38.5	-180	177.2	0	0	0	0	112.2	A1183 M1216 L1219 I1221 G1234 R1235 A1240 L1241 L1242 L1385	A1183-V1238 HydrophobicContact CB-CG1 3.59Å; M1216-V1238 HydrophobicContact CG-CG1 4.38Å; M1216-V1238 HydrophobicContact SD-CG1 4.36Å; L1219-V1238 HydrophobicContact CD1-CG2 4.41Å; I1221-V1238 HydrophobicContact CD1-CB 4.35Å; I1221-V1238 HydrophobicContact CD1-CG2 3.69Å; G1234-V1238 WeakPolarHBondContact O-CG2 3.34Å; G1234-V1238 PolarHBondContact O-N 2.9Å; R1235-V1238 PolarHBondContact O-N 3.16Å; V1238-A1240 VanDerWaalsContact C-N 3.3Å; V1238-A1240 PolarHBondContact O-N 2.92Å; V1238-L1241 PolarHBondContact O-N 3.24Å; V1238-L1242 HydrophobicContact CG1-CD1 3.76Å; V1238-L1242 HydrophobicContact CG1-CG 4.27Å; V1238-L1242 WeakPolarHBondContact O-CB 3.4Å; V1238-L1242 PolarHBondContact O-N 2.86Å; V1238-L1385 HydrophobicContact CG2-CD1 3.98Å; V1238-L1385 HydrophobicContact CG2-CD2 3.64Å; V1238-L1385 HydrophobicContact CG2-CG 4.41Å
1239	A	92.4	Very high	90.8	Very high	48 Å²	48	44.5 Å²	44.5	40%	0.397	25%	0.25	S	C	.	.	H	α-helix	trans	-65.9	-29.7	175.2	0	0	0	0	0	113.3	R1235 R1236 C1237 S1243	R1235-A1239 VanDerWaalsContact O-CB 3.32Å; R1235-A1239 WeakPolarHBondContact O-CB 3.49Å; R1235-A1239 PolarHBondContact O-N 2.94Å; R1236-A1239 PolarHBondContact O-N 3.25Å; C1237-A1239 VanDerWaalsContact C-N 3.31Å; C1237-A1239 PolarHBondContact O-N 3.11Å; A1239-S1243 PolarHBondContact O-N 2.96Å
1240	A	92	Very high	90.7	Very high	6 Å²	6	44.9 Å²	44.9	5%	0.05	25%	0.252	C	S	.	.	H	α-helix	trans	-74.6	-43.7	170.5	0	0	0	0	0	111.7	R1236 C1237 V1238 L1242 S1243 I1250 I1254	R1236-A1240 PolarHBondContact O-N 3.13Å; C1237-A1240 WeakPolarHBondContact O-CA 3.42Å; C1237-A1240 WeakPolarHBondContact O-CB 3.29Å; C1237-A1240 PolarHBondContact O-N 3.27Å; V1238-A1240 VanDerWaalsContact C-N 3.3Å; V1238-A1240 PolarHBondContact O-N 2.92Å; A1240-L1242 VanDerWaalsContact C-N 3.3Å; A1240-L1242 PolarHBondContact O-N 3.33Å; A1240-S1243 VanDerWaalsContact O-CB 3.25Å; A1240-S1243 WeakPolarHBondContact O-CB 3.41Å; A1240-S1243 PolarHBondContact O-N 2.95Å; A1240-S1243 VanDerWaalsContact O-N 3.15Å; A1240-S1243 PolarHBondContact O-OG 3.38Å; A1240-I1250 HydrophobicContact CB-CG2 4.35Å; A1240-I1250 VanDerWaalsContact O-CD1 3.3Å; A1240-I1250 WeakPolarHBondContact O-CD1 3.49Å; A1240-I1250 WeakPolarHBondContact O-CG1 3.35Å; A1240-I1254 HydrophobicContact CB-CD1 4.37Å; A1240-I1254 HydrophobicContact CB-CG1 4.18Å
1241	L	91.3	Very high	90.7	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-38.8	176.8	-64	-176.3	0	0	0	112.4	F952 L1175 C1237 V1238 I1250 I1254 V1386 I1389	F952-L1241 VanDerWaalsContact CE2-O 3.29Å; F952-L1241 WeakPolarHBondContact CE2-O 3.49Å; F952-L1241 VanDerWaalsContact CZ-O 3.3Å; F952-L1241 WeakPolarHBondContact CZ-O 3.15Å; L1175-L1241 HydrophobicContact CD2-CD1 3.62Å; C1237-L1241 WeakPolarHBondContact O-CG 3.23Å; C1237-L1241 PolarHBondContact O-N 2.89Å; V1238-L1241 PolarHBondContact O-N 3.24Å; L1241-I1250 HydrophobicContact CD2-CG2 3.61Å; L1241-I1254 HydrophobicContact CD2-CD1 3.72Å; L1241-I1254 HydrophobicContact CG-CD1 4.24Å; L1241-V1386 HydrophobicContact CD1-CG1 4.47Å; L1241-V1386 HydrophobicContact CD2-CG1 4.5Å; L1241-I1389 HydrophobicContact CD1-CD1 3.89Å; L1241-I1389 HydrophobicContact CD2-CD1 3.37Å; L1241-I1389 HydrophobicContact CG-CD1 4.2Å
1242	L	90.9	Very high	90.7	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.052	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	12.9	178.6	-63.3	176.5	0	0	0	113.6	F952 A1173 A1183 L1185 Q1214 V1238 A1240 G1244	F952-L1242 HydrophobicContact CE2-CD2 4.27Å; A1173-L1242 HydrophobicContact CB-CD2 4.05Å; A1183-L1242 HydrophobicContact CB-CD1 4.29Å; L1185-L1242 HydrophobicContact CD1-CB 4.32Å; L1185-L1242 WeakPolarHBondContact CD1-O 3.46Å; L1185-L1242 HydrophobicContact CD2-CB 4.18Å; L1185-L1242 HydrophobicContact CD2-CD1 4.25Å; L1185-L1242 HydrophobicContact CG-CB 4.03Å; L1185-L1242 HydrophobicContact CG-CD1 4.28Å; L1185-L1242 HydrophobicContact CG-CD2 4.42Å; L1185-L1242 HydrophobicContact CG-CG 4.48Å; Q1214-L1242 HydrophobicContact CG-CD1 4.14Å; V1238-L1242 HydrophobicContact CG1-CD1 3.76Å; V1238-L1242 HydrophobicContact CG1-CG 4.27Å; V1238-L1242 WeakPolarHBondContact O-CB 3.4Å; V1238-L1242 PolarHBondContact O-N 2.86Å; A1240-L1242 VanDerWaalsContact C-N 3.3Å; A1240-L1242 PolarHBondContact O-N 3.33Å; L1242-G1244 VanDerWaalsContact C-N 3.34Å; L1242-G1244 PolarHBondContact O-N 2.95Å
1243	S	88.3	Confident	90.8	Very high	50 Å²	50	55.6 Å²	55.6	35%	0.35	30%	0.296	S	S	.	.	S	Bend	trans	-72.4	-23.2	-176.2	63.8	0	0	0	0	114.7	A1239 A1240 E1245	A1239-S1243 PolarHBondContact O-N 2.96Å; A1240-S1243 VanDerWaalsContact O-CB 3.25Å; A1240-S1243 WeakPolarHBondContact O-CB 3.41Å; A1240-S1243 PolarHBondContact O-N 2.95Å; A1240-S1243 VanDerWaalsContact O-N 3.15Å; A1240-S1243 PolarHBondContact O-OG 3.38Å; S1243-E1245 VanDerWaalsContact C-N 3.29Å; S1243-E1245 WeakPolarHBondContact OG-CB 3.23Å; S1243-E1245 WeakPolarHBondContact OG-CG 3.36Å; S1243-E1245 PolarHBondContact OG-N 2.7Å; S1243-E1245 VanDerWaalsContact OG-N 3.13Å; S1243-E1245 PolarHBondContact OG-OE2 3.07Å
1244	G	83.3	Confident	90.7	Very high	77 Å²	77	55.9 Å²	55.9	79%	0.794	30%	0.298	S	S	*	.			trans	79	6.3	-168.1	0	0	0	0	0	114.4	L1242	L1242-G1244 VanDerWaalsContact C-N 3.34Å; L1242-G1244 PolarHBondContact O-N 2.95Å
1245	E	87.4	Confident	90.8	Very high	73 Å²	73	56.7 Å²	56.7	34%	0.341	30%	0.302	S	S	.	.			trans	-72.5	158.8	171.9	-64.9	170.5	156.5	0	0	111.2	S1243 I1250 R1253	S1243-E1245 VanDerWaalsContact C-N 3.29Å; S1243-E1245 WeakPolarHBondContact OG-CB 3.23Å; S1243-E1245 WeakPolarHBondContact OG-CG 3.36Å; S1243-E1245 PolarHBondContact OG-N 2.7Å; S1243-E1245 VanDerWaalsContact OG-N 3.13Å; S1243-E1245 PolarHBondContact OG-OE2 3.07Å; E1245-I1250 HydrophobicContact CB-CD1 4.19Å; E1245-I1250 HydrophobicContact CB-CG1 3.81Å; E1245-I1250 WeakPolarHBondContact O-CD1 3.43Å; E1245-R1253 IonicContact OE1-NH1 3.26Å; E1245-R1253 PolarHBondContact OE1-NH1 3.02Å; E1245-R1253 IonicContact OE2-CZ 3.99Å; E1245-R1253 IonicContact OE2-NH1 2.73Å; E1245-R1253 PolarHBondContact OE2-NH1 3.42Å
1246	P	87.4	Confident	90.9	Very high	79 Å²	79	54 Å²	54	51%	0.513	31%	0.305	S	S	.	.			trans	-58.6	142.4	172.5	-25.1	34.5	0	0	0	113	D1248 I1249 I1250	P1246-D1248 VanDerWaalsContact C-N 3.27Å; P1246-D1248 PolarHBondContact O-N 3.19Å; P1246-D1248 VanDerWaalsContact O-N 3.13Å; P1246-I1249 HydrophobicContact CB-CD1 4.44Å; P1246-I1249 HydrophobicContact CB-CG1 4.49Å; P1246-I1249 HydrophobicContact CG-CD1 4.17Å; P1246-I1249 PolarHBondContact O-N 3.14Å; P1246-I1250 PolarHBondContact O-N 3.01Å; P1246-I1250 VanDerWaalsContact O-N 3.11Å
1247	K	85.9	Confident	91	Very high	112 Å²	112	50.8 Å²	50.8	49%	0.487	30%	0.295	S	S	.	.	H	α-helix	trans	-49.1	-42.9	-175.5	-69.4	-177.5	178.3	-178.2	0	113.7	I1249 I1250 L1251	K1247-I1249 PolarHBondContact O-N 2.74Å; K1247-I1250 WeakPolarHBondContact O-CB 3.33Å; K1247-I1250 PolarHBondContact O-N 2.79Å; K1247-L1251 WeakPolarHBondContact O-CG 3.37Å; K1247-L1251 PolarHBondContact O-N 2.88Å
1248	D	87.3	Confident	91.1	Very high	124 Å²	124	50.8 Å²	50.8	66%	0.663	30%	0.295	S	S	*	.	H	α-helix	trans	-62.7	-44.9	-178.8	-47.2	-59.9	0	0	0	111.9	P1246 I1250 L1251 D1252	P1246-D1248 VanDerWaalsContact C-N 3.27Å; P1246-D1248 PolarHBondContact O-N 3.19Å; P1246-D1248 VanDerWaalsContact O-N 3.13Å; D1248-I1250 VanDerWaalsContact C-N 3.34Å; D1248-I1250 PolarHBondContact O-N 2.98Å; D1248-L1251 PolarHBondContact O-N 2.81Å; D1248-D1252 PolarHBondContact O-N 3.13Å
1249	I	91.6	Very high	91.2	Very high	94 Å²	94	53.6 Å²	53.6	48%	0.482	31%	0.312	S	S	.	.	H	α-helix	trans	-66.1	-38.9	179.4	-61.1	-178.4	0	0	0	110.4	P1246 K1247 R1253	P1246-I1249 HydrophobicContact CB-CD1 4.44Å; P1246-I1249 HydrophobicContact CB-CG1 4.49Å; P1246-I1249 HydrophobicContact CG-CD1 4.17Å; P1246-I1249 PolarHBondContact O-N 3.14Å; K1247-I1249 PolarHBondContact O-N 2.74Å; I1249-R1253 WeakPolarHBondContact O-CB 3.29Å; I1249-R1253 PolarHBondContact O-N 2.79Å
1250	I	90.8	Very high	91.4	Very high	11 Å²	11	56.2 Å²	56.2	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-45.6	174.7	-68.5	176.3	0	0	0	110.8	A1240 L1241 E1245 P1246 K1247 D1248 R1253 I1254	A1240-I1250 HydrophobicContact CB-CG2 4.35Å; A1240-I1250 VanDerWaalsContact O-CD1 3.3Å; A1240-I1250 WeakPolarHBondContact O-CD1 3.49Å; A1240-I1250 WeakPolarHBondContact O-CG1 3.35Å; L1241-I1250 HydrophobicContact CD2-CG2 3.61Å; E1245-I1250 HydrophobicContact CB-CD1 4.19Å; E1245-I1250 HydrophobicContact CB-CG1 3.81Å; E1245-I1250 WeakPolarHBondContact O-CD1 3.43Å; P1246-I1250 PolarHBondContact O-N 3.01Å; P1246-I1250 VanDerWaalsContact O-N 3.11Å; K1247-I1250 WeakPolarHBondContact O-CB 3.33Å; K1247-I1250 PolarHBondContact O-N 2.79Å; D1248-I1250 VanDerWaalsContact C-N 3.34Å; D1248-I1250 PolarHBondContact O-N 2.98Å; I1250-R1253 PolarHBondContact O-N 3.3Å; I1250-I1254 HydrophobicContact CG2-CD1 3.97Å; I1250-I1254 WeakPolarHBondContact O-CG1 3.45Å; I1250-I1254 PolarHBondContact O-N 3.3Å
1251	L	91.1	Very high	91.5	Very high	13 Å²	13	56.1 Å²	56.1	7%	0.068	32%	0.315	C	S	.	.	H	α-helix	trans	-67.4	-46.1	-179.8	-72.1	178.9	0	0	0	112.3	K1247 D1248 R1253 I1254 H1255 I1389 E1390 T1392	K1247-L1251 WeakPolarHBondContact O-CG 3.37Å; K1247-L1251 PolarHBondContact O-N 2.88Å; D1248-L1251 PolarHBondContact O-N 2.81Å; L1251-R1253 VanDerWaalsContact C-N 3.29Å; L1251-R1253 PolarHBondContact O-N 3.13Å; L1251-I1254 PolarHBondContact O-N 3.32Å; L1251-I1254 VanDerWaalsContact O-N 3.17Å; L1251-H1255 PolarHBondContact O-CD2 3.1Å; L1251-H1255 PolarHBondContact O-N 2.79Å; L1251-I1389 HydrophobicContact CD2-CG2 4.23Å; L1251-E1390 WeakPolarHBondContact CD1-O 3.34Å; L1251-T1392 HydrophobicContact CD2-CG2 3.94Å
1252	D	92.1	Very high	91.6	Very high	117 Å²	117	56 Å²	56	63%	0.626	31%	0.314	S	S	*	.	H	α-helix	trans	-57.8	-43	175.7	-85.8	-18.8	0	0	0	111.5	D1248 I1254 H1255 A1256	D1248-D1252 PolarHBondContact O-N 3.13Å; D1252-I1254 PolarHBondContact O-N 3.32Å; D1252-H1255 PolarHBondContact O-N 3.25Å; D1252-A1256 WeakPolarHBondContact O-CB 3.29Å; D1252-A1256 PolarHBondContact O-N 2.85Å
1253	R	93.7	Very high	91.8	Very high	133 Å²	133	60.6 Å²	60.6	50%	0.502	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-40.6	176.6	-174.9	178.8	-174.1	162.6	4.9	112.4	E1245 I1249 I1250 L1251 D1257	E1245-R1253 IonicContact OE1-NH1 3.26Å; E1245-R1253 PolarHBondContact OE1-NH1 3.02Å; E1245-R1253 IonicContact OE2-CZ 3.99Å; E1245-R1253 IonicContact OE2-NH1 2.73Å; E1245-R1253 PolarHBondContact OE2-NH1 3.42Å; I1249-R1253 WeakPolarHBondContact O-CB 3.29Å; I1249-R1253 PolarHBondContact O-N 2.79Å; I1250-R1253 PolarHBondContact O-N 3.3Å; L1251-R1253 VanDerWaalsContact C-N 3.29Å; L1251-R1253 PolarHBondContact O-N 3.13Å; R1253-D1257 PolarHBondContact O-N 3.24Å; R1253-D1257 VanDerWaalsContact O-N 3.13Å
1254	I	94.2	Very high	92	Very high	7 Å²	7	61.3 Å²	61.3	4%	0.036	33%	0.332	C	S	.	.	H	α-helix	trans	-68.2	-44.5	175	-70.6	168.2	0	0	0	110.8	C1237 A1240 L1241 I1250 L1251 D1252 A1256 D1257 L1258 V1382 V1386	C1237-I1254 HydrophobicContact CB-CD1 4.44Å; A1240-I1254 HydrophobicContact CB-CD1 4.37Å; A1240-I1254 HydrophobicContact CB-CG1 4.18Å; L1241-I1254 HydrophobicContact CD2-CD1 3.72Å; L1241-I1254 HydrophobicContact CG-CD1 4.24Å; I1250-I1254 HydrophobicContact CG2-CD1 3.97Å; I1250-I1254 WeakPolarHBondContact O-CG1 3.45Å; I1250-I1254 PolarHBondContact O-N 3.3Å; L1251-I1254 PolarHBondContact O-N 3.32Å; L1251-I1254 VanDerWaalsContact O-N 3.17Å; D1252-I1254 PolarHBondContact O-N 3.32Å; I1254-A1256 VanDerWaalsContact C-N 3.29Å; I1254-A1256 PolarHBondContact O-N 3.43Å; I1254-D1257 PolarHBondContact O-N 2.8Å; I1254-L1258 HydrophobicContact CG2-CD1 3.89Å; I1254-L1258 HydrophobicContact CG2-CG 4.33Å; I1254-L1258 WeakPolarHBondContact O-CB 3.36Å; I1254-L1258 VanDerWaalsContact O-CG 3.23Å; I1254-L1258 WeakPolarHBondContact O-CG 3.49Å; I1254-L1258 PolarHBondContact O-N 3.3Å; I1254-V1382 HydrophobicContact CG2-CG1 4.44Å; I1254-V1386 HydrophobicContact CD1-CG1 4.37Å
1255	H	94.9	Very high	92.5	Very high	17 Å²	17	57.9 Å²	57.9	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-37.4	179.8	-70.4	-164	0	0	0	111.3	L1251 D1252 T1259 T1392 R1396	L1251-H1255 PolarHBondContact O-CD2 3.1Å; L1251-H1255 PolarHBondContact O-N 2.79Å; D1252-H1255 PolarHBondContact O-N 3.25Å; H1255-T1259 PolarHBondContact O-N 3.37Å; H1255-T1259 PolarHBondContact O-OG1 2.82Å; H1255-T1392 PolarHBondContact NE2-OG1 2.84Å; H1255-R1396 VanDerWaalsContact CE1-CG 3.46Å; H1255-R1396 WeakPolarHBondContact CE1-CG 3.42Å; H1255-R1396 PolarHBondContact ND1-NE 2.89Å; H1255-R1396 VanDerWaalsContact ND1-NE 3.11Å
1256	A	95.1	Very high	92.8	Very high	61 Å²	61	59.8 Å²	59.8	50%	0.504	30%	0.3	S	S	.	.	H	α-helix	trans	-65.8	-49.8	174.3	0	0	0	0	0	112.9	D1252 I1254 L1258 T1259 E1260	D1252-A1256 WeakPolarHBondContact O-CB 3.29Å; D1252-A1256 PolarHBondContact O-N 2.85Å; I1254-A1256 VanDerWaalsContact C-N 3.29Å; I1254-A1256 PolarHBondContact O-N 3.43Å; A1256-L1258 VanDerWaalsContact C-N 3.33Å; A1256-L1258 PolarHBondContact O-N 3.36Å; A1256-T1259 WeakPolarHBondContact O-CB 3.42Å; A1256-T1259 PolarHBondContact O-N 3.45Å; A1256-T1259 VanDerWaalsContact O-N 3.12Å; A1256-E1260 PolarHBondContact O-N 2.83Å
1257	D	94.8	Very high	92.9	Very high	30 Å²	30	60.6 Å²	60.6	16%	0.16	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-34.8	-179.3	-177.6	39.7	0	0	0	112.9	R1236 R1253 I1254 T1261	R1236-D1257 IonicContact CZ-OD1 2.77Å; R1236-D1257 IonicContact CZ-OD2 3.4Å; R1236-D1257 IonicContact NE-OD1 3.22Å; R1236-D1257 PolarHBondContact NE-OD1 3.47Å; R1236-D1257 IonicContact NE-OD2 2.73Å; R1236-D1257 PolarHBondContact NE-OD2 3.3Å; R1236-D1257 VanDerWaalsContact NH2-CG 3.28Å; R1236-D1257 IonicContact NH2-OD1 3.16Å; R1236-D1257 PolarHBondContact NH2-OD1 2.78Å; R1236-D1257 IonicContact NH2-OD2 3.72Å; R1236-D1257 PolarHBondContact NH2-OD2 3.08Å; R1236-D1257 VanDerWaalsContact NH2-OD2 3.08Å; R1253-D1257 PolarHBondContact O-N 3.24Å; R1253-D1257 VanDerWaalsContact O-N 3.13Å; I1254-D1257 PolarHBondContact O-N 2.8Å; D1257-T1261 VanDerWaalsContact O-CB 3.23Å; D1257-T1261 WeakPolarHBondContact O-CB 3.44Å; D1257-T1261 PolarHBondContact O-N 3.11Å; D1257-T1261 PolarHBondContact O-OG1 3.41Å
1258	L	95.5	Very high	92.9	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-45.7	170.7	-71.3	169.2	0	0	0	111.6	V1233 I1254 A1256 T1261 A1262 I1378 V1382 I1397 C1400 L1401	V1233-L1258 HydrophobicContact CG1-CD2 4.12Å; I1254-L1258 HydrophobicContact CG2-CD1 3.89Å; I1254-L1258 HydrophobicContact CG2-CG 4.33Å; I1254-L1258 WeakPolarHBondContact O-CB 3.36Å; I1254-L1258 VanDerWaalsContact O-CG 3.23Å; I1254-L1258 WeakPolarHBondContact O-CG 3.49Å; I1254-L1258 PolarHBondContact O-N 3.3Å; A1256-L1258 VanDerWaalsContact C-N 3.33Å; A1256-L1258 PolarHBondContact O-N 3.36Å; L1258-T1261 PolarHBondContact O-N 2.96Å; L1258-A1262 VanDerWaalsContact O-CB 3.27Å; L1258-A1262 WeakPolarHBondContact O-CB 3.46Å; L1258-A1262 PolarHBondContact O-N 3.14Å; L1258-I1378 HydrophobicContact CD2-CG2 4.05Å; L1258-V1382 HydrophobicContact CD1-CG1 4.17Å; L1258-V1382 HydrophobicContact CD2-CB 4.42Å; L1258-V1382 HydrophobicContact CD2-CG1 4.15Å; L1258-V1382 HydrophobicContact CD2-CG2 4.07Å; L1258-I1397 HydrophobicContact CD1-CG2 4.23Å; L1258-C1400 HydrophobicContact CB-CB 4.06Å; L1258-C1400 HydrophobicContact CD1-CB 4.33Å; L1258-L1401 HydrophobicContact CB-CD2 4.21Å; L1258-L1401 HydrophobicContact CD2-CD2 3.94Å; L1258-L1401 HydrophobicContact CD2-CG 4.45Å
1259	T	95.8	Very high	92.9	Very high	59 Å²	59	59.3 Å²	59.3	36%	0.362	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-49	-179.6	-51.6	0	0	0	0	110.6	H1255 A1256 T1261 A1262 E1263 C1400	H1255-T1259 PolarHBondContact O-N 3.37Å; H1255-T1259 PolarHBondContact O-OG1 2.82Å; A1256-T1259 WeakPolarHBondContact O-CB 3.42Å; A1256-T1259 PolarHBondContact O-N 3.45Å; A1256-T1259 VanDerWaalsContact O-N 3.12Å; T1259-T1261 VanDerWaalsContact C-N 3.33Å; T1259-T1261 PolarHBondContact O-N 3.45Å; T1259-A1262 PolarHBondContact O-N 3.19Å; T1259-E1263 PolarHBondContact O-N 2.93Å; T1259-C1400 WeakPolarHBondContact CA-O 3.19Å
1260	E	95.2	Very high	92.7	Very high	103 Å²	103	56.9 Å²	56.9	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-62.4	-39.1	177.9	-162.4	-164.4	158.3	0	0	112	A1256 E1263 K1264	A1256-E1260 PolarHBondContact O-N 2.83Å; E1260-E1263 PolarHBondContact O-N 3.35Å; E1260-K1264 VanDerWaalsContact O-CG 3.32Å; E1260-K1264 WeakPolarHBondContact O-CG 3.34Å; E1260-K1264 PolarHBondContact O-N 2.85Å; E1260-K1264 WeakPolarHBondContact OE1-CE 3.28Å; E1260-K1264 IonicContact OE1-NZ 3.31Å; E1260-K1264 PolarHBondContact OE1-NZ 2.88Å; E1260-K1264 IonicContact OE2-NZ 2.71Å
1261	T	94.1	Very high	92.5	Very high	4 Å²	4	59.2 Å²	59.2	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-65.5	-44.6	175.2	-60.5	0	0	0	0	111.4	L1229 V1233 R1236 D1257 L1258 T1259 E1263 K1264 V1265 I1378	L1229-T1261 HydrophobicContact CD1-CG2 4.08Å; V1233-T1261 HydrophobicContact CG2-CG2 3.77Å; R1236-T1261 PolarHBondContact NH2-OG1 3.34Å; D1257-T1261 VanDerWaalsContact O-CB 3.23Å; D1257-T1261 WeakPolarHBondContact O-CB 3.44Å; D1257-T1261 PolarHBondContact O-N 3.11Å; D1257-T1261 PolarHBondContact O-OG1 3.41Å; L1258-T1261 PolarHBondContact O-N 2.96Å; T1259-T1261 VanDerWaalsContact C-N 3.33Å; T1259-T1261 PolarHBondContact O-N 3.45Å; T1261-E1263 PolarHBondContact O-N 2.68Å; T1261-K1264 PolarHBondContact O-N 2.91Å; T1261-K1264 VanDerWaalsContact O-N 3.12Å; T1261-V1265 HydrophobicContact CG2-CG2 4.37Å; T1261-V1265 WeakPolarHBondContact O-CG2 3.27Å; T1261-V1265 PolarHBondContact O-N 3.3Å; T1261-I1378 HydrophobicContact CG2-CD1 4.2Å
1262	A	93.9	Very high	92.2	Very high	2 Å²	2	60.9 Å²	60.9	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-67.8	-24.9	-179.5	0	0	0	0	0	112.9	L1258 T1259 R1266 L1374 L1401	L1258-A1262 VanDerWaalsContact O-CB 3.27Å; L1258-A1262 WeakPolarHBondContact O-CB 3.46Å; L1258-A1262 PolarHBondContact O-N 3.14Å; T1259-A1262 PolarHBondContact O-N 3.19Å; A1262-R1266 VanDerWaalsContact O-CG 3.32Å; A1262-R1266 WeakPolarHBondContact O-CG 3.45Å; A1262-R1266 PolarHBondContact O-N 2.88Å; A1262-R1266 PolarHBondContact O-NH1 3.07Å; A1262-L1374 HydrophobicContact CB-CD2 3.75Å; A1262-L1401 HydrophobicContact CB-CD2 4.04Å
1263	E	94.8	Very high	91.8	Very high	105 Å²	105	57.1 Å²	57.1	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-71.2	-48.8	165.4	-76.9	-169.1	-162.5	0	0	112.6	T1259 E1260 T1261 V1265 R1266 Q1267	T1259-E1263 PolarHBondContact O-N 2.93Å; E1260-E1263 PolarHBondContact O-N 3.35Å; T1261-E1263 PolarHBondContact O-N 2.68Å; E1263-V1265 VanDerWaalsContact C-N 3.3Å; E1263-V1265 PolarHBondContact O-N 3.23Å; E1263-R1266 PolarHBondContact O-N 2.7Å; E1263-Q1267 WeakPolarHBondContact O-CB 3.42Å; E1263-Q1267 VanDerWaalsContact O-CG 3.22Å; E1263-Q1267 WeakPolarHBondContact O-CG 3.2Å; E1263-Q1267 PolarHBondContact O-N 3.03Å
1264	K	93.8	Very high	91.6	Very high	65 Å²	65	53.3 Å²	53.3	28%	0.283	29%	0.287	S	S	.	.	H	α-helix	trans	-57.3	-40.8	179.1	-74	165.4	-177.3	163.3	0	112.6	E1260 T1261 G1268 K1269 L1270	E1260-K1264 VanDerWaalsContact O-CG 3.32Å; E1260-K1264 WeakPolarHBondContact O-CG 3.34Å; E1260-K1264 PolarHBondContact O-N 2.85Å; E1260-K1264 WeakPolarHBondContact OE1-CE 3.28Å; E1260-K1264 IonicContact OE1-NZ 3.31Å; E1260-K1264 PolarHBondContact OE1-NZ 2.88Å; E1260-K1264 IonicContact OE2-NZ 2.71Å; T1261-K1264 PolarHBondContact O-N 2.91Å; T1261-K1264 VanDerWaalsContact O-N 3.12Å; K1264-G1268 PolarHBondContact O-N 3.33Å; K1264-K1269 PolarHBondContact O-N 3.36Å; K1264-K1269 VanDerWaalsContact O-N 3.09Å; K1264-L1270 HydrophobicContact CB-CD1 4.36Å; K1264-L1270 HydrophobicContact CB-CD2 4.29Å; K1264-L1270 HydrophobicContact CB-CG 4.17Å
1265	V	93.1	Very high	91.5	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.03	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-53.9	174.9	176.3	0	0	0	0	110.6	L1229 T1261 E1263 Q1267 G1268 L1270 F1275 V1370	L1229-V1265 HydrophobicContact CD2-CG2 3.63Å; T1261-V1265 HydrophobicContact CG2-CG2 4.37Å; T1261-V1265 WeakPolarHBondContact O-CG2 3.27Å; T1261-V1265 PolarHBondContact O-N 3.3Å; E1263-V1265 VanDerWaalsContact C-N 3.3Å; E1263-V1265 PolarHBondContact O-N 3.23Å; V1265-Q1267 PolarHBondContact O-N 3.05Å; V1265-G1268 PolarHBondContact O-N 3.26Å; V1265-L1270 HydrophobicContact CG2-CD1 3.65Å; V1265-F1275 HydrophobicContact CG1-CE1 4.15Å; V1265-F1275 HydrophobicContact CG1-CZ 4.33Å; V1265-V1370 HydrophobicContact CG1-CB 4.33Å; V1265-V1370 HydrophobicContact CG1-CG1 3.87Å; V1265-V1370 HydrophobicContact CG1-CG2 4.07Å
1266	R	92.8	Very high	91.2	Very high	113 Å²	113	53.9 Å²	53.9	43%	0.426	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-31.1	179.7	-75.3	179.1	-178.9	93.2	-3.3	113.4	A1262 E1263 G1268 V1370 L1401 G1402	A1262-R1266 VanDerWaalsContact O-CG 3.32Å; A1262-R1266 WeakPolarHBondContact O-CG 3.45Å; A1262-R1266 PolarHBondContact O-N 2.88Å; A1262-R1266 PolarHBondContact O-NH1 3.07Å; E1263-R1266 PolarHBondContact O-N 2.7Å; R1266-G1268 VanDerWaalsContact C-N 3.3Å; R1266-V1370 HydrophobicContact CG-CG1 3.93Å; R1266-L1401 PolarHBondContact NH1-O 2.88Å; R1266-L1401 PolarHBondContact NH2-O 3.19Å; R1266-G1402 PolarHBondContact NH2-O 3.34Å
1267	Q	90.8	Very high	91	Very high	96 Å²	96	51 Å²	51	45%	0.449	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1	178.5	-67.1	170.6	28.3	0	0	113.5	E1263 V1265 K1269	E1263-Q1267 WeakPolarHBondContact O-CB 3.42Å; E1263-Q1267 VanDerWaalsContact O-CG 3.22Å; E1263-Q1267 WeakPolarHBondContact O-CG 3.2Å; E1263-Q1267 PolarHBondContact O-N 3.03Å; V1265-Q1267 PolarHBondContact O-N 3.05Å; Q1267-K1269 HydrophobicContact CB-CD 4.08Å; Q1267-K1269 HydrophobicContact CB-CG 4.04Å; Q1267-K1269 PolarHBondContact O-N 3.01Å
1268	G	86.2	Confident	90.6	Very high	65 Å²	65	50.1 Å²	50.1	67%	0.67	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	25.1	-179.6	0	0	0	0	0	114.2	K1264 V1265 R1266	K1264-G1268 PolarHBondContact O-N 3.33Å; V1265-G1268 PolarHBondContact O-N 3.26Å; R1266-G1268 VanDerWaalsContact C-N 3.3Å
1269	K	86.8	Confident	90.1	Very high	145 Å²	145	53.9 Å²	53.9	63%	0.63	28%	0.278	S	S	*	.			trans	-86.3	-3.8	-173.7	-76.6	178.7	173.4	169.7	0	114.7	K1264 Q1267	K1264-K1269 PolarHBondContact O-N 3.36Å; K1264-K1269 VanDerWaalsContact O-N 3.09Å; Q1267-K1269 HydrophobicContact CB-CD 4.08Å; Q1267-K1269 HydrophobicContact CB-CG 4.04Å; Q1267-K1269 PolarHBondContact O-N 3.01Å
1270	L	86.5	Confident	89.5	Confident	42 Å²	42	52.1 Å²	52.1	22%	0.22	27%	0.266	C	S	.	.	S	Bend	trans	-100.3	143.4	-177.8	-62.5	175.2	0	0	0	110.8	L1229 K1264 V1265 F1275	L1229-L1270 HydrophobicContact CD1-CD1 3.83Å; L1229-L1270 HydrophobicContact CD2-CD1 3.93Å; K1264-L1270 HydrophobicContact CB-CD1 4.36Å; K1264-L1270 HydrophobicContact CB-CD2 4.29Å; K1264-L1270 HydrophobicContact CB-CG 4.17Å; V1265-L1270 HydrophobicContact CG2-CD1 3.65Å; L1270-F1275 HydrophobicContact CB-CE2 3.82Å; L1270-F1275 HydrophobicContact CB-CZ 4.11Å; L1270-F1275 HydrophobicContact CD1-CZ 4.24Å
1271	P	87	Confident	89	Confident	60 Å²	60	47.2 Å²	47.2	39%	0.39	24%	0.243	S	C	.	.			trans	-69.4	155.7	177.2	31.1	-35.8	0	0	0	111.4	S1273 E1274 F1275	P1271-S1273 PolarHBondContact O-N 3.37Å; P1271-S1273 VanDerWaalsContact O-N 3.13Å; P1271-E1274 HydrophobicContact CG-CG 4.07Å; P1271-E1274 PolarHBondContact O-N 2.89Å; P1271-E1274 VanDerWaalsContact O-N 3.13Å; P1271-F1275 WeakPolarHBondContact O-CD2 3.34Å
1272	I	84.8	Confident	88.3	Confident	48 Å²	48	51.2 Å²	51.2	25%	0.246	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-57.8	-30.1	-178.9	-60.6	176.4	0	0	0	111.8	E1274 F1275 V1327 L1347 L1351	I1272-E1274 VanDerWaalsContact C-N 3.28Å; I1272-E1274 PolarHBondContact O-N 2.93Å; I1272-F1275 PolarHBondContact O-N 3.18Å; I1272-V1327 HydrophobicContact CG2-CG2 4.46Å; I1272-L1347 HydrophobicContact CD1-CD2 4.43Å; I1272-L1347 HydrophobicContact CG2-CD2 4.24Å; I1272-L1351 HydrophobicContact CD1-CD1 4.3Å
1273	S	83.9	Confident	87.7	Confident	39 Å²	39	54.9 Å²	54.9	27%	0.273	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-56.4	-34.2	177.1	44.8	0	0	0	0	114.3	P1271 F1275 I1276	P1271-S1273 PolarHBondContact O-N 3.37Å; P1271-S1273 VanDerWaalsContact O-N 3.13Å; S1273-F1275 PolarHBondContact O-N 2.86Å; S1273-I1276 PolarHBondContact O-N 2.91Å
1274	E	88.7	Confident	87.2	Confident	52 Å²	52	51.5 Å²	51.5	24%	0.243	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-65.8	-23.4	175.9	-73.2	-74	159.1	0	0	112.1	A1228 L1229 S1232 P1271 I1272	A1228-E1274 PolarHBondContact N-O 3.38Å; L1229-E1274 WeakPolarHBondContact CA-OE2 3.46Å; L1229-E1274 HydrophobicContact CB-CB 4.14Å; L1229-E1274 WeakPolarHBondContact CB-O 3.38Å; L1229-E1274 PolarHBondContact N-O 2.84Å; L1229-E1274 PolarHBondContact N-OE2 3.07Å; S1232-E1274 PolarHBondContact OG-OE2 3.03Å; S1232-E1274 VanDerWaalsContact OG-OE2 3.06Å; P1271-E1274 HydrophobicContact CG-CG 4.07Å; P1271-E1274 PolarHBondContact O-N 2.89Å; P1271-E1274 VanDerWaalsContact O-N 3.13Å; I1272-E1274 VanDerWaalsContact C-N 3.28Å; I1272-E1274 PolarHBondContact O-N 2.93Å
1275	F	92.2	Very high	86.8	Confident	8 Å²	8	48.4 Å²	48.4	4%	0.035	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-94.5	-6.8	-177.8	-59.5	-84	0	0	0	114.1	L1229 V1265 L1270 P1271 I1272 S1273 I1277 V1327 I1368 Y1373	L1229-F1275 HydrophobicContact CD2-CD1 4.5Å; L1229-F1275 HydrophobicContact CD2-CE1 3.97Å; L1229-F1275 HydrophobicContact CD2-CZ 4.39Å; V1265-F1275 HydrophobicContact CG1-CE1 4.15Å; V1265-F1275 HydrophobicContact CG1-CZ 4.33Å; L1270-F1275 HydrophobicContact CB-CE2 3.82Å; L1270-F1275 HydrophobicContact CB-CZ 4.11Å; L1270-F1275 HydrophobicContact CD1-CZ 4.24Å; P1271-F1275 WeakPolarHBondContact O-CD2 3.34Å; I1272-F1275 PolarHBondContact O-N 3.18Å; S1273-F1275 PolarHBondContact O-N 2.86Å; F1275-I1277 PolarHBondContact O-N 2.93Å; F1275-V1327 HydrophobicContact CB-CG1 4.07Å; F1275-I1368 HydrophobicContact CD1-CG2 3.76Å; F1275-I1368 HydrophobicContact CD2-CD1 3.73Å; F1275-I1368 HydrophobicContact CE1-CG2 3.99Å; F1275-I1368 HydrophobicContact CE2-CD1 4Å; F1275-I1368 HydrophobicContact CG-CD1 4.07Å; F1275-I1368 HydrophobicContact CG-CG2 4.12Å; F1275-Y1373 HydrophobicContact CB-CE1 4.07Å; F1275-Y1373 HydrophobicContact CB-CE2 4.33Å; F1275-Y1373 AromaticContact CD1-CD1 3.89Å; F1275-Y1373 HydrophobicContact CD1-CD1 3.89Å; F1275-Y1373 AromaticContact CD1-CD2 3.75Å; F1275-Y1373 HydrophobicContact CD1-CD2 3.75Å; F1275-Y1373 HydrophobicContact CD1-CE1 4.07Å; F1275-Y1373 AromaticContact CD1-CE2 3.97Å; F1275-Y1373 HydrophobicContact CD1-CE2 3.97Å; F1275-Y1373 AromaticContact CD1-CG 3.73Å; F1275-Y1373 HydrophobicContact CD1-CG 3.73Å; F1275-Y1373 HydrophobicContact CE1-CD2 4.35Å; F1275-Y1373 HydrophobicContact CE1-CG 4.25Å; F1275-Y1373 VanDerWaalsContact O-CE1 3.28Å; F1275-Y1373 WeakPolarHBondContact O-CE1 3.33Å; F1275-Y1373 VanDerWaalsContact O-CZ 3.3Å; F1275-Y1373 PolarHBondContact O-OH 2.74Å
1276	I	90	Very high	86.5	Confident	28 Å²	28	53 Å²	53	14%	0.144	28%	0.276	C	S	.	.			trans	-67.9	131.2	-179.5	-59.8	-179.9	0	0	0	110.5	S1227 A1228 S1273 E1325 V1327 P1344	S1227-I1276 VanDerWaalsContact CA-O 3.32Å; S1227-I1276 WeakPolarHBondContact CA-O 3.48Å; A1228-I1276 PolarHBondContact N-O 3.31Å; S1273-I1276 PolarHBondContact O-N 2.91Å; I1276-E1325 HydrophobicContact CG2-CB 3.79Å; I1276-E1325 HydrophobicContact CG2-CG 3.88Å; I1276-V1327 HydrophobicContact CG1-CG2 4.18Å; I1276-P1344 HydrophobicContact CD1-CB 4.36Å; I1276-P1344 HydrophobicContact CD1-CG 3.82Å; I1276-P1344 HydrophobicContact CG1-CG 3.96Å
1277	I	90.2	Very high	86	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	137.6	170.9	-56.6	170.4	0	0	0	108.2	D1225 F1275 E1325 Y1326 Y1372 Y1373 Q1377	D1225-I1277 VanDerWaalsContact O-CG2 3.29Å; D1225-I1277 WeakPolarHBondContact O-CG2 3.41Å; F1275-I1277 PolarHBondContact O-N 2.93Å; I1277-E1325 WeakPolarHBondContact O-CA 3.49Å; I1277-Y1326 HydrophobicContact CB-CD1 4.48Å; I1277-Y1326 HydrophobicContact CB-CD2 4.44Å; I1277-Y1326 HydrophobicContact CB-CE1 4.09Å; I1277-Y1326 HydrophobicContact CB-CE2 4.04Å; I1277-Y1326 HydrophobicContact CD1-CE2 4.07Å; I1277-Y1326 HydrophobicContact CG2-CE1 3.84Å; I1277-Y1326 HydrophobicContact CG2-CE2 4.17Å; I1277-Y1326 WeakPolarHBondContact CG2-OH 3.5Å; I1277-Y1326 PolarHBondContact N-O 2.7Å; I1277-Y1326 WeakPolarHBondContact O-CD1 3.4Å; I1277-Y1326 PolarHBondContact O-N 3.11Å; I1277-Y1372 HydrophobicContact CD1-CE1 4.11Å; I1277-Y1373 HydrophobicContact CD1-CE1 4.17Å; I1277-Y1373 HydrophobicContact CG1-CE1 4.41Å; I1277-Q1377 HydrophobicContact CD1-CG 4.48Å
1278	T	86.3	Confident	85.5	Confident	13 Å²	13	47.4 Å²	47.4	8%	0.08	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	105	-166.1	-55.8	0	0	0	0	111.2	T755 R1224 T1323 E1325	T755-T1278 HydrophobicContact CG2-CG2 3.85Å; R1224-T1278 CarbonylContact C-O 3.51Å; R1224-T1278 CarbonylContact O-C 3.25Å; R1224-T1278 WeakPolarHBondContact O-CB 3.49Å; R1224-T1278 PolarHBondContact O-N 2.9Å; T1278-T1323 HydrophobicContact CG2-CG2 3.42Å; T1278-T1323 VanDerWaalsContact CG2-CG2 3.42Å; T1278-E1325 HydrophobicContact CG2-CG 4.49Å
1279	K	85.4	Confident	85.1	Confident	79 Å²	79	49 Å²	49	34%	0.343	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.3	-179	-168.9	162.7	172.9	166.9	0	113.1	H1296 V1324 Y1326	K1279-H1296 HydrophobicContact CB-CB 4.13Å; K1279-H1296 WeakPolarHBondContact CD-NE2 3.27Å; K1279-H1296 WeakPolarHBondContact CE-NE2 3.3Å; K1279-V1324 PolarHBondContact N-O 3.26Å; K1279-V1324 PolarHBondContact O-N 3.49Å; K1279-Y1326 HydrophobicContact CB-CE1 4.24Å
1280	M	83.9	Confident	84.7	Confident	23 Å²	23	44.8 Å²	44.8	11%	0.113	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.9	-177.4	179.8	179.6	60.5	0	0	111.4	R49 R1224 T1323	R49-M1280 PolarHBondContact NH2-SD 2.76Å; R1224-M1280 VanDerWaalsContact NH2-CE 3.33Å; M1280-T1323 HydrophobicContact CB-CG2 4.43Å
1281	L	84.4	Confident	84.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.237	C	C	.	.			trans	-73.1	128.4	173.6	-68.2	164.7	0	0	0	110.4	R49 P1285 Y1288 V1297 A1300 L1318 R1319 G1321 D1322 V1324	R49-L1281 PolarHBondContact NH2-O 3Å; L1281-P1285 HydrophobicContact CD1-CG 3.79Å; L1281-P1285 HydrophobicContact CD2-CG 4.33Å; L1281-Y1288 HydrophobicContact CD2-CE2 4.04Å; L1281-V1297 HydrophobicContact CD2-CG2 4.25Å; L1281-A1300 HydrophobicContact CD1-CB 4.12Å; L1281-A1300 HydrophobicContact CD2-CB 4.36Å; L1281-L1318 HydrophobicContact CD1-CB 4Å; L1281-R1319 WeakPolarHBondContact CD1-O 3.36Å; L1281-G1321 WeakPolarHBondContact O-CA 3.35Å; L1281-G1321 PolarHBondContact O-N 3.42Å; L1281-D1322 PolarHBondContact N-O 2.77Å; L1281-V1324 HydrophobicContact CD1-CG2 3.71Å; L1281-V1324 HydrophobicContact CD2-CG2 4.24Å; L1281-V1324 HydrophobicContact CG-CG2 3.72Å
1282	T	79.3	Confident	83.8	Confident	88 Å²	88	48.5 Å²	48.5	54%	0.54	25%	0.252	S	S	.	.	S	Bend	trans	-85.8	-40	172.4	48.4	0	0	0	0	111.7	Y1288	T1282-Y1288 PolarHBondContact N-OH 2.77Å; T1282-Y1288 PolarHBondContact OG1-OH 2.64Å
1283	K	81.6	Confident	83.4	Confident	79 Å²	79	48.5 Å²	48.5	34%	0.343	26%	0.257	S	S	.	.	S	Bend	trans	-115.3	-179.8	173.7	-54.5	-162.4	172.8	-147.3	0	110.9	D1287 Y1288 A1320	K1283-D1287 HydrophobicContact CB-CB 4.01Å; K1283-D1287 HydrophobicContact CD-CB 4.38Å; K1283-Y1288 HydrophobicContact CB-CD2 4.47Å; K1283-Y1288 HydrophobicContact CB-CE2 3.96Å; K1283-Y1288 PolarHBondContact N-OH 2.96Å; K1283-Y1288 VanDerWaalsContact N-OH 3.13Å; K1283-A1320 WeakPolarHBondContact O-CA 3.48Å; K1283-A1320 PolarHBondContact O-N 2.98Å
1284	N	83.1	Confident	83.3	Confident	33 Å²	33	48.6 Å²	48.6	18%	0.176	25%	0.253	C	S	.	.			trans	-71	150.1	169.7	-49.3	-70.2	0	0	0	109.2	E1286 D1287 Y1288 R1319 A1320	N1284-E1286 PolarHBondContact O-N 3Å; N1284-D1287 WeakPolarHBondContact CA-OD2 3.49Å; N1284-D1287 WeakPolarHBondContact CB-OD2 3.08Å; N1284-D1287 PolarHBondContact N-OD2 2.83Å; N1284-D1287 PolarHBondContact ND2-OD2 2.62Å; N1284-D1287 PolarHBondContact O-N 2.84Å; N1284-Y1288 WeakPolarHBondContact O-CD2 3.46Å; N1284-Y1288 WeakPolarHBondContact O-CE2 3.28Å; N1284-R1319 WeakPolarHBondContact OD1-CB 3.44Å; N1284-A1320 PolarHBondContact OD1-N 3.19Å
1285	P	85.8	Confident	83.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-53.5	-29.8	-177.9	-28.5	36.1	0	0	0	114.4	L1281 V1297 A1300 L1301 L1318	L1281-P1285 HydrophobicContact CD1-CG 3.79Å; L1281-P1285 HydrophobicContact CD2-CG 4.33Å; P1285-V1297 HydrophobicContact CB-CG1 4.5Å; P1285-V1297 WeakPolarHBondContact O-CG1 3.32Å; P1285-A1300 HydrophobicContact CB-CB 3.91Å; P1285-A1300 HydrophobicContact CG-CB 3.55Å; P1285-L1301 HydrophobicContact CB-CD2 3.82Å; P1285-L1301 HydrophobicContact CB-CG 3.85Å; P1285-L1318 WeakPolarHBondContact CD-O 3.33Å
1286	E	85.7	Confident	83.1	Confident	101 Å²	101	46.7 Å²	46.7	47%	0.472	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-74.1	-23.2	179.6	-61.5	76.6	-169.2	0	0	113.5	N1284 Y1288 L1301 N1304	N1284-E1286 PolarHBondContact O-N 3Å; E1286-Y1288 PolarHBondContact O-N 3.21Å; E1286-L1301 HydrophobicContact CG-CD2 4.1Å; E1286-N1304 PolarHBondContact OE1-ND2 2.94Å
1287	D	82.9	Confident	83.1	Confident	64 Å²	64	45.4 Å²	45.4	34%	0.342	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-88.9	0.6	-172.7	-42.5	-28.2	0	0	0	113.3	K1283 N1284 S1289	K1283-D1287 HydrophobicContact CB-CB 4.01Å; K1283-D1287 HydrophobicContact CD-CB 4.38Å; N1284-D1287 WeakPolarHBondContact CA-OD2 3.49Å; N1284-D1287 WeakPolarHBondContact CB-OD2 3.08Å; N1284-D1287 PolarHBondContact N-OD2 2.83Å; N1284-D1287 PolarHBondContact ND2-OD2 2.62Å; N1284-D1287 PolarHBondContact O-N 2.84Å; D1287-S1289 PolarHBondContact O-N 2.93Å
1288	Y	80.3	Confident	83.1	Confident	28 Å²	28	47 Å²	47	11%	0.11	25%	0.246	C	C	.	.			trans	-86.1	106.1	-176.7	-78.2	-90.2	0	0	0	111.9	L1281 T1282 K1283 N1284 E1286 D1290 A1291 V1297	L1281-Y1288 HydrophobicContact CD2-CE2 4.04Å; T1282-Y1288 PolarHBondContact N-OH 2.77Å; T1282-Y1288 PolarHBondContact OG1-OH 2.64Å; K1283-Y1288 HydrophobicContact CB-CD2 4.47Å; K1283-Y1288 HydrophobicContact CB-CE2 3.96Å; K1283-Y1288 PolarHBondContact N-OH 2.96Å; K1283-Y1288 VanDerWaalsContact N-OH 3.13Å; N1284-Y1288 WeakPolarHBondContact O-CD2 3.46Å; N1284-Y1288 WeakPolarHBondContact O-CE2 3.28Å; E1286-Y1288 PolarHBondContact O-N 3.21Å; Y1288-D1290 PolarHBondContact O-N 3Å; Y1288-D1290 VanDerWaalsContact O-N 3.13Å; Y1288-A1291 WeakPolarHBondContact O-CB 3.33Å; Y1288-A1291 PolarHBondContact O-N 3.36Å; Y1288-A1291 VanDerWaalsContact O-N 3.12Å; Y1288-V1297 HydrophobicContact CD1-CG2 4.02Å; Y1288-V1297 HydrophobicContact CD2-CG1 3.73Å; Y1288-V1297 HydrophobicContact CD2-CG2 3.92Å; Y1288-V1297 HydrophobicContact CE1-CG2 4.08Å; Y1288-V1297 HydrophobicContact CE2-CG1 4.44Å; Y1288-V1297 HydrophobicContact CE2-CG2 3.97Å; Y1288-V1297 HydrophobicContact CG-CG1 3.9Å; Y1288-V1297 HydrophobicContact CG-CG2 3.94Å
1289	S	78.5	Confident	83.2	Confident	98 Å²	98	46.4 Å²	46.4	69%	0.685	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-29.7	174	52.5	0	0	0	0	113.8	T933 D1287	T933-S1289 PolarHBondContact OG1-OG 3.44Å; D1287-S1289 PolarHBondContact O-N 2.93Å
1290	D	77.2	Confident	83.3	Confident	58 Å²	58	42.6 Å²	42.6	31%	0.31	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	25.3	179.6	84.6	-57	0	0	0	113.7	Y1288 K1292 S1293 Q1294	Y1288-D1290 PolarHBondContact O-N 3Å; Y1288-D1290 VanDerWaalsContact O-N 3.13Å; D1290-K1292 PolarHBondContact O-N 3.34Å; D1290-S1293 WeakPolarHBondContact CB-OG 3.17Å; D1290-S1293 PolarHBondContact O-N 3.18Å; D1290-S1293 PolarHBondContact O-OG 3.14Å; D1290-S1293 PolarHBondContact OD2-OG 3Å; D1290-Q1294 PolarHBondContact OD1-NE2 2.99Å; D1290-Q1294 WeakPolarHBondContact OD2-CG 3.37Å; D1290-Q1294 PolarHBondContact OD2-NE2 2.75Å
1291	A	78.9	Confident	83.5	Confident	17 Å²	17	44.4 Å²	44.4	14%	0.14	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-22.6	-175.8	0	0	0	0	0	116.2	Y1288 V1297 Q1298 L1301	Y1288-A1291 WeakPolarHBondContact O-CB 3.33Å; Y1288-A1291 PolarHBondContact O-N 3.36Å; Y1288-A1291 VanDerWaalsContact O-N 3.12Å; A1291-V1297 HydrophobicContact CB-CG1 3.67Å; A1291-Q1298 VanDerWaalsContact O-CG 3.32Å; A1291-Q1298 WeakPolarHBondContact O-CG 3.44Å; A1291-L1301 HydrophobicContact CB-CD1 3.82Å
1292	K	76.9	Confident	83.6	Confident	162 Å²	162	47.5 Å²	47.5	70%	0.704	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-31.5	175.3	-66.9	178.9	-178.2	173.6	0	114.1	D1290 Q1294 Q1298	D1290-K1292 PolarHBondContact O-N 3.34Å; K1292-Q1294 VanDerWaalsContact C-N 3.27Å; K1292-Q1294 PolarHBondContact O-N 3.09Å; K1292-Q1298 PolarHBondContact O-NE2 2.97Å
1293	S	77	Confident	83.6	Confident	49 Å²	49	44.9 Å²	44.9	34%	0.343	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-16.3	177.2	5	0	0	0	0	113.1	D1290 T1338	D1290-S1293 WeakPolarHBondContact CB-OG 3.17Å; D1290-S1293 PolarHBondContact O-N 3.18Å; D1290-S1293 PolarHBondContact O-OG 3.14Å; D1290-S1293 PolarHBondContact OD2-OG 3Å; S1293-T1338 WeakPolarHBondContact O-CB 3.49Å
1294	Q	81.8	Confident	83.5	Confident	41 Å²	41	41.4 Å²	41.4	19%	0.192	22%	0.215	C	C	.	.			trans	-112.6	106.3	-165	-56.5	-159.6	27.5	0	0	112.2	D1290 K1292 H1296 V1297 Q1298	D1290-Q1294 PolarHBondContact OD1-NE2 2.99Å; D1290-Q1294 WeakPolarHBondContact OD2-CG 3.37Å; D1290-Q1294 PolarHBondContact OD2-NE2 2.75Å; K1292-Q1294 VanDerWaalsContact C-N 3.27Å; K1292-Q1294 PolarHBondContact O-N 3.09Å; Q1294-H1296 PolarHBondContact O-N 2.73Å; Q1294-H1296 PolarHBondContact OE1-CE1 2.77Å; Q1294-V1297 HydrophobicContact CB-CB 3.96Å; Q1294-V1297 HydrophobicContact CB-CG2 3.69Å; Q1294-V1297 HydrophobicContact CG-CG2 4.5Å; Q1294-V1297 PolarHBondContact O-N 2.91Å; Q1294-Q1298 PolarHBondContact O-N 3.26Å
1295	P	88.6	Confident	82.9	Confident	16 Å²	16	41.2 Å²	41.2	10%	0.104	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-43	-173	19.1	-31.1	0	0	0	113.2	V1297 Q1298 V1299 Y1326 I1328 T1338	P1295-V1297 VanDerWaalsContact C-N 3.31Å; P1295-V1297 PolarHBondContact O-N 2.92Å; P1295-Q1298 PolarHBondContact O-N 2.85Å; P1295-V1299 WeakPolarHBondContact O-CG2 3.4Å; P1295-V1299 PolarHBondContact O-N 3.41Å; P1295-Y1326 HydrophobicContact CB-CD2 4.03Å; P1295-Y1326 HydrophobicContact CB-CE2 3.86Å; P1295-Y1326 HydrophobicContact CG-CD2 4.37Å; P1295-Y1326 HydrophobicContact CG-CE2 3.7Å; P1295-I1328 HydrophobicContact CB-CD1 4.44Å; P1295-T1338 WeakPolarHBondContact CA-O 3.29Å; P1295-T1338 WeakPolarHBondContact CB-O 3.34Å
1296	H	88	Confident	81.7	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.019	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-35.3	174.8	66.9	-57.2	0	0	0	113.9	K1279 Q1294 A1300 V1324 Y1326	K1279-H1296 HydrophobicContact CB-CB 4.13Å; K1279-H1296 WeakPolarHBondContact CD-NE2 3.27Å; K1279-H1296 WeakPolarHBondContact CE-NE2 3.3Å; Q1294-H1296 PolarHBondContact O-N 2.73Å; Q1294-H1296 PolarHBondContact OE1-CE1 2.77Å; H1296-A1300 WeakPolarHBondContact O-CB 3.41Å; H1296-A1300 PolarHBondContact O-N 3.46Å; H1296-V1324 HydrophobicContact CB-CB 4.21Å; H1296-V1324 HydrophobicContact CB-CG1 4.49Å; H1296-Y1326 HydrophobicContact CB-CD1 3.87Å; H1296-Y1326 HydrophobicContact CB-CE1 3.74Å
1297	V	89.8	Confident	80	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-72.9	-41.5	175.3	-175.7	0	0	0	0	110.4	L1281 P1285 Y1288 A1291 Q1294 P1295 V1299 A1300 L1301	L1281-V1297 HydrophobicContact CD2-CG2 4.25Å; P1285-V1297 HydrophobicContact CB-CG1 4.5Å; P1285-V1297 WeakPolarHBondContact O-CG1 3.32Å; Y1288-V1297 HydrophobicContact CD1-CG2 4.02Å; Y1288-V1297 HydrophobicContact CD2-CG1 3.73Å; Y1288-V1297 HydrophobicContact CD2-CG2 3.92Å; Y1288-V1297 HydrophobicContact CE1-CG2 4.08Å; Y1288-V1297 HydrophobicContact CE2-CG1 4.44Å; Y1288-V1297 HydrophobicContact CE2-CG2 3.97Å; Y1288-V1297 HydrophobicContact CG-CG1 3.9Å; Y1288-V1297 HydrophobicContact CG-CG2 3.94Å; A1291-V1297 HydrophobicContact CB-CG1 3.67Å; Q1294-V1297 HydrophobicContact CB-CB 3.96Å; Q1294-V1297 HydrophobicContact CB-CG2 3.69Å; Q1294-V1297 HydrophobicContact CG-CG2 4.5Å; Q1294-V1297 PolarHBondContact O-N 2.91Å; P1295-V1297 VanDerWaalsContact C-N 3.31Å; P1295-V1297 PolarHBondContact O-N 2.92Å; V1297-V1299 VanDerWaalsContact C-N 3.33Å; V1297-V1299 PolarHBondContact O-N 3.4Å; V1297-A1300 PolarHBondContact O-N 2.87Å; V1297-L1301 HydrophobicContact CG1-CD1 4.11Å; V1297-L1301 HydrophobicContact CG1-CG 4.4Å; V1297-L1301 WeakPolarHBondContact O-CB 3.38Å; V1297-L1301 WeakPolarHBondContact O-CG 3.44Å; V1297-L1301 PolarHBondContact O-N 3.22Å
1298	Q	88.9	Confident	78.2	Confident	34 Å²	34	39.4 Å²	39.4	16%	0.159	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-41.9	172.9	-67.3	-160.1	21.6	0	0	112.8	A1291 K1292 Q1294 P1295 R1302 H1339	A1291-Q1298 VanDerWaalsContact O-CG 3.32Å; A1291-Q1298 WeakPolarHBondContact O-CG 3.44Å; K1292-Q1298 PolarHBondContact O-NE2 2.97Å; Q1294-Q1298 PolarHBondContact O-N 3.26Å; P1295-Q1298 PolarHBondContact O-N 2.85Å; Q1298-R1302 WeakPolarHBondContact O-CB 3.47Å; Q1298-R1302 PolarHBondContact O-N 2.83Å; Q1298-H1339 PolarHBondContact NE2-ND1 3.26Å; Q1298-H1339 PolarHBondContact OE1-O 3.41Å
1299	V	89.2	Confident	76.2	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-43.3	176.5	171.3	0	0	0	0	110.6	P1295 V1297 R1302 L1303 V1324 G1341	P1295-V1299 WeakPolarHBondContact O-CG2 3.4Å; P1295-V1299 PolarHBondContact O-N 3.41Å; V1297-V1299 VanDerWaalsContact C-N 3.33Å; V1297-V1299 PolarHBondContact O-N 3.4Å; V1299-R1302 PolarHBondContact O-N 3.03Å; V1299-L1303 HydrophobicContact CG1-CD1 3.88Å; V1299-L1303 HydrophobicContact CG1-CG 4.36Å; V1299-L1303 WeakPolarHBondContact O-CG 3.48Å; V1299-L1303 PolarHBondContact O-N 3.48Å; V1299-V1324 HydrophobicContact CB-CG1 4.21Å; V1299-V1324 HydrophobicContact CG1-CG1 3.88Å; V1299-G1341 VanDerWaalsContact CG2-O 3.24Å; V1299-G1341 WeakPolarHBondContact CG2-O 3.34Å
1300	A	87.9	Confident	74.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-44.3	176.3	0	0	0	0	0	112.5	L1281 P1285 H1296 V1297 R1302 L1303 N1304 L1318 V1324	L1281-A1300 HydrophobicContact CD1-CB 4.12Å; L1281-A1300 HydrophobicContact CD2-CB 4.36Å; P1285-A1300 HydrophobicContact CB-CB 3.91Å; P1285-A1300 HydrophobicContact CG-CB 3.55Å; H1296-A1300 WeakPolarHBondContact O-CB 3.41Å; H1296-A1300 PolarHBondContact O-N 3.46Å; V1297-A1300 PolarHBondContact O-N 2.87Å; A1300-R1302 VanDerWaalsContact C-N 3.34Å; A1300-R1302 PolarHBondContact O-N 3.39Å; A1300-L1303 PolarHBondContact O-N 3.44Å; A1300-N1304 WeakPolarHBondContact O-CB 3.27Å; A1300-N1304 PolarHBondContact O-N 3.4Å; A1300-L1318 HydrophobicContact CB-CB 4.22Å; A1300-L1318 HydrophobicContact CB-CD1 3.98Å; A1300-V1324 HydrophobicContact CB-CG1 4.47Å; A1300-V1324 HydrophobicContact CB-CG2 4.06Å
1301	L	88.5	Confident	72.7	Confident	61 Å²	61	47.9 Å²	47.9	32%	0.319	26%	0.263	S	S	.	.	H	α-helix	trans	-61.2	-39.8	172.9	-76.2	171.4	0	0	0	112.1	P1285 E1286 A1291 V1297 G1305	P1285-L1301 HydrophobicContact CB-CD2 3.82Å; P1285-L1301 HydrophobicContact CB-CG 3.85Å; E1286-L1301 HydrophobicContact CG-CD2 4.1Å; A1291-L1301 HydrophobicContact CB-CD1 3.82Å; V1297-L1301 HydrophobicContact CG1-CD1 4.11Å; V1297-L1301 HydrophobicContact CG1-CG 4.4Å; V1297-L1301 WeakPolarHBondContact O-CB 3.38Å; V1297-L1301 WeakPolarHBondContact O-CG 3.44Å; V1297-L1301 PolarHBondContact O-N 3.22Å; L1301-G1305 WeakPolarHBondContact O-CA 3.14Å; L1301-G1305 PolarHBondContact O-N 3.44Å
1302	R	85.4	Confident	70.7	Confident	64 Å²	64	55.2 Å²	55.2	24%	0.242	29%	0.291	C	S	.	.	H	α-helix	trans	-68.4	-35.5	175.2	-97.1	-175.4	-78.2	127.3	-6.6	113.3	Q1298 V1299 A1300 S1306 G1341 E1346	Q1298-R1302 WeakPolarHBondContact O-CB 3.47Å; Q1298-R1302 PolarHBondContact O-N 2.83Å; V1299-R1302 PolarHBondContact O-N 3.03Å; A1300-R1302 VanDerWaalsContact C-N 3.34Å; A1300-R1302 PolarHBondContact O-N 3.39Å; R1302-S1306 WeakPolarHBondContact O-CB 3.33Å; R1302-S1306 PolarHBondContact O-N 3.39Å; R1302-S1306 PolarHBondContact O-OG 2.78Å; R1302-G1341 PolarHBondContact NH2-O 3.01Å; R1302-E1346 IonicContact CZ-OE1 3.92Å; R1302-E1346 IonicContact NH1-OE1 2.76Å; R1302-E1346 PolarHBondContact NH1-OE1 2.82Å; R1302-E1346 IonicContact NH1-OE2 3.87Å; R1302-E1346 PolarHBondContact NH1-OE2 3.07Å
1303	L	78.9	Confident	68.9	Low	34 Å²	34	50.5 Å²	50.5	18%	0.178	28%	0.277	C	S	.	.	H	α-helix	trans	-71.8	-45.3	174.8	-67.4	170.5	0	0	0	110.9	V1299 A1300 G1305 A1307 L1318	V1299-L1303 HydrophobicContact CG1-CD1 3.88Å; V1299-L1303 HydrophobicContact CG1-CG 4.36Å; V1299-L1303 WeakPolarHBondContact O-CG 3.48Å; V1299-L1303 PolarHBondContact O-N 3.48Å; A1300-L1303 PolarHBondContact O-N 3.44Å; L1303-G1305 VanDerWaalsContact C-N 3.3Å; L1303-G1305 PolarHBondContact O-N 3.21Å; L1303-A1307 PolarHBondContact O-N 2.79Å; L1303-L1318 HydrophobicContact CB-CD1 4.24Å; L1303-L1318 HydrophobicContact CD1-CD1 3.72Å
1304	N	80.9	Confident	67.3	Low	5 Å²	5	48.4 Å²	48.4	3%	0.027	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-36.3	174	-77	6.4	0	0	0	112.8	E1286 A1300 R1317 L1318	E1286-N1304 PolarHBondContact OE1-ND2 2.94Å; A1300-N1304 WeakPolarHBondContact O-CB 3.27Å; A1300-N1304 PolarHBondContact O-N 3.4Å; N1304-R1317 WeakPolarHBondContact OD1-CA 3.4Å; N1304-L1318 PolarHBondContact ND2-O 2.78Å; N1304-L1318 PolarHBondContact OD1-N 3.42Å
1305	G	70.3	Confident	65.8	Low	29 Å²	29	48.7 Å²	48.7	30%	0.299	27%	0.267	S	S	.	.	H	α-helix	trans	-84.2	-37.1	-179.7	0	0	0	0	0	114.5	L1301 L1303 A1307 A1308 D1309	L1301-G1305 WeakPolarHBondContact O-CA 3.14Å; L1301-G1305 PolarHBondContact O-N 3.44Å; L1303-G1305 VanDerWaalsContact C-N 3.3Å; L1303-G1305 PolarHBondContact O-N 3.21Å; G1305-A1307 PolarHBondContact O-N 3.4Å; G1305-A1308 WeakPolarHBondContact O-CA 3.28Å; G1305-A1308 WeakPolarHBondContact O-CB 3.48Å; G1305-A1308 PolarHBondContact O-N 2.71Å; G1305-D1309 PolarHBondContact O-N 2.96Å
1306	S	60.1	Low	64.5	Low	45 Å²	45	50.6 Å²	50.6	32%	0.315	27%	0.272	S	S	.	.	H	α-helix	trans	-64.3	-32.5	175.1	-60.4	0	0	0	0	111.4	R1302 A1308 D1310	R1302-S1306 WeakPolarHBondContact O-CB 3.33Å; R1302-S1306 PolarHBondContact O-N 3.39Å; R1302-S1306 PolarHBondContact O-OG 2.78Å; S1306-A1308 PolarHBondContact O-N 3.46Å; S1306-D1310 PolarHBondContact O-N 3.37Å
1307	A	50.8	Low	63.7	Low	25 Å²	25	57.8 Å²	57.8	21%	0.207	30%	0.299	C	S	.	.	H	α-helix	trans	-66.4	-8.3	170	0	0	0	0	0	114.4	L1303 G1305	L1303-A1307 PolarHBondContact O-N 2.79Å; G1305-A1307 PolarHBondContact O-N 3.4Å
1308	A	43.5	Very low	63.3	Low	57 Å²	57	58.8 Å²	58.8	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-103.6	-46.8	173.8	0	0	0	0	0	112.6	G1305 S1306	G1305-A1308 WeakPolarHBondContact O-CA 3.28Å; G1305-A1308 WeakPolarHBondContact O-CB 3.48Å; G1305-A1308 PolarHBondContact O-N 2.71Å; S1306-A1308 PolarHBondContact O-N 3.46Å
1309	D	39.7	Very low	63	Low	147 Å²	147	59 Å²	59	79%	0.786	30%	0.304	S	S	*	.	H	α-helix	trans	-85.8	-45.5	-175.7	-79.2	-32.1	0	0	0	113.7	G1305 K1311	G1305-D1309 PolarHBondContact O-N 2.96Å; D1309-K1311 PolarHBondContact O-N 3.07Å
1310	D	39.4	Very low	62.6	Low	79 Å²	79	61 Å²	61	42%	0.422	32%	0.32	S	S	.	.	S	Bend	trans	-97.4	96.4	-176.8	-142.9	-31.3	0	0	0	110.3	S1306 K1312 T1313	S1306-D1310 PolarHBondContact O-N 3.37Å; D1310-K1312 PolarHBondContact O-N 2.75Å; D1310-T1313 PolarHBondContact O-N 3.3Å
1311	K	41.3	Very low	62.1	Low	136 Å²	136	61 Å²	61	59%	0.591	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	28.5	-171.4	-73	171.9	175.4	171.2	0	116.3	K561 D1309	K561-K1311 WeakPolarHBondContact O-CB 3.35Å; K561-K1311 WeakPolarHBondContact O-CD 3.46Å; K561-K1311 WeakPolarHBondContact O-CG 3.47Å; D1309-K1311 PolarHBondContact O-N 3.07Å
1312	K	37.5	Very low	61.7	Low	171 Å²	171	58.3 Å²	58.3	74%	0.743	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132	-28.8	-171.2	-68.1	175.7	-179.6	170.5	0	114	A825 D1310	A825-K1312 VanDerWaalsContact CB-O 3.26Å; A825-K1312 WeakPolarHBondContact CB-O 3.39Å; D1310-K1312 PolarHBondContact O-N 2.75Å
1313	T	38.5	Very low	61.7	Low	64 Å²	64	56 Å²	56	39%	0.393	30%	0.299	S	S	.	.			trans	-107	115.9	178	44.7	0	0	0	0	109.3	D823 D1310	D823-T1313 WeakPolarHBondContact OD2-CA 3.28Å; D1310-T1313 PolarHBondContact O-N 3.3Å
1314	G	45.4	Very low	62.1	Low	5 Å²	5	54.5 Å²	54.5	5%	0.052	29%	0.292	C	S	.	.			trans	-104.1	33.1	-166.4	0	0	0	0	0	113.3	D823 S824	D823-G1314 VanDerWaalsContact CG-N 3.33Å; D823-G1314 WeakPolarHBondContact OD1-CA 3.43Å; D823-G1314 PolarHBondContact OD1-N 3.02Å; D823-G1314 PolarHBondContact OD2-N 3.11Å; S824-G1314 WeakPolarHBondContact CB-O 3.28Å; S824-G1314 PolarHBondContact OG-O 3.36Å
1315	T	50.3	Low	62.4	Low	46 Å²	46	57.9 Å²	57.9	28%	0.282	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-55.4	142.5	-168.9	-42.2	0	0	0	0	112.8	D823 R1317	D823-T1315 PolarHBondContact OD1-N 3.02Å; T1315-R1317 PolarHBondContact O-N 3.2Å
1316	R	59.9	Low	63.4	Low	56 Å²	56	57.2 Å²	57.2	21%	0.211	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-49	130.1	166.3	170.7	-166	176.7	123.8	11.7	109.8	D687 K744 E821 L1318 D1322	D687-R1316 IonicContact OD1-NH2 2.89Å; D687-R1316 IonicContact OD2-CZ 3.33Å; D687-R1316 IonicContact OD2-NH1 2.71Å; D687-R1316 IonicContact OD2-NH2 3.63Å; D687-R1316 PolarHBondContact OD2-NH2 3.46Å; K744-R1316 VanDerWaalsContact NZ-NH2 3.2Å; E821-R1316 IonicContact OE1-NH1 3.53Å; E821-R1316 PolarHBondContact OE1-NH1 2.98Å; E821-R1316 WeakPolarHBondContact OE2-CD 3.44Å; E821-R1316 IonicContact OE2-NH1 3.44Å; R1316-L1318 PolarHBondContact O-N 3.44Å; R1316-D1322 IonicContact CZ-OD2 3.13Å; R1316-D1322 VanDerWaalsContact CZ-OD2 3.31Å; R1316-D1322 IonicContact NE-OD2 2.68Å; R1316-D1322 PolarHBondContact NE-OD2 3.49Å; R1316-D1322 VanDerWaalsContact NH2-CG 3.34Å; R1316-D1322 IonicContact NH2-OD1 3.91Å; R1316-D1322 PolarHBondContact NH2-OD1 3.45Å; R1316-D1322 IonicContact NH2-OD2 2.75Å; R1316-D1322 PolarHBondContact NH2-OD2 2.85Å
1317	R	72.7	Confident	65	Low	156 Å²	156	55.1 Å²	55.1	59%	0.589	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-65.8	124.7	170.2	-84.4	-171.7	164.1	-147.6	-9.6	110.5	N1304 T1315	N1304-R1317 WeakPolarHBondContact OD1-CA 3.4Å; T1315-R1317 PolarHBondContact O-N 3.2Å
1318	L	80.6	Confident	66.9	Low	21 Å²	21	54 Å²	54	11%	0.11	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-79.8	139.1	172.8	-67.4	164	0	0	0	109	L1281 P1285 A1300 L1303 N1304 R1316 D1322 V1324	L1281-L1318 HydrophobicContact CD1-CB 4Å; P1285-L1318 WeakPolarHBondContact CD-O 3.33Å; A1300-L1318 HydrophobicContact CB-CB 4.22Å; A1300-L1318 HydrophobicContact CB-CD1 3.98Å; L1303-L1318 HydrophobicContact CB-CD1 4.24Å; L1303-L1318 HydrophobicContact CD1-CD1 3.72Å; N1304-L1318 PolarHBondContact ND2-O 2.78Å; N1304-L1318 PolarHBondContact OD1-N 3.42Å; R1316-L1318 PolarHBondContact O-N 3.44Å; L1318-D1322 HydrophobicContact CD2-CB 4.05Å; L1318-V1324 HydrophobicContact CD1-CG1 4.33Å; L1318-V1324 HydrophobicContact CD1-CG2 4.23Å
1319	R	81.5	Confident	69.2	Low	39 Å²	39	51.2 Å²	51.2	15%	0.147	25%	0.249	C	C	.	.			trans	-145.6	177.1	-171.6	63.9	176	-176	-81.1	-4.7	111	D687 G690 L1281 N1284 G1321 D1322	D687-R1319 IonicContact OD1-NH2 3.55Å; D687-R1319 PolarHBondContact OD1-NH2 3.23Å; D687-R1319 IonicContact OD2-CZ 2.9Å; D687-R1319 IonicContact OD2-NH1 2.87Å; D687-R1319 IonicContact OD2-NH2 3.51Å; D687-R1319 PolarHBondContact OD2-NH2 3.02Å; G690-R1319 VanDerWaalsContact CA-NH2 3.28Å; G690-R1319 PolarHBondContact O-NE 3Å; G690-R1319 PolarHBondContact O-NH2 3.37Å; L1281-R1319 WeakPolarHBondContact CD1-O 3.36Å; N1284-R1319 WeakPolarHBondContact OD1-CB 3.44Å; R1319-G1321 PolarHBondContact O-N 2.93Å; R1319-D1322 IonicContact CZ-OD2 2.74Å; R1319-D1322 IonicContact NH1-OD2 2.81Å; R1319-D1322 PolarHBondContact NH1-OD2 3.4Å; R1319-D1322 PolarHBondContact O-N 2.87Å
1320	A	81.4	Confident	71.6	Confident	40 Å²	40	47.5 Å²	47.5	33%	0.331	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	127.1	172.9	0	0	0	0	0	111.7	K1283 N1284 D1322	K1283-A1320 WeakPolarHBondContact O-CA 3.48Å; K1283-A1320 PolarHBondContact O-N 2.98Å; N1284-A1320 PolarHBondContact OD1-N 3.19Å; A1320-D1322 PolarHBondContact O-N 3.49Å
1321	G	77.5	Confident	73.7	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.021	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-10.9	-178.6	0	0	0	0	0	116.3	R748 L1281 R1319	R748-G1321 PolarHBondContact NH2-O 3.35Å; L1281-G1321 WeakPolarHBondContact O-CA 3.35Å; L1281-G1321 PolarHBondContact O-N 3.42Å; R1319-G1321 PolarHBondContact O-N 2.93Å
1322	D	81.4	Confident	75.6	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	22%	0.221	C	C	.	.			trans	-81.4	158.8	169	-77.8	-13.9	0	0	0	110.8	K744 L1281 R1316 L1318 R1319 A1320	K744-D1322 IonicContact NZ-OD1 3.29Å; K744-D1322 PolarHBondContact NZ-OD1 2.98Å; L1281-D1322 PolarHBondContact N-O 2.77Å; R1316-D1322 IonicContact CZ-OD2 3.13Å; R1316-D1322 VanDerWaalsContact CZ-OD2 3.31Å; R1316-D1322 IonicContact NE-OD2 2.68Å; R1316-D1322 PolarHBondContact NE-OD2 3.49Å; R1316-D1322 VanDerWaalsContact NH2-CG 3.34Å; R1316-D1322 IonicContact NH2-OD1 3.91Å; R1316-D1322 PolarHBondContact NH2-OD1 3.45Å; R1316-D1322 IonicContact NH2-OD2 2.75Å; R1316-D1322 PolarHBondContact NH2-OD2 2.85Å; L1318-D1322 HydrophobicContact CD2-CB 4.05Å; R1319-D1322 IonicContact CZ-OD2 2.74Å; R1319-D1322 IonicContact NH1-OD2 2.81Å; R1319-D1322 PolarHBondContact NH1-OD2 3.4Å; R1319-D1322 PolarHBondContact O-N 2.87Å; A1320-D1322 PolarHBondContact O-N 3.49Å
1323	T	84.3	Confident	77.6	Confident	14 Å²	14	36.6 Å²	36.6	9%	0.086	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.6	-171.6	-48.7	0	0	0	0	110.2	T755 T1278 M1280	T755-T1323 HydrophobicContact CG2-CG2 3.88Å; T1278-T1323 HydrophobicContact CG2-CG2 3.42Å; T1278-T1323 VanDerWaalsContact CG2-CG2 3.42Å; M1280-T1323 HydrophobicContact CB-CG2 4.43Å
1324	V	87	Confident	79.3	Confident	3 Å²	3	37 Å²	37	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.7	-170.9	-166.7	0	0	0	0	109.7	K1279 L1281 H1296 V1299 A1300 L1318	K1279-V1324 PolarHBondContact N-O 3.26Å; K1279-V1324 PolarHBondContact O-N 3.49Å; L1281-V1324 HydrophobicContact CD1-CG2 3.71Å; L1281-V1324 HydrophobicContact CD2-CG2 4.24Å; L1281-V1324 HydrophobicContact CG-CG2 3.72Å; H1296-V1324 HydrophobicContact CB-CB 4.21Å; H1296-V1324 HydrophobicContact CB-CG1 4.49Å; V1299-V1324 HydrophobicContact CB-CG1 4.21Å; V1299-V1324 HydrophobicContact CG1-CG1 3.88Å; A1300-V1324 HydrophobicContact CB-CG1 4.47Å; A1300-V1324 HydrophobicContact CB-CG2 4.06Å; L1318-V1324 HydrophobicContact CD1-CG1 4.33Å; L1318-V1324 HydrophobicContact CD1-CG2 4.23Å
1325	E	88.2	Confident	81	Confident	77 Å²	77	41.1 Å²	41.1	36%	0.36	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.7	175.8	-68.8	-176.9	173.5	0	0	110.5	I1276 I1277 T1278 P1344	I1276-E1325 HydrophobicContact CG2-CB 3.79Å; I1276-E1325 HydrophobicContact CG2-CG 3.88Å; I1277-E1325 WeakPolarHBondContact O-CA 3.49Å; T1278-E1325 HydrophobicContact CG2-CG 4.49Å; E1325-P1344 HydrophobicContact CB-CG 4.38Å
1326	Y	91.1	Very high	82.2	Confident	15 Å²	15	43.2 Å²	43.2	6%	0.059	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	158.5	178.2	67.5	-83.5	0	0	0	112.8	I1277 K1279 P1295 H1296 I1328 Y1342	I1277-Y1326 HydrophobicContact CB-CD1 4.48Å; I1277-Y1326 HydrophobicContact CB-CD2 4.44Å; I1277-Y1326 HydrophobicContact CB-CE1 4.09Å; I1277-Y1326 HydrophobicContact CB-CE2 4.04Å; I1277-Y1326 HydrophobicContact CD1-CE2 4.07Å; I1277-Y1326 HydrophobicContact CG2-CE1 3.84Å; I1277-Y1326 HydrophobicContact CG2-CE2 4.17Å; I1277-Y1326 WeakPolarHBondContact CG2-OH 3.5Å; I1277-Y1326 PolarHBondContact N-O 2.7Å; I1277-Y1326 WeakPolarHBondContact O-CD1 3.4Å; I1277-Y1326 PolarHBondContact O-N 3.11Å; K1279-Y1326 HydrophobicContact CB-CE1 4.24Å; P1295-Y1326 HydrophobicContact CB-CD2 4.03Å; P1295-Y1326 HydrophobicContact CB-CE2 3.86Å; P1295-Y1326 HydrophobicContact CG-CD2 4.37Å; P1295-Y1326 HydrophobicContact CG-CE2 3.7Å; H1296-Y1326 HydrophobicContact CB-CD1 3.87Å; H1296-Y1326 HydrophobicContact CB-CE1 3.74Å; Y1326-I1328 HydrophobicContact CD2-CD1 3.89Å; Y1326-I1328 HydrophobicContact CE2-CD1 3.88Å; Y1326-Y1342 CarbonylContact C-O 3.56Å; Y1326-Y1342 VanDerWaalsContact CA-O 3.27Å; Y1326-Y1342 WeakPolarHBondContact CA-O 3.45Å
1327	V	92.5	Very high	83.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132.7	179.8	-180	0	0	0	0	107.7	I1272 F1275 I1276 Y1342 P1344 L1347 I1368 Y1373	I1272-V1327 HydrophobicContact CG2-CG2 4.46Å; F1275-V1327 HydrophobicContact CB-CG1 4.07Å; I1276-V1327 HydrophobicContact CG1-CG2 4.18Å; V1327-Y1342 PolarHBondContact N-O 2.77Å; V1327-Y1342 PolarHBondContact O-N 3.27Å; V1327-P1344 HydrophobicContact CG2-CG 4.26Å; V1327-L1347 HydrophobicContact CG1-CD2 4.16Å; V1327-I1368 HydrophobicContact CG1-CG1 4.39Å; V1327-Y1373 WeakPolarHBondContact CA-OH 3.32Å; V1327-Y1373 HydrophobicContact CG1-CE2 4.48Å; V1327-Y1373 WeakPolarHBondContact CG1-OH 3.4Å
1328	I	92.3	Very high	83.4	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.4	175.1	-56.3	-48.8	0	0	0	109.4	P1295 Y1326 A1337 R1340 D1369 Y1372 Y1373	P1295-I1328 HydrophobicContact CB-CD1 4.44Å; Y1326-I1328 HydrophobicContact CD2-CD1 3.89Å; Y1326-I1328 HydrophobicContact CE2-CD1 3.88Å; I1328-A1337 HydrophobicContact CG2-CB 4.05Å; I1328-R1340 WeakPolarHBondContact CA-O 3.27Å; I1328-D1369 HydrophobicContact CG2-CB 4.05Å; I1328-D1369 PolarHBondContact O-N 3.26Å; I1328-D1369 VanDerWaalsContact O-N 3.12Å; I1328-Y1372 HydrophobicContact CB-CD1 3.63Å; I1328-Y1372 HydrophobicContact CB-CE1 3.95Å; I1328-Y1372 HydrophobicContact CB-CG 4.06Å; I1328-Y1372 HydrophobicContact CG1-CD1 3.61Å; I1328-Y1372 HydrophobicContact CG1-CE1 3.35Å; I1328-Y1372 HydrophobicContact CG1-CE2 4.31Å; I1328-Y1372 HydrophobicContact CG1-CG 4.2Å; I1328-Y1372 HydrophobicContact CG2-CD1 4.01Å; I1328-Y1372 HydrophobicContact CG2-CD2 4.31Å; I1328-Y1372 HydrophobicContact CG2-CG 3.88Å; I1328-Y1373 HydrophobicContact CB-CE2 4.23Å; I1328-Y1373 PolarHBondContact N-OH 2.82Å
1329	C	91.4	Very high	83.5	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	146	-174.4	-57.9	0	0	0	0	111.1	R1340 Y1342 L1366 S1367	C1329-R1340 PolarHBondContact N-O 2.78Å; C1329-R1340 VanDerWaalsContact O-CB 3.3Å; C1329-R1340 WeakPolarHBondContact O-CB 3.43Å; C1329-R1340 PolarHBondContact O-NH1 3.26Å; C1329-Y1342 HydrophobicContact CB-CD2 3.72Å; C1329-Y1342 HydrophobicContact CB-CE2 4.19Å; C1329-L1366 HydrophobicContact CB-CD2 3.98Å; C1329-S1367 CarbonylContact C-O 3.19Å; C1329-S1367 WeakPolarHBondContact CA-O 3.31Å; C1329-S1367 WeakPolarHBondContact CB-O 3.28Å
1330	E	89.2	Confident	83.8	Confident	69 Å²	69	36.2 Å²	36.2	32%	0.322	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123	160.7	-170.1	53	-106.8	0	0	108.5	G1332 R1340 S1367	E1330-G1332 PolarHBondContact OE1-N 2.89Å; E1330-G1332 VanDerWaalsContact OE1-N 3.11Å; E1330-R1340 IonicContact OE2-CZ 3.55Å; E1330-R1340 IonicContact OE2-NH1 2.69Å; E1330-R1340 IonicContact OE2-NH2 3.07Å; E1330-S1367 PolarHBondContact N-O 3.04Å; E1330-S1367 PolarHBondContact O-N 2.88Å; E1330-S1367 VanDerWaalsContact O-N 3.16Å
1331	D	84.3	Confident	84.2	Confident	35 Å²	35	34.3 Å²	34.3	19%	0.187	21%	0.214	C	C	.	.			trans	-115.5	-4.6	-177.2	73.7	-17.1	0	0	0	112.4	S1333 R1340 Y1342 L1366	D1331-S1333 VanDerWaalsContact C-N 3.25Å; D1331-S1333 PolarHBondContact O-N 3Å; D1331-S1333 VanDerWaalsContact OD1-CB 3.23Å; D1331-S1333 WeakPolarHBondContact OD1-CB 3.34Å; D1331-S1333 PolarHBondContact OD1-N 3.46Å; D1331-S1333 PolarHBondContact OD1-OG 3.09Å; D1331-S1333 WeakPolarHBondContact OD2-CB 3.44Å; D1331-S1333 PolarHBondContact OD2-OG 3Å; D1331-R1340 WeakPolarHBondContact OD1-CD 3.37Å; D1331-Y1342 HydrophobicContact CB-CE2 4.37Å; D1331-Y1342 PolarHBondContact OD2-OH 3.24Å; D1331-L1366 HydrophobicContact CB-CD2 3.71Å
1332	G	80.5	Confident	84.8	Confident	68 Å²	68	36 Å²	36	70%	0.701	22%	0.22	S	C	*	.	S	Bend	trans	76.2	6.1	-177.3	0	0	0	0	0	114.4	E1330	E1330-G1332 PolarHBondContact OE1-N 2.89Å; E1330-G1332 VanDerWaalsContact OE1-N 3.11Å
1333	S	79.4	Confident	85	Confident	53 Å²	53	36 Å²	36	37%	0.371	22%	0.22	S	C	.	.	S	Bend	trans	-80.6	-16.3	179.6	72.3	0	0	0	0	113.8	D1331 Q1335	D1331-S1333 VanDerWaalsContact C-N 3.25Å; D1331-S1333 PolarHBondContact O-N 3Å; D1331-S1333 VanDerWaalsContact OD1-CB 3.23Å; D1331-S1333 WeakPolarHBondContact OD1-CB 3.34Å; D1331-S1333 PolarHBondContact OD1-N 3.46Å; D1331-S1333 PolarHBondContact OD1-OG 3.09Å; D1331-S1333 WeakPolarHBondContact OD2-CB 3.44Å; D1331-S1333 PolarHBondContact OD2-OG 3Å; S1333-Q1335 PolarHBondContact O-N 2.86Å; S1333-Q1335 WeakPolarHBondContact OG-CB 3.25Å; S1333-Q1335 WeakPolarHBondContact OG-CG 3.46Å; S1333-Q1335 PolarHBondContact OG-N 3.21Å; S1333-Q1335 PolarHBondContact OG-NE2 3.44Å
1334	G	75.8	Confident	84.9	Confident	73 Å²	73	36.4 Å²	36.4	75%	0.753	22%	0.223	S	C	*	.			trans	68.1	11.7	-173.8	0	0	0	0	0	114.4
1335	Q	79.2	Confident	84.3	Confident	92 Å²	92	40.3 Å²	40.3	43%	0.43	25%	0.247	S	C	.	.			trans	-72.4	160.7	178.1	-70.9	176.4	85.5	0	0	112.5	S1333 H1339 R1340	S1333-Q1335 PolarHBondContact O-N 2.86Å; S1333-Q1335 WeakPolarHBondContact OG-CB 3.25Å; S1333-Q1335 WeakPolarHBondContact OG-CG 3.46Å; S1333-Q1335 PolarHBondContact OG-N 3.21Å; S1333-Q1335 PolarHBondContact OG-NE2 3.44Å; Q1335-H1339 HydrophobicContact CB-CB 4.13Å; Q1335-R1340 HydrophobicContact CB-CG 4.25Å; Q1335-R1340 PolarHBondContact O-NE 3.47Å
1336	L	76.7	Confident	83.8	Confident	89 Å²	89	38.8 Å²	38.8	47%	0.466	24%	0.24	S	C	.	.			trans	-56.6	144.2	170.6	-69.3	162.7	0	0	0	110.8	T1338 H1339 V1553	L1336-T1338 PolarHBondContact O-N 2.89Å; L1336-H1339 PolarHBondContact O-N 2.7Å; L1336-V1553 WeakPolarHBondContact CD1-O 3.35Å; L1336-V1553 HydrophobicContact CD2-CG1 4.29Å; L1336-V1553 WeakPolarHBondContact CD2-O 3.45Å
1337	A	79.9	Confident	83.2	Confident	20 Å²	20	38.2 Å²	38.2	17%	0.165	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-55.1	-29.4	-177.3	0	0	0	0	0	113.7	I1328 H1339 R1340 Y1372	I1328-A1337 HydrophobicContact CG2-CB 4.05Å; A1337-H1339 PolarHBondContact O-N 2.66Å; A1337-R1340 PolarHBondContact O-N 2.88Å; A1337-Y1372 HydrophobicContact CB-CD2 3.61Å; A1337-Y1372 HydrophobicContact CB-CE2 3.86Å; A1337-Y1372 HydrophobicContact CB-CG 4.49Å
1338	T	78.5	Confident	82.2	Confident	31 Å²	31	39.6 Å²	39.6	19%	0.19	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-58.9	-27.3	173.6	45.5	0	0	0	0	114.3	S1293 P1295 L1336	S1293-T1338 WeakPolarHBondContact O-CB 3.49Å; P1295-T1338 WeakPolarHBondContact CA-O 3.29Å; P1295-T1338 WeakPolarHBondContact CB-O 3.34Å; L1336-T1338 PolarHBondContact O-N 2.89Å
1339	H	82.4	Confident	80.9	Confident	53 Å²	53	42.2 Å²	42.2	25%	0.245	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-90.8	-16.7	175.1	-67.3	-109.7	0	0	0	113.2	Q1298 Q1335 L1336 A1337	Q1298-H1339 PolarHBondContact NE2-ND1 3.26Å; Q1298-H1339 PolarHBondContact OE1-O 3.41Å; Q1335-H1339 HydrophobicContact CB-CB 4.13Å; L1336-H1339 PolarHBondContact O-N 2.7Å; A1337-H1339 PolarHBondContact O-N 2.66Å
1340	R	87.3	Confident	79.6	Confident	21 Å²	21	44.1 Å²	44.1	8%	0.079	28%	0.277	C	S	.	.			trans	-100.2	23.9	-173.8	-60.9	-168.6	-75.5	104.5	-11.6	114	I1328 C1329 E1330 D1331 Q1335 A1337 Y1342 D1369	I1328-R1340 WeakPolarHBondContact CA-O 3.27Å; C1329-R1340 PolarHBondContact N-O 2.78Å; C1329-R1340 VanDerWaalsContact O-CB 3.3Å; C1329-R1340 WeakPolarHBondContact O-CB 3.43Å; C1329-R1340 PolarHBondContact O-NH1 3.26Å; E1330-R1340 IonicContact OE2-CZ 3.55Å; E1330-R1340 IonicContact OE2-NH1 2.69Å; E1330-R1340 IonicContact OE2-NH2 3.07Å; D1331-R1340 WeakPolarHBondContact OD1-CD 3.37Å; Q1335-R1340 HydrophobicContact CB-CG 4.25Å; Q1335-R1340 PolarHBondContact O-NE 3.47Å; A1337-R1340 PolarHBondContact O-N 2.88Å; R1340-Y1342 HydrophobicContact CB-CE2 4.47Å; R1340-Y1342 VanDerWaalsContact O-CD2 3.28Å; R1340-Y1342 WeakPolarHBondContact O-CD2 3.34Å; R1340-D1369 IonicContact CZ-OD2 3.65Å; R1340-D1369 VanDerWaalsContact CZ-OD2 3.26Å; R1340-D1369 IonicContact NH1-OD2 3.94Å; R1340-D1369 PolarHBondContact NH1-OD2 2.63Å; R1340-D1369 IonicContact NH2-OD2 2.68Å; R1340-D1369 PolarHBondContact NH2-OD2 3.13Å
1341	G	88.9	Confident	78.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130	170	0	0	0	0	0	111.7	V1299 R1302	V1299-G1341 VanDerWaalsContact CG2-O 3.24Å; V1299-G1341 WeakPolarHBondContact CG2-O 3.34Å; R1302-G1341 PolarHBondContact NH2-O 3.01Å
1342	Y	89.9	Confident	76.4	Confident	38 Å²	38	50 Å²	50	15%	0.149	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	153.8	177.2	-64.8	-95.2	0	0	0	110.4	Y1326 V1327 C1329 D1331 R1340 L1366	Y1326-Y1342 CarbonylContact C-O 3.56Å; Y1326-Y1342 VanDerWaalsContact CA-O 3.27Å; Y1326-Y1342 WeakPolarHBondContact CA-O 3.45Å; V1327-Y1342 PolarHBondContact N-O 2.77Å; V1327-Y1342 PolarHBondContact O-N 3.27Å; C1329-Y1342 HydrophobicContact CB-CD2 3.72Å; C1329-Y1342 HydrophobicContact CB-CE2 4.19Å; D1331-Y1342 HydrophobicContact CB-CE2 4.37Å; D1331-Y1342 PolarHBondContact OD2-OH 3.24Å; R1340-Y1342 HydrophobicContact CB-CE2 4.47Å; R1340-Y1342 VanDerWaalsContact O-CD2 3.28Å; R1340-Y1342 WeakPolarHBondContact O-CD2 3.34Å; Y1342-L1366 HydrophobicContact CD1-CD1 3.98Å; Y1342-L1366 HydrophobicContact CD1-CD2 4.36Å; Y1342-L1366 HydrophobicContact CD2-CD2 3.92Å; Y1342-L1366 HydrophobicContact CE1-CD1 4.14Å; Y1342-L1366 HydrophobicContact CE1-CD2 4.07Å; Y1342-L1366 HydrophobicContact CE2-CD2 3.59Å; Y1342-L1366 HydrophobicContact CG-CD1 4.29Å; Y1342-L1366 HydrophobicContact CG-CD2 4.3Å
1343	S	85.6	Confident	74.8	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.028	30%	0.301	C	S	.	.			trans	-65.9	151.7	171.7	60.8	0	0	0	0	111.3	T1345 E1346 L1347	S1343-T1345 PolarHBondContact O-N 3.12Å; S1343-T1345 VanDerWaalsContact O-N 3.16Å; S1343-E1346 WeakPolarHBondContact CB-OE2 3.3Å; S1343-E1346 PolarHBondContact N-OE2 3.01Å; S1343-E1346 PolarHBondContact O-N 2.56Å; S1343-E1346 VanDerWaalsContact O-N 3.13Å; S1343-E1346 WeakPolarHBondContact OG-CB 3.27Å; S1343-E1346 VanDerWaalsContact OG-CG 3.24Å; S1343-E1346 WeakPolarHBondContact OG-CG 3.5Å; S1343-E1346 PolarHBondContact OG-N 3.06Å; S1343-E1346 PolarHBondContact OG-OE2 3.01Å; S1343-L1347 PolarHBondContact O-N 2.93Å
1344	P	82.4	Confident	73	Confident	22 Å²	22	57.6 Å²	57.6	14%	0.143	32%	0.318	C	S	.	.	H	α-helix	trans	-54.9	-33.5	173.8	-25.2	34.3	0	0	0	112.7	I1276 E1325 V1327 T1348	I1276-P1344 HydrophobicContact CD1-CB 4.36Å; I1276-P1344 HydrophobicContact CD1-CG 3.82Å; I1276-P1344 HydrophobicContact CG1-CG 3.96Å; E1325-P1344 HydrophobicContact CB-CG 4.38Å; V1327-P1344 HydrophobicContact CG2-CG 4.26Å; P1344-T1348 WeakPolarHBondContact O-CB 3.46Å; P1344-T1348 PolarHBondContact O-N 3.12Å; P1344-T1348 PolarHBondContact O-OG1 3.3Å
1345	T	74.1	Confident	71.2	Confident	85 Å²	85	59 Å²	59	52%	0.521	32%	0.317	S	S	.	.	H	α-helix	trans	-69.9	-39.8	178.3	-42.6	0	0	0	0	112.8	S1343 S1349	S1343-T1345 PolarHBondContact O-N 3.12Å; S1343-T1345 VanDerWaalsContact O-N 3.16Å; T1345-S1349 WeakPolarHBondContact O-CB 3.39Å; T1345-S1349 PolarHBondContact O-N 3.28Å; T1345-S1349 PolarHBondContact O-OG 3.25Å
1346	E	77.6	Confident	69.1	Low	45 Å²	45	61.5 Å²	61.5	21%	0.21	33%	0.333	C	S	.	.	H	α-helix	trans	-61.8	-49	174.2	-80.8	164.6	115.2	0	0	111.1	R1302 S1343 S1349 C1350	R1302-E1346 IonicContact CZ-OE1 3.92Å; R1302-E1346 IonicContact NH1-OE1 2.76Å; R1302-E1346 PolarHBondContact NH1-OE1 2.82Å; R1302-E1346 IonicContact NH1-OE2 3.87Å; R1302-E1346 PolarHBondContact NH1-OE2 3.07Å; S1343-E1346 WeakPolarHBondContact CB-OE2 3.3Å; S1343-E1346 PolarHBondContact N-OE2 3.01Å; S1343-E1346 PolarHBondContact O-N 2.56Å; S1343-E1346 VanDerWaalsContact O-N 3.13Å; S1343-E1346 WeakPolarHBondContact OG-CB 3.27Å; S1343-E1346 VanDerWaalsContact OG-CG 3.24Å; S1343-E1346 WeakPolarHBondContact OG-CG 3.5Å; S1343-E1346 PolarHBondContact OG-N 3.06Å; S1343-E1346 PolarHBondContact OG-OE2 3.01Å; E1346-S1349 PolarHBondContact O-N 2.91Å; E1346-C1350 PolarHBondContact O-N 3.08Å
1347	L	79	Confident	67.2	Low	2 Å²	2	65.7 Å²	65.7	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-58.7	-51.3	178.5	176.5	61.7	0	0	0	111.2	I1272 V1327 S1343 S1349 C1350 L1351 L1366 I1368	I1272-L1347 HydrophobicContact CD1-CD2 4.43Å; I1272-L1347 HydrophobicContact CG2-CD2 4.24Å; V1327-L1347 HydrophobicContact CG1-CD2 4.16Å; S1343-L1347 PolarHBondContact O-N 2.93Å; L1347-S1349 VanDerWaalsContact C-N 3.31Å; L1347-S1349 PolarHBondContact O-N 3.16Å; L1347-C1350 PolarHBondContact O-N 3.45Å; L1347-C1350 VanDerWaalsContact O-N 3.13Å; L1347-L1351 HydrophobicContact CD1-CD1 4.42Å; L1347-L1351 HydrophobicContact CG-CD1 4.29Å; L1347-L1351 PolarHBondContact O-N 3.12Å; L1347-L1366 HydrophobicContact CD1-CB 3.97Å; L1347-I1368 HydrophobicContact CD2-CD1 4.41Å; L1347-I1368 HydrophobicContact CD2-CG1 3.94Å
1348	T	72.2	Confident	64.9	Low	30 Å²	30	69.7 Å²	69.7	18%	0.184	38%	0.383	C	S	.	.	H	α-helix	trans	-59.7	-41.4	178.6	-54.4	0	0	0	0	111.5	P1344 C1350 L1351 Y1352	P1344-T1348 WeakPolarHBondContact O-CB 3.46Å; P1344-T1348 PolarHBondContact O-N 3.12Å; P1344-T1348 PolarHBondContact O-OG1 3.3Å; T1348-C1350 PolarHBondContact O-N 2.92Å; T1348-L1351 PolarHBondContact O-N 2.69Å; T1348-Y1352 HydrophobicContact CG2-CD2 3.94Å; T1348-Y1352 HydrophobicContact CG2-CE2 3.77Å; T1348-Y1352 WeakPolarHBondContact O-CD2 3.48Å; T1348-Y1352 PolarHBondContact O-N 3.18Å
1349	S	65.5	Low	62.7	Low	55 Å²	55	76.9 Å²	76.9	39%	0.385	41%	0.414	S	S	.	.	H	α-helix	trans	-67.1	-15.7	178.8	-64.3	0	0	0	0	114.8	T1345 E1346 L1347 K1353	T1345-S1349 WeakPolarHBondContact O-CB 3.39Å; T1345-S1349 PolarHBondContact O-N 3.28Å; T1345-S1349 PolarHBondContact O-OG 3.25Å; E1346-S1349 PolarHBondContact O-N 2.91Å; L1347-S1349 VanDerWaalsContact C-N 3.31Å; L1347-S1349 PolarHBondContact O-N 3.16Å; S1349-K1353 VanDerWaalsContact O-CD 3.29Å; S1349-K1353 WeakPolarHBondContact O-CD 3.19Å; S1349-K1353 VanDerWaalsContact O-CE 3.23Å; S1349-K1353 WeakPolarHBondContact O-CE 3.34Å; S1349-K1353 WeakPolarHBondContact O-CG 3.41Å; S1349-K1353 PolarHBondContact O-NZ 3.34Å
1350	C	62.3	Low	60.3	Low	40 Å²	40	80.5 Å²	80.5	27%	0.27	44%	0.442	S	S	.	.	H	α-helix	trans	-91.7	-41.5	173.6	-74.5	0	0	0	0	111.8	E1346 L1347 T1348 Y1352 K1353 L1366	E1346-C1350 PolarHBondContact O-N 3.08Å; L1347-C1350 PolarHBondContact O-N 3.45Å; L1347-C1350 VanDerWaalsContact O-N 3.13Å; T1348-C1350 PolarHBondContact O-N 2.92Å; C1350-Y1352 VanDerWaalsContact C-N 3.27Å; C1350-Y1352 PolarHBondContact O-N 3.26Å; C1350-K1353 PolarHBondContact O-N 3.06Å; C1350-L1366 HydrophobicContact CB-CB 4.49Å
1351	L	58	Low	57.8	Low	96 Å²	96	84.3 Å²	84.3	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-57.4	-35.8	179.6	-69	168.8	0	0	0	113.3	I1272 L1347 T1348	I1272-L1351 HydrophobicContact CD1-CD1 4.3Å; L1347-L1351 HydrophobicContact CD1-CD1 4.42Å; L1347-L1351 HydrophobicContact CG-CD1 4.29Å; L1347-L1351 PolarHBondContact O-N 3.12Å; T1348-L1351 PolarHBondContact O-N 2.69Å
1352	Y	49.9	Very low	55.4	Low	132 Å²	132	91.3 Å²	91.3	52%	0.518	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.3	-178	-76	-70.7	0	0	0	115.8	T1348 C1350 V1354 S1355	T1348-Y1352 HydrophobicContact CG2-CD2 3.94Å; T1348-Y1352 HydrophobicContact CG2-CE2 3.77Å; T1348-Y1352 WeakPolarHBondContact O-CD2 3.48Å; T1348-Y1352 PolarHBondContact O-N 3.18Å; C1350-Y1352 VanDerWaalsContact C-N 3.27Å; C1350-Y1352 PolarHBondContact O-N 3.26Å; Y1352-V1354 VanDerWaalsContact C-N 3.31Å; Y1352-V1354 PolarHBondContact O-N 2.93Å; Y1352-S1355 PolarHBondContact O-OG 2.91Å
1353	K	46.1	Very low	53.3	Low	158 Å²	158	98 Å²	98	69%	0.687	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-1.2	-174.9	-78.9	175.5	-176.4	156	0	115.4	S1349 C1350 S1355	S1349-K1353 VanDerWaalsContact O-CD 3.29Å; S1349-K1353 WeakPolarHBondContact O-CD 3.19Å; S1349-K1353 VanDerWaalsContact O-CE 3.23Å; S1349-K1353 WeakPolarHBondContact O-CE 3.34Å; S1349-K1353 WeakPolarHBondContact O-CG 3.41Å; S1349-K1353 PolarHBondContact O-NZ 3.34Å; C1350-K1353 PolarHBondContact O-N 3.06Å; K1353-S1355 PolarHBondContact O-N 2.92Å; K1353-S1355 VanDerWaalsContact O-N 3.07Å
1354	V	41.7	Very low	51.7	Low	122 Å²	122	100.1 Å²	100.1	74%	0.739	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	41.3	-172	-160.1	0	0	0	0	112.2	Y1352	Y1352-V1354 VanDerWaalsContact C-N 3.31Å; Y1352-V1354 PolarHBondContact O-N 2.93Å
1355	S	38.6	Very low	51.1	Low	104 Å²	104	106 Å²	106	73%	0.727	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146	18.7	-168.7	60.2	0	0	0	0	117.2	Y1352 K1353	Y1352-S1355 PolarHBondContact O-OG 2.91Å; K1353-S1355 PolarHBondContact O-N 2.92Å; K1353-S1355 VanDerWaalsContact O-N 3.07Å
1356	D	34.7	Very low	51.5	Low	143 Å²	143	103 Å²	103	77%	0.765	58%	0.578	S	S	*	*	S	Bend	trans	-138.4	127.2	174	-147	-8.5	0	0	0	110.2	S1358	D1356-S1358 PolarHBondContact O-N 2.96Å
1357	D	36.7	Very low	52	Low	178 Å²	178	103.7 Å²	103.7	95%	0.952	59%	0.588	S	S	*	*			trans	-77.3	72.9	-164.3	-76	-48.6	0	0	0	113.3
1358	S	32.4	Very low	52.5	Low	104 Å²	104	105.7 Å²	105.7	73%	0.727	60%	0.599	S	S	*	*	S	Bend	trans	-141.1	160.6	174.1	58.6	0	0	0	0	113	D1356	D1356-S1358 PolarHBondContact O-N 2.96Å
1359	E	31.4	Very low	53.4	Low	182 Å²	182	105 Å²	105	85%	0.85	59%	0.594	S	S	*	*			trans	-56.4	147.7	-159.7	-68.8	-169.3	141.5	0	0	115.8	S1361	E1359-S1361 VanDerWaalsContact C-N 3.3Å; E1359-S1361 PolarHBondContact O-N 3.24Å
1360	P	31.5	Very low	54.7	Low	128 Å²	128	104.2 Å²	104.2	83%	0.831	59%	0.586	S	S	*	*			trans	-72.3	77.9	-177.1	31.7	-37.3	0	0	0	112.4
1361	S	35.1	Very low	56.1	Low	101 Å²	101	107.4 Å²	107.4	71%	0.706	60%	0.601	S	S	*	*			trans	-61	136.5	169.5	72.9	0	0	0	0	110.5	E1359 K1363	E1359-S1361 VanDerWaalsContact C-N 3.3Å; E1359-S1361 PolarHBondContact O-N 3.24Å; S1361-K1363 VanDerWaalsContact C-N 3.32Å; S1361-K1363 PolarHBondContact O-N 2.85Å
1362	T	38.8	Very low	57.6	Low	149 Å²	149	104.5 Å²	104.5	91%	0.914	58%	0.584	S	S	*	*	S	Bend	trans	-75.5	72.3	-166.9	48.2	0	0	0	0	114
1363	K	44.9	Very low	59.7	Low	178 Å²	178	98.2 Å²	98.2	77%	0.774	56%	0.559	S	S	*	*			trans	-122	114.5	157.5	-70.2	-168.6	174.5	-170.8	0	107.4	S1361	S1361-K1363 VanDerWaalsContact C-N 3.32Å; S1361-K1363 PolarHBondContact O-N 2.85Å
1364	G	52.6	Low	62	Low	49 Å²	49	90.7 Å²	90.7	51%	0.505	53%	0.526	S	S	.	.			trans	-72.6	166.2	-161.7	0	0	0	0	0	116.2	L1366	G1364-L1366 PolarHBondContact O-N 3.49Å
1365	N	69.7	Low	64.2	Low	144 Å²	144	85.6 Å²	85.6	77%	0.77	50%	0.497	S	S	*	.			trans	-69.8	88.1	174	-74.5	-10.7	0	0	0	110.8	S1367	N1365-S1367 PolarHBondContact O-N 2.86Å
1366	L	82.2	Confident	66.5	Low	22 Å²	22	83.8 Å²	83.8	12%	0.115	48%	0.477	C	S	.	.			trans	-63.8	127.7	168.2	-71.9	170.7	0	0	0	110.2	C1329 D1331 Y1342 L1347 C1350 G1364	C1329-L1366 HydrophobicContact CB-CD2 3.98Å; D1331-L1366 HydrophobicContact CB-CD2 3.71Å; Y1342-L1366 HydrophobicContact CD1-CD1 3.98Å; Y1342-L1366 HydrophobicContact CD1-CD2 4.36Å; Y1342-L1366 HydrophobicContact CD2-CD2 3.92Å; Y1342-L1366 HydrophobicContact CE1-CD1 4.14Å; Y1342-L1366 HydrophobicContact CE1-CD2 4.07Å; Y1342-L1366 HydrophobicContact CE2-CD2 3.59Å; Y1342-L1366 HydrophobicContact CG-CD1 4.29Å; Y1342-L1366 HydrophobicContact CG-CD2 4.3Å; L1347-L1366 HydrophobicContact CD1-CB 3.97Å; C1350-L1366 HydrophobicContact CB-CB 4.49Å; G1364-L1366 PolarHBondContact O-N 3.49Å
1367	S	88	Confident	69.2	Low	60 Å²	60	77.3 Å²	77.3	42%	0.42	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	162.8	177.7	58.8	0	0	0	0	110	C1329 E1330 N1365	C1329-S1367 CarbonylContact C-O 3.19Å; C1329-S1367 WeakPolarHBondContact CA-O 3.31Å; C1329-S1367 WeakPolarHBondContact CB-O 3.28Å; E1330-S1367 PolarHBondContact N-O 3.04Å; E1330-S1367 PolarHBondContact O-N 2.88Å; E1330-S1367 VanDerWaalsContact O-N 3.16Å; N1365-S1367 PolarHBondContact O-N 2.86Å
1368	I	90.2	Very high	71.9	Confident	45 Å²	45	68.9 Å²	68.9	23%	0.231	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	132.1	-176	-62.1	173.4	0	0	0	110.5	F1275 V1327 L1347 V1370 Y1373	F1275-I1368 HydrophobicContact CD1-CG2 3.76Å; F1275-I1368 HydrophobicContact CD2-CD1 3.73Å; F1275-I1368 HydrophobicContact CE1-CG2 3.99Å; F1275-I1368 HydrophobicContact CE2-CD1 4Å; F1275-I1368 HydrophobicContact CG-CD1 4.07Å; F1275-I1368 HydrophobicContact CG-CG2 4.12Å; V1327-I1368 HydrophobicContact CG1-CG1 4.39Å; L1347-I1368 HydrophobicContact CD2-CD1 4.41Å; L1347-I1368 HydrophobicContact CD2-CG1 3.94Å; I1368-V1370 PolarHBondContact O-N 3.13Å; I1368-Y1373 HydrophobicContact CG2-CD2 3.9Å; I1368-Y1373 HydrophobicContact CG2-CE2 3.85Å
1369	D	91.7	Very high	74.7	Confident	14 Å²	14	64.3 Å²	64.3	8%	0.075	36%	0.364	C	S	.	.			trans	-75.9	85.6	176.6	-173.9	-18.2	0	0	0	111.1	I1328 R1340 N1371 Y1372 Y1373	I1328-D1369 HydrophobicContact CG2-CB 4.05Å; I1328-D1369 PolarHBondContact O-N 3.26Å; I1328-D1369 VanDerWaalsContact O-N 3.12Å; R1340-D1369 IonicContact CZ-OD2 3.65Å; R1340-D1369 VanDerWaalsContact CZ-OD2 3.26Å; R1340-D1369 IonicContact NH1-OD2 3.94Å; R1340-D1369 PolarHBondContact NH1-OD2 2.63Å; R1340-D1369 IonicContact NH2-OD2 2.68Å; R1340-D1369 PolarHBondContact NH2-OD2 3.13Å; D1369-N1371 PolarHBondContact O-N 3.24Å; D1369-N1371 PolarHBondContact OD1-N 2.99Å; D1369-N1371 VanDerWaalsContact OD1-N 3.12Å; D1369-Y1372 VanDerWaalsContact CG-CB 3.43Å; D1369-Y1372 WeakPolarHBondContact O-CB 3.15Å; D1369-Y1372 PolarHBondContact O-N 3.11Å; D1369-Y1372 VanDerWaalsContact O-N 3.15Å; D1369-Y1372 PolarHBondContact OD1-N 3.46Å; D1369-Y1373 VanDerWaalsContact O-CD2 3.29Å; D1369-Y1373 WeakPolarHBondContact O-CD2 3.44Å; D1369-Y1373 PolarHBondContact O-N 3.37Å
1370	V	92.6	Very high	77.4	Confident	39 Å²	39	57 Å²	57	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-52.4	-37.3	178.2	167.7	0	0	0	0	112.6	V1265 R1266 I1368 L1374	V1265-V1370 HydrophobicContact CG1-CB 4.33Å; V1265-V1370 HydrophobicContact CG1-CG1 3.87Å; V1265-V1370 HydrophobicContact CG1-CG2 4.07Å; R1266-V1370 HydrophobicContact CG-CG1 3.93Å; I1368-V1370 PolarHBondContact O-N 3.13Å; V1370-L1374 HydrophobicContact CG1-CD1 3.8Å; V1370-L1374 HydrophobicContact CG1-CG 4.44Å; V1370-L1374 VanDerWaalsContact O-CG 3.3Å; V1370-L1374 WeakPolarHBondContact O-CG 3.32Å; V1370-L1374 PolarHBondContact O-N 3.1Å; V1370-L1374 VanDerWaalsContact O-N 3.11Å
1371	N	90.5	Very high	80.1	Confident	107 Å²	107	50.9 Å²	50.9	57%	0.572	29%	0.292	S	S	*	.	H	α-helix	trans	-72.6	-38.5	-177.6	-67.4	-32.4	0	0	0	111.2	D1369 A1375	D1369-N1371 PolarHBondContact O-N 3.24Å; D1369-N1371 PolarHBondContact OD1-N 2.99Å; D1369-N1371 VanDerWaalsContact OD1-N 3.12Å; N1371-A1375 VanDerWaalsContact O-CB 3.32Å; N1371-A1375 WeakPolarHBondContact O-CB 3.28Å; N1371-A1375 PolarHBondContact O-N 2.93Å
1372	Y	90.6	Very high	82.8	Confident	36 Å²	36	46.1 Å²	46.1	14%	0.141	26%	0.259	C	S	.	.	H	α-helix	trans	-57.8	-51.3	172.4	178.4	-95.5	0	0	0	111.5	I1277 I1328 A1337 D1369 L1374 A1375 H1376 Q1377	I1277-Y1372 HydrophobicContact CD1-CE1 4.11Å; I1328-Y1372 HydrophobicContact CB-CD1 3.63Å; I1328-Y1372 HydrophobicContact CB-CE1 3.95Å; I1328-Y1372 HydrophobicContact CB-CG 4.06Å; I1328-Y1372 HydrophobicContact CG1-CD1 3.61Å; I1328-Y1372 HydrophobicContact CG1-CE1 3.35Å; I1328-Y1372 HydrophobicContact CG1-CE2 4.31Å; I1328-Y1372 HydrophobicContact CG1-CG 4.2Å; I1328-Y1372 HydrophobicContact CG2-CD1 4.01Å; I1328-Y1372 HydrophobicContact CG2-CD2 4.31Å; I1328-Y1372 HydrophobicContact CG2-CG 3.88Å; A1337-Y1372 HydrophobicContact CB-CD2 3.61Å; A1337-Y1372 HydrophobicContact CB-CE2 3.86Å; A1337-Y1372 HydrophobicContact CB-CG 4.49Å; D1369-Y1372 VanDerWaalsContact CG-CB 3.43Å; D1369-Y1372 WeakPolarHBondContact O-CB 3.15Å; D1369-Y1372 PolarHBondContact O-N 3.11Å; D1369-Y1372 VanDerWaalsContact O-N 3.15Å; D1369-Y1372 PolarHBondContact OD1-N 3.46Å; Y1372-L1374 PolarHBondContact O-N 3.48Å; Y1372-A1375 PolarHBondContact O-N 3.17Å; Y1372-H1376 HydrophobicContact CD2-CB 3.77Å; Y1372-H1376 AromaticContact CD2-CG 3.74Å; Y1372-H1376 AromaticContact CD2-ND1 3.74Å; Y1372-H1376 HydrophobicContact CE2-CB 3.61Å; Y1372-H1376 AromaticContact CE2-CG 3.88Å; Y1372-H1376 HydrophobicContact CG-CB 4.36Å; Y1372-H1376 WeakPolarHBondContact O-CA 3.35Å; Y1372-H1376 VanDerWaalsContact O-CB 3.32Å; Y1372-H1376 WeakPolarHBondContact O-CB 3.38Å; Y1372-H1376 PolarHBondContact O-N 3.31Å; Y1372-Q1377 HydrophobicContact CD1-CG 4.22Å; Y1372-Q1377 HydrophobicContact CE1-CG 3.66Å
1373	Y	93.7	Very high	85.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.	I	π-helix	trans	-67.5	-34.7	-177.3	-73.8	-83.2	0	0	0	113.4	F1275 I1277 V1327 I1328 I1368 D1369 Q1377 I1378	F1275-Y1373 HydrophobicContact CB-CE1 4.07Å; F1275-Y1373 HydrophobicContact CB-CE2 4.33Å; F1275-Y1373 AromaticContact CD1-CD1 3.89Å; F1275-Y1373 HydrophobicContact CD1-CD1 3.89Å; F1275-Y1373 AromaticContact CD1-CD2 3.75Å; F1275-Y1373 HydrophobicContact CD1-CD2 3.75Å; F1275-Y1373 HydrophobicContact CD1-CE1 4.07Å; F1275-Y1373 AromaticContact CD1-CE2 3.97Å; F1275-Y1373 HydrophobicContact CD1-CE2 3.97Å; F1275-Y1373 AromaticContact CD1-CG 3.73Å; F1275-Y1373 HydrophobicContact CD1-CG 3.73Å; F1275-Y1373 HydrophobicContact CE1-CD2 4.35Å; F1275-Y1373 HydrophobicContact CE1-CG 4.25Å; F1275-Y1373 VanDerWaalsContact O-CE1 3.28Å; F1275-Y1373 WeakPolarHBondContact O-CE1 3.33Å; F1275-Y1373 VanDerWaalsContact O-CZ 3.3Å; F1275-Y1373 PolarHBondContact O-OH 2.74Å; I1277-Y1373 HydrophobicContact CD1-CE1 4.17Å; I1277-Y1373 HydrophobicContact CG1-CE1 4.41Å; V1327-Y1373 WeakPolarHBondContact CA-OH 3.32Å; V1327-Y1373 HydrophobicContact CG1-CE2 4.48Å; V1327-Y1373 WeakPolarHBondContact CG1-OH 3.4Å; I1328-Y1373 HydrophobicContact CB-CE2 4.23Å; I1328-Y1373 PolarHBondContact N-OH 2.82Å; I1368-Y1373 HydrophobicContact CG2-CD2 3.9Å; I1368-Y1373 HydrophobicContact CG2-CE2 3.85Å; D1369-Y1373 VanDerWaalsContact O-CD2 3.29Å; D1369-Y1373 WeakPolarHBondContact O-CD2 3.44Å; D1369-Y1373 PolarHBondContact O-N 3.37Å; Y1373-Q1377 HydrophobicContact CD1-CB 4.11Å; Y1373-Q1377 HydrophobicContact CD1-CG 3.82Å; Y1373-Q1377 HydrophobicContact CE1-CG 4.24Å; Y1373-Q1377 WeakPolarHBondContact O-CB 3.26Å; Y1373-Q1377 PolarHBondContact O-N 3.47Å; Y1373-I1378 PolarHBondContact O-N 3.07Å
1374	L	93.9	Very high	87.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-68.4	-51	174.3	-67.4	171.7	0	0	0	111.7	A1262 V1370 Y1372 I1378 H1379 L1401 L1403	A1262-L1374 HydrophobicContact CB-CD2 3.75Å; V1370-L1374 HydrophobicContact CG1-CD1 3.8Å; V1370-L1374 HydrophobicContact CG1-CG 4.44Å; V1370-L1374 VanDerWaalsContact O-CG 3.3Å; V1370-L1374 WeakPolarHBondContact O-CG 3.32Å; V1370-L1374 PolarHBondContact O-N 3.1Å; V1370-L1374 VanDerWaalsContact O-N 3.11Å; Y1372-L1374 PolarHBondContact O-N 3.48Å; L1374-I1378 HydrophobicContact CD2-CD1 4.35Å; L1374-H1379 VanDerWaalsContact O-CB 3.28Å; L1374-H1379 WeakPolarHBondContact O-CB 3.42Å; L1374-H1379 PolarHBondContact O-N 3.11Å; L1374-L1401 HydrophobicContact CD2-CD2 4.14Å; L1374-L1403 HydrophobicContact CB-CD1 4.42Å; L1374-L1403 HydrophobicContact CB-CD2 4.09Å
1375	A	89	Confident	88.8	Confident	15 Å²	15	34.4 Å²	34.4	12%	0.124	18%	0.181	C	C	.	.	I	π-helix	trans	-86.9	-30.8	-170.3	0	0	0	0	0	115.2	N1371 Y1372 P1380 L1403	N1371-A1375 VanDerWaalsContact O-CB 3.32Å; N1371-A1375 WeakPolarHBondContact O-CB 3.28Å; N1371-A1375 PolarHBondContact O-N 2.93Å; Y1372-A1375 PolarHBondContact O-N 3.17Å; A1375-P1380 WeakPolarHBondContact O-CD 3.23Å; A1375-L1403 HydrophobicContact CB-CD1 3.85Å; A1375-L1403 HydrophobicContact CB-CD2 4.2Å
1376	H	86.8	Confident	89.7	Confident	65 Å²	65	27.8 Å²	27.8	30%	0.301	15%	0.146	S	C	.	.	I	π-helix	trans	-113.5	-6.5	-173.6	-54.6	78.1	0	0	0	113.8	W1226 Y1372 A1517	W1226-H1376 WeakPolarHBondContact CZ3-O 3.44Å; Y1372-H1376 HydrophobicContact CD2-CB 3.77Å; Y1372-H1376 AromaticContact CD2-CG 3.74Å; Y1372-H1376 AromaticContact CD2-ND1 3.74Å; Y1372-H1376 HydrophobicContact CE2-CB 3.61Å; Y1372-H1376 AromaticContact CE2-CG 3.88Å; Y1372-H1376 HydrophobicContact CG-CB 4.36Å; Y1372-H1376 WeakPolarHBondContact O-CA 3.35Å; Y1372-H1376 VanDerWaalsContact O-CB 3.32Å; Y1372-H1376 WeakPolarHBondContact O-CB 3.38Å; Y1372-H1376 PolarHBondContact O-N 3.31Å; H1376-A1517 WeakPolarHBondContact NE2-CB 3.2Å
1377	Q	90.1	Very high	89.8	Confident	8 Å²	8	30.5 Å²	30.5	4%	0.037	17%	0.171	C	C	.	.	I	π-helix	trans	-119	-57.1	177.1	-65.1	-72.4	-80.9	0	0	112.1	A1230 I1277 Y1372 Y1373 V1381	A1230-Q1377 HydrophobicContact CB-CB 4.11Å; A1230-Q1377 WeakPolarHBondContact CB-O 3.49Å; I1277-Q1377 HydrophobicContact CD1-CG 4.48Å; Y1372-Q1377 HydrophobicContact CD1-CG 4.22Å; Y1372-Q1377 HydrophobicContact CE1-CG 3.66Å; Y1373-Q1377 HydrophobicContact CD1-CB 4.11Å; Y1373-Q1377 HydrophobicContact CD1-CG 3.82Å; Y1373-Q1377 HydrophobicContact CE1-CG 4.24Å; Y1373-Q1377 WeakPolarHBondContact O-CB 3.26Å; Y1373-Q1377 PolarHBondContact O-N 3.47Å; Q1377-V1381 WeakPolarHBondContact O-CG2 3.24Å
1378	I	94.1	Very high	89.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.164	C	C	.	.	I	π-helix	trans	-77.5	-51.7	-178.3	-60.6	169.3	0	0	0	111.7	L1229 V1233 L1258 T1261 Y1373 L1374 V1381 V1382 L1401	L1229-I1378 HydrophobicContact CD2-CD1 3.92Å; L1229-I1378 HydrophobicContact CG-CD1 4.02Å; L1229-I1378 HydrophobicContact CG-CG1 4.49Å; V1233-I1378 HydrophobicContact CG1-CG2 4.07Å; L1258-I1378 HydrophobicContact CD2-CG2 4.05Å; T1261-I1378 HydrophobicContact CG2-CD1 4.2Å; Y1373-I1378 PolarHBondContact O-N 3.07Å; L1374-I1378 HydrophobicContact CD2-CD1 4.35Å; I1378-V1381 PolarHBondContact O-N 3.49Å; I1378-V1382 HydrophobicContact CG2-CG2 4.15Å; I1378-V1382 WeakPolarHBondContact O-CG2 3.25Å; I1378-V1382 PolarHBondContact O-N 3.28Å; I1378-V1382 VanDerWaalsContact O-N 3.12Å; I1378-L1401 HydrophobicContact CB-CD1 4.47Å; I1378-L1401 HydrophobicContact CG2-CD1 4.12Å; I1378-L1401 HydrophobicContact CG2-CD2 3.94Å
1379	H	92.1	Very high	89.1	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.037	16%	0.158	C	C	.	.	H	α-helix	trans	-55.1	-46.7	-175.1	-177.4	-74.7	0	0	0	114.2	L1374 S1383 P1394 L1401 L1403 Y1408	L1374-H1379 VanDerWaalsContact O-CB 3.28Å; L1374-H1379 WeakPolarHBondContact O-CB 3.42Å; L1374-H1379 PolarHBondContact O-N 3.11Å; H1379-S1383 PolarHBondContact CE1-OG 2.93Å; H1379-S1383 PolarHBondContact ND1-OG 3.04Å; H1379-S1383 WeakPolarHBondContact O-CB 3.18Å; H1379-S1383 PolarHBondContact O-N 3.08Å; H1379-S1383 PolarHBondContact O-OG 3.36Å; H1379-P1394 PolarHBondContact NE2-O 3.22Å; H1379-L1401 HydrophobicContact CB-CD1 3.69Å; H1379-L1403 HydrophobicContact CB-CD1 4.38Å; H1379-Y1408 AromaticContact CE1-CD1 3.26Å; H1379-Y1408 WeakPolarHBondContact CE1-CD1 3.32Å; H1379-Y1408 AromaticContact CE1-CE1 3.23Å; H1379-Y1408 WeakPolarHBondContact CE1-CE1 3.34Å; H1379-Y1408 AromaticContact ND1-CE1 3.54Å; H1379-Y1408 AromaticContact NE2-CD1 3.57Å; H1379-Y1408 AromaticContact NE2-CE1 3.61Å; H1379-Y1408 AromaticContact NE2-CG 3.98Å
1380	P	86.9	Confident	88.6	Confident	28 Å²	28	35.5 Å²	35.5	18%	0.182	19%	0.19	C	C	.	.	H	α-helix	trans	-69.2	-39.6	-175.7	-20.5	34.7	0	0	0	112.8	W1226 A1375 R1384	W1226-P1380 HydrophobicContact CH2-CB 4.08Å; W1226-P1380 HydrophobicContact CZ3-CB 4.3Å; W1226-P1380 HydrophobicContact CZ3-CG 4.43Å; A1375-P1380 WeakPolarHBondContact O-CD 3.23Å; P1380-R1384 WeakPolarHBondContact O-CG 3.44Å; P1380-R1384 PolarHBondContact O-N 2.96Å
1381	V	88.5	Confident	88	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-53.4	177.8	174.1	0	0	0	0	110	D1220 I1221 W1226 A1230 Q1377 I1378 S1383 R1384 L1385	D1220-V1381 HydrophobicContact CB-CB 4.44Å; D1220-V1381 HydrophobicContact CB-CG1 4.15Å; D1220-V1381 HydrophobicContact CB-CG2 3.7Å; I1221-V1381 HydrophobicContact CG2-CG1 3.78Å; W1226-V1381 HydrophobicContact CD2-CG2 3.74Å; W1226-V1381 HydrophobicContact CE3-CG2 3.39Å; W1226-V1381 HydrophobicContact CG-CG2 4.43Å; W1226-V1381 HydrophobicContact CH2-CG2 4.25Å; W1226-V1381 HydrophobicContact CZ3-CG2 3.66Å; A1230-V1381 HydrophobicContact CB-CG2 4.37Å; Q1377-V1381 WeakPolarHBondContact O-CG2 3.24Å; I1378-V1381 PolarHBondContact O-N 3.49Å; V1381-S1383 PolarHBondContact O-N 3.27Å; V1381-R1384 PolarHBondContact O-N 3.12Å; V1381-L1385 HydrophobicContact CG1-CD1 4.08Å; V1381-L1385 WeakPolarHBondContact O-CG 3.48Å; V1381-L1385 PolarHBondContact O-N 3.34Å
1382	V	92.3	Very high	87.8	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-68.4	-38.8	-176	-178.8	0	0	0	0	111.1	V1233 I1254 L1258 I1378 R1384 L1385 V1386 I1397	V1233-V1382 HydrophobicContact CG1-CG2 3.97Å; I1254-V1382 HydrophobicContact CG2-CG1 4.44Å; L1258-V1382 HydrophobicContact CD1-CG1 4.17Å; L1258-V1382 HydrophobicContact CD2-CB 4.42Å; L1258-V1382 HydrophobicContact CD2-CG1 4.15Å; L1258-V1382 HydrophobicContact CD2-CG2 4.07Å; I1378-V1382 HydrophobicContact CG2-CG2 4.15Å; I1378-V1382 WeakPolarHBondContact O-CG2 3.25Å; I1378-V1382 PolarHBondContact O-N 3.28Å; I1378-V1382 VanDerWaalsContact O-N 3.12Å; V1382-R1384 VanDerWaalsContact C-N 3.32Å; V1382-R1384 PolarHBondContact O-N 3.29Å; V1382-L1385 PolarHBondContact O-N 2.94Å; V1382-V1386 WeakPolarHBondContact O-CG2 3.23Å; V1382-V1386 PolarHBondContact O-N 3.27Å; V1382-V1386 VanDerWaalsContact O-N 3.13Å; V1382-I1397 HydrophobicContact CG1-CD1 4.49Å; V1382-I1397 HydrophobicContact CG1-CG2 4.44Å
1383	S	89.7	Confident	87.5	Confident	16 Å²	16	33.1 Å²	33.1	11%	0.112	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-37.7	174.9	-61.9	0	0	0	0	112.8	H1379 V1381 A1387	H1379-S1383 PolarHBondContact CE1-OG 2.93Å; H1379-S1383 PolarHBondContact ND1-OG 3.04Å; H1379-S1383 WeakPolarHBondContact O-CB 3.18Å; H1379-S1383 PolarHBondContact O-N 3.08Å; H1379-S1383 PolarHBondContact O-OG 3.36Å; V1381-S1383 PolarHBondContact O-N 3.27Å; S1383-A1387 WeakPolarHBondContact O-CB 3.36Å; S1383-A1387 PolarHBondContact O-N 3.17Å
1384	R	84.7	Confident	87.1	Confident	110 Å²	110	34.3 Å²	34.3	42%	0.415	21%	0.208	S	C	.	.	H	α-helix	trans	-70.4	-41.1	174.1	-75.7	-172	-70.1	-99.6	1.9	112.6	D1220 P1380 V1381 V1382 V1386 A1387	D1220-R1384 IonicContact OD1-CZ 2.71Å; D1220-R1384 IonicContact OD1-NH2 3.26Å; D1220-R1384 PolarHBondContact OD1-NH2 3.16Å; D1220-R1384 IonicContact OD2-CZ 2.77Å; D1220-R1384 VanDerWaalsContact OD2-CZ 3.22Å; D1220-R1384 IonicContact OD2-NE 3.74Å; D1220-R1384 PolarHBondContact OD2-NE 3.08Å; D1220-R1384 IonicContact OD2-NH2 2.69Å; D1220-R1384 PolarHBondContact OD2-NH2 2.94Å; P1380-R1384 WeakPolarHBondContact O-CG 3.44Å; P1380-R1384 PolarHBondContact O-N 2.96Å; V1381-R1384 PolarHBondContact O-N 3.12Å; V1382-R1384 VanDerWaalsContact C-N 3.32Å; V1382-R1384 PolarHBondContact O-N 3.29Å; R1384-V1386 VanDerWaalsContact C-N 3.34Å; R1384-V1386 PolarHBondContact O-N 3.26Å; R1384-A1387 PolarHBondContact O-N 2.96Å
1385	L	88	Confident	86.7	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-38	179.5	-71.6	174.2	0	0	0	113.2	L1175 L1177 L1219 C1237 V1238 V1381 V1382	L1175-L1385 HydrophobicContact CD2-CD2 4.49Å; L1177-L1385 HydrophobicContact CD1-CD2 4.14Å; L1219-L1385 HydrophobicContact CD1-CD2 4.02Å; L1219-L1385 HydrophobicContact CD2-CD2 4.46Å; C1237-L1385 HydrophobicContact CB-CD1 4.1Å; V1238-L1385 HydrophobicContact CG2-CD1 3.98Å; V1238-L1385 HydrophobicContact CG2-CD2 3.64Å; V1238-L1385 HydrophobicContact CG2-CG 4.41Å; V1381-L1385 HydrophobicContact CG1-CD1 4.08Å; V1381-L1385 WeakPolarHBondContact O-CG 3.48Å; V1381-L1385 PolarHBondContact O-N 3.34Å; V1382-L1385 PolarHBondContact O-N 2.94Å
1386	V	88.7	Confident	86.8	Confident	5 Å²	5	39.4 Å²	39.4	3%	0.03	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	4.9	-177.6	-50.9	0	0	0	0	114.2	L1241 I1254 V1382 R1384 P1388 I1389 T1392 I1397	L1241-V1386 HydrophobicContact CD1-CG1 4.47Å; L1241-V1386 HydrophobicContact CD2-CG1 4.5Å; I1254-V1386 HydrophobicContact CD1-CG1 4.37Å; V1382-V1386 WeakPolarHBondContact O-CG2 3.23Å; V1382-V1386 PolarHBondContact O-N 3.27Å; V1382-V1386 VanDerWaalsContact O-N 3.13Å; R1384-V1386 VanDerWaalsContact C-N 3.34Å; R1384-V1386 PolarHBondContact O-N 3.26Å; V1386-P1388 VanDerWaalsContact C-CD 3.49Å; V1386-I1389 WeakPolarHBondContact O-CB 3.35Å; V1386-I1389 PolarHBondContact O-N 3.44Å; V1386-T1392 HydrophobicContact CB-CG2 3.89Å; V1386-T1392 HydrophobicContact CG2-CG2 3.48Å; V1386-T1392 VanDerWaalsContact CG2-CG2 3.48Å; V1386-I1397 HydrophobicContact CG2-CD1 3.55Å
1387	A	83.2	Confident	87	Confident	79 Å²	79	36.4 Å²	36.4	65%	0.653	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-38.2	-179.6	0	0	0	0	0	114.7	S1383 R1384 I1389	S1383-A1387 WeakPolarHBondContact O-CB 3.36Å; S1383-A1387 PolarHBondContact O-N 3.17Å; R1384-A1387 PolarHBondContact O-N 2.96Å; A1387-I1389 PolarHBondContact O-N 3.37Å
1388	P	82	Confident	87	Confident	42 Å²	42	36 Å²	36	27%	0.273	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	8.1	176.9	-9.3	27	0	0	0	114.3	L1175 L1177 V1386	L1175-P1388 HydrophobicContact CD1-CG 4.44Å; L1177-P1388 HydrophobicContact CD2-CG 3.55Å; V1386-P1388 VanDerWaalsContact C-CD 3.49Å
1389	I	82.6	Confident	86.9	Confident	18 Å²	18	39.2 Å²	39.2	9%	0.092	23%	0.227	C	C	.	.	S	Bend	trans	-113.7	109.4	-169.2	-52.9	-176.9	0	0	0	109.9	L1175 L1241 L1251 V1386 A1387	L1175-I1389 HydrophobicContact CD1-CD1 4.38Å; L1241-I1389 HydrophobicContact CD1-CD1 3.89Å; L1241-I1389 HydrophobicContact CD2-CD1 3.37Å; L1241-I1389 HydrophobicContact CG-CD1 4.2Å; L1251-I1389 HydrophobicContact CD2-CG2 4.23Å; V1386-I1389 WeakPolarHBondContact O-CB 3.35Å; V1386-I1389 PolarHBondContact O-N 3.44Å; A1387-I1389 PolarHBondContact O-N 3.37Å
1390	E	80.8	Confident	87	Confident	164 Å²	164	39.4 Å²	39.4	77%	0.766	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	144.7	173.8	-60.5	178.7	159.2	0	0	111.9	L1251	L1251-E1390 WeakPolarHBondContact CD1-O 3.34Å
1391	G	80.7	Confident	87.2	Confident	72 Å²	72	38.1 Å²	38.1	74%	0.742	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	102	-8.2	178.5	0	0	0	0	0	115.4
1392	T	84.8	Confident	87.3	Confident	26 Å²	26	40.3 Å²	40.3	16%	0.16	24%	0.243	C	C	.	.			trans	-129.9	174.6	175.7	-167.2	0	0	0	0	112.8	L1251 H1255 V1386	L1251-T1392 HydrophobicContact CD2-CG2 3.94Å; H1255-T1392 PolarHBondContact NE2-OG1 2.84Å; V1386-T1392 HydrophobicContact CB-CG2 3.89Å; V1386-T1392 HydrophobicContact CG2-CG2 3.48Å; V1386-T1392 VanDerWaalsContact CG2-CG2 3.48Å
1393	S	84.9	Confident	87.2	Confident	34 Å²	34	41.6 Å²	41.6	24%	0.238	25%	0.25	C	C	.	.			trans	-157.1	158.4	175.3	63.5	0	0	0	0	112	A1395 R1396 I1397	S1393-A1395 PolarHBondContact O-N 3.2Å; S1393-R1396 WeakPolarHBondContact O-CA 3.17Å; S1393-R1396 WeakPolarHBondContact O-CB 3.4Å; S1393-R1396 PolarHBondContact O-N 3.01Å; S1393-R1396 PolarHBondContact OG-N 3.44Å; S1393-I1397 WeakPolarHBondContact O-CG1 3.5Å; S1393-I1397 PolarHBondContact O-N 3.4Å
1394	P	84.5	Confident	86.9	Confident	26 Å²	26	45.8 Å²	45.8	17%	0.169	27%	0.271	C	S	.	.	H	α-helix	trans	-55.3	-32.3	172.3	-25.2	35.7	0	0	0	113.2	H1379 I1397 A1398 N1412	H1379-P1394 PolarHBondContact NE2-O 3.22Å; P1394-I1397 PolarHBondContact O-N 3.06Å; P1394-A1398 WeakPolarHBondContact O-CB 3.41Å; P1394-A1398 PolarHBondContact O-N 3.48Å; P1394-N1412 WeakPolarHBondContact CD-OD1 3.44Å; P1394-N1412 WeakPolarHBondContact CG-OD1 3.46Å
1395	A	86.2	Confident	86.8	Confident	8 Å²	8	41.7 Å²	41.7	7%	0.066	26%	0.259	C	S	.	.	H	α-helix	trans	-67.6	-40.9	173.6	0	0	0	0	0	112.4	S1393 I1397 A1398 D1399 P1405 R1409	S1393-A1395 PolarHBondContact O-N 3.2Å; A1395-I1397 VanDerWaalsContact C-N 3.35Å; A1395-A1398 WeakPolarHBondContact O-CB 3.3Å; A1395-A1398 PolarHBondContact O-N 2.83Å; A1395-D1399 PolarHBondContact O-N 3.12Å; A1395-P1405 HydrophobicContact CB-CB 4.16Å; A1395-R1409 HydrophobicContact CB-CG 3.59Å
1396	R	90.3	Very high	86.2	Confident	113 Å²	113	44.6 Å²	44.6	43%	0.426	28%	0.279	S	S	.	.	H	α-helix	trans	-67	-35.4	174.6	178.3	55.9	175.8	-173	-3.1	112.3	H1255 S1393 A1398 D1399 C1400	H1255-R1396 VanDerWaalsContact CE1-CG 3.46Å; H1255-R1396 WeakPolarHBondContact CE1-CG 3.42Å; H1255-R1396 PolarHBondContact ND1-NE 2.89Å; H1255-R1396 VanDerWaalsContact ND1-NE 3.11Å; S1393-R1396 WeakPolarHBondContact O-CA 3.17Å; S1393-R1396 WeakPolarHBondContact O-CB 3.4Å; S1393-R1396 PolarHBondContact O-N 3.01Å; S1393-R1396 PolarHBondContact OG-N 3.44Å; R1396-A1398 VanDerWaalsContact C-N 3.33Å; R1396-D1399 WeakPolarHBondContact O-CB 3.1Å; R1396-D1399 PolarHBondContact O-N 3.32Å; R1396-C1400 PolarHBondContact O-N 2.71Å; R1396-C1400 PolarHBondContact O-SG 3.26Å; R1396-C1400 VanDerWaalsContact O-SG 3.39Å
1397	I	91.5	Very high	85.3	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-67.5	-37.4	174.7	-62.4	164	0	0	0	110.3	L1258 V1382 V1386 S1393 P1394 A1395 C1400 L1401	L1258-I1397 HydrophobicContact CD1-CG2 4.23Å; V1382-I1397 HydrophobicContact CG1-CD1 4.49Å; V1382-I1397 HydrophobicContact CG1-CG2 4.44Å; V1386-I1397 HydrophobicContact CG2-CD1 3.55Å; S1393-I1397 WeakPolarHBondContact O-CG1 3.5Å; S1393-I1397 PolarHBondContact O-N 3.4Å; P1394-I1397 PolarHBondContact O-N 3.06Å; A1395-I1397 VanDerWaalsContact C-N 3.35Å; I1397-C1400 PolarHBondContact O-N 3.36Å; I1397-L1401 HydrophobicContact CG2-CD1 4.13Å; I1397-L1401 WeakPolarHBondContact O-CG 3.44Å; I1397-L1401 PolarHBondContact O-N 3.2Å
1398	A	90.6	Very high	84.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-45.5	171.1	0	0	0	0	0	111.9	P1394 A1395 R1396 C1400 L1401 G1402 L1403 Y1408	P1394-A1398 WeakPolarHBondContact O-CB 3.41Å; P1394-A1398 PolarHBondContact O-N 3.48Å; A1395-A1398 WeakPolarHBondContact O-CB 3.3Å; A1395-A1398 PolarHBondContact O-N 2.83Å; R1396-A1398 VanDerWaalsContact C-N 3.33Å; A1398-C1400 PolarHBondContact O-N 2.84Å; A1398-L1401 PolarHBondContact O-N 3.02Å; A1398-G1402 PolarHBondContact O-N 3.19Å; A1398-L1403 HydrophobicContact CB-CB 4.08Å; A1398-L1403 PolarHBondContact O-N 3.07Å; A1398-Y1408 HydrophobicContact CB-CD2 3.36Å; A1398-Y1408 HydrophobicContact CB-CE2 3.65Å; A1398-Y1408 HydrophobicContact CB-CG 4.02Å
1399	D	92	Very high	84	Confident	68 Å²	68	48.1 Å²	48.1	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-54.9	-50.1	173.7	-70.2	-41.5	0	0	0	111.4	A1395 R1396 L1401 G1402 P1405	A1395-D1399 PolarHBondContact O-N 3.12Å; R1396-D1399 WeakPolarHBondContact O-CB 3.1Å; R1396-D1399 PolarHBondContact O-N 3.32Å; D1399-L1401 VanDerWaalsContact C-N 3.32Å; D1399-L1401 PolarHBondContact O-N 3.11Å; D1399-G1402 PolarHBondContact O-N 3.15Å; D1399-P1405 WeakPolarHBondContact OD1-CB 3.19Å; D1399-P1405 WeakPolarHBondContact OD1-CG 3.43Å
1400	C	93.1	Very high	82.5	Confident	12 Å²	12	55.4 Å²	55.4	8%	0.081	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-32.6	179.6	-70.4	0	0	0	0	113.5	L1258 T1259 R1396 I1397 A1398 G1402	L1258-C1400 HydrophobicContact CB-CB 4.06Å; L1258-C1400 HydrophobicContact CD1-CB 4.33Å; T1259-C1400 WeakPolarHBondContact CA-O 3.19Å; R1396-C1400 PolarHBondContact O-N 2.71Å; R1396-C1400 PolarHBondContact O-SG 3.26Å; R1396-C1400 VanDerWaalsContact O-SG 3.39Å; I1397-C1400 PolarHBondContact O-N 3.36Å; A1398-C1400 PolarHBondContact O-N 2.84Å; C1400-G1402 VanDerWaalsContact C-N 3.29Å
1401	L	92.9	Very high	80.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-80.9	-8.7	173.9	-67.1	172.6	0	0	0	112.9	L1258 A1262 R1266 L1374 I1378 H1379 I1397 A1398 D1399 L1403	L1258-L1401 HydrophobicContact CB-CD2 4.21Å; L1258-L1401 HydrophobicContact CD2-CD2 3.94Å; L1258-L1401 HydrophobicContact CD2-CG 4.45Å; A1262-L1401 HydrophobicContact CB-CD2 4.04Å; R1266-L1401 PolarHBondContact NH1-O 2.88Å; R1266-L1401 PolarHBondContact NH2-O 3.19Å; L1374-L1401 HydrophobicContact CD2-CD2 4.14Å; I1378-L1401 HydrophobicContact CB-CD1 4.47Å; I1378-L1401 HydrophobicContact CG2-CD1 4.12Å; I1378-L1401 HydrophobicContact CG2-CD2 3.94Å; H1379-L1401 HydrophobicContact CB-CD1 3.69Å; I1397-L1401 HydrophobicContact CG2-CD1 4.13Å; I1397-L1401 WeakPolarHBondContact O-CG 3.44Å; I1397-L1401 PolarHBondContact O-N 3.2Å; A1398-L1401 PolarHBondContact O-N 3.02Å; D1399-L1401 VanDerWaalsContact C-N 3.32Å; D1399-L1401 PolarHBondContact O-N 3.11Å; L1401-L1403 HydrophobicContact CB-CD1 4.17Å; L1401-L1403 HydrophobicContact CB-CG 4.18Å; L1401-L1403 HydrophobicContact CD1-CD1 4.43Å
1402	G	90.1	Very high	79	Confident	47 Å²	47	49 Å²	49	49%	0.485	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	38.2	-175.6	0	0	0	0	0	113.4	R1266 A1398 D1399 C1400	R1266-G1402 PolarHBondContact NH2-O 3.34Å; A1398-G1402 PolarHBondContact O-N 3.19Å; D1399-G1402 PolarHBondContact O-N 3.15Å; C1400-G1402 VanDerWaalsContact C-N 3.29Å
1403	L	89.1	Confident	76.7	Confident	28 Å²	28	52.6 Å²	52.6	15%	0.147	28%	0.281	C	S	.	.	S	Bend	trans	-102.4	164.4	171.4	-58.6	172.4	0	0	0	109.3	L1374 A1375 H1379 A1398 L1401 P1405 Y1408	L1374-L1403 HydrophobicContact CB-CD1 4.42Å; L1374-L1403 HydrophobicContact CB-CD2 4.09Å; A1375-L1403 HydrophobicContact CB-CD1 3.85Å; A1375-L1403 HydrophobicContact CB-CD2 4.2Å; H1379-L1403 HydrophobicContact CB-CD1 4.38Å; A1398-L1403 HydrophobicContact CB-CB 4.08Å; A1398-L1403 PolarHBondContact O-N 3.07Å; L1401-L1403 HydrophobicContact CB-CD1 4.17Å; L1401-L1403 HydrophobicContact CB-CG 4.18Å; L1401-L1403 HydrophobicContact CD1-CD1 4.43Å; L1403-P1405 VanDerWaalsContact O-CD 3.29Å; L1403-P1405 WeakPolarHBondContact O-CD 3.42Å; L1403-Y1408 HydrophobicContact CB-CE2 4.4Å
1404	D	83.9	Confident	74.3	Confident	104 Å²	104	53.4 Å²	53.4	56%	0.556	29%	0.285	S	S	*	.			trans	-72.3	116.6	175.2	175.7	17.1	0	0	0	110.9	S1406 Y1408	D1404-S1406 VanDerWaalsContact CG-OG 3.29Å; D1404-S1406 PolarHBondContact O-N 2.95Å; D1404-S1406 WeakPolarHBondContact OD1-CB 3.41Å; D1404-S1406 PolarHBondContact OD1-N 2.7Å; D1404-S1406 PolarHBondContact OD1-OG 2.71Å; D1404-S1406 WeakPolarHBondContact OD2-CB 3.5Å; D1404-S1406 PolarHBondContact OD2-OG 3.4Å; D1404-Y1408 VanDerWaalsContact O-CD2 3.28Å; D1404-Y1408 WeakPolarHBondContact O-CD2 3.36Å
1405	P	83.6	Confident	71.9	Confident	24 Å²	24	55.4 Å²	55.4	16%	0.156	30%	0.297	C	S	.	.	H	α-helix	trans	-67	-14.7	177.2	32.1	-41.2	0	0	0	113.7	A1395 D1399 L1403 G1407 Y1408 R1409	A1395-P1405 HydrophobicContact CB-CB 4.16Å; D1399-P1405 WeakPolarHBondContact OD1-CB 3.19Å; D1399-P1405 WeakPolarHBondContact OD1-CG 3.43Å; L1403-P1405 VanDerWaalsContact O-CD 3.29Å; L1403-P1405 WeakPolarHBondContact O-CD 3.42Å; P1405-G1407 PolarHBondContact O-N 2.86Å; P1405-Y1408 PolarHBondContact O-N 3.45Å; P1405-R1409 WeakPolarHBondContact O-CG 3.31Å; P1405-R1409 PolarHBondContact O-N 3.15Å; P1405-R1409 VanDerWaalsContact O-N 3.1Å
1406	S	75.3	Confident	69.5	Low	65 Å²	65	59.5 Å²	59.5	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-37.3	-168.6	85.3	0	0	0	0	113.7	D1404	D1404-S1406 VanDerWaalsContact CG-OG 3.29Å; D1404-S1406 PolarHBondContact O-N 2.95Å; D1404-S1406 WeakPolarHBondContact OD1-CB 3.41Å; D1404-S1406 PolarHBondContact OD1-N 2.7Å; D1404-S1406 PolarHBondContact OD1-OG 2.71Å; D1404-S1406 WeakPolarHBondContact OD2-CB 3.5Å; D1404-S1406 PolarHBondContact OD2-OG 3.4Å
1407	G	68.7	Low	66.8	Low	22 Å²	22	57.2 Å²	57.2	23%	0.227	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-50.8	173.9	0	0	0	0	0	111.9	P1405 R1409 R1410	P1405-G1407 PolarHBondContact O-N 2.86Å; G1407-R1409 VanDerWaalsContact C-N 3.26Å; G1407-R1409 PolarHBondContact O-N 2.91Å; G1407-R1410 PolarHBondContact O-N 2.81Å
1408	Y	72	Confident	64.1	Low	17 Å²	17	59 Å²	59	7%	0.067	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-22.6	-175	-59	-79.9	0	0	0	114.4	H1379 A1398 L1403 D1404 P1405 R1410 S1411 P1516	H1379-Y1408 AromaticContact CE1-CD1 3.26Å; H1379-Y1408 WeakPolarHBondContact CE1-CD1 3.32Å; H1379-Y1408 AromaticContact CE1-CE1 3.23Å; H1379-Y1408 WeakPolarHBondContact CE1-CE1 3.34Å; H1379-Y1408 AromaticContact ND1-CE1 3.54Å; H1379-Y1408 AromaticContact NE2-CD1 3.57Å; H1379-Y1408 AromaticContact NE2-CE1 3.61Å; H1379-Y1408 AromaticContact NE2-CG 3.98Å; A1398-Y1408 HydrophobicContact CB-CD2 3.36Å; A1398-Y1408 HydrophobicContact CB-CE2 3.65Å; A1398-Y1408 HydrophobicContact CB-CG 4.02Å; L1403-Y1408 HydrophobicContact CB-CE2 4.4Å; D1404-Y1408 VanDerWaalsContact O-CD2 3.28Å; D1404-Y1408 WeakPolarHBondContact O-CD2 3.36Å; P1405-Y1408 PolarHBondContact O-N 3.45Å; Y1408-R1410 PolarHBondContact O-N 2.94Å; Y1408-S1411 PolarHBondContact O-N 3.45Å; Y1408-S1411 PolarHBondContact O-OG 2.71Å; Y1408-P1516 HydrophobicContact CD1-CB 3.66Å; Y1408-P1516 HydrophobicContact CD1-CG 3.85Å; Y1408-P1516 HydrophobicContact CE1-CB 3.68Å; Y1408-P1516 HydrophobicContact CE1-CG 4.07Å; Y1408-P1516 HydrophobicContact CG-CB 4.3Å
1409	R	67	Low	61.4	Low	160 Å²	160	64.7 Å²	64.7	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-62.6	-25.7	174.6	-77.8	179.7	-173.7	-141.2	0.1	114	A1395 P1405 G1407	A1395-R1409 HydrophobicContact CB-CG 3.59Å; P1405-R1409 WeakPolarHBondContact O-CG 3.31Å; P1405-R1409 PolarHBondContact O-N 3.15Å; P1405-R1409 VanDerWaalsContact O-N 3.1Å; G1407-R1409 VanDerWaalsContact C-N 3.26Å; G1407-R1409 PolarHBondContact O-N 2.91Å
1410	R	51.1	Low	58.7	Low	172 Å²	172	66.8 Å²	66.8	65%	0.649	37%	0.367	S	S	*	.	H	α-helix	trans	-70.5	-37.8	179.3	-64.1	-175.9	-172.1	158.4	7.2	112	G1407 Y1408 N1412 V1413 T1414	G1407-R1410 PolarHBondContact O-N 2.81Å; Y1408-R1410 PolarHBondContact O-N 2.94Å; R1410-N1412 PolarHBondContact O-N 3.08Å; R1410-V1413 PolarHBondContact O-N 3.02Å; R1410-V1413 VanDerWaalsContact O-N 3.12Å; R1410-T1414 PolarHBondContact O-N 3.4Å; R1410-T1414 PolarHBondContact O-OG1 2.88Å
1411	S	46.8	Very low	56	Low	34 Å²	34	68.1 Å²	68.1	24%	0.238	37%	0.373	C	S	.	.	H	α-helix	trans	-51.3	-54.8	-177.8	-18.8	0	0	0	0	112.1	Y1408 V1413 T1414 T1415	Y1408-S1411 PolarHBondContact O-N 3.45Å; Y1408-S1411 PolarHBondContact O-OG 2.71Å; S1411-V1413 PolarHBondContact O-N 3.01Å; S1411-T1414 PolarHBondContact O-N 3.02Å; S1411-T1414 VanDerWaalsContact O-N 3.1Å; S1411-T1414 PolarHBondContact O-OG1 2.9Å; S1411-T1414 VanDerWaalsContact O-OG1 3.05Å; S1411-T1415 PolarHBondContact O-N 2.92Å; S1411-T1415 PolarHBondContact O-OG1 2.92Å
1412	N	39.8	Very low	53.3	Low	66 Å²	66	74.8 Å²	74.8	35%	0.353	40%	0.404	S	S	.	.	H	α-helix	trans	-61.5	-26.8	-178.4	-93.2	42.2	0	0	0	114.5	P1394 R1410	P1394-N1412 WeakPolarHBondContact CD-OD1 3.44Å; P1394-N1412 WeakPolarHBondContact CG-OD1 3.46Å; R1410-N1412 PolarHBondContact O-N 3.08Å
1413	V	36.8	Very low	50.6	Low	102 Å²	102	78.8 Å²	78.8	62%	0.618	42%	0.415	S	S	*	.	H	α-helix	trans	-82.4	-19.1	-178.9	-178	0	0	0	0	111.4	R1410 S1411 V1417	R1410-V1413 PolarHBondContact O-N 3.02Å; R1410-V1413 VanDerWaalsContact O-N 3.12Å; S1411-V1413 PolarHBondContact O-N 3.01Å; V1413-V1417 WeakPolarHBondContact O-CB 3.31Å; V1413-V1417 VanDerWaalsContact O-CG2 3.26Å; V1413-V1417 WeakPolarHBondContact O-CG2 3.4Å
1414	T	34.4	Very low	47.9	Very low	51 Å²	51	80.9 Å²	80.9	31%	0.313	43%	0.426	S	S	.	.	H	α-helix	trans	-99.7	-31.8	175.3	44.7	0	0	0	0	114	R1410 S1411 D1418	R1410-T1414 PolarHBondContact O-N 3.4Å; R1410-T1414 PolarHBondContact O-OG1 2.88Å; S1411-T1414 PolarHBondContact O-N 3.02Å; S1411-T1414 VanDerWaalsContact O-N 3.1Å; S1411-T1414 PolarHBondContact O-OG1 2.9Å; S1411-T1414 VanDerWaalsContact O-OG1 3.05Å; T1414-D1418 WeakPolarHBondContact CB-OD2 3.17Å; T1414-D1418 VanDerWaalsContact CG2-OD2 3.32Å; T1414-D1418 WeakPolarHBondContact CG2-OD2 3.43Å; T1414-D1418 VanDerWaalsContact O-CB 3.32Å; T1414-D1418 WeakPolarHBondContact O-CB 3.29Å; T1414-D1418 PolarHBondContact O-N 3.43Å
1415	T	34.3	Very low	45.7	Very low	68 Å²	68	81.1 Å²	81.1	42%	0.417	43%	0.433	S	S	.	.	H	α-helix	trans	-70.7	-36.6	-179.4	52.2	0	0	0	0	112.9	S1411 V1417	S1411-T1415 PolarHBondContact O-N 2.92Å; S1411-T1415 PolarHBondContact O-OG1 2.92Å; T1415-V1417 VanDerWaalsContact C-N 3.34Å
1416	V	35.4	Very low	43.3	Very low	95 Å²	95	86.6 Å²	86.6	58%	0.576	46%	0.461	S	S	*	.	H	α-helix	trans	-91.1	3.9	-177.6	-165.3	0	0	0	0	112.4
1417	V	34.3	Very low	41.5	Very low	65 Å²	65	89 Å²	89	39%	0.394	47%	0.468	S	S	.	.	H	α-helix	trans	-137.9	-15.8	-173.4	-162.6	0	0	0	0	113.4	V1413 T1415 D1421	V1413-V1417 WeakPolarHBondContact O-CB 3.31Å; V1413-V1417 VanDerWaalsContact O-CG2 3.26Å; V1413-V1417 WeakPolarHBondContact O-CG2 3.4Å; T1415-V1417 VanDerWaalsContact C-N 3.34Å; V1417-D1421 WeakPolarHBondContact O-CB 3.3Å
1418	D	34.6	Very low	39.8	Very low	39 Å²	39	90 Å²	90	21%	0.209	48%	0.477	C	S	.	.	H	α-helix	trans	-101.1	-38.2	169.2	-57	-50.9	0	0	0	112.1	T1414 D1421 E1422 K1561	T1414-D1418 WeakPolarHBondContact CB-OD2 3.17Å; T1414-D1418 VanDerWaalsContact CG2-OD2 3.32Å; T1414-D1418 WeakPolarHBondContact CG2-OD2 3.43Å; T1414-D1418 VanDerWaalsContact O-CB 3.32Å; T1414-D1418 WeakPolarHBondContact O-CB 3.29Å; T1414-D1418 PolarHBondContact O-N 3.43Å; D1418-D1421 PolarHBondContact O-N 3.3Å; D1418-E1422 PolarHBondContact O-N 3.23Å; D1418-E1422 VanDerWaalsContact O-N 3.13Å; D1418-K1561 IonicContact OD2-NZ 3.99Å; D1418-K1561 PolarHBondContact OD2-NZ 3.18Å
1419	E	35.2	Very low	38.1	Very low	120 Å²	120	98 Å²	98	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-71.9	-38.8	-176.5	-63.1	-162.9	161	0	0	113.4	D1421	E1419-D1421 VanDerWaalsContact C-N 3.33Å
1420	D	34.8	Very low	36.5	Very low	111 Å²	111	95.1 Å²	95.1	59%	0.594	52%	0.517	S	S	*	.	H	α-helix	trans	-81.5	-8.9	176.8	-67.8	-41.5	0	0	0	113.5	N1424	D1420-N1424 WeakPolarHBondContact O-CB 3.31Å
1421	D	35.3	Very low	35.8	Very low	41 Å²	41	92.1 Å²	92.1	22%	0.219	52%	0.523	C	S	.	.	H	α-helix	trans	-111.3	-17	-171.4	-159.8	68.4	0	0	0	112.7	V1417 D1418 E1419 I1427 R1571	V1417-D1421 WeakPolarHBondContact O-CB 3.3Å; D1418-D1421 PolarHBondContact O-N 3.3Å; E1419-D1421 VanDerWaalsContact C-N 3.33Å; D1421-I1427 WeakPolarHBondContact OD1-CD1 3.35Å; D1421-R1571 IonicContact OD2-CZ 2.88Å; D1421-R1571 IonicContact OD2-NH1 2.87Å; D1421-R1571 PolarHBondContact OD2-NH1 3.27Å; D1421-R1571 IonicContact OD2-NH2 2.81Å; D1421-R1571 PolarHBondContact OD2-NH2 3.03Å
1422	E	35.9	Very low	35.4	Very low	139 Å²	139	92.1 Å²	92.1	65%	0.65	53%	0.528	S	S	*	.	H	α-helix	trans	-88.4	-32.1	165.7	-68.3	-171.7	150.2	0	0	112.1	D1418	D1418-E1422 PolarHBondContact O-N 3.23Å; D1418-E1422 VanDerWaalsContact O-N 3.13Å
1423	N	34.1	Very low	35.8	Very low	132 Å²	132	92.7 Å²	92.7	71%	0.706	53%	0.528	S	S	*	.	S	Bend	trans	-93.1	2.7	-178.6	-75.3	-7.5	0	0	0	115.2	P1425	N1423-P1425 WeakPolarHBondContact O-CD 3.31Å
1424	N	33.4	Very low	36.3	Very low	71 Å²	71	92.1 Å²	92.1	38%	0.38	53%	0.528	S	S	.	.			trans	-111.2	89.1	-178.6	-172.6	-5.2	0	0	0	112.3	D1420 D1426 I1427	D1420-N1424 WeakPolarHBondContact O-CB 3.31Å; N1424-D1426 PolarHBondContact O-N 3.45Å; N1424-D1426 VanDerWaalsContact O-N 3.1Å; N1424-D1426 WeakPolarHBondContact OD1-CB 3.45Å; N1424-D1426 PolarHBondContact OD1-N 3.45Å; N1424-D1426 VanDerWaalsContact OD1-N 3.08Å; N1424-I1427 PolarHBondContact O-N 3.34Å
1425	P	36.1	Very low	37.2	Very low	109 Å²	109	93.4 Å²	93.4	71%	0.708	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-67.2	-6	178.4	28.6	-35.5	0	0	0	114.2	N1423 I1427 G1428	N1423-P1425 WeakPolarHBondContact O-CD 3.31Å; P1425-I1427 VanDerWaalsContact C-N 3.35Å; P1425-G1428 WeakPolarHBondContact O-CA 3.23Å; P1425-G1428 PolarHBondContact O-N 3.18Å
1426	D	34.3	Very low	38.3	Very low	140 Å²	140	92.3 Å²	92.3	75%	0.749	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-85.1	-2.2	173.7	-76.8	-33.5	0	0	0	114	N1424 G1428	N1424-D1426 PolarHBondContact O-N 3.45Å; N1424-D1426 VanDerWaalsContact O-N 3.1Å; N1424-D1426 WeakPolarHBondContact OD1-CB 3.45Å; N1424-D1426 PolarHBondContact OD1-N 3.45Å; N1424-D1426 VanDerWaalsContact OD1-N 3.08Å; D1426-G1428 PolarHBondContact O-N 3.01Å
1427	I	37.2	Very low	39	Very low	116 Å²	116	91.8 Å²	91.8	60%	0.595	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-84.1	25.5	148.6	-40.7	-173.2	0	0	0	110.1	D1421 N1424 P1425	D1421-I1427 WeakPolarHBondContact OD1-CD1 3.35Å; N1424-I1427 PolarHBondContact O-N 3.34Å; P1425-I1427 VanDerWaalsContact C-N 3.35Å
1428	G	32.4	Very low	39.6	Very low	41 Å²	41	95.9 Å²	95.9	42%	0.423	55%	0.545	S	S	.	.	S	Bend	trans	-53.6	168.2	163.4	0	0	0	0	0	112.3	P1425 D1426 S1430	P1425-G1428 WeakPolarHBondContact O-CA 3.23Å; P1425-G1428 PolarHBondContact O-N 3.18Å; D1426-G1428 PolarHBondContact O-N 3.01Å; G1428-S1430 PolarHBondContact O-N 2.94Å
1429	F	36.8	Very low	40.4	Very low	185 Å²	185	96.1 Å²	96.1	81%	0.811	55%	0.55	S	S	*	.			trans	-75.6	56.9	-159.5	-140	-99.6	0	0	0	113.6	S1431	F1429-S1431 PolarHBondContact O-N 3.05Å
1430	S	33.6	Very low	41.4	Very low	100 Å²	100	94.1 Å²	94.1	70%	0.699	56%	0.562	S	S	*	*			trans	-53.2	128.7	178.5	76.6	0	0	0	0	109.2	G1428 G1432	G1428-S1430 PolarHBondContact O-N 2.94Å; S1430-G1432 PolarHBondContact O-N 2.98Å
1431	S	36	Very low	42.7	Very low	109 Å²	109	91.4 Å²	91.4	76%	0.762	55%	0.547	S	S	*	.	S	Bend	trans	-70.2	11.2	-154.7	59.8	0	0	0	0	116.5	F1429	F1429-S1431 PolarHBondContact O-N 3.05Å
1432	G	39.3	Very low	44.7	Very low	35 Å²	35	90.4 Å²	90.4	36%	0.361	54%	0.542	S	S	.	.			trans	-95.5	115.4	174.7	0	0	0	0	0	113.4	S1430 S1434	S1430-G1432 PolarHBondContact O-N 2.98Å; G1432-S1434 PolarHBondContact O-N 3.48Å
1433	F	48.2	Very low	46.7	Very low	78 Å²	78	88.1 Å²	88.1	34%	0.342	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	3.3	166.7	-98.3	-72.5	0	0	0	114.8	F1436 Y1578 T1581	F1433-F1436 HydrophobicContact CD1-CD2 4.38Å; F1433-F1436 AromaticContact CD1-CE2 3.98Å; F1433-F1436 HydrophobicContact CD1-CE2 3.98Å; F1433-F1436 HydrophobicContact CE1-CE2 4.4Å; F1433-Y1578 HydrophobicContact CB-CD2 3.76Å; F1433-Y1578 HydrophobicContact CB-CE2 3.93Å; F1433-Y1578 AromaticContact CD1-CD2 3.44Å; F1433-Y1578 HydrophobicContact CD1-CD2 3.44Å; F1433-Y1578 VanDerWaalsContact CD1-CD2 3.44Å; F1433-Y1578 HydrophobicContact CD1-CE2 4.43Å; F1433-Y1578 AromaticContact CD1-CG 3.88Å; F1433-Y1578 HydrophobicContact CD1-CG 3.88Å; F1433-Y1578 HydrophobicContact CE1-CD2 4.17Å; F1433-Y1578 HydrophobicContact CE1-CG 4.38Å; F1433-Y1578 AromaticContact CG-CD2 3.81Å; F1433-Y1578 HydrophobicContact CG-CD2 3.81Å; F1433-Y1578 HydrophobicContact CG-CE2 4.45Å; F1433-T1581 HydrophobicContact CE2-CG2 4.23Å; F1433-T1581 HydrophobicContact CZ-CG2 4.33Å
1434	S	46	Very low	49	Very low	89 Å²	89	82.9 Å²	82.9	62%	0.622	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.3	-174.7	39.1	0	0	0	0	115.2	G1432 F1436 T1437	G1432-S1434 PolarHBondContact O-N 3.48Å; S1434-F1436 VanDerWaalsContact C-N 3.33Å; S1434-F1436 PolarHBondContact O-N 2.52Å; S1434-T1437 PolarHBondContact O-OG1 3.06Å
1435	S	53	Low	51.4	Low	78 Å²	78	79.6 Å²	79.6	55%	0.545	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-65.2	-31	-173.9	-172	0	0	0	0	114.3	T1437 N1438 C1439	S1435-T1437 PolarHBondContact O-N 3.29Å; S1435-N1438 PolarHBondContact O-N 2.77Å; S1435-C1439 PolarHBondContact O-N 2.75Å
1436	F	59	Low	53.8	Low	46 Å²	46	80.4 Å²	80.4	20%	0.202	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-60.2	-14.2	-172.8	-70.1	-73.3	0	0	0	116	F1433 S1434 C1574 F1575 Y1578	F1433-F1436 HydrophobicContact CD1-CD2 4.38Å; F1433-F1436 AromaticContact CD1-CE2 3.98Å; F1433-F1436 HydrophobicContact CD1-CE2 3.98Å; F1433-F1436 HydrophobicContact CE1-CE2 4.4Å; S1434-F1436 VanDerWaalsContact C-N 3.33Å; S1434-F1436 PolarHBondContact O-N 2.52Å; F1436-C1574 HydrophobicContact CE1-CB 4.47Å; F1436-C1574 HydrophobicContact CZ-CB 3.97Å; F1436-F1575 HydrophobicContact CB-CD2 3.87Å; F1436-F1575 HydrophobicContact CB-CE2 4.46Å; F1436-F1575 HydrophobicContact CD1-CB 3.84Å; F1436-F1575 HydrophobicContact CD1-CD2 4.23Å; F1436-F1575 HydrophobicContact CD1-CG 4.47Å; F1436-F1575 HydrophobicContact CE1-CB 4.03Å; F1436-F1575 HydrophobicContact CG-CB 4.43Å; F1436-F1575 HydrophobicContact CG-CD2 4.11Å; F1436-Y1578 HydrophobicContact CD2-CG 4.39Å
1437	T	49.5	Very low	56.2	Low	84 Å²	84	73.8 Å²	73.8	52%	0.515	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-81.9	-17.6	175.9	51.8	0	0	0	0	114.2	S1434 S1435	S1434-T1437 PolarHBondContact O-OG1 3.06Å; S1435-T1437 PolarHBondContact O-N 3.29Å
1438	N	47.8	Very low	58.5	Low	150 Å²	150	73.2 Å²	73.2	80%	0.802	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-21.5	178.7	-73	9.7	0	0	0	113.3	S1435 G1440	S1435-N1438 PolarHBondContact O-N 2.77Å; N1438-G1440 PolarHBondContact O-N 3.44Å
1439	C	50.1	Low	60.9	Low	44 Å²	44	71.7 Å²	71.7	30%	0.297	42%	0.423	S	S	.	.			trans	-69.2	118.8	178.1	-174.2	0	0	0	0	111	S1435 D1441	S1435-C1439 PolarHBondContact O-N 2.75Å; C1439-D1441 VanDerWaalsContact C-N 3.29Å; C1439-D1441 PolarHBondContact O-N 3.43Å
1440	G	55.8	Low	62.9	Low	79 Å²	79	65 Å²	65	81%	0.814	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.7	-173.3	0	0	0	0	0	115.7	N1438	N1438-G1440 PolarHBondContact O-N 3.44Å
1441	D	62.9	Low	65	Low	54 Å²	54	68.4 Å²	68.4	29%	0.289	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-7.9	-168.6	-70.6	-64.1	0	0	0	116.1	C1439 K1568	C1439-D1441 VanDerWaalsContact C-N 3.29Å; C1439-D1441 PolarHBondContact O-N 3.43Å; D1441-K1568 VanDerWaalsContact CG-CE 3.41Å; D1441-K1568 WeakPolarHBondContact OD1-CE 3.27Å; D1441-K1568 IonicContact OD1-NZ 3.06Å; D1441-K1568 PolarHBondContact OD1-NZ 3.2Å
1442	V	76.9	Confident	67.1	Low	19 Å²	19	70 Å²	70	12%	0.115	40%	0.396	C	S	.	.	S	Bend	trans	-101.2	122.3	-174.2	-74.6	0	0	0	0	113.5	S1444 R1571 F1575	V1442-S1444 PolarHBondContact O-N 2.97Å; V1442-R1571 HydrophobicContact CG1-CB 4.49Å; V1442-F1575 HydrophobicContact CB-CB 4.39Å; V1442-F1575 HydrophobicContact CB-CD1 4.32Å; V1442-F1575 HydrophobicContact CB-CG 4.32Å; V1442-F1575 HydrophobicContact CG1-CB 4.1Å; V1442-F1575 HydrophobicContact CG2-CG 4.44Å
1443	E	79.1	Confident	69.2	Low	92 Å²	92	70.5 Å²	70.5	43%	0.43	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-60.8	124.5	171.9	-85.9	-162.1	169	0	0	110.1	R1501 Q1572 F1575	E1443-R1501 IonicContact OE1-CZ 3.55Å; E1443-R1501 IonicContact OE1-NH2 3.99Å; E1443-R1501 PolarHBondContact OE1-NH2 3.27Å; E1443-R1501 IonicContact OE2-CZ 2.72Å; E1443-R1501 IonicContact OE2-NH1 3.71Å; E1443-R1501 PolarHBondContact OE2-NH1 3.44Å; E1443-R1501 IonicContact OE2-NH2 3.37Å; E1443-R1501 PolarHBondContact OE2-NH2 2.91Å; E1443-Q1572 PolarHBondContact O-NE2 2.86Å; E1443-F1575 WeakPolarHBondContact O-CE1 3.45Å
1444	S	81.5	Confident	70.7	Confident	22 Å²	22	70.7 Å²	70.7	15%	0.154	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-67.3	142.8	170.6	-62.6	0	0	0	0	111	V1442 Y1446 K1461	V1442-S1444 PolarHBondContact O-N 2.97Å; S1444-Y1446 WeakPolarHBondContact O-CD2 3.36Å; S1444-Y1446 WeakPolarHBondContact O-CE2 3.5Å; S1444-Y1446 PolarHBondContact O-N 3.01Å; S1444-K1461 VanDerWaalsContact OG-CE 3.29Å; S1444-K1461 WeakPolarHBondContact OG-CE 3.25Å
1445	L	84.6	Confident	72.3	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	117.9	-179.2	175.6	71.8	0	0	0	110.9	I1447 I1460 L1495 L1579	L1445-I1447 HydrophobicContact CD2-CD1 3.59Å; L1445-I1447 HydrophobicContact CG-CD1 3.79Å; L1445-I1447 HydrophobicContact CG-CG1 4.31Å; L1445-I1460 HydrophobicContact CB-CB 4.3Å; L1445-I1460 HydrophobicContact CD2-CB 4.26Å; L1445-I1460 HydrophobicContact CD2-CD1 4.39Å; L1445-I1460 PolarHBondContact N-O 3.02Å; L1445-I1460 PolarHBondContact O-N 3.15Å; L1445-L1495 HydrophobicContact CD1-CG 4.06Å; L1445-L1495 HydrophobicContact CD2-CD1 3.72Å; L1445-L1495 HydrophobicContact CD2-CD2 4.25Å; L1445-L1495 HydrophobicContact CD2-CG 3.55Å; L1445-L1495 HydrophobicContact CG-CG 4.45Å; L1445-L1579 HydrophobicContact CB-CD1 3.95Å; L1445-L1579 HydrophobicContact CD2-CD1 3.87Å
1446	Y	86.5	Confident	73.7	Confident	126 Å²	126	67.9 Å²	67.9	49%	0.494	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.9	178.6	-68.1	-85.5	0	0	0	113.1	S1444 P1457 I1458 A1459 R1494	S1444-Y1446 WeakPolarHBondContact O-CD2 3.36Å; S1444-Y1446 WeakPolarHBondContact O-CE2 3.5Å; S1444-Y1446 PolarHBondContact O-N 3.01Å; Y1446-P1457 HydrophobicContact CD1-CB 4.05Å; Y1446-I1458 WeakPolarHBondContact CA-O 3.19Å; Y1446-A1459 HydrophobicContact CD1-CB 4Å; Y1446-A1459 HydrophobicContact CE1-CB 3.65Å; Y1446-R1494 PolarHBondContact O-NE 2.93Å
1447	I	84.9	Confident	74.8	Confident	1 Å²	1	69 Å²	69	1%	0.005	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.4	-176.4	-75	147.7	0	0	0	111.4	L1445 I1458 I1460 L1481 V1491 R1494	L1445-I1447 HydrophobicContact CD2-CD1 3.59Å; L1445-I1447 HydrophobicContact CG-CD1 3.79Å; L1445-I1447 HydrophobicContact CG-CG1 4.31Å; I1447-I1458 PolarHBondContact N-O 2.94Å; I1447-I1458 WeakPolarHBondContact O-CB 3.32Å; I1447-I1458 WeakPolarHBondContact O-CG1 3.46Å; I1447-I1458 PolarHBondContact O-N 2.8Å; I1447-I1460 HydrophobicContact CD1-CD1 3.4Å; I1447-I1460 VanDerWaalsContact CD1-CD1 3.4Å; I1447-I1460 HydrophobicContact CD1-CG1 4.04Å; I1447-L1481 HydrophobicContact CG2-CD1 4.21Å; I1447-L1481 HydrophobicContact CG2-CD2 4.44Å; I1447-V1491 HydrophobicContact CD1-CB 4.34Å; I1447-V1491 HydrophobicContact CD1-CG1 3.6Å; I1447-V1491 HydrophobicContact CD1-CG2 4.12Å; I1447-V1491 HydrophobicContact CG2-CG2 4.34Å; I1447-R1494 HydrophobicContact CG1-CB 4.29Å; I1447-R1494 HydrophobicContact CG1-CG 3.79Å
1448	N	84.2	Confident	76.4	Confident	103 Å²	103	65.4 Å²	65.4	55%	0.551	39%	0.388	S	S	*	.			trans	-76.8	143.8	169.7	-65.2	-9	0	0	0	110
1449	C	83.5	Confident	78.2	Confident	10 Å²	10	60 Å²	60	7%	0.068	36%	0.364	C	S	.	.			trans	-61.1	130.5	-178.4	-177.1	0	0	0	0	111.9	R1451 N1452 I1458 C1474	C1449-R1451 PolarHBondContact O-N 3.02Å; C1449-R1451 VanDerWaalsContact O-N 3.08Å; C1449-N1452 WeakPolarHBondContact O-CA 3.48Å; C1449-N1452 PolarHBondContact O-N 2.79Å; C1449-I1458 HydrophobicContact CB-CD1 4.33Å; C1449-C1474 HydrophobicContact CB-CB 4.16Å
1450	P	78.7	Confident	79.7	Confident	44 Å²	44	57.9 Å²	57.9	29%	0.286	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.3	176.5	-27.7	34.1	0	0	0	115.2	N1452 L1481 L1490	P1450-N1452 VanDerWaalsContact C-N 3.26Å; P1450-N1452 PolarHBondContact O-N 3.27Å; P1450-L1481 HydrophobicContact CG-CD2 3.79Å; P1450-L1490 HydrophobicContact CG-CD2 4.47Å
1451	R	77.8	Confident	80.7	Confident	172 Å²	172	59.2 Å²	59.2	65%	0.649	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	1.8	174.1	-64.6	-170.7	177.7	-167.7	-2	113.9	C1449 C1453 H1479	C1449-R1451 PolarHBondContact O-N 3.02Å; C1449-R1451 VanDerWaalsContact O-N 3.08Å; R1451-C1453 PolarHBondContact O-N 3.47Å; R1451-C1453 VanDerWaalsContact O-N 3.17Å; R1451-H1479 HydrophobicContact CG-CB 4.44Å; R1451-H1479 PolarHBondContact NE-ND1 2.61Å
1452	N	79.6	Confident	81.4	Confident	142 Å²	142	57.7 Å²	57.7	76%	0.759	33%	0.326	S	S	*	.			trans	51.4	36.4	179.6	-150.2	63	0	0	0	114.4	C1449 P1450 G1454	C1449-N1452 WeakPolarHBondContact O-CA 3.48Å; C1449-N1452 PolarHBondContact O-N 2.79Å; P1450-N1452 VanDerWaalsContact C-N 3.26Å; P1450-N1452 PolarHBondContact O-N 3.27Å; N1452-G1454 PolarHBondContact O-N 2.72Å
1453	C	83.9	Confident	81.4	Confident	46 Å²	46	57.1 Å²	57.1	31%	0.311	32%	0.323	S	S	.	.			trans	-75.1	21.3	-166.6	70.6	0	0	0	0	116	R1451 G1455 C1477	R1451-C1453 PolarHBondContact O-N 3.47Å; R1451-C1453 VanDerWaalsContact O-N 3.17Å; C1453-G1455 PolarHBondContact O-N 3.09Å; C1453-C1477 HydrophobicContact CB-CB 4.09Å
1454	G	80.3	Confident	81.3	Confident	81 Å²	81	53.1 Å²	53.1	84%	0.835	31%	0.305	S	S	*	.	S	Bend	trans	66	1.7	-178.4	0	0	0	0	0	116.5	N1452	N1452-G1454 PolarHBondContact O-N 2.72Å
1455	G	79.7	Confident	80.9	Confident	20 Å²	20	53.3 Å²	53.3	21%	0.206	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-73.9	157.1	180	0	0	0	0	0	113.5	C1453 T1476	C1453-G1455 PolarHBondContact O-N 3.09Å; G1455-T1476 WeakPolarHBondContact CA-OG1 3.4Å
1456	P	82	Confident	80.1	Confident	89 Å²	89	54.9 Å²	54.9	58%	0.578	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-63.5	158.8	175.7	28.4	-35.5	0	0	0	112.1	I1458	P1456-I1458 PolarHBondContact O-N 2.8Å
1457	P	81.5	Confident	78.5	Confident	70 Å²	70	52.5 Å²	52.5	46%	0.455	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-58.9	131.8	-180	-23.3	34.1	0	0	0	112.6	Y1446 A1459	Y1446-P1457 HydrophobicContact CD1-CB 4.05Å; P1457-A1459 PolarHBondContact O-N 2.64Å
1458	I	83.8	Confident	76.9	Confident	8 Å²	8	57.2 Å²	57.2	4%	0.041	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.5	-178.2	-51.9	164.6	0	0	0	108.1	Y1446 I1447 C1449 P1456 T1471 C1474 L1481	Y1446-I1458 WeakPolarHBondContact CA-O 3.19Å; I1447-I1458 PolarHBondContact N-O 2.94Å; I1447-I1458 WeakPolarHBondContact O-CB 3.32Å; I1447-I1458 WeakPolarHBondContact O-CG1 3.46Å; I1447-I1458 PolarHBondContact O-N 2.8Å; C1449-I1458 HydrophobicContact CB-CD1 4.33Å; P1456-I1458 PolarHBondContact O-N 2.8Å; I1458-T1471 VanDerWaalsContact CG2-O 3.25Å; I1458-T1471 WeakPolarHBondContact CG2-O 3.16Å; I1458-C1474 HydrophobicContact CD1-CB 3.74Å; I1458-L1481 HydrophobicContact CD1-CD1 3.94Å; I1458-L1481 HydrophobicContact CD1-CD2 4.03Å; I1458-L1481 HydrophobicContact CD1-CG 4.32Å; I1458-L1481 HydrophobicContact CG2-CD1 4.36Å
1459	A	84.6	Confident	75.2	Confident	35 Å²	35	53 Å²	53	29%	0.289	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	110.5	177.9	0	0	0	0	0	110.8	Y1446 P1457	Y1446-A1459 HydrophobicContact CD1-CB 4Å; Y1446-A1459 HydrophobicContact CE1-CB 3.65Å; P1457-A1459 PolarHBondContact O-N 2.64Å
1460	I	81.9	Confident	73.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	122	176.3	-54.2	-166.7	0	0	0	109.6	L1445 I1447 W1472 L1481 L1579	L1445-I1460 HydrophobicContact CB-CB 4.3Å; L1445-I1460 HydrophobicContact CD2-CB 4.26Å; L1445-I1460 HydrophobicContact CD2-CD1 4.39Å; L1445-I1460 PolarHBondContact N-O 3.02Å; L1445-I1460 PolarHBondContact O-N 3.15Å; I1447-I1460 HydrophobicContact CD1-CD1 3.4Å; I1447-I1460 VanDerWaalsContact CD1-CD1 3.4Å; I1447-I1460 HydrophobicContact CD1-CG1 4.04Å; I1460-W1472 HydrophobicContact CD1-CD2 3.75Å; I1460-W1472 HydrophobicContact CD1-CE3 3.69Å; I1460-W1472 HydrophobicContact CD1-CG 4.42Å; I1460-W1472 HydrophobicContact CD1-CH2 4.08Å; I1460-W1472 HydrophobicContact CD1-CZ2 4.1Å; I1460-W1472 HydrophobicContact CD1-CZ3 3.89Å; I1460-W1472 HydrophobicContact CG2-CD2 4.29Å; I1460-W1472 HydrophobicContact CG2-CZ2 3.7Å; I1460-L1481 HydrophobicContact CD1-CD1 3.99Å; I1460-L1579 HydrophobicContact CG2-CD1 4.25Å; I1460-L1579 HydrophobicContact CG2-CD2 4Å
1461	K	77.3	Confident	73	Confident	108 Å²	108	60.8 Å²	60.8	47%	0.47	35%	0.353	S	S	.	.			trans	-123.9	-8.8	-178.7	-61	-162.9	176.9	-154.5	0	114.7	S1444	S1444-K1461 VanDerWaalsContact OG-CE 3.29Å; S1444-K1461 WeakPolarHBondContact OG-CE 3.25Å
1462	T	76.8	Confident	73.1	Confident	22 Å²	22	52.9 Å²	52.9	14%	0.135	32%	0.323	C	S	.	.	S	Bend	trans	-131.2	149.8	-172.9	48.9	0	0	0	0	111.3	T1471 W1472 L1579	T1462-T1471 PolarHBondContact OG1-OG1 3.44Å; T1462-W1472 PolarHBondContact O-NE1 3.46Å; T1462-L1579 WeakPolarHBondContact O-CD2 3.37Å
1463	S	78.3	Confident	73.1	Confident	7 Å²	7	50.2 Å²	50.2	5%	0.049	31%	0.305	C	S	.	.			trans	-54	142.3	178.3	171.4	0	0	0	0	112.7	F1465 S1466 Y1578 T1581	S1463-F1465 PolarHBondContact O-N 3Å; S1463-F1465 PolarHBondContact OG-N 3.03Å; S1463-S1466 WeakPolarHBondContact O-CB 3.46Å; S1463-S1466 PolarHBondContact O-N 3.31Å; S1463-Y1578 PolarHBondContact N-OH 2.77Å; S1463-T1581 PolarHBondContact OG-O 3.1Å
1464	A	75.2	Confident	73	Confident	7 Å²	7	48 Å²	48	6%	0.058	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-18.2	173.6	0	0	0	0	0	114.6	W1472 L1482 L1579 L1598 L1606	A1464-W1472 HydrophobicContact CB-CH2 4.11Å; A1464-W1472 HydrophobicContact CB-CZ2 3.74Å; A1464-L1482 HydrophobicContact CB-CD1 3.69Å; A1464-L1579 WeakPolarHBondContact CB-O 3.43Å; A1464-L1579 PolarHBondContact N-O 2.84Å; A1464-L1598 HydrophobicContact CB-CD1 4.5Å; A1464-L1606 HydrophobicContact CB-CD1 3.88Å; A1464-L1606 HydrophobicContact CB-CD2 4.42Å
1465	F	74.4	Confident	72.9	Confident	26 Å²	26	48.9 Å²	48.9	11%	0.114	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	2.1	-178	-58.3	-91.4	0	0	0	113.4	S1463 P1582 L1598 L1606	S1463-F1465 PolarHBondContact O-N 3Å; S1463-F1465 PolarHBondContact OG-N 3.03Å; F1465-P1582 HydrophobicContact CD1-CB 3.94Å; F1465-P1582 HydrophobicContact CD2-CB 3.98Å; F1465-P1582 HydrophobicContact CE1-CB 4Å; F1465-P1582 HydrophobicContact CE2-CB 4.05Å; F1465-P1582 HydrophobicContact CE2-CG 4.46Å; F1465-P1582 HydrophobicContact CG-CB 3.92Å; F1465-P1582 HydrophobicContact CZ-CB 4.06Å; F1465-P1582 HydrophobicContact CZ-CG 4.42Å; F1465-L1598 HydrophobicContact CD1-CD1 4.04Å; F1465-L1598 HydrophobicContact CE1-CD1 3.81Å; F1465-L1598 HydrophobicContact CZ-CD1 4.18Å; F1465-L1606 HydrophobicContact CE2-CD1 4.02Å; F1465-L1606 HydrophobicContact CZ-CB 4.48Å; F1465-L1606 HydrophobicContact CZ-CD1 3.85Å
1466	S	66.4	Low	73	Confident	36 Å²	36	51.7 Å²	51.7	25%	0.252	29%	0.294	S	S	.	.			trans	-83.2	138.3	-178.1	-176.3	0	0	0	0	112.9	S1463 V1468 G1469	S1463-S1466 WeakPolarHBondContact O-CB 3.46Å; S1463-S1466 PolarHBondContact O-N 3.31Å; S1466-V1468 PolarHBondContact O-N 2.95Å; S1466-V1468 PolarHBondContact OG-N 3.16Å; S1466-G1469 PolarHBondContact O-N 3.06Å
1467	V	53	Low	73.2	Confident	75 Å²	75	49.5 Å²	49.5	46%	0.455	28%	0.28	S	S	.	.	S	Bend	trans	-60.7	-24.4	176.7	-170.7	0	0	0	0	112.7	G1469 D1593 M1594	V1467-G1469 PolarHBondContact O-N 2.94Å; V1467-D1593 HydrophobicContact CG2-CB 3.96Å; V1467-M1594 VanDerWaalsContact CG2-O 3.24Å; V1467-M1594 WeakPolarHBondContact CG2-O 3.47Å
1468	V	51.6	Low	73.2	Confident	101 Å²	101	50.6 Å²	50.6	61%	0.612	29%	0.29	S	S	*	.			trans	-78.6	44.2	173.8	-159.5	0	0	0	0	111.1	S1466 K1470	S1466-V1468 PolarHBondContact O-N 2.95Å; S1466-V1468 PolarHBondContact OG-N 3.16Å; V1468-K1470 PolarHBondContact O-N 2.84Å
1469	G	49.6	Very low	73	Confident	13 Å²	13	51.3 Å²	51.3	13%	0.134	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-67	1	-167.1	0	0	0	0	0	116.4	S1466 V1467 T1471 W1472 F1473	S1466-G1469 PolarHBondContact O-N 3.06Å; V1467-G1469 PolarHBondContact O-N 2.94Å; G1469-T1471 PolarHBondContact O-N 3Å; G1469-W1472 PolarHBondContact O-N 3.35Å; G1469-F1473 WeakPolarHBondContact O-CD2 3.5Å; G1469-F1473 WeakPolarHBondContact O-CE2 3.41Å
1470	K	54.1	Low	72.8	Confident	185 Å²	185	51.3 Å²	51.3	80%	0.804	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-53.5	-27.5	-178.4	-74.2	-174.5	177.1	177.1	0	113.8	V1468 W1472 F1473	V1468-K1470 PolarHBondContact O-N 2.84Å; K1470-W1472 VanDerWaalsContact C-N 3.28Å; K1470-W1472 PolarHBondContact O-N 3.06Å; K1470-F1473 PolarHBondContact O-N 3.44Å
1471	T	62.3	Low	72.7	Confident	34 Å²	34	51.3 Å²	51.3	21%	0.209	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-64.5	-26.2	174.6	47.6	0	0	0	0	113.8	I1458 T1462 G1469	I1458-T1471 VanDerWaalsContact CG2-O 3.25Å; I1458-T1471 WeakPolarHBondContact CG2-O 3.16Å; T1462-T1471 PolarHBondContact OG1-OG1 3.44Å; G1469-T1471 PolarHBondContact O-N 3Å
1472	W	78.5	Confident	72.8	Confident	6 Å²	6	46.5 Å²	46.5	2%	0.023	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-95.8	11	-179.8	-70	84.7	0	0	0	113.5	I1460 T1462 A1464 G1469 K1470 L1481 L1482 V1491	I1460-W1472 HydrophobicContact CD1-CD2 3.75Å; I1460-W1472 HydrophobicContact CD1-CE3 3.69Å; I1460-W1472 HydrophobicContact CD1-CG 4.42Å; I1460-W1472 HydrophobicContact CD1-CH2 4.08Å; I1460-W1472 HydrophobicContact CD1-CZ2 4.1Å; I1460-W1472 HydrophobicContact CD1-CZ3 3.89Å; I1460-W1472 HydrophobicContact CG2-CD2 4.29Å; I1460-W1472 HydrophobicContact CG2-CZ2 3.7Å; T1462-W1472 PolarHBondContact O-NE1 3.46Å; A1464-W1472 HydrophobicContact CB-CH2 4.11Å; A1464-W1472 HydrophobicContact CB-CZ2 3.74Å; G1469-W1472 PolarHBondContact O-N 3.35Å; K1470-W1472 VanDerWaalsContact C-N 3.28Å; K1470-W1472 PolarHBondContact O-N 3.06Å; W1472-L1481 HydrophobicContact CE3-CB 4.22Å; W1472-L1481 WeakPolarHBondContact O-CB 3.38Å; W1472-L1481 WeakPolarHBondContact O-CG 3.5Å; W1472-L1481 PolarHBondContact O-N 3.39Å; W1472-L1482 HydrophobicContact CB-CD1 4.37Å; W1472-L1482 HydrophobicContact CD2-CD1 3.76Å; W1472-L1482 HydrophobicContact CD2-CG 4.17Å; W1472-L1482 HydrophobicContact CE3-CD1 3.59Å; W1472-L1482 HydrophobicContact CE3-CD2 3.79Å; W1472-L1482 HydrophobicContact CE3-CG 3.49Å; W1472-L1482 VanDerWaalsContact CE3-CG 3.49Å; W1472-L1482 HydrophobicContact CG-CD1 4.12Å; W1472-L1482 HydrophobicContact CH2-CD2 4.41Å; W1472-L1482 HydrophobicContact CZ3-CD1 4.08Å; W1472-L1482 HydrophobicContact CZ3-CD2 3.58Å; W1472-L1482 HydrophobicContact CZ3-CG 3.87Å; W1472-V1491 HydrophobicContact CH2-CG1 3.88Å; W1472-V1491 HydrophobicContact CZ3-CB 4.28Å; W1472-V1491 HydrophobicContact CZ3-CG1 3.49Å; W1472-V1491 VanDerWaalsContact CZ3-CG1 3.49Å; W1472-V1491 HydrophobicContact CZ3-CG2 4.43Å
1473	F	80	Confident	72.7	Confident	85 Å²	85	51.4 Å²	51.4	37%	0.373	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-110.1	143.8	169.5	-63.5	-106.1	0	0	0	109.6	G1469 K1470 P1475 H1479 N1480	G1469-F1473 WeakPolarHBondContact O-CD2 3.5Å; G1469-F1473 WeakPolarHBondContact O-CE2 3.41Å; K1470-F1473 PolarHBondContact O-N 3.44Å; F1473-P1475 WeakPolarHBondContact O-CD 3.42Å; F1473-H1479 WeakPolarHBondContact CA-O 3.39Å; F1473-N1480 HydrophobicContact CD1-CB 3.77Å; F1473-N1480 HydrophobicContact CE1-CB 3.62Å; F1473-N1480 HydrophobicContact CG-CB 4.5Å; F1473-N1480 HydrophobicContact CZ-CB 4.22Å
1474	C	81.6	Confident	72.6	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.007	31%	0.305	C	S	.	.			trans	-66.9	122.7	167	179.3	0	0	0	0	110.2	C1449 I1458 T1476 C1477 S1478 H1479	C1449-C1474 HydrophobicContact CB-CB 4.16Å; I1458-C1474 HydrophobicContact CD1-CB 3.74Å; C1474-T1476 PolarHBondContact O-N 3.16Å; C1474-C1477 PolarHBondContact O-N 3.15Å; C1474-C1477 VanDerWaalsContact SG-SG 3.62Å; C1474-S1478 VanDerWaalsContact O-CA 3.26Å; C1474-S1478 WeakPolarHBondContact O-CA 3.22Å; C1474-S1478 PolarHBondContact O-N 3.36Å; C1474-H1479 PolarHBondContact N-O 3.1Å
1475	P	78.2	Confident	73.1	Confident	99 Å²	99	56.8 Å²	56.8	64%	0.643	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.3	-178.5	28.4	-34.9	0	0	0	113	F1473	F1473-P1475 WeakPolarHBondContact O-CD 3.42Å
1476	T	82.6	Confident	73.5	Confident	78 Å²	78	60.6 Å²	60.6	48%	0.479	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-28.7	-177.3	-43.7	0	0	0	0	113.6	G1455 C1474	G1455-T1476 WeakPolarHBondContact CA-OG1 3.4Å; C1474-T1476 PolarHBondContact O-N 3.16Å
1477	C	85.6	Confident	74.3	Confident	43 Å²	43	59.2 Å²	59.2	29%	0.291	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.2	8.4	-175.9	72.2	0	0	0	0	115	C1453 C1474 H1479	C1453-C1477 HydrophobicContact CB-CB 4.09Å; C1474-C1477 PolarHBondContact O-N 3.15Å; C1474-C1477 VanDerWaalsContact SG-SG 3.62Å; C1477-H1479 PolarHBondContact O-N 3.06Å
1478	S	81.3	Confident	75.7	Confident	94 Å²	94	55.7 Å²	55.7	66%	0.657	31%	0.311	S	S	*	.			trans	54.6	16.7	179.8	-54.4	0	0	0	0	115.5	C1474 N1480	C1474-S1478 VanDerWaalsContact O-CA 3.26Å; C1474-S1478 WeakPolarHBondContact O-CA 3.22Å; C1474-S1478 PolarHBondContact O-N 3.36Å; S1478-N1480 PolarHBondContact O-N 3.06Å
1479	H	79.9	Confident	77.5	Confident	23 Å²	23	56.4 Å²	56.4	11%	0.106	30%	0.303	C	S	.	.			trans	-70.4	116.7	176	-178.1	64	0	0	0	110.4	R1451 F1473 C1474 C1477 S1487	R1451-H1479 HydrophobicContact CG-CB 4.44Å; R1451-H1479 PolarHBondContact NE-ND1 2.61Å; F1473-H1479 WeakPolarHBondContact CA-O 3.39Å; C1474-H1479 PolarHBondContact N-O 3.1Å; C1477-H1479 PolarHBondContact O-N 3.06Å; H1479-S1487 PolarHBondContact NE2-OG 2.86Å
1480	N	81.1	Confident	79.2	Confident	35 Å²	35	59.8 Å²	59.8	19%	0.187	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-71.5	121.3	173.5	179	-26.7	0	0	0	110.2	F1473 S1478 L1482 L1483	F1473-N1480 HydrophobicContact CD1-CB 3.77Å; F1473-N1480 HydrophobicContact CE1-CB 3.62Å; F1473-N1480 HydrophobicContact CG-CB 4.5Å; F1473-N1480 HydrophobicContact CZ-CB 4.22Å; S1478-N1480 PolarHBondContact O-N 3.06Å; N1480-L1482 VanDerWaalsContact C-N 3.25Å; N1480-L1482 PolarHBondContact O-N 3.12Å; N1480-L1482 WeakPolarHBondContact OD1-CA 3.21Å; N1480-L1482 PolarHBondContact OD1-N 2.82Å; N1480-L1483 HydrophobicContact CB-CB 3.98Å; N1480-L1483 PolarHBondContact O-N 3.46Å; N1480-L1483 PolarHBondContact OD1-N 3.44Å
1481	L	79.5	Confident	80.7	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-14.5	-176	-63.3	176.7	0	0	0	114.2	I1447 P1450 I1458 I1460 W1472 S1487 A1488 V1491	I1447-L1481 HydrophobicContact CG2-CD1 4.21Å; I1447-L1481 HydrophobicContact CG2-CD2 4.44Å; P1450-L1481 HydrophobicContact CG-CD2 3.79Å; I1458-L1481 HydrophobicContact CD1-CD1 3.94Å; I1458-L1481 HydrophobicContact CD1-CD2 4.03Å; I1458-L1481 HydrophobicContact CD1-CG 4.32Å; I1458-L1481 HydrophobicContact CG2-CD1 4.36Å; I1460-L1481 HydrophobicContact CD1-CD1 3.99Å; W1472-L1481 HydrophobicContact CE3-CB 4.22Å; W1472-L1481 WeakPolarHBondContact O-CB 3.38Å; W1472-L1481 WeakPolarHBondContact O-CG 3.5Å; W1472-L1481 PolarHBondContact O-N 3.39Å; L1481-S1487 CarbonylContact O-C 3.46Å; L1481-S1487 WeakPolarHBondContact O-CB 3.42Å; L1481-A1488 PolarHBondContact O-N 2.9Å; L1481-V1491 HydrophobicContact CB-CG2 3.98Å; L1481-V1491 HydrophobicContact CD1-CG2 4.28Å
1482	L	79.4	Confident	81.9	Confident	6 Å²	6	50 Å²	50	3%	0.031	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-3	-178.4	-66.5	171.3	0	0	0	113.5	A1464 W1472 N1480 S1484 A1488 L1598 V1602 L1606	A1464-L1482 HydrophobicContact CB-CD1 3.69Å; W1472-L1482 HydrophobicContact CB-CD1 4.37Å; W1472-L1482 HydrophobicContact CD2-CD1 3.76Å; W1472-L1482 HydrophobicContact CD2-CG 4.17Å; W1472-L1482 HydrophobicContact CE3-CD1 3.59Å; W1472-L1482 HydrophobicContact CE3-CD2 3.79Å; W1472-L1482 HydrophobicContact CE3-CG 3.49Å; W1472-L1482 VanDerWaalsContact CE3-CG 3.49Å; W1472-L1482 HydrophobicContact CG-CD1 4.12Å; W1472-L1482 HydrophobicContact CH2-CD2 4.41Å; W1472-L1482 HydrophobicContact CZ3-CD1 4.08Å; W1472-L1482 HydrophobicContact CZ3-CD2 3.58Å; W1472-L1482 HydrophobicContact CZ3-CG 3.87Å; N1480-L1482 VanDerWaalsContact C-N 3.25Å; N1480-L1482 PolarHBondContact O-N 3.12Å; N1480-L1482 WeakPolarHBondContact OD1-CA 3.21Å; N1480-L1482 PolarHBondContact OD1-N 2.82Å; L1482-S1484 PolarHBondContact O-N 3.21Å; L1482-A1488 HydrophobicContact CD2-CB 4.48Å; L1482-L1598 HydrophobicContact CB-CD2 4.12Å; L1482-L1598 HydrophobicContact CD1-CD1 4.33Å; L1482-L1598 HydrophobicContact CD1-CD2 4.19Å; L1482-V1602 HydrophobicContact CB-CG1 4.35Å; L1482-V1602 HydrophobicContact CD2-CG1 4.16Å; L1482-V1602 WeakPolarHBondContact O-CG2 3.44Å; L1482-L1606 HydrophobicContact CD2-CD1 4.31Å; L1482-L1606 HydrophobicContact CD2-CD2 4.28Å
1483	L	73.9	Confident	82.5	Confident	125 Å²	125	55 Å²	55	65%	0.654	30%	0.301	S	S	*	.	S	Bend	trans	-75.5	-24.2	-172	-156.4	78.7	0	0	0	114	N1480	N1480-L1483 HydrophobicContact CB-CB 3.98Å; N1480-L1483 PolarHBondContact O-N 3.46Å; N1480-L1483 PolarHBondContact OD1-N 3.44Å
1484	S	77.4	Confident	82.9	Confident	45 Å²	45	55.3 Å²	55.3	32%	0.315	30%	0.299	S	S	.	.	S	Bend	trans	-121.5	152.6	178.2	84.6	0	0	0	0	111.5	L1482 D1486 S1487 A1488	L1482-S1484 PolarHBondContact O-N 3.21Å; S1484-D1486 PolarHBondContact O-N 3.45Å; S1484-S1487 PolarHBondContact O-N 3.11Å; S1484-S1487 WeakPolarHBondContact OG-CB 3.45Å; S1484-S1487 PolarHBondContact OG-N 3.41Å; S1484-S1487 VanDerWaalsContact OG-N 3.09Å; S1484-S1487 PolarHBondContact OG-OG 2.8Å; S1484-A1488 WeakPolarHBondContact O-CB 3.47Å; S1484-A1488 PolarHBondContact O-N 3.08Å
1485	Q	84.2	Confident	83.3	Confident	82 Å²	82	55.3 Å²	55.3	38%	0.383	30%	0.299	S	S	.	.	H	α-helix	trans	-57.3	-38.3	178.7	-169	176	15.5	0	0	112.1	R1489 V1601 I1605	Q1485-R1489 WeakPolarHBondContact O-CB 3.43Å; Q1485-R1489 VanDerWaalsContact O-CG 3.28Å; Q1485-R1489 WeakPolarHBondContact O-CG 3.37Å; Q1485-R1489 PolarHBondContact O-N 2.83Å; Q1485-V1601 HydrophobicContact CB-CG1 4.43Å; Q1485-V1601 HydrophobicContact CG-CG1 3.77Å; Q1485-V1601 VanDerWaalsContact NE2-CG1 3.3Å; Q1485-I1605 HydrophobicContact CG-CD1 3.63Å
1486	D	84.2	Confident	83.9	Confident	107 Å²	107	51.9 Å²	51.9	57%	0.572	28%	0.276	S	S	*	.	H	α-helix	trans	-79.4	-34.7	-177.6	-56.9	-45.1	0	0	0	112.4	S1484 R1489 L1490	S1484-D1486 PolarHBondContact O-N 3.45Å; D1486-R1489 PolarHBondContact O-N 3.09Å; D1486-R1489 IonicContact OD1-NH1 3.34Å; D1486-R1489 PolarHBondContact OD1-NH1 2.88Å; D1486-L1490 WeakPolarHBondContact O-CB 3.49Å; D1486-L1490 PolarHBondContact O-N 3.36Å
1487	S	81.8	Confident	84.4	Confident	7 Å²	7	54.9 Å²	54.9	5%	0.049	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-44.7	171	-60.7	0	0	0	0	110.8	H1479 L1481 S1484 R1489 L1490 V1491	H1479-S1487 PolarHBondContact NE2-OG 2.86Å; L1481-S1487 CarbonylContact O-C 3.46Å; L1481-S1487 WeakPolarHBondContact O-CB 3.42Å; S1484-S1487 PolarHBondContact O-N 3.11Å; S1484-S1487 WeakPolarHBondContact OG-CB 3.45Å; S1484-S1487 PolarHBondContact OG-N 3.41Å; S1484-S1487 VanDerWaalsContact OG-N 3.09Å; S1484-S1487 PolarHBondContact OG-OG 2.8Å; S1487-R1489 PolarHBondContact O-N 2.6Å; S1487-L1490 PolarHBondContact O-N 3.3Å; S1487-V1491 PolarHBondContact O-N 3.14Å
1488	A	84.1	Confident	84.7	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-39.8	177.1	0	0	0	0	0	112.8	L1481 L1482 S1484 T1492 V1602 I1605	L1481-A1488 PolarHBondContact O-N 2.9Å; L1482-A1488 HydrophobicContact CD2-CB 4.48Å; S1484-A1488 WeakPolarHBondContact O-CB 3.47Å; S1484-A1488 PolarHBondContact O-N 3.08Å; A1488-T1492 PolarHBondContact O-N 3.42Å; A1488-T1492 PolarHBondContact O-OG1 2.98Å; A1488-V1602 HydrophobicContact CB-CG1 3.92Å; A1488-V1602 HydrophobicContact CB-CG2 4.24Å; A1488-I1605 HydrophobicContact CB-CG2 4.36Å
1489	R	87.5	Confident	85.1	Confident	115 Å²	115	49.4 Å²	49.4	43%	0.434	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-41.4	171.3	-80.1	168.8	168.8	160.3	-5.3	112.5	Q1485 D1486 S1487 T1492 N1493 I1605	Q1485-R1489 WeakPolarHBondContact O-CB 3.43Å; Q1485-R1489 VanDerWaalsContact O-CG 3.28Å; Q1485-R1489 WeakPolarHBondContact O-CG 3.37Å; Q1485-R1489 PolarHBondContact O-N 2.83Å; D1486-R1489 PolarHBondContact O-N 3.09Å; D1486-R1489 IonicContact OD1-NH1 3.34Å; D1486-R1489 PolarHBondContact OD1-NH1 2.88Å; S1487-R1489 PolarHBondContact O-N 2.6Å; R1489-T1492 WeakPolarHBondContact CA-OG1 3.27Å; R1489-T1492 PolarHBondContact O-OG1 3.32Å; R1489-N1493 VanDerWaalsContact O-CB 3.23Å; R1489-N1493 WeakPolarHBondContact O-CB 3.14Å; R1489-N1493 VanDerWaalsContact O-CG 3.23Å; R1489-N1493 PolarHBondContact O-N 2.89Å; R1489-N1493 PolarHBondContact O-ND2 2.8Å; R1489-I1605 HydrophobicContact CG-CD1 4.01Å
1490	L	86.2	Confident	85.7	Confident	84 Å²	84	55.7 Å²	55.7	44%	0.44	27%	0.265	S	S	.	.	H	α-helix	trans	-67.2	-40	-179.2	-164.1	151.5	0	0	0	111.2	P1450 D1486 S1487 R1494	P1450-L1490 HydrophobicContact CG-CD2 4.47Å; D1486-L1490 WeakPolarHBondContact O-CB 3.49Å; D1486-L1490 PolarHBondContact O-N 3.36Å; S1487-L1490 PolarHBondContact O-N 3.3Å; L1490-R1494 WeakPolarHBondContact O-CB 3.44Å; L1490-R1494 PolarHBondContact O-N 3.15Å
1491	V	85.3	Confident	86.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-66.7	-49.3	173.1	175.7	0	0	0	0	112.3	I1447 W1472 L1481 S1487 N1493 R1494 L1495	I1447-V1491 HydrophobicContact CD1-CB 4.34Å; I1447-V1491 HydrophobicContact CD1-CG1 3.6Å; I1447-V1491 HydrophobicContact CD1-CG2 4.12Å; I1447-V1491 HydrophobicContact CG2-CG2 4.34Å; W1472-V1491 HydrophobicContact CH2-CG1 3.88Å; W1472-V1491 HydrophobicContact CZ3-CB 4.28Å; W1472-V1491 HydrophobicContact CZ3-CG1 3.49Å; W1472-V1491 VanDerWaalsContact CZ3-CG1 3.49Å; W1472-V1491 HydrophobicContact CZ3-CG2 4.43Å; L1481-V1491 HydrophobicContact CB-CG2 3.98Å; L1481-V1491 HydrophobicContact CD1-CG2 4.28Å; S1487-V1491 PolarHBondContact O-N 3.14Å; V1491-N1493 VanDerWaalsContact C-N 3.33Å; V1491-N1493 PolarHBondContact O-N 3.26Å; V1491-R1494 WeakPolarHBondContact O-CA 3.18Å; V1491-R1494 WeakPolarHBondContact O-CB 3.47Å; V1491-R1494 PolarHBondContact O-N 2.81Å; V1491-L1495 PolarHBondContact O-N 3.18Å
1492	T	88.8	Confident	86.8	Confident	12 Å²	12	59.3 Å²	59.3	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-39.4	-179.6	44.9	0	0	0	0	112	A1488 R1489 R1494 L1495 V1496 I1605 L1606 C1609	A1488-T1492 PolarHBondContact O-N 3.42Å; A1488-T1492 PolarHBondContact O-OG1 2.98Å; R1489-T1492 WeakPolarHBondContact CA-OG1 3.27Å; R1489-T1492 PolarHBondContact O-OG1 3.32Å; T1492-R1494 VanDerWaalsContact C-N 3.34Å; T1492-R1494 PolarHBondContact O-N 3.29Å; T1492-L1495 WeakPolarHBondContact O-CB 3.34Å; T1492-L1495 PolarHBondContact O-N 3.08Å; T1492-V1496 WeakPolarHBondContact O-CG2 3.43Å; T1492-V1496 PolarHBondContact O-N 3.02Å; T1492-I1605 HydrophobicContact CG2-CG2 3.9Å; T1492-L1606 HydrophobicContact CG2-CD2 4.12Å; T1492-C1609 HydrophobicContact CG2-CB 3.61Å
1493	N	90	Very high	87.3	Confident	113 Å²	113	60.4 Å²	60.4	60%	0.604	28%	0.282	S	S	*	.	H	α-helix	trans	-59.2	-41.5	169.8	-78	-17.5	0	0	0	112.5	R1489 V1491 V1496 F1497	R1489-N1493 VanDerWaalsContact O-CB 3.23Å; R1489-N1493 WeakPolarHBondContact O-CB 3.14Å; R1489-N1493 VanDerWaalsContact O-CG 3.23Å; R1489-N1493 PolarHBondContact O-N 2.89Å; R1489-N1493 PolarHBondContact O-ND2 2.8Å; V1491-N1493 VanDerWaalsContact C-N 3.33Å; V1491-N1493 PolarHBondContact O-N 3.26Å; N1493-V1496 PolarHBondContact O-N 3.23Å; N1493-F1497 WeakPolarHBondContact O-CB 2.97Å; N1493-F1497 PolarHBondContact O-N 2.86Å
1494	R	88.9	Confident	88.2	Confident	91 Å²	91	58.1 Å²	58.1	34%	0.343	27%	0.273	S	S	.	.	H	α-helix	trans	-65.5	-39.4	177.2	-175.3	60.4	172.1	148.6	10.3	112.2	Y1446 I1447 L1490 V1491 T1492 F1497 E1498	Y1446-R1494 PolarHBondContact O-NE 2.93Å; I1447-R1494 HydrophobicContact CG1-CB 4.29Å; I1447-R1494 HydrophobicContact CG1-CG 3.79Å; L1490-R1494 WeakPolarHBondContact O-CB 3.44Å; L1490-R1494 PolarHBondContact O-N 3.15Å; V1491-R1494 WeakPolarHBondContact O-CA 3.18Å; V1491-R1494 WeakPolarHBondContact O-CB 3.47Å; V1491-R1494 PolarHBondContact O-N 2.81Å; T1492-R1494 VanDerWaalsContact C-N 3.34Å; T1492-R1494 PolarHBondContact O-N 3.29Å; R1494-F1497 PolarHBondContact O-N 3.36Å; R1494-E1498 IonicContact CZ-OE1 2.91Å; R1494-E1498 IonicContact NE-OE1 3.88Å; R1494-E1498 IonicContact NH1-OE1 2.81Å; R1494-E1498 PolarHBondContact NH1-OE1 2.89Å; R1494-E1498 IonicContact NH2-OE1 2.65Å; R1494-E1498 PolarHBondContact NH2-OE1 2.79Å; R1494-E1498 PolarHBondContact O-N 2.77Å
1495	L	89.6	Confident	88.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.2	-49.7	173.6	-115.7	156.2	0	0	0	111.8	L1445 V1491 T1492 F1497 E1498 A1499 F1576 V1580 F1613	L1445-L1495 HydrophobicContact CD1-CG 4.06Å; L1445-L1495 HydrophobicContact CD2-CD1 3.72Å; L1445-L1495 HydrophobicContact CD2-CD2 4.25Å; L1445-L1495 HydrophobicContact CD2-CG 3.55Å; L1445-L1495 HydrophobicContact CG-CG 4.45Å; V1491-L1495 PolarHBondContact O-N 3.18Å; T1492-L1495 WeakPolarHBondContact O-CB 3.34Å; T1492-L1495 PolarHBondContact O-N 3.08Å; L1495-F1497 VanDerWaalsContact C-N 3.27Å; L1495-F1497 PolarHBondContact O-N 2.82Å; L1495-E1498 PolarHBondContact O-N 3Å; L1495-A1499 WeakPolarHBondContact O-CB 3.12Å; L1495-A1499 PolarHBondContact O-N 3.46Å; L1495-F1576 HydrophobicContact CD2-CB 3.54Å; L1495-F1576 HydrophobicContact CD2-CD1 3.8Å; L1495-F1576 HydrophobicContact CD2-CD2 4.3Å; L1495-F1576 HydrophobicContact CD2-CG 3.64Å; L1495-V1580 HydrophobicContact CD1-CG1 3.76Å; L1495-F1613 HydrophobicContact CB-CZ 4.46Å; L1495-F1613 HydrophobicContact CD2-CE2 3.87Å; L1495-F1613 HydrophobicContact CD2-CZ 3.68Å
1496	V	91.4	Very high	89	Confident	28 Å²	28	59.5 Å²	59.5	17%	0.17	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-33.7	175.7	174.1	0	0	0	0	111.7	T1492 N1493 R1500	T1492-V1496 WeakPolarHBondContact O-CG2 3.43Å; T1492-V1496 PolarHBondContact O-N 3.02Å; N1493-V1496 PolarHBondContact O-N 3.23Å; V1496-R1500 WeakPolarHBondContact O-CB 3.31Å; V1496-R1500 WeakPolarHBondContact O-CG 3.44Å; V1496-R1500 PolarHBondContact O-N 3.46Å
1497	F	92.1	Very high	89.2	Confident	140 Å²	140	61 Å²	61	61%	0.614	28%	0.276	S	S	*	.	H	α-helix	trans	-70.2	-42.1	178.4	-150.1	-78	0	0	0	112.6	N1493 R1494 L1495 R1500 R1501	N1493-F1497 WeakPolarHBondContact O-CB 2.97Å; N1493-F1497 PolarHBondContact O-N 2.86Å; R1494-F1497 PolarHBondContact O-N 3.36Å; L1495-F1497 VanDerWaalsContact C-N 3.27Å; L1495-F1497 PolarHBondContact O-N 2.82Å; F1497-R1500 PolarHBondContact O-N 3.33Å; F1497-R1501 PolarHBondContact O-N 2.78Å
1498	E	91.5	Very high	89.5	Confident	22 Å²	22	63.6 Å²	63.6	10%	0.103	29%	0.288	C	S	.	.	H	α-helix	trans	-73.3	-35.5	176.4	-68.3	-61.2	170.3	0	0	112.4	R1494 L1495 R1500 R1501 L1502 F1576	R1494-E1498 IonicContact CZ-OE1 2.91Å; R1494-E1498 IonicContact NE-OE1 3.88Å; R1494-E1498 IonicContact NH1-OE1 2.81Å; R1494-E1498 PolarHBondContact NH1-OE1 2.89Å; R1494-E1498 IonicContact NH2-OE1 2.65Å; R1494-E1498 PolarHBondContact NH2-OE1 2.79Å; R1494-E1498 PolarHBondContact O-N 2.77Å; L1495-E1498 PolarHBondContact O-N 3Å; E1498-R1500 VanDerWaalsContact C-N 3.28Å; E1498-R1500 PolarHBondContact O-N 2.88Å; E1498-R1501 WeakPolarHBondContact O-CB 3.23Å; E1498-R1501 PolarHBondContact O-N 3.3Å; E1498-R1501 VanDerWaalsContact O-N 3.08Å; E1498-R1501 VanDerWaalsContact OE2-CD 3.26Å; E1498-R1501 WeakPolarHBondContact OE2-CD 3.38Å; E1498-R1501 IonicContact OE2-CZ 2.72Å; E1498-R1501 IonicContact OE2-NE 3.52Å; E1498-R1501 IonicContact OE2-NH1 2.77Å; E1498-R1501 PolarHBondContact OE2-NH1 3.37Å; E1498-L1502 WeakPolarHBondContact O-CG 3.42Å; E1498-L1502 PolarHBondContact O-N 3.11Å; E1498-F1576 HydrophobicContact CB-CE2 4.46Å; E1498-F1576 HydrophobicContact CB-CZ 4.29Å
1499	A	91	Very high	89.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-54.9	-45.4	167.7	0	0	0	0	0	111.3	L1495 L1502 I1503 L1573 F1576 F1613	L1495-A1499 WeakPolarHBondContact O-CB 3.12Å; L1495-A1499 PolarHBondContact O-N 3.46Å; A1499-L1502 PolarHBondContact O-N 3.32Å; A1499-I1503 WeakPolarHBondContact O-CB 3.41Å; A1499-I1503 WeakPolarHBondContact O-CD1 3.24Å; A1499-I1503 VanDerWaalsContact O-CG1 3.22Å; A1499-I1503 WeakPolarHBondContact O-CG1 3.5Å; A1499-I1503 PolarHBondContact O-N 3.17Å; A1499-L1573 HydrophobicContact CB-CD2 4.07Å; A1499-F1576 HydrophobicContact CB-CD2 4.04Å; A1499-F1576 HydrophobicContact CB-CE2 4.26Å; A1499-F1613 HydrophobicContact CB-CE1 3.62Å; A1499-F1613 HydrophobicContact CB-CZ 4.03Å
1500	R	91.8	Very high	89.6	Confident	155 Å²	155	64.4 Å²	64.4	59%	0.585	30%	0.301	S	S	*	.	H	α-helix	trans	-64.4	-37.8	173.2	-76.7	176.2	171.9	-172.3	-4	113.4	V1496 F1497 E1498 L1502 V1504	V1496-R1500 WeakPolarHBondContact O-CB 3.31Å; V1496-R1500 WeakPolarHBondContact O-CG 3.44Å; V1496-R1500 PolarHBondContact O-N 3.46Å; F1497-R1500 PolarHBondContact O-N 3.33Å; E1498-R1500 VanDerWaalsContact C-N 3.28Å; E1498-R1500 PolarHBondContact O-N 2.88Å; R1500-L1502 VanDerWaalsContact C-N 3.29Å; R1500-L1502 PolarHBondContact O-N 2.9Å; R1500-V1504 WeakPolarHBondContact O-CB 3.38Å; R1500-V1504 VanDerWaalsContact O-CG2 3.29Å; R1500-V1504 WeakPolarHBondContact O-CG2 3.43Å; R1500-V1504 PolarHBondContact O-N 3.36Å
1501	R	93.5	Very high	89.6	Confident	108 Å²	108	61.2 Å²	61.2	41%	0.408	28%	0.284	S	S	.	.	H	α-helix	trans	-56.8	-45.3	174.5	-165.3	-166	94.2	-135.9	10.8	110.8	E1443 F1497 E1498 V1504 H1505	E1443-R1501 IonicContact OE1-CZ 3.55Å; E1443-R1501 IonicContact OE1-NH2 3.99Å; E1443-R1501 PolarHBondContact OE1-NH2 3.27Å; E1443-R1501 IonicContact OE2-CZ 2.72Å; E1443-R1501 IonicContact OE2-NH1 3.71Å; E1443-R1501 PolarHBondContact OE2-NH1 3.44Å; E1443-R1501 IonicContact OE2-NH2 3.37Å; E1443-R1501 PolarHBondContact OE2-NH2 2.91Å; F1497-R1501 PolarHBondContact O-N 2.78Å; E1498-R1501 WeakPolarHBondContact O-CB 3.23Å; E1498-R1501 PolarHBondContact O-N 3.3Å; E1498-R1501 VanDerWaalsContact O-N 3.08Å; E1498-R1501 VanDerWaalsContact OE2-CD 3.26Å; E1498-R1501 WeakPolarHBondContact OE2-CD 3.38Å; E1498-R1501 IonicContact OE2-CZ 2.72Å; E1498-R1501 IonicContact OE2-NE 3.52Å; E1498-R1501 IonicContact OE2-NH1 2.77Å; E1498-R1501 PolarHBondContact OE2-NH1 3.37Å; R1501-V1504 PolarHBondContact O-N 2.71Å; R1501-H1505 WeakPolarHBondContact O-CB 3.38Å; R1501-H1505 PolarHBondContact O-N 2.8Å
1502	L	90.7	Very high	89.5	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-79.2	-35.6	-174	-64.1	166	0	0	0	112.2	E1498 A1499 R1500 V1504 H1505 Y1506 Y1564 L1569 Q1572 F1576	E1498-L1502 WeakPolarHBondContact O-CG 3.42Å; E1498-L1502 PolarHBondContact O-N 3.11Å; A1499-L1502 PolarHBondContact O-N 3.32Å; R1500-L1502 VanDerWaalsContact C-N 3.29Å; R1500-L1502 PolarHBondContact O-N 2.9Å; L1502-V1504 VanDerWaalsContact C-N 3.35Å; L1502-H1505 WeakPolarHBondContact O-CB 3.36Å; L1502-H1505 PolarHBondContact O-N 3.28Å; L1502-Y1506 PolarHBondContact O-N 3.12Å; L1502-Y1564 HydrophobicContact CB-CE1 4.26Å; L1502-Y1564 HydrophobicContact CD2-CE1 4.45Å; L1502-L1569 HydrophobicContact CB-CD1 4.26Å; L1502-Q1572 HydrophobicContact CD1-CG 3.75Å; L1502-F1576 HydrophobicContact CD1-CE2 3.85Å; L1502-F1576 HydrophobicContact CD1-CZ 3.87Å
1503	I	90.7	Very high	89	Confident	30 Å²	30	62.1 Å²	62.1	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-44.5	167.8	-67.8	163.2	0	0	0	110.6	A1499 H1505 Y1506 Q1507 L1569 L1616	A1499-I1503 WeakPolarHBondContact O-CB 3.41Å; A1499-I1503 WeakPolarHBondContact O-CD1 3.24Å; A1499-I1503 VanDerWaalsContact O-CG1 3.22Å; A1499-I1503 WeakPolarHBondContact O-CG1 3.5Å; A1499-I1503 PolarHBondContact O-N 3.17Å; I1503-H1505 VanDerWaalsContact C-N 3.32Å; I1503-H1505 PolarHBondContact O-N 3.1Å; I1503-Y1506 PolarHBondContact O-N 3.07Å; I1503-Q1507 HydrophobicContact CG2-CG 4.39Å; I1503-Q1507 WeakPolarHBondContact O-CB 3.42Å; I1503-Q1507 VanDerWaalsContact O-CG 3.31Å; I1503-Q1507 WeakPolarHBondContact O-CG 3.46Å; I1503-Q1507 PolarHBondContact O-N 3.38Å; I1503-L1569 HydrophobicContact CG1-CD1 3.96Å; I1503-L1569 HydrophobicContact CG1-CD2 4.28Å; I1503-L1616 HydrophobicContact CD1-CD1 4.11Å; I1503-L1616 HydrophobicContact CD1-CD2 3.85Å
1504	V	91.5	Very high	88.1	Confident	76 Å²	76	60.1 Å²	60.1	46%	0.461	28%	0.277	S	S	.	.	H	α-helix	trans	-65.1	-35.9	175	169.6	0	0	0	0	111.4	R1500 R1501 L1502 Q1507 L1508	R1500-V1504 WeakPolarHBondContact O-CB 3.38Å; R1500-V1504 VanDerWaalsContact O-CG2 3.29Å; R1500-V1504 WeakPolarHBondContact O-CG2 3.43Å; R1500-V1504 PolarHBondContact O-N 3.36Å; R1501-V1504 PolarHBondContact O-N 2.71Å; L1502-V1504 VanDerWaalsContact C-N 3.35Å; V1504-Q1507 PolarHBondContact O-N 3.05Å; V1504-L1508 HydrophobicContact CG1-CD1 4.33Å; V1504-L1508 HydrophobicContact CG1-CG 4.41Å; V1504-L1508 VanDerWaalsContact O-CG 3.28Å; V1504-L1508 WeakPolarHBondContact O-CG 3.43Å; V1504-L1508 PolarHBondContact O-N 2.94Å
1505	H	88.6	Confident	86.9	Confident	75 Å²	75	57.7 Å²	57.7	35%	0.347	27%	0.271	S	S	.	.	H	α-helix	trans	-63.7	-42.7	176.9	-166.2	-114.5	0	0	0	112.4	R1501 L1502 I1503 Y1564	R1501-H1505 WeakPolarHBondContact O-CB 3.38Å; R1501-H1505 PolarHBondContact O-N 2.8Å; L1502-H1505 WeakPolarHBondContact O-CB 3.36Å; L1502-H1505 PolarHBondContact O-N 3.28Å; I1503-H1505 VanDerWaalsContact C-N 3.32Å; I1503-H1505 PolarHBondContact O-N 3.1Å; H1505-Y1564 WeakPolarHBondContact ND1-CB 3.3Å; H1505-Y1564 AromaticContact ND1-CD2 3.97Å; H1505-Y1564 AromaticContact ND1-CG 3.58Å
1506	Y	89.4	Confident	85.3	Confident	82 Å²	82	59.7 Å²	59.7	32%	0.322	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-52.5	168.9	164.1	-98.7	0	0	0	111.6	L1502 I1503 L1508 G1509 E1566 L1569	L1502-Y1506 PolarHBondContact O-N 3.12Å; I1503-Y1506 PolarHBondContact O-N 3.07Å; Y1506-L1508 PolarHBondContact O-N 3Å; Y1506-L1508 VanDerWaalsContact O-N 3.1Å; Y1506-G1509 PolarHBondContact O-N 2.85Å; Y1506-E1566 HydrophobicContact CD2-CB 4.49Å; Y1506-E1566 HydrophobicContact CE2-CB 3.69Å; Y1506-E1566 HydrophobicContact CE2-CG 4.15Å; Y1506-E1566 PolarHBondContact OH-OE2 2.87Å; Y1506-L1569 HydrophobicContact CD1-CD2 3.81Å; Y1506-L1569 HydrophobicContact CD2-CD2 4.35Å; Y1506-L1569 HydrophobicContact CE1-CD2 4.4Å; Y1506-L1569 HydrophobicContact CG-CD2 3.79Å
1507	Q	88.2	Confident	83.3	Confident	139 Å²	139	60.3 Å²	60.3	65%	0.65	29%	0.292	S	S	*	.	H	α-helix	trans	-63.2	-17.8	-179.5	-73.8	178.4	-15.5	0	0	114.4	I1503 V1504 G1509	I1503-Q1507 HydrophobicContact CG2-CG 4.39Å; I1503-Q1507 WeakPolarHBondContact O-CB 3.42Å; I1503-Q1507 VanDerWaalsContact O-CG 3.31Å; I1503-Q1507 WeakPolarHBondContact O-CG 3.46Å; I1503-Q1507 PolarHBondContact O-N 3.38Å; V1504-Q1507 PolarHBondContact O-N 3.05Å; Q1507-G1509 VanDerWaalsContact C-N 3.26Å; Q1507-G1509 PolarHBondContact O-N 3.29Å
1508	L	89.3	Confident	82.2	Confident	61 Å²	61	55.1 Å²	55.1	32%	0.319	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-22.4	171.9	-78.9	168.2	0	0	0	112.3	V1504 Y1506 W1510 R1523	V1504-L1508 HydrophobicContact CG1-CD1 4.33Å; V1504-L1508 HydrophobicContact CG1-CG 4.41Å; V1504-L1508 VanDerWaalsContact O-CG 3.28Å; V1504-L1508 WeakPolarHBondContact O-CG 3.43Å; V1504-L1508 PolarHBondContact O-N 2.94Å; Y1506-L1508 PolarHBondContact O-N 3Å; Y1506-L1508 VanDerWaalsContact O-N 3.1Å; L1508-W1510 VanDerWaalsContact C-N 3.34Å; L1508-W1510 PolarHBondContact O-N 2.71Å; L1508-R1523 PolarHBondContact O-NE 3.08Å; L1508-R1523 PolarHBondContact O-NH2 2.81Å
1509	G	86.5	Confident	81	Confident	32 Å²	32	56 Å²	56	33%	0.33	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	39.8	175	0	0	0	0	0	113.5	Y1506 Q1507	Y1506-G1509 PolarHBondContact O-N 2.85Å; Q1507-G1509 VanDerWaalsContact C-N 3.26Å; Q1507-G1509 PolarHBondContact O-N 3.29Å
1510	W	87.5	Confident	80.3	Confident	100 Å²	100	58.1 Å²	58.1	38%	0.379	30%	0.297	S	S	.	.			trans	-74.9	128.2	172.8	-76.6	110.8	0	0	0	110.3	L1508 V1521 R1523 N1563	L1508-W1510 VanDerWaalsContact C-N 3.34Å; L1508-W1510 PolarHBondContact O-N 2.71Å; W1510-V1521 HydrophobicContact CE3-CG1 3.71Å; W1510-V1521 HydrophobicContact CZ3-CG1 4.07Å; W1510-R1523 HydrophobicContact CD2-CG 3.52Å; W1510-R1523 HydrophobicContact CE3-CG 3.34Å; W1510-R1523 HydrophobicContact CG-CG 4.23Å; W1510-R1523 HydrophobicContact CH2-CG 3.93Å; W1510-R1523 HydrophobicContact CZ2-CG 4.07Å; W1510-R1523 HydrophobicContact CZ3-CG 3.57Å; W1510-N1563 HydrophobicContact CB-CB 4.28Å; W1510-N1563 WeakPolarHBondContact O-CB 3.39Å; W1510-N1563 PolarHBondContact O-N 2.98Å
1511	M	85.8	Confident	79.8	Confident	17 Å²	17	54.3 Å²	54.3	8%	0.084	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.9	-180	-49.9	165.4	-74.7	0	0	109.9	V1521 T1522 L1525 P1549 L1560 K1561	M1511-V1521 CarbonylContact O-C 3.56Å; M1511-V1521 WeakPolarHBondContact O-CA 3.29Å; M1511-T1522 HydrophobicContact CE-CG2 4.42Å; M1511-T1522 PolarHBondContact N-O 2.69Å; M1511-T1522 PolarHBondContact O-N 3.12Å; M1511-L1525 HydrophobicContact CE-CD2 3.87Å; M1511-L1525 HydrophobicContact CE-CG 4.33Å; M1511-L1525 HydrophobicContact SD-CD2 4.01Å; M1511-P1549 HydrophobicContact CE-CG 4.46Å; M1511-P1549 HydrophobicContact SD-CG 3.47Å; M1511-P1549 WeakPolarHBondContact SD-CG 3.28Å; M1511-L1560 HydrophobicContact CB-CB 3.85Å; M1511-L1560 HydrophobicContact CE-CD1 4.3Å; M1511-L1560 HydrophobicContact SD-CB 4.28Å; M1511-K1561 CarbonylContact C-O 3.47Å; M1511-K1561 VanDerWaalsContact CA-O 3.24Å; M1511-K1561 WeakPolarHBondContact CA-O 3.23Å
1512	T	83.3	Confident	79.3	Confident	23 Å²	23	50.6 Å²	50.6	14%	0.141	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.7	176.2	-53.3	0	0	0	0	109.9	E1514 V1520 V1521 L1560 K1561 N1563	T1512-E1514 PolarHBondContact O-N 3.04Å; T1512-V1520 WeakPolarHBondContact CA-O 3.49Å; T1512-V1521 HydrophobicContact CG2-CG2 4.02Å; T1512-L1560 CarbonylContact O-C 3.57Å; T1512-L1560 WeakPolarHBondContact O-CA 3.35Å; T1512-K1561 PolarHBondContact N-O 3.17Å; T1512-K1561 PolarHBondContact O-N 3.01Å; T1512-N1563 WeakPolarHBondContact CB-OD1 3.45Å; T1512-N1563 PolarHBondContact N-OD1 3.46Å; T1512-N1563 PolarHBondContact OG1-ND2 3.41Å; T1512-N1563 PolarHBondContact OG1-OD1 2.68Å
1513	C	78.3	Confident	79	Confident	9 Å²	9	56.6 Å²	56.6	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	133.6	172.9	-165.1	0	0	0	0	111.6	D1515 C1518 V1520 C1551 L1560	C1513-D1515 VanDerWaalsContact C-N 3.29Å; C1513-D1515 PolarHBondContact O-N 3.42Å; C1513-C1518 HydrophobicContact CB-CB 4.23Å; C1513-V1520 HydrophobicContact CB-CG1 4.19Å; C1513-V1520 PolarHBondContact N-O 2.84Å; C1513-C1551 HydrophobicContact CB-CB 4.3Å; C1513-C1551 VanDerWaalsContact SG-CB 3.53Å; C1513-L1560 HydrophobicContact CB-CD2 4.21Å
1514	E	69.9	Low	78.3	Confident	72 Å²	72	59 Å²	59	34%	0.336	32%	0.322	S	S	.	.	S	Bend	trans	-69.9	-24.2	176.9	-70.5	178.9	166.4	0	0	112.6	T1512 P1516 R1548 A1558 A1559 K1561	T1512-E1514 PolarHBondContact O-N 3.04Å; E1514-P1516 WeakPolarHBondContact O-CD 3.36Å; E1514-R1548 IonicContact OE1-CZ 3.08Å; E1514-R1548 VanDerWaalsContact OE1-CZ 3.31Å; E1514-R1548 IonicContact OE1-NE 3.89Å; E1514-R1548 PolarHBondContact OE1-NE 3.2Å; E1514-R1548 IonicContact OE1-NH2 3.43Å; E1514-R1548 PolarHBondContact OE1-NH2 2.88Å; E1514-A1558 HydrophobicContact CB-CB 4.48Å; E1514-A1559 PolarHBondContact N-O 2.93Å; E1514-K1561 HydrophobicContact CG-CB 3.77Å; E1514-K1561 HydrophobicContact CG-CD 4.44Å
1515	D	64.3	Low	77.2	Confident	39 Å²	39	59.2 Å²	59.2	21%	0.209	32%	0.32	C	S	.	.	S	Bend	trans	-69.4	117.8	171.9	164.7	27.5	0	0	0	110.9	C1513 A1517 C1518 A1519 A1558	C1513-D1515 VanDerWaalsContact C-N 3.29Å; C1513-D1515 PolarHBondContact O-N 3.42Å; D1515-A1517 VanDerWaalsContact C-N 3.25Å; D1515-A1517 PolarHBondContact O-N 2.92Å; D1515-A1517 WeakPolarHBondContact OD1-CB 3.31Å; D1515-A1517 PolarHBondContact OD1-N 2.78Å; D1515-C1518 HydrophobicContact CB-CB 4.08Å; D1515-C1518 PolarHBondContact O-N 2.65Å; D1515-C1518 WeakPolarHBondContact OD2-CB 3.3Å; D1515-C1518 PolarHBondContact OD2-N 2.92Å; D1515-A1519 PolarHBondContact O-N 2.66Å; D1515-A1558 HydrophobicContact CB-CB 3.65Å
1516	P	55.6	Low	75.9	Confident	43 Å²	43	61 Å²	61	28%	0.279	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-22.5	-179.9	-20.9	33.7	0	0	0	114.8	Y1408 E1514	Y1408-P1516 HydrophobicContact CD1-CB 3.66Å; Y1408-P1516 HydrophobicContact CD1-CG 3.85Å; Y1408-P1516 HydrophobicContact CE1-CB 3.68Å; Y1408-P1516 HydrophobicContact CE1-CG 4.07Å; Y1408-P1516 HydrophobicContact CG-CB 4.3Å; E1514-P1516 WeakPolarHBondContact O-CD 3.36Å
1517	A	50.2	Low	74.1	Confident	41 Å²	41	60.6 Å²	60.6	34%	0.339	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-31.3	178.4	0	0	0	0	0	112.1	H1376 D1515	H1376-A1517 WeakPolarHBondContact NE2-CB 3.2Å; D1515-A1517 VanDerWaalsContact C-N 3.25Å; D1515-A1517 PolarHBondContact O-N 2.92Å; D1515-A1517 WeakPolarHBondContact OD1-CB 3.31Å; D1515-A1517 PolarHBondContact OD1-N 2.78Å
1518	C	68.3	Low	72.2	Confident	30 Å²	30	57.5 Å²	57.5	20%	0.203	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-52.9	170.3	179.6	0	0	0	0	112.3	C1513 D1515 V1520 C1551 C1554	C1513-C1518 HydrophobicContact CB-CB 4.23Å; D1515-C1518 HydrophobicContact CB-CB 4.08Å; D1515-C1518 PolarHBondContact O-N 2.65Å; D1515-C1518 WeakPolarHBondContact OD2-CB 3.3Å; D1515-C1518 PolarHBondContact OD2-N 2.92Å; C1518-V1520 PolarHBondContact O-N 3.04Å; C1518-C1551 VanDerWaalsContact SG-SG 3.7Å; C1518-C1554 HydrophobicContact CB-CB 4.08Å
1519	A	67.7	Low	69.9	Low	42 Å²	42	60.8 Å²	60.8	35%	0.347	35%	0.353	S	S	.	.			trans	45.8	16.8	179.2	0	0	0	0	0	116.9	D1515 V1521	D1515-A1519 PolarHBondContact O-N 2.66Å; A1519-V1521 PolarHBondContact O-N 3.19Å
1520	V	75.5	Confident	67.6	Low	44 Å²	44	64.3 Å²	64.3	27%	0.267	37%	0.373	S	S	.	.			trans	-69.7	135.4	-169.1	77.6	0	0	0	0	111.3	T1512 C1513 C1518 C1551 V1553	T1512-V1520 WeakPolarHBondContact CA-O 3.49Å; C1513-V1520 HydrophobicContact CB-CG1 4.19Å; C1513-V1520 PolarHBondContact N-O 2.84Å; C1518-V1520 PolarHBondContact O-N 3.04Å; V1520-C1551 VanDerWaalsContact CG1-SG 3.57Å; V1520-V1553 HydrophobicContact CG1-CB 4.04Å; V1520-V1553 HydrophobicContact CG1-CG2 3.93Å; V1520-V1553 HydrophobicContact CG2-CG2 4.37Å
1521	V	82.3	Confident	65.2	Low	74 Å²	74	64.5 Å²	64.5	45%	0.448	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.6	179.2	-174.5	0	0	0	0	108.9	W1510 M1511 T1512 A1519	W1510-V1521 HydrophobicContact CE3-CG1 3.71Å; W1510-V1521 HydrophobicContact CZ3-CG1 4.07Å; M1511-V1521 CarbonylContact O-C 3.56Å; M1511-V1521 WeakPolarHBondContact O-CA 3.29Å; T1512-V1521 HydrophobicContact CG2-CG2 4.02Å; A1519-V1521 PolarHBondContact O-N 3.19Å
1522	T	82.7	Confident	62.5	Low	30 Å²	30	66.6 Å²	66.6	18%	0.184	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	158.3	-172.8	-177.3	0	0	0	0	112.4	M1511 S1524 L1560	M1511-T1522 HydrophobicContact CE-CG2 4.42Å; M1511-T1522 PolarHBondContact N-O 2.69Å; M1511-T1522 PolarHBondContact O-N 3.12Å; T1522-S1524 PolarHBondContact OG1-N 3.15Å; T1522-S1524 PolarHBondContact OG1-O 2.84Å; T1522-L1560 HydrophobicContact CG2-CD1 3.7Å; T1522-L1560 HydrophobicContact CG2-CD2 3.75Å; T1522-L1560 HydrophobicContact CG2-CG 4.36Å
1523	R	84.3	Confident	60.2	Low	130 Å²	130	74.7 Å²	74.7	49%	0.491	45%	0.451	S	S	.	.	S	Bend	trans	-114.3	-12.1	165.6	-53.8	-178.8	68.2	-150.8	-7.8	112.2	L1508 W1510 L1525	L1508-R1523 PolarHBondContact O-NE 3.08Å; L1508-R1523 PolarHBondContact O-NH2 2.81Å; W1510-R1523 HydrophobicContact CD2-CG 3.52Å; W1510-R1523 HydrophobicContact CE3-CG 3.34Å; W1510-R1523 HydrophobicContact CG-CG 4.23Å; W1510-R1523 HydrophobicContact CH2-CG 3.93Å; W1510-R1523 HydrophobicContact CZ2-CG 4.07Å; W1510-R1523 HydrophobicContact CZ3-CG 3.57Å; R1523-L1525 PolarHBondContact O-N 2.77Å
1524	S	75	Confident	57.9	Low	80 Å²	80	82 Å²	82	56%	0.559	49%	0.485	S	S	*	.			trans	-86.4	109	179.2	-64.8	0	0	0	0	108.9	T1522 H1526	T1522-S1524 PolarHBondContact OG1-N 3.15Å; T1522-S1524 PolarHBondContact OG1-O 2.84Å; S1524-H1526 PolarHBondContact O-N 3.26Å
1525	L	69.4	Low	55.9	Low	80 Å²	80	85.2 Å²	85.2	42%	0.419	51%	0.509	S	S	.	.			trans	-57.5	122.3	160	-63.3	166.3	0	0	0	108	M1511 R1523 W1543 P1549	M1511-L1525 HydrophobicContact CE-CD2 3.87Å; M1511-L1525 HydrophobicContact CE-CG 4.33Å; M1511-L1525 HydrophobicContact SD-CD2 4.01Å; R1523-L1525 PolarHBondContact O-N 2.77Å; L1525-W1543 HydrophobicContact CD1-CH2 3.85Å; L1525-W1543 HydrophobicContact CD1-CZ2 4.43Å; L1525-W1543 HydrophobicContact CD2-CH2 3.73Å; L1525-W1543 HydrophobicContact CD2-CZ3 3.66Å; L1525-W1543 HydrophobicContact CG-CH2 4.48Å; L1525-P1549 HydrophobicContact CD2-CB 3.46Å; L1525-P1549 VanDerWaalsContact CD2-CB 3.46Å; L1525-P1549 HydrophobicContact CD2-CG 3.46Å; L1525-P1549 VanDerWaalsContact CD2-CG 3.46Å
1526	H	60.6	Low	54.1	Low	114 Å²	114	90.2 Å²	90.2	53%	0.528	53%	0.534	S	S	.	.			trans	-86.7	104.6	162.8	-100.6	56.8	0	0	0	107.5	S1524 P1528	S1524-H1526 PolarHBondContact O-N 3.26Å; H1526-P1528 WeakPolarHBondContact O-CD 2.99Å
1527	C	51.1	Low	52.8	Low	72 Å²	72	91.4 Å²	91.4	49%	0.486	56%	0.555	S	S	.	*			trans	-62.8	125.8	152.3	-58.5	0	0	0	0	106.5
1528	P	48.7	Very low	51.7	Low	74 Å²	74	98.5 Å²	98.5	48%	0.481	58%	0.581	S	S	.	*			trans	-56.5	144.6	161.1	27.1	-32.7	0	0	0	107.9	H1526 S1530	H1526-P1528 WeakPolarHBondContact O-CD 2.99Å; P1528-S1530 PolarHBondContact O-N 2.93Å
1529	P	41.7	Very low	50	Low	131 Å²	131	101.6 Å²	101.6	85%	0.851	60%	0.603	S	S	*	*			trans	-61	113.4	177.1	25.8	-32.9	0	0	0	108.2	S1531	P1529-S1531 PolarHBondContact O-N 2.93Å
1530	S	38.4	Very low	48.5	Very low	105 Å²	105	105.5 Å²	105.5	73%	0.734	62%	0.618	S	S	*	*			trans	-61.2	114.8	-178.8	39.5	0	0	0	0	109.5	P1528 G1532	P1528-S1530 PolarHBondContact O-N 2.93Å; S1530-G1532 PolarHBondContact O-N 3.13Å
1531	S	36.3	Very low	46.8	Very low	104 Å²	104	106.1 Å²	106.1	73%	0.727	63%	0.633	S	S	*	*			trans	-56	104.6	166.9	48.4	0	0	0	0	107.6	P1529 H1533	P1529-S1531 PolarHBondContact O-N 2.93Å; S1531-H1533 PolarHBondContact O-N 3.4Å
1532	G	29.6	Very low	44.9	Very low	62 Å²	62	106.7 Å²	106.7	64%	0.639	63%	0.633	S	S	*	*	S	Bend	trans	-80.5	116.3	-155	0	0	0	0	0	113.5	S1530	S1530-G1532 PolarHBondContact O-N 3.13Å
1533	H	35.4	Very low	43	Very low	193 Å²	193	111.4 Å²	111.4	89%	0.894	65%	0.648	S	S	*	*				-148.1	148.4	121.9	-121.4	-93.1	0	0	0	110.7	S1531	S1531-H1533 PolarHBondContact O-N 3.4Å
1534	H	29.4	Very low	41.3	Very low	163 Å²	163	105.7 Å²	105.7	76%	0.755	63%	0.628	S	S	*	*			trans	-101.1	109.4	-179.3	-81.8	-75	0	0	0	111.3
1535	T	27.3	Very low	39.6	Very low	139 Å²	139	107.5 Å²	107.5	85%	0.853	62%	0.623	S	S	*	*			trans	-107.8	138	139	46.8	0	0	0	0	107.2	G1537	T1535-G1537 PolarHBondContact O-N 3.47Å
1536	I	27.2	Very low	38.5	Very low	143 Å²	143	106 Å²	106	73%	0.733	63%	0.626	S	S	*	*			trans	-97.5	91.6	-168.6	-58.6	177.1	0	0	0	109.6	E1538	I1536-E1538 HydrophobicContact CG2-CG 4.2Å
1537	G	27.9	Very low	38.3	Very low	69 Å²	69	102.7 Å²	102.7	71%	0.711	62%	0.623	S	S	*	*			trans	-95.5	134	152.2	0	0	0	0	0	109.4	T1535 S1539	T1535-G1537 PolarHBondContact O-N 3.47Å; G1537-S1539 PolarHBondContact O-N 3.33Å
1538	E	28	Very low	39	Very low	189 Å²	189	103.1 Å²	103.1	88%	0.883	61%	0.614	S	S	*	*	S	Bend	trans	-92.2	73.4	-167.3	-64.8	-169.9	123.2	0	0	114.6	I1536	I1536-E1538 HydrophobicContact CG2-CG 4.2Å
1539	S	32.5	Very low	40.1	Very low	95 Å²	95	100 Å²	100	66%	0.664	59%	0.594	S	S	*	*	S	Bend	trans	-169.4	-50.6	156.3	53.9	0	0	0	0	115.2	G1537 G1541	G1537-S1539 PolarHBondContact O-N 3.33Å; S1539-G1541 PolarHBondContact O-N 3.06Å
1540	D	34.9	Very low	41.5	Very low	125 Å²	125	96.3 Å²	96.3	67%	0.668	57%	0.567	S	S	*	*			trans	-92.4	106	-150.8	-75.5	11	0	0	0	114.3
1541	G	39.5	Very low	43.1	Very low	57 Å²	57	91.3 Å²	91.3	59%	0.588	53%	0.532	S	S	*	.	S	Bend	trans	176.5	1.6	170.3	0	0	0	0	0	118.8	S1539	S1539-G1541 PolarHBondContact O-N 3.06Å
1542	L	44.1	Very low	44.6	Very low	85 Å²	85	88.2 Å²	88.2	45%	0.445	52%	0.516	S	S	.	.	S	Bend	trans	-115.6	-10.6	-171.6	-87.9	79.6	0	0	0	116.1
1543	W	42.5	Very low	46.3	Very low	129 Å²	129	88.5 Å²	88.5	49%	0.489	51%	0.506	S	S	.	.			trans	-139.5	146.5	-165.2	-45.2	92	0	0	0	111.8	L1525 R1548 P1549	L1525-W1543 HydrophobicContact CD1-CH2 3.85Å; L1525-W1543 HydrophobicContact CD1-CZ2 4.43Å; L1525-W1543 HydrophobicContact CD2-CH2 3.73Å; L1525-W1543 HydrophobicContact CD2-CZ3 3.66Å; L1525-W1543 HydrophobicContact CG-CH2 4.48Å; W1543-R1548 CarbonylContact C-O 3.56Å; W1543-R1548 WeakPolarHBondContact CA-O 3.45Å; W1543-P1549 HydrophobicContact CE3-CB 3.65Å; W1543-P1549 HydrophobicContact CE3-CG 3.92Å; W1543-P1549 HydrophobicContact CZ3-CB 3.73Å; W1543-P1549 HydrophobicContact CZ3-CG 3.65Å
1544	A	48.6	Very low	47.6	Very low	10 Å²	10	80.1 Å²	80.1	8%	0.083	47%	0.469	C	S	.	.			trans	-149.9	139.4	176.3	0	0	0	0	0	113.3	R1548 L1550	A1544-R1548 CarbonylContact C-O 3.58Å; A1544-R1548 PolarHBondContact N-O 2.95Å; A1544-L1550 HydrophobicContact CB-CD1 4.05Å; A1544-L1550 HydrophobicContact CB-CD2 3.87Å; A1544-L1550 HydrophobicContact CB-CG 3.87Å
1545	R	39.5	Very low	49.1	Very low	119 Å²	119	75 Å²	75	45%	0.449	46%	0.46	S	S	.	.	S	Bend	trans	61.7	102.9	-165.3	-66.9	-166.2	177.5	-132.5	-18.5	113.9	E25 E32 G1547 R1548	E25-R1545 WeakPolarHBondContact OE1-CA 3.49Å; E32-R1545 WeakPolarHBondContact OE2-CG 3.33Å; E32-R1545 IonicContact OE2-CZ 3.25Å; E32-R1545 VanDerWaalsContact OE2-CZ 3.23Å; E32-R1545 IonicContact OE2-NE 3.18Å; E32-R1545 PolarHBondContact OE2-NE 2.85Å; E32-R1545 IonicContact OE2-NH2 2.67Å; E32-R1545 PolarHBondContact OE2-NH2 3.13Å; R1545-G1547 VanDerWaalsContact C-N 3.31Å; R1545-G1547 PolarHBondContact O-N 3.01Å; R1545-R1548 VanDerWaalsContact O-CB 3.31Å; R1545-R1548 WeakPolarHBondContact O-CB 3.36Å; R1545-R1548 WeakPolarHBondContact O-CG 3.38Å; R1545-R1548 PolarHBondContact O-N 3.21Å
1546	G	46	Very low	50.6	Low	47 Å²	47	69.5 Å²	69.5	49%	0.485	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	42.3	175.2	0	0	0	0	0	112.8	E25 R1548	E25-G1546 VanDerWaalsContact CD-N 3.3Å; E25-G1546 PolarHBondContact OE1-N 3.04Å; G1546-R1548 PolarHBondContact O-N 3.14Å
1547	G	56.7	Low	52	Low	45 Å²	45	70.4 Å²	70.4	46%	0.464	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	10.7	-176	0	0	0	0	0	115.7	R1545	R1545-G1547 VanDerWaalsContact C-N 3.31Å; R1545-G1547 PolarHBondContact O-N 3.01Å
1548	R	65.4	Low	53.6	Low	82 Å²	82	67.9 Å²	67.9	31%	0.309	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-82.7	153.2	179.6	-57.5	-152.8	-89.7	-85.6	11.4	111.3	E1514 W1543 A1544 R1545 G1546 A1559	E1514-R1548 IonicContact OE1-CZ 3.08Å; E1514-R1548 VanDerWaalsContact OE1-CZ 3.31Å; E1514-R1548 IonicContact OE1-NE 3.89Å; E1514-R1548 PolarHBondContact OE1-NE 3.2Å; E1514-R1548 IonicContact OE1-NH2 3.43Å; E1514-R1548 PolarHBondContact OE1-NH2 2.88Å; W1543-R1548 CarbonylContact C-O 3.56Å; W1543-R1548 WeakPolarHBondContact CA-O 3.45Å; A1544-R1548 CarbonylContact C-O 3.58Å; A1544-R1548 PolarHBondContact N-O 2.95Å; R1545-R1548 VanDerWaalsContact O-CB 3.31Å; R1545-R1548 WeakPolarHBondContact O-CB 3.36Å; R1545-R1548 WeakPolarHBondContact O-CG 3.38Å; R1545-R1548 PolarHBondContact O-N 3.21Å; G1546-R1548 PolarHBondContact O-N 3.14Å; R1548-A1559 HydrophobicContact CB-CB 4.02Å
1549	P	71.6	Confident	55.8	Low	7 Å²	7	59 Å²	59	5%	0.045	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-86.8	150.3	179.9	28.7	-26	0	0	0	111.5	M1511 L1525 W1543 L1560	M1511-P1549 HydrophobicContact CE-CG 4.46Å; M1511-P1549 HydrophobicContact SD-CG 3.47Å; M1511-P1549 WeakPolarHBondContact SD-CG 3.28Å; L1525-P1549 HydrophobicContact CD2-CB 3.46Å; L1525-P1549 VanDerWaalsContact CD2-CB 3.46Å; L1525-P1549 HydrophobicContact CD2-CG 3.46Å; L1525-P1549 VanDerWaalsContact CD2-CG 3.46Å; W1543-P1549 HydrophobicContact CE3-CB 3.65Å; W1543-P1549 HydrophobicContact CE3-CG 3.92Å; W1543-P1549 HydrophobicContact CZ3-CB 3.73Å; W1543-P1549 HydrophobicContact CZ3-CG 3.65Å; P1549-L1560 HydrophobicContact CG-CB 4.09Å; P1549-L1560 HydrophobicContact CG-CD1 4.36Å; P1549-L1560 WeakPolarHBondContact O-CB 3.46Å; P1549-L1560 PolarHBondContact O-N 3.42Å
1550	L	70.5	Confident	57.8	Low	54 Å²	54	54.6 Å²	54.6	28%	0.283	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-77.3	145.3	-178.8	-70.4	179.7	0	0	0	113.2	A1544 G1552 L1560	A1544-L1550 HydrophobicContact CB-CD1 4.05Å; A1544-L1550 HydrophobicContact CB-CD2 3.87Å; A1544-L1550 HydrophobicContact CB-CG 3.87Å; L1550-G1552 PolarHBondContact O-N 3.4Å; L1550-L1560 WeakPolarHBondContact O-CD1 3.44Å
1551	C	72.4	Confident	59.9	Low	1 Å²	1	51.3 Å²	51.3	1%	0.007	31%	0.312	C	S	.	.			trans	-78.2	105.6	174.5	-178.9	0	0	0	0	111.4	C1513 C1518 V1520 V1553 C1554 G1556 A1558 L1560	C1513-C1551 HydrophobicContact CB-CB 4.3Å; C1513-C1551 VanDerWaalsContact SG-CB 3.53Å; C1518-C1551 VanDerWaalsContact SG-SG 3.7Å; V1520-C1551 VanDerWaalsContact CG1-SG 3.57Å; C1551-V1553 PolarHBondContact O-N 2.96Å; C1551-V1553 VanDerWaalsContact O-N 3.08Å; C1551-C1554 VanDerWaalsContact CB-SG 3.58Å; C1551-C1554 PolarHBondContact O-N 3.29Å; C1551-G1556 PolarHBondContact O-N 2.92Å; C1551-A1558 VanDerWaalsContact CB-O 3.29Å; C1551-A1558 WeakPolarHBondContact CB-O 3.46Å; C1551-A1558 PolarHBondContact N-O 2.85Å; C1551-L1560 HydrophobicContact CB-CD2 3.69Å; C1551-L1560 HydrophobicContact CB-CG 3.92Å
1552	G	66.8	Low	61.9	Low	38 Å²	38	51 Å²	51	39%	0.392	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-10.3	176.1	0	0	0	0	0	115.5	L1550	L1550-G1552 PolarHBondContact O-N 3.4Å
1553	V	67.3	Low	63.8	Low	69 Å²	69	50.4 Å²	50.4	42%	0.418	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-39.7	-179.6	-178.8	0	0	0	0	112.3	L1336 V1520 C1551 G1555	L1336-V1553 WeakPolarHBondContact CD1-O 3.35Å; L1336-V1553 HydrophobicContact CD2-CG1 4.29Å; L1336-V1553 WeakPolarHBondContact CD2-O 3.45Å; V1520-V1553 HydrophobicContact CG1-CB 4.04Å; V1520-V1553 HydrophobicContact CG1-CG2 3.93Å; V1520-V1553 HydrophobicContact CG2-CG2 4.37Å; C1551-V1553 PolarHBondContact O-N 2.96Å; C1551-V1553 VanDerWaalsContact O-N 3.08Å; V1553-G1555 PolarHBondContact O-N 2.92Å
1554	C	62.7	Low	65.8	Low	17 Å²	17	45.7 Å²	45.7	12%	0.115	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	22.4	171	65.1	0	0	0	0	112.8	C1518 C1551 G1556 Q1557	C1518-C1554 HydrophobicContact CB-CB 4.08Å; C1551-C1554 VanDerWaalsContact CB-SG 3.58Å; C1551-C1554 PolarHBondContact O-N 3.29Å; C1554-G1556 PolarHBondContact O-N 2.97Å; C1554-Q1557 WeakPolarHBondContact O-CB 3.31Å; C1554-Q1557 WeakPolarHBondContact O-CG 3.47Å; C1554-Q1557 PolarHBondContact O-N 3.17Å
1555	G	59.1	Low	67.5	Low	55 Å²	55	47.5 Å²	47.5	57%	0.567	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	28	178.6	0	0	0	0	0	114.3	V1553	V1553-G1555 PolarHBondContact O-N 2.92Å
1556	G	60.7	Low	69.6	Low	24 Å²	24	44.1 Å²	44.1	25%	0.247	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	7.8	-177.7	0	0	0	0	0	115.5	C1551 C1554 A1558	C1551-G1556 PolarHBondContact O-N 2.92Å; C1554-G1556 PolarHBondContact O-N 2.97Å; G1556-A1558 PolarHBondContact O-N 3.02Å
1557	Q	55.5	Low	71.3	Confident	161 Å²	161	42.8 Å²	42.8	75%	0.752	27%	0.266	S	S	*	.	S	Bend	trans	-69.1	-10.9	179.1	-69.2	-170.8	-18.9	0	0	114.7	C1554	C1554-Q1557 WeakPolarHBondContact O-CB 3.31Å; C1554-Q1557 WeakPolarHBondContact O-CG 3.47Å; C1554-Q1557 PolarHBondContact O-N 3.17Å
1558	A	62.3	Low	72.7	Confident	16 Å²	16	43.7 Å²	43.7	13%	0.132	26%	0.258	C	S	.	.	S	Bend	trans	-146.2	153.9	172.5	0	0	0	0	0	111.5	E1514 D1515 C1551 G1556	E1514-A1558 HydrophobicContact CB-CB 4.48Å; D1515-A1558 HydrophobicContact CB-CB 3.65Å; C1551-A1558 VanDerWaalsContact CB-O 3.29Å; C1551-A1558 WeakPolarHBondContact CB-O 3.46Å; C1551-A1558 PolarHBondContact N-O 2.85Å; G1556-A1558 PolarHBondContact O-N 3.02Å
1559	A	72.5	Confident	73.8	Confident	3 Å²	3	40.4 Å²	40.4	3%	0.025	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-77.4	161.5	173.8	0	0	0	0	0	111.6	E1514 R1548	E1514-A1559 PolarHBondContact N-O 2.93Å; R1548-A1559 HydrophobicContact CB-CB 4.02Å
1560	L	75.5	Confident	74.6	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	108.3	171.1	-65.6	170	0	0	0	108.6	M1511 T1512 C1513 T1522 P1549 L1550 C1551	M1511-L1560 HydrophobicContact CB-CB 3.85Å; M1511-L1560 HydrophobicContact CE-CD1 4.3Å; M1511-L1560 HydrophobicContact SD-CB 4.28Å; T1512-L1560 CarbonylContact O-C 3.57Å; T1512-L1560 WeakPolarHBondContact O-CA 3.35Å; C1513-L1560 HydrophobicContact CB-CD2 4.21Å; T1522-L1560 HydrophobicContact CG2-CD1 3.7Å; T1522-L1560 HydrophobicContact CG2-CD2 3.75Å; T1522-L1560 HydrophobicContact CG2-CG 4.36Å; P1549-L1560 HydrophobicContact CG-CB 4.09Å; P1549-L1560 HydrophobicContact CG-CD1 4.36Å; P1549-L1560 WeakPolarHBondContact O-CB 3.46Å; P1549-L1560 PolarHBondContact O-N 3.42Å; L1550-L1560 WeakPolarHBondContact O-CD1 3.44Å; C1551-L1560 HydrophobicContact CB-CD2 3.69Å; C1551-L1560 HydrophobicContact CB-CG 3.92Å
1561	K	78.8	Confident	75.3	Confident	55 Å²	55	43.6 Å²	43.6	24%	0.239	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.1	176.3	-169.3	160.5	-179.2	167.1	0	110.2	D1418 M1511 T1512 E1514 N1563	D1418-K1561 IonicContact OD2-NZ 3.99Å; D1418-K1561 PolarHBondContact OD2-NZ 3.18Å; M1511-K1561 CarbonylContact C-O 3.47Å; M1511-K1561 VanDerWaalsContact CA-O 3.24Å; M1511-K1561 WeakPolarHBondContact CA-O 3.23Å; T1512-K1561 PolarHBondContact N-O 3.17Å; T1512-K1561 PolarHBondContact O-N 3.01Å; E1514-K1561 HydrophobicContact CG-CB 3.77Å; E1514-K1561 HydrophobicContact CG-CD 4.44Å; K1561-N1563 PolarHBondContact O-N 2.77Å
1562	S	82.3	Confident	76	Confident	51 Å²	51	43.6 Å²	43.6	36%	0.357	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	134.1	176	178.9	0	0	0	0	110.8	Y1564	S1562-Y1564 PolarHBondContact O-N 2.96Å; S1562-Y1564 PolarHBondContact OG-N 3.25Å; S1562-Y1564 PolarHBondContact OG-O 3.44Å; S1562-Y1564 VanDerWaalsContact OG-O 3.08Å
1563	N	82.6	Confident	77.1	Confident	72 Å²	72	42.2 Å²	42.2	39%	0.385	24%	0.237	S	C	.	.	S	Bend	trans	-70.6	-15	177	-67	5.4	0	0	0	112.4	W1510 T1512 K1561	W1510-N1563 HydrophobicContact CB-CB 4.28Å; W1510-N1563 WeakPolarHBondContact O-CB 3.39Å; W1510-N1563 PolarHBondContact O-N 2.98Å; T1512-N1563 WeakPolarHBondContact CB-OD1 3.45Å; T1512-N1563 PolarHBondContact N-OD1 3.46Å; T1512-N1563 PolarHBondContact OG1-ND2 3.41Å; T1512-N1563 PolarHBondContact OG1-OD1 2.68Å; K1561-N1563 PolarHBondContact O-N 2.77Å
1564	Y	85.3	Confident	78.1	Confident	31 Å²	31	39.6 Å²	39.6	12%	0.122	22%	0.222	C	C	.	.	S	Bend	trans	-153.4	97.8	175.8	-155.8	-108.9	0	0	0	109.3	L1502 H1505 S1562 K1568 L1569	L1502-Y1564 HydrophobicContact CB-CE1 4.26Å; L1502-Y1564 HydrophobicContact CD2-CE1 4.45Å; H1505-Y1564 WeakPolarHBondContact ND1-CB 3.3Å; H1505-Y1564 AromaticContact ND1-CD2 3.97Å; H1505-Y1564 AromaticContact ND1-CG 3.58Å; S1562-Y1564 PolarHBondContact O-N 2.96Å; S1562-Y1564 PolarHBondContact OG-N 3.25Å; S1562-Y1564 PolarHBondContact OG-O 3.44Å; S1562-Y1564 VanDerWaalsContact OG-O 3.08Å; Y1564-K1568 HydrophobicContact CE2-CB 4.29Å; Y1564-L1569 HydrophobicContact CD1-CB 4.47Å; Y1564-L1569 HydrophobicContact CE1-CB 3.97Å; Y1564-L1569 HydrophobicContact CE1-CD1 4.12Å
1565	S	84.5	Confident	79.3	Confident	48 Å²	48	39 Å²	39	34%	0.336	22%	0.217	S	C	.	.			trans	-72.7	161.6	-177.1	63.3	0	0	0	0	112.7	A1567 K1568 L1569	S1565-A1567 VanDerWaalsContact C-N 3.3Å; S1565-A1567 PolarHBondContact O-N 3Å; S1565-K1568 PolarHBondContact O-N 3.25Å; S1565-K1568 PolarHBondContact OG-N 3.08Å; S1565-L1569 PolarHBondContact O-N 2.93Å
1566	E	84.1	Confident	80.8	Confident	47 Å²	47	36.5 Å²	36.5	22%	0.22	19%	0.191	C	C	.	.	H	α-helix	trans	-63.7	-37.7	174.1	-167.6	166.6	148.4	0	0	111.7	Y1506 K1568 L1569 Y1570 S1620 A1621 F1622	Y1506-E1566 HydrophobicContact CD2-CB 4.49Å; Y1506-E1566 HydrophobicContact CE2-CB 3.69Å; Y1506-E1566 HydrophobicContact CE2-CG 4.15Å; Y1506-E1566 PolarHBondContact OH-OE2 2.87Å; E1566-K1568 VanDerWaalsContact C-N 3.28Å; E1566-K1568 PolarHBondContact O-N 2.83Å; E1566-L1569 CarbonylContact O-C 3.36Å; E1566-L1569 PolarHBondContact O-N 2.83Å; E1566-L1569 VanDerWaalsContact O-N 3.13Å; E1566-Y1570 WeakPolarHBondContact O-CB 3.49Å; E1566-Y1570 PolarHBondContact O-N 2.6Å; E1566-S1620 VanDerWaalsContact OE1-CA 3.29Å; E1566-S1620 WeakPolarHBondContact OE1-CA 3.49Å; E1566-S1620 WeakPolarHBondContact OE1-CB 3.48Å; E1566-S1620 PolarHBondContact OE1-OG 3.33Å; E1566-A1621 PolarHBondContact OE1-N 3.19Å; E1566-F1622 HydrophobicContact CB-CD2 4.43Å; E1566-F1622 HydrophobicContact CB-CE2 4.15Å; E1566-F1622 HydrophobicContact CG-CD2 4.16Å; E1566-F1622 HydrophobicContact CG-CE2 4.37Å
1567	A	81.2	Confident	82.1	Confident	20 Å²	20	38.4 Å²	38.4	17%	0.165	19%	0.19	C	C	.	.	H	α-helix	trans	-56.2	-41.9	173.3	0	0	0	0	0	112	S1565 Y1570 R1571 F1622	S1565-A1567 VanDerWaalsContact C-N 3.3Å; S1565-A1567 PolarHBondContact O-N 3Å; A1567-Y1570 PolarHBondContact O-N 2.85Å; A1567-R1571 WeakPolarHBondContact O-CB 3.47Å; A1567-R1571 WeakPolarHBondContact O-CG 3.26Å; A1567-R1571 PolarHBondContact O-N 3.5Å; A1567-F1622 HydrophobicContact CB-CE2 4.08Å; A1567-F1622 HydrophobicContact CB-CZ 3.96Å
1568	K	84.9	Confident	83.5	Confident	64 Å²	64	32.2 Å²	32.2	28%	0.278	16%	0.16	S	C	.	.	H	α-helix	trans	-67.9	-40.7	174.8	-99	168.7	166.9	144	0	112.7	D1441 Y1564 S1565 E1566 Y1570 Q1572	D1441-K1568 VanDerWaalsContact CG-CE 3.41Å; D1441-K1568 WeakPolarHBondContact OD1-CE 3.27Å; D1441-K1568 IonicContact OD1-NZ 3.06Å; D1441-K1568 PolarHBondContact OD1-NZ 3.2Å; Y1564-K1568 HydrophobicContact CE2-CB 4.29Å; S1565-K1568 PolarHBondContact O-N 3.25Å; S1565-K1568 PolarHBondContact OG-N 3.08Å; E1566-K1568 VanDerWaalsContact C-N 3.28Å; E1566-K1568 PolarHBondContact O-N 2.83Å; K1568-Y1570 VanDerWaalsContact C-N 3.34Å; K1568-Y1570 PolarHBondContact O-N 3.5Å; K1568-Q1572 WeakPolarHBondContact O-CB 3.37Å; K1568-Q1572 PolarHBondContact O-N 3.41Å
1569	L	88.8	Confident	84.6	Confident	13 Å²	13	31.5 Å²	31.5	7%	0.068	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-41.3	172.2	-179.8	63.2	0	0	0	112	L1502 I1503 Y1506 Y1564 S1565 E1566 Q1572 L1573	L1502-L1569 HydrophobicContact CB-CD1 4.26Å; I1503-L1569 HydrophobicContact CG1-CD1 3.96Å; I1503-L1569 HydrophobicContact CG1-CD2 4.28Å; Y1506-L1569 HydrophobicContact CD1-CD2 3.81Å; Y1506-L1569 HydrophobicContact CD2-CD2 4.35Å; Y1506-L1569 HydrophobicContact CE1-CD2 4.4Å; Y1506-L1569 HydrophobicContact CG-CD2 3.79Å; Y1564-L1569 HydrophobicContact CD1-CB 4.47Å; Y1564-L1569 HydrophobicContact CE1-CB 3.97Å; Y1564-L1569 HydrophobicContact CE1-CD1 4.12Å; S1565-L1569 PolarHBondContact O-N 2.93Å; E1566-L1569 CarbonylContact O-C 3.36Å; E1566-L1569 PolarHBondContact O-N 2.83Å; E1566-L1569 VanDerWaalsContact O-N 3.13Å; L1569-Q1572 PolarHBondContact O-N 3.34Å; L1569-L1573 HydrophobicContact CD1-CD1 4.1Å; L1569-L1573 HydrophobicContact CD1-CG 4.16Å; L1569-L1573 HydrophobicContact CG-CD1 3.96Å; L1569-L1573 HydrophobicContact CG-CG 4.42Å; L1569-L1573 WeakPolarHBondContact O-CB 3.48Å; L1569-L1573 VanDerWaalsContact O-CG 3.28Å; L1569-L1573 WeakPolarHBondContact O-CG 3.26Å; L1569-L1573 PolarHBondContact O-N 2.88Å
1570	Y	88.2	Confident	85.2	Confident	48 Å²	48	31.4 Å²	31.4	19%	0.188	15%	0.153	C	C	.	.	H	α-helix	trans	-66.5	-51.1	179.5	-179.1	-106.5	0	0	0	111.9	E1566 A1567 K1568 Q1572 L1573 C1574 L1617 F1622 A1623	E1566-Y1570 WeakPolarHBondContact O-CB 3.49Å; E1566-Y1570 PolarHBondContact O-N 2.6Å; A1567-Y1570 PolarHBondContact O-N 2.85Å; K1568-Y1570 VanDerWaalsContact C-N 3.34Å; K1568-Y1570 PolarHBondContact O-N 3.5Å; Y1570-Q1572 PolarHBondContact O-N 3.37Å; Y1570-L1573 PolarHBondContact O-N 3.34Å; Y1570-C1574 WeakPolarHBondContact O-CB 3.01Å; Y1570-C1574 PolarHBondContact O-N 2.94Å; Y1570-L1617 HydrophobicContact CD2-CD2 3.61Å; Y1570-L1617 HydrophobicContact CE2-CD2 3.65Å; Y1570-F1622 HydrophobicContact CD1-CB 3.74Å; Y1570-F1622 HydrophobicContact CD1-CG 4.44Å; Y1570-F1622 HydrophobicContact CD2-CB 3.95Å; Y1570-F1622 HydrophobicContact CE1-CB 3.93Å; Y1570-F1622 HydrophobicContact CE2-CB 4.16Å; Y1570-F1622 HydrophobicContact CG-CB 3.75Å; Y1570-F1622 PolarHBondContact OH-O 3.02Å; Y1570-A1623 HydrophobicContact CE2-CB 4.06Å
1571	R	85.8	Confident	85.5	Confident	80 Å²	80	31.9 Å²	31.9	30%	0.302	16%	0.156	S	C	.	.	H	α-helix	trans	-53.3	-43.6	173	-71.6	177.6	-173.1	-165.7	1	110.9	D1421 V1442 A1567 C1574 F1575	D1421-R1571 IonicContact OD2-CZ 2.88Å; D1421-R1571 IonicContact OD2-NH1 2.87Å; D1421-R1571 PolarHBondContact OD2-NH1 3.27Å; D1421-R1571 IonicContact OD2-NH2 2.81Å; D1421-R1571 PolarHBondContact OD2-NH2 3.03Å; V1442-R1571 HydrophobicContact CG1-CB 4.49Å; A1567-R1571 WeakPolarHBondContact O-CB 3.47Å; A1567-R1571 WeakPolarHBondContact O-CG 3.26Å; A1567-R1571 PolarHBondContact O-N 3.5Å; R1571-C1574 PolarHBondContact O-N 3.42Å; R1571-F1575 PolarHBondContact O-N 3Å
1572	Q	88.1	Confident	85.3	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-67.8	-42.2	178.6	-172.6	71	49.1	0	0	114	E1443 L1502 K1568 L1569 Y1570 C1574 F1575 F1576	E1443-Q1572 PolarHBondContact O-NE2 2.86Å; L1502-Q1572 HydrophobicContact CD1-CG 3.75Å; K1568-Q1572 WeakPolarHBondContact O-CB 3.37Å; K1568-Q1572 PolarHBondContact O-N 3.41Å; L1569-Q1572 PolarHBondContact O-N 3.34Å; Y1570-Q1572 PolarHBondContact O-N 3.37Å; Q1572-C1574 VanDerWaalsContact C-N 3.34Å; Q1572-F1575 PolarHBondContact O-N 3.1Å; Q1572-F1576 HydrophobicContact CG-CD2 4.49Å; Q1572-F1576 HydrophobicContact CG-CE2 4.07Å; Q1572-F1576 HydrophobicContact CG-CZ 4.14Å; Q1572-F1576 WeakPolarHBondContact O-CG 3.49Å; Q1572-F1576 PolarHBondContact O-N 3.46Å
1573	L	89.6	Confident	84.4	Confident	9 Å²	9	33.2 Å²	33.2	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-67.8	-35.5	175.9	-72.6	172.5	0	0	0	111.4	A1499 L1569 Y1570 F1576 R1577 F1613 L1616 L1617	A1499-L1573 HydrophobicContact CB-CD2 4.07Å; L1569-L1573 HydrophobicContact CD1-CD1 4.1Å; L1569-L1573 HydrophobicContact CD1-CG 4.16Å; L1569-L1573 HydrophobicContact CG-CD1 3.96Å; L1569-L1573 HydrophobicContact CG-CG 4.42Å; L1569-L1573 WeakPolarHBondContact O-CB 3.48Å; L1569-L1573 VanDerWaalsContact O-CG 3.28Å; L1569-L1573 WeakPolarHBondContact O-CG 3.26Å; L1569-L1573 PolarHBondContact O-N 2.88Å; Y1570-L1573 PolarHBondContact O-N 3.34Å; L1573-F1576 PolarHBondContact O-N 3.06Å; L1573-R1577 WeakPolarHBondContact O-CB 3.19Å; L1573-R1577 PolarHBondContact O-N 2.97Å; L1573-F1613 HydrophobicContact CD2-CD1 4.01Å; L1573-F1613 HydrophobicContact CD2-CE1 3.96Å; L1573-L1616 HydrophobicContact CD1-CB 4.44Å; L1573-L1616 HydrophobicContact CD2-CD1 4.22Å; L1573-L1617 HydrophobicContact CB-CD2 3.61Å; L1573-L1617 HydrophobicContact CB-CG 4.34Å; L1573-L1617 HydrophobicContact CD1-CD2 4.49Å
1574	C	88.1	Confident	83.1	Confident	13 Å²	13	37 Å²	37	9%	0.088	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-38.6	171.1	-78.7	0	0	0	0	112.5	F1436 Y1570 R1571 Q1572 R1577 Y1578	F1436-C1574 HydrophobicContact CE1-CB 4.47Å; F1436-C1574 HydrophobicContact CZ-CB 3.97Å; Y1570-C1574 WeakPolarHBondContact O-CB 3.01Å; Y1570-C1574 PolarHBondContact O-N 2.94Å; R1571-C1574 PolarHBondContact O-N 3.42Å; Q1572-C1574 VanDerWaalsContact C-N 3.34Å; C1574-R1577 WeakPolarHBondContact O-CB 3.44Å; C1574-R1577 PolarHBondContact O-N 2.85Å; C1574-Y1578 PolarHBondContact O-N 3.43Å
1575	F	88	Confident	81.2	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-45.5	170.9	171.5	-112.6	0	0	0	112.4	F1436 V1442 E1443 R1571 Q1572 R1577 Y1578 L1579	F1436-F1575 HydrophobicContact CB-CD2 3.87Å; F1436-F1575 HydrophobicContact CB-CE2 4.46Å; F1436-F1575 HydrophobicContact CD1-CB 3.84Å; F1436-F1575 HydrophobicContact CD1-CD2 4.23Å; F1436-F1575 HydrophobicContact CD1-CG 4.47Å; F1436-F1575 HydrophobicContact CE1-CB 4.03Å; F1436-F1575 HydrophobicContact CG-CB 4.43Å; F1436-F1575 HydrophobicContact CG-CD2 4.11Å; V1442-F1575 HydrophobicContact CB-CB 4.39Å; V1442-F1575 HydrophobicContact CB-CD1 4.32Å; V1442-F1575 HydrophobicContact CB-CG 4.32Å; V1442-F1575 HydrophobicContact CG1-CB 4.1Å; V1442-F1575 HydrophobicContact CG2-CG 4.44Å; E1443-F1575 WeakPolarHBondContact O-CE1 3.45Å; R1571-F1575 PolarHBondContact O-N 3Å; Q1572-F1575 PolarHBondContact O-N 3.1Å; F1575-R1577 VanDerWaalsContact C-N 3.28Å; F1575-R1577 PolarHBondContact O-N 3.48Å; F1575-Y1578 HydrophobicContact CD2-CD1 4.13Å; F1575-Y1578 HydrophobicContact CE2-CD1 4.28Å; F1575-Y1578 WeakPolarHBondContact O-CB 3.48Å; F1575-Y1578 PolarHBondContact O-N 2.92Å; F1575-Y1578 VanDerWaalsContact O-N 3.11Å; F1575-L1579 HydrophobicContact CE1-CD1 3.94Å; F1575-L1579 HydrophobicContact CE1-CG 4.4Å; F1575-L1579 HydrophobicContact CE2-CD2 3.9Å; F1575-L1579 HydrophobicContact CE2-CG 4.17Å; F1575-L1579 HydrophobicContact CZ-CD1 3.9Å; F1575-L1579 HydrophobicContact CZ-CD2 3.93Å; F1575-L1579 HydrophobicContact CZ-CG 4.05Å; F1575-L1579 PolarHBondContact O-N 3.46Å; F1575-L1579 VanDerWaalsContact O-N 3.09Å
1576	F	89.7	Confident	79.4	Confident	3 Å²	3	48.4 Å²	48.4	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-34	175.9	-71.6	-17	0	0	0	113.1	L1495 E1498 A1499 L1502 Q1572 L1573 L1579 F1613	L1495-F1576 HydrophobicContact CD2-CB 3.54Å; L1495-F1576 HydrophobicContact CD2-CD1 3.8Å; L1495-F1576 HydrophobicContact CD2-CD2 4.3Å; L1495-F1576 HydrophobicContact CD2-CG 3.64Å; E1498-F1576 HydrophobicContact CB-CE2 4.46Å; E1498-F1576 HydrophobicContact CB-CZ 4.29Å; A1499-F1576 HydrophobicContact CB-CD2 4.04Å; A1499-F1576 HydrophobicContact CB-CE2 4.26Å; L1502-F1576 HydrophobicContact CD1-CE2 3.85Å; L1502-F1576 HydrophobicContact CD1-CZ 3.87Å; Q1572-F1576 HydrophobicContact CG-CD2 4.49Å; Q1572-F1576 HydrophobicContact CG-CE2 4.07Å; Q1572-F1576 HydrophobicContact CG-CZ 4.14Å; Q1572-F1576 WeakPolarHBondContact O-CG 3.49Å; Q1572-F1576 PolarHBondContact O-N 3.46Å; L1573-F1576 PolarHBondContact O-N 3.06Å; F1576-L1579 HydrophobicContact CD1-CD1 4.47Å; F1576-F1613 HydrophobicContact CB-CD1 4.16Å; F1576-F1613 HydrophobicContact CB-CE1 3.6Å; F1576-F1613 HydrophobicContact CB-CE2 4.21Å; F1576-F1613 HydrophobicContact CB-CZ 3.64Å; F1576-F1613 HydrophobicContact CD2-CE1 4.07Å; F1576-F1613 HydrophobicContact CD2-CZ 4.31Å; F1576-F1613 HydrophobicContact CG-CE1 4.33Å; F1576-F1613 HydrophobicContact CG-CZ 4.36Å
1577	R	88.3	Confident	77.2	Confident	64 Å²	64	52.8 Å²	52.8	24%	0.242	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-45.9	169.1	-179.5	179.6	-176.5	-114.6	10.3	112.1	L1573 C1574 F1575 L1579 V1580 T1581 R1610 F1613 D1614 L1617	L1573-R1577 WeakPolarHBondContact O-CB 3.19Å; L1573-R1577 PolarHBondContact O-N 2.97Å; C1574-R1577 WeakPolarHBondContact O-CB 3.44Å; C1574-R1577 PolarHBondContact O-N 2.85Å; F1575-R1577 VanDerWaalsContact C-N 3.28Å; F1575-R1577 PolarHBondContact O-N 3.48Å; R1577-L1579 VanDerWaalsContact C-N 3.29Å; R1577-L1579 PolarHBondContact O-N 2.9Å; R1577-V1580 WeakPolarHBondContact O-CG2 3.44Å; R1577-V1580 PolarHBondContact O-N 3.49Å; R1577-V1580 VanDerWaalsContact O-N 3.16Å; R1577-T1581 WeakPolarHBondContact O-CB 3.15Å; R1577-T1581 PolarHBondContact O-N 2.9Å; R1577-T1581 PolarHBondContact O-OG1 3.15Å; R1577-R1610 HydrophobicContact CG-CG 4.14Å; R1577-F1613 HydrophobicContact CB-CB 3.95Å; R1577-F1613 HydrophobicContact CB-CG 4.44Å; R1577-F1613 HydrophobicContact CG-CB 4.34Å; R1577-D1614 IonicContact CZ-OD1 3.45Å; R1577-D1614 IonicContact NE-OD1 2.72Å; R1577-D1614 PolarHBondContact NE-OD1 3.14Å; R1577-D1614 IonicContact NH2-OD1 3.36Å; R1577-D1614 PolarHBondContact NH2-OD1 2.84Å; R1577-L1617 VanDerWaalsContact CD-CD1 3.47Å
1578	Y	85.5	Confident	75.2	Confident	32 Å²	32	55.5 Å²	55.5	13%	0.125	29%	0.287	C	S	.	.	H	α-helix	trans	-53.8	-45.1	176.6	162.8	-113	0	0	0	111.9	F1433 F1436 S1463 C1574 F1575 V1580 T1581	F1433-Y1578 HydrophobicContact CB-CD2 3.76Å; F1433-Y1578 HydrophobicContact CB-CE2 3.93Å; F1433-Y1578 AromaticContact CD1-CD2 3.44Å; F1433-Y1578 HydrophobicContact CD1-CD2 3.44Å; F1433-Y1578 VanDerWaalsContact CD1-CD2 3.44Å; F1433-Y1578 HydrophobicContact CD1-CE2 4.43Å; F1433-Y1578 AromaticContact CD1-CG 3.88Å; F1433-Y1578 HydrophobicContact CD1-CG 3.88Å; F1433-Y1578 HydrophobicContact CE1-CD2 4.17Å; F1433-Y1578 HydrophobicContact CE1-CG 4.38Å; F1433-Y1578 AromaticContact CG-CD2 3.81Å; F1433-Y1578 HydrophobicContact CG-CD2 3.81Å; F1433-Y1578 HydrophobicContact CG-CE2 4.45Å; F1436-Y1578 HydrophobicContact CD2-CG 4.39Å; S1463-Y1578 PolarHBondContact N-OH 2.77Å; C1574-Y1578 PolarHBondContact O-N 3.43Å; F1575-Y1578 HydrophobicContact CD2-CD1 4.13Å; F1575-Y1578 HydrophobicContact CE2-CD1 4.28Å; F1575-Y1578 WeakPolarHBondContact O-CB 3.48Å; F1575-Y1578 PolarHBondContact O-N 2.92Å; F1575-Y1578 VanDerWaalsContact O-N 3.11Å; Y1578-V1580 PolarHBondContact O-N 2.88Å; Y1578-T1581 PolarHBondContact O-N 2.7Å
1579	L	84.8	Confident	72.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-56.3	-26.9	-179.1	-67.8	-176.2	0	0	0	114	L1445 I1460 T1462 A1464 F1575 F1576 R1577	L1445-L1579 HydrophobicContact CB-CD1 3.95Å; L1445-L1579 HydrophobicContact CD2-CD1 3.87Å; I1460-L1579 HydrophobicContact CG2-CD1 4.25Å; I1460-L1579 HydrophobicContact CG2-CD2 4Å; T1462-L1579 WeakPolarHBondContact O-CD2 3.37Å; A1464-L1579 WeakPolarHBondContact CB-O 3.43Å; A1464-L1579 PolarHBondContact N-O 2.84Å; F1575-L1579 HydrophobicContact CE1-CD1 3.94Å; F1575-L1579 HydrophobicContact CE1-CG 4.4Å; F1575-L1579 HydrophobicContact CE2-CD2 3.9Å; F1575-L1579 HydrophobicContact CE2-CG 4.17Å; F1575-L1579 HydrophobicContact CZ-CD1 3.9Å; F1575-L1579 HydrophobicContact CZ-CD2 3.93Å; F1575-L1579 HydrophobicContact CZ-CG 4.05Å; F1575-L1579 PolarHBondContact O-N 3.46Å; F1575-L1579 VanDerWaalsContact O-N 3.09Å; F1576-L1579 HydrophobicContact CD1-CD1 4.47Å; R1577-L1579 VanDerWaalsContact C-N 3.29Å; R1577-L1579 PolarHBondContact O-N 2.9Å
1580	V	85.7	Confident	70.4	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	11.2	-179.9	-57.5	0	0	0	0	113.7	L1495 R1577 Y1578 L1606 C1609 R1610 F1613	L1495-V1580 HydrophobicContact CD1-CG1 3.76Å; R1577-V1580 WeakPolarHBondContact O-CG2 3.44Å; R1577-V1580 PolarHBondContact O-N 3.49Å; R1577-V1580 VanDerWaalsContact O-N 3.16Å; Y1578-V1580 PolarHBondContact O-N 2.88Å; V1580-L1606 HydrophobicContact CB-CD2 4.18Å; V1580-L1606 HydrophobicContact CG1-CD2 3.87Å; V1580-C1609 HydrophobicContact CG1-CB 4.47Å; V1580-R1610 HydrophobicContact CG2-CB 3.92Å; V1580-R1610 HydrophobicContact CG2-CG 4.15Å; V1580-F1613 HydrophobicContact CG2-CD2 4.3Å
1581	T	80.8	Confident	68	Low	13 Å²	13	65.1 Å²	65.1	8%	0.08	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-103.5	128.4	-178.1	-63.7	0	0	0	0	111.3	F1433 S1463 R1577 Y1578 R1610	F1433-T1581 HydrophobicContact CE2-CG2 4.23Å; F1433-T1581 HydrophobicContact CZ-CG2 4.33Å; S1463-T1581 PolarHBondContact OG-O 3.1Å; R1577-T1581 WeakPolarHBondContact O-CB 3.15Å; R1577-T1581 PolarHBondContact O-N 2.9Å; R1577-T1581 PolarHBondContact O-OG1 3.15Å; Y1578-T1581 PolarHBondContact O-N 2.7Å; T1581-R1610 WeakPolarHBondContact OG1-CD 3.5Å; T1581-R1610 WeakPolarHBondContact OG1-CG 3.49Å
1582	P	74.3	Confident	65.8	Low	53 Å²	53	66.2 Å²	66.2	34%	0.344	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-72.1	150.2	170.9	30.6	-34.7	0	0	0	111.2	F1465	F1465-P1582 HydrophobicContact CD1-CB 3.94Å; F1465-P1582 HydrophobicContact CD2-CB 3.98Å; F1465-P1582 HydrophobicContact CE1-CB 4Å; F1465-P1582 HydrophobicContact CE2-CB 4.05Å; F1465-P1582 HydrophobicContact CE2-CG 4.46Å; F1465-P1582 HydrophobicContact CG-CB 3.92Å; F1465-P1582 HydrophobicContact CZ-CB 4.06Å; F1465-P1582 HydrophobicContact CZ-CG 4.42Å
1583	P	64.1	Low	63.6	Low	81 Å²	81	72.3 Å²	72.3	53%	0.526	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-64.2	134.7	-179.7	26.9	-34.4	0	0	0	112	N1585	P1583-N1585 PolarHBondContact O-N 3.3Å; P1583-N1585 VanDerWaalsContact O-N 3.07Å
1584	N	56	Low	61.4	Low	151 Å²	151	79.7 Å²	79.7	81%	0.807	46%	0.464	S	S	*	.			trans	-75.8	97.2	176.6	-100.8	-10	0	0	0	110.3	K1586	N1584-K1586 VanDerWaalsContact C-N 3.28Å; N1584-K1586 PolarHBondContact O-N 2.77Å
1585	N	45.8	Very low	59.6	Low	127 Å²	127	85.1 Å²	85.1	68%	0.679	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	69.1	-173.6	-161.5	-1.9	0	0	0	112.9	P1583	P1583-N1585 PolarHBondContact O-N 3.3Å; P1583-N1585 VanDerWaalsContact O-N 3.07Å
1586	K	45	Very low	58.2	Low	192 Å²	192	88.3 Å²	88.3	84%	0.835	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	-31	176.6	-73.9	-166.3	174	-173.1	0	115.7	N1584	N1584-K1586 VanDerWaalsContact C-N 3.28Å; N1584-K1586 PolarHBondContact O-N 2.77Å
1587	N	39.6	Very low	56.8	Low	139 Å²	139	94.8 Å²	94.8	74%	0.743	55%	0.545	S	S	*	.	S	Bend	trans	-116.2	8.7	-174.4	-67.9	11.3	0	0	0	114	G1589	N1587-G1589 PolarHBondContact O-N 2.81Å
1588	A	37.5	Very low	56	Low	77 Å²	77	92.9 Å²	92.9	64%	0.636	54%	0.54	S	S	*	.			trans	-83.8	103.6	-177.6	0	0	0	0	0	111.8
1589	G	35.8	Very low	55.7	Low	60 Å²	60	94 Å²	94	62%	0.619	55%	0.551	S	S	*	*			trans	-75	129.3	176.9	0	0	0	0	0	113.6	N1587 N1591	N1587-G1589 PolarHBondContact O-N 2.81Å; G1589-N1591 VanDerWaalsContact C-N 3.27Å; G1589-N1591 PolarHBondContact O-N 3.49Å
1590	S	36.8	Very low	55.4	Low	128 Å²	128	99.4 Å²	99.4	90%	0.895	59%	0.586	S	S	*	*	S	Bend	trans	59.6	-18.4	158.7	51.5	0	0	0	0	121.5
1591	N	39	Very low	55.4	Low	139 Å²	139	102.8 Å²	102.8	74%	0.743	61%	0.606	S	S	*	*			trans	-118.2	95.4	173.6	-88.1	-23.6	0	0	0	111.4	G1589 D1593	G1589-N1591 VanDerWaalsContact C-N 3.27Å; G1589-N1591 PolarHBondContact O-N 3.49Å; N1591-D1593 PolarHBondContact O-N 3.17Å
1592	A	39.4	Very low	55.6	Low	103 Å²	103	102.3 Å²	102.3	85%	0.851	60%	0.603	S	S	*	*			trans	-85.3	80.2	172.6	0	0	0	0	0	110.4	M1594	A1592-M1594 PolarHBondContact O-N 3.4Å
1593	D	41.7	Very low	56	Low	130 Å²	130	102 Å²	102	70%	0.695	60%	0.602	S	S	*	*			trans	-55.9	130.7	169.8	-85.8	-34.9	0	0	0	110.4	V1467 N1591 E1595	V1467-D1593 HydrophobicContact CG2-CB 3.96Å; N1591-D1593 PolarHBondContact O-N 3.17Å; D1593-E1595 PolarHBondContact O-N 3.31Å; D1593-E1595 VanDerWaalsContact O-N 3.07Å
1594	M	43.1	Very low	57.1	Low	164 Å²	164	101 Å²	101	81%	0.808	60%	0.597	S	S	*	*			trans	-55.7	110.9	-165.6	-78.2	-175.6	162.1	0	0	114	V1467 A1592 I1596	V1467-M1594 VanDerWaalsContact CG2-O 3.24Å; V1467-M1594 WeakPolarHBondContact CG2-O 3.47Å; A1592-M1594 PolarHBondContact O-N 3.4Å; M1594-I1596 PolarHBondContact O-N 3.29Å
1595	E	51.2	Low	58.7	Low	126 Å²	126	94.6 Å²	94.6	59%	0.589	56%	0.563	S	S	*	*			trans	-61.8	114.6	-179.5	-169.7	172	-133.5	0	0	111.8	D1593 T1597	D1593-E1595 PolarHBondContact O-N 3.31Å; D1593-E1595 VanDerWaalsContact O-N 3.07Å; E1595-T1597 PolarHBondContact O-N 2.99Å
1596	I	58.2	Low	60.7	Low	72 Å²	72	88.6 Å²	88.6	37%	0.369	53%	0.531	S	S	.	.			trans	-70.2	105.9	-179.4	-61.3	-179	0	0	0	109.3	M1594 L1598	M1594-I1596 PolarHBondContact O-N 3.29Å; I1596-L1598 VanDerWaalsContact C-N 3.34Å; I1596-L1598 HydrophobicContact CG2-CD2 4.29Å; I1596-L1598 PolarHBondContact O-N 2.87Å
1597	T	61.3	Low	62.8	Low	139 Å²	139	82.2 Å²	82.2	85%	0.853	51%	0.51	S	S	*	.			trans	-72	84	178.5	-28.9	0	0	0	0	111	E1595	E1595-T1597 PolarHBondContact O-N 2.99Å
1598	L	71.5	Confident	65.2	Low	24 Å²	24	82 Å²	82	13%	0.126	51%	0.505	C	S	.	.			trans	-61.7	145	175.1	-70.9	176.9	0	0	0	111.1	A1464 F1465 L1482 I1596 L1606	A1464-L1598 HydrophobicContact CB-CD1 4.5Å; F1465-L1598 HydrophobicContact CD1-CD1 4.04Å; F1465-L1598 HydrophobicContact CE1-CD1 3.81Å; F1465-L1598 HydrophobicContact CZ-CD1 4.18Å; L1482-L1598 HydrophobicContact CB-CD2 4.12Å; L1482-L1598 HydrophobicContact CD1-CD1 4.33Å; L1482-L1598 HydrophobicContact CD1-CD2 4.19Å; I1596-L1598 VanDerWaalsContact C-N 3.34Å; I1596-L1598 HydrophobicContact CG2-CD2 4.29Å; I1596-L1598 PolarHBondContact O-N 2.87Å; L1598-L1606 HydrophobicContact CD1-CD1 3.54Å
1599	P	77.4	Confident	67.7	Low	56 Å²	56	78.6 Å²	78.6	36%	0.364	48%	0.477	S	S	.	.			trans	-53.8	140	177.4	-25.6	33.7	0	0	0	111.5	V1601 V1602 S1603	P1599-V1601 PolarHBondContact O-N 2.96Å; P1599-V1601 VanDerWaalsContact O-N 3.08Å; P1599-V1602 HydrophobicContact CB-CB 4.39Å; P1599-V1602 HydrophobicContact CB-CG2 4.14Å; P1599-V1602 HydrophobicContact CG-CG2 4.27Å; P1599-V1602 WeakPolarHBondContact O-CA 3.27Å; P1599-V1602 WeakPolarHBondContact O-CB 3.27Å; P1599-V1602 PolarHBondContact O-N 2.82Å; P1599-S1603 PolarHBondContact O-N 2.87Å
1600	P	80.1	Confident	70.3	Confident	112 Å²	112	79.5 Å²	79.5	73%	0.727	46%	0.461	S	S	*	.	H	α-helix	trans	-59.1	-31.6	-171.9	20.6	-32.6	0	0	0	113.1	S1604	P1600-S1604 WeakPolarHBondContact O-CB 3.16Å; P1600-S1604 PolarHBondContact O-N 2.89Å
1601	V	85.6	Confident	72.9	Confident	72 Å²	72	77.1 Å²	77.1	44%	0.436	44%	0.439	S	S	.	.	H	α-helix	trans	-65.2	-39.4	173.8	-176.2	0	0	0	0	112.1	Q1485 P1599 I1605	Q1485-V1601 HydrophobicContact CB-CG1 4.43Å; Q1485-V1601 HydrophobicContact CG-CG1 3.77Å; Q1485-V1601 VanDerWaalsContact NE2-CG1 3.3Å; P1599-V1601 PolarHBondContact O-N 2.96Å; P1599-V1601 VanDerWaalsContact O-N 3.08Å; V1601-I1605 HydrophobicContact CG1-CD1 4.38Å; V1601-I1605 WeakPolarHBondContact O-CD1 3.48Å; V1601-I1605 WeakPolarHBondContact O-CG1 3.45Å; V1601-I1605 PolarHBondContact O-N 3.18Å; V1601-I1605 VanDerWaalsContact O-N 3.15Å
1602	V	84.2	Confident	75.4	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.018	42%	0.416	C	S	.	.	H	α-helix	trans	-73.3	-42.7	177.8	174.5	0	0	0	0	110.4	L1482 A1488 P1599 S1604 I1605 L1606	L1482-V1602 HydrophobicContact CB-CG1 4.35Å; L1482-V1602 HydrophobicContact CD2-CG1 4.16Å; L1482-V1602 WeakPolarHBondContact O-CG2 3.44Å; A1488-V1602 HydrophobicContact CB-CG1 3.92Å; A1488-V1602 HydrophobicContact CB-CG2 4.24Å; P1599-V1602 HydrophobicContact CB-CB 4.39Å; P1599-V1602 HydrophobicContact CB-CG2 4.14Å; P1599-V1602 HydrophobicContact CG-CG2 4.27Å; P1599-V1602 WeakPolarHBondContact O-CA 3.27Å; P1599-V1602 WeakPolarHBondContact O-CB 3.27Å; P1599-V1602 PolarHBondContact O-N 2.82Å; V1602-S1604 VanDerWaalsContact C-N 3.29Å; V1602-S1604 PolarHBondContact O-N 2.98Å; V1602-I1605 WeakPolarHBondContact O-CB 3.45Å; V1602-I1605 PolarHBondContact O-N 2.9Å; V1602-I1605 VanDerWaalsContact O-N 3.12Å; V1602-L1606 HydrophobicContact CG1-CD1 4.29Å; V1602-L1606 WeakPolarHBondContact O-CG 3.38Å; V1602-L1606 PolarHBondContact O-N 3.17Å
1603	S	83.3	Confident	77.9	Confident	47 Å²	47	68.4 Å²	68.4	33%	0.329	38%	0.376	S	S	.	.	H	α-helix	trans	-60	-39.2	174.1	-166.9	0	0	0	0	111.8	P1599 L1606 S1607	P1599-S1603 PolarHBondContact O-N 2.87Å; S1603-L1606 PolarHBondContact O-N 3.04Å; S1603-S1607 WeakPolarHBondContact O-CB 3.4Å; S1603-S1607 PolarHBondContact O-N 3.48Å
1604	S	87.6	Confident	80.1	Confident	60 Å²	60	64.2 Å²	64.2	42%	0.42	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-41.6	172.2	-172.4	0	0	0	0	113	P1600 V1602 S1607 Q1608	P1600-S1604 WeakPolarHBondContact O-CB 3.16Å; P1600-S1604 PolarHBondContact O-N 2.89Å; V1602-S1604 VanDerWaalsContact C-N 3.29Å; V1602-S1604 PolarHBondContact O-N 2.98Å; S1604-S1607 PolarHBondContact O-N 2.93Å; S1604-Q1608 WeakPolarHBondContact O-CG 3.11Å; S1604-Q1608 PolarHBondContact O-N 3.03Å
1605	I	88.3	Confident	82.4	Confident	16 Å²	16	65.3 Å²	65.3	8%	0.082	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-43.9	175.6	-73.1	160	0	0	0	111.5	Q1485 A1488 R1489 T1492 V1601 V1602 Q1608 C1609	Q1485-I1605 HydrophobicContact CG-CD1 3.63Å; A1488-I1605 HydrophobicContact CB-CG2 4.36Å; R1489-I1605 HydrophobicContact CG-CD1 4.01Å; T1492-I1605 HydrophobicContact CG2-CG2 3.9Å; V1601-I1605 HydrophobicContact CG1-CD1 4.38Å; V1601-I1605 WeakPolarHBondContact O-CD1 3.48Å; V1601-I1605 WeakPolarHBondContact O-CG1 3.45Å; V1601-I1605 PolarHBondContact O-N 3.18Å; V1601-I1605 VanDerWaalsContact O-N 3.15Å; V1602-I1605 WeakPolarHBondContact O-CB 3.45Å; V1602-I1605 PolarHBondContact O-N 2.9Å; V1602-I1605 VanDerWaalsContact O-N 3.12Å; I1605-Q1608 PolarHBondContact O-N 3.15Å; I1605-C1609 PolarHBondContact O-N 2.85Å
1606	L	88.4	Confident	84.2	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-63.5	-41.2	175.5	-68.2	171.9	0	0	0	111.3	A1464 F1465 L1482 T1492 V1580 L1598 V1602 S1603 C1609 R1610	A1464-L1606 HydrophobicContact CB-CD1 3.88Å; A1464-L1606 HydrophobicContact CB-CD2 4.42Å; F1465-L1606 HydrophobicContact CE2-CD1 4.02Å; F1465-L1606 HydrophobicContact CZ-CB 4.48Å; F1465-L1606 HydrophobicContact CZ-CD1 3.85Å; L1482-L1606 HydrophobicContact CD2-CD1 4.31Å; L1482-L1606 HydrophobicContact CD2-CD2 4.28Å; T1492-L1606 HydrophobicContact CG2-CD2 4.12Å; V1580-L1606 HydrophobicContact CB-CD2 4.18Å; V1580-L1606 HydrophobicContact CG1-CD2 3.87Å; L1598-L1606 HydrophobicContact CD1-CD1 3.54Å; V1602-L1606 HydrophobicContact CG1-CD1 4.29Å; V1602-L1606 WeakPolarHBondContact O-CG 3.38Å; V1602-L1606 PolarHBondContact O-N 3.17Å; S1603-L1606 PolarHBondContact O-N 3.04Å; L1606-C1609 CarbonylContact O-C 3.56Å; L1606-C1609 WeakPolarHBondContact O-CB 3.39Å; L1606-C1609 PolarHBondContact O-N 2.78Å; L1606-R1610 PolarHBondContact O-N 2.8Å
1607	S	88	Confident	85.6	Confident	58 Å²	58	58.8 Å²	58.8	41%	0.406	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-42.5	174.5	177.8	0	0	0	0	112.6	S1603 S1604 C1609 R1610 N1611	S1603-S1607 WeakPolarHBondContact O-CB 3.4Å; S1603-S1607 PolarHBondContact O-N 3.48Å; S1604-S1607 PolarHBondContact O-N 2.93Å; S1607-C1609 VanDerWaalsContact C-N 3.31Å; S1607-C1609 PolarHBondContact O-N 2.9Å; S1607-R1610 PolarHBondContact O-N 3.05Å; S1607-N1611 WeakPolarHBondContact O-CB 3.34Å; S1607-N1611 PolarHBondContact O-N 3.13Å; S1607-N1611 PolarHBondContact O-ND2 3.47Å
1608	Q	90.7	Very high	86.8	Confident	134 Å²	134	55.1 Å²	55.1	63%	0.626	30%	0.298	S	S	*	.	H	α-helix	trans	-60.8	-40.3	172.5	-73.2	179.8	10	0	0	111.9	S1604 I1605 N1611 H1612	S1604-Q1608 WeakPolarHBondContact O-CG 3.11Å; S1604-Q1608 PolarHBondContact O-N 3.03Å; I1605-Q1608 PolarHBondContact O-N 3.15Å; Q1608-N1611 PolarHBondContact O-N 3.25Å; Q1608-H1612 PolarHBondContact O-N 3.16Å; Q1608-H1612 VanDerWaalsContact O-N 3.14Å
1609	C	90.7	Very high	87.2	Confident	7 Å²	7	61.7 Å²	61.7	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-66.9	-39.9	175.5	-160.5	0	0	0	0	112	T1492 V1580 I1605 L1606 S1607 H1612 F1613	T1492-C1609 HydrophobicContact CG2-CB 3.61Å; V1580-C1609 HydrophobicContact CG1-CB 4.47Å; I1605-C1609 PolarHBondContact O-N 2.85Å; L1606-C1609 CarbonylContact O-C 3.56Å; L1606-C1609 WeakPolarHBondContact O-CB 3.39Å; L1606-C1609 PolarHBondContact O-N 2.78Å; S1607-C1609 VanDerWaalsContact C-N 3.31Å; S1607-C1609 PolarHBondContact O-N 2.9Å; C1609-H1612 WeakPolarHBondContact O-CB 3.37Å; C1609-H1612 PolarHBondContact O-N 3.49Å; C1609-F1613 WeakPolarHBondContact O-CD2 3.41Å; C1609-F1613 PolarHBondContact O-N 3.23Å
1610	R	89.9	Confident	87.4	Confident	79 Å²	79	59.7 Å²	59.7	30%	0.298	32%	0.315	S	S	.	.	H	α-helix	trans	-62.2	-44.9	174.8	-156	-159.9	85.6	177.6	7	111.3	R1577 V1580 T1581 L1606 S1607 H1612 F1613 D1614	R1577-R1610 HydrophobicContact CG-CG 4.14Å; V1580-R1610 HydrophobicContact CG2-CB 3.92Å; V1580-R1610 HydrophobicContact CG2-CG 4.15Å; T1581-R1610 WeakPolarHBondContact OG1-CD 3.5Å; T1581-R1610 WeakPolarHBondContact OG1-CG 3.49Å; L1606-R1610 PolarHBondContact O-N 2.8Å; S1607-R1610 PolarHBondContact O-N 3.05Å; R1610-H1612 PolarHBondContact O-N 3.32Å; R1610-F1613 CarbonylContact O-C 3.56Å; R1610-F1613 WeakPolarHBondContact O-CA 3.26Å; R1610-F1613 PolarHBondContact O-N 3.26Å; R1610-D1614 IonicContact CZ-OD2 3.65Å; R1610-D1614 IonicContact NE-OD2 3.79Å; R1610-D1614 PolarHBondContact NE-OD2 3.13Å; R1610-D1614 IonicContact NH2-OD2 2.86Å; R1610-D1614 PolarHBondContact NH2-OD2 3.17Å; R1610-D1614 VanDerWaalsContact NH2-OD2 3.08Å; R1610-D1614 PolarHBondContact O-N 2.88Å
1611	N	90.7	Very high	87	Confident	78 Å²	78	57.7 Å²	57.7	42%	0.417	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-25	176.3	-66.9	-16.3	0	0	0	112.9	S1607 Q1608 R1615	S1607-N1611 WeakPolarHBondContact O-CB 3.34Å; S1607-N1611 PolarHBondContact O-N 3.13Å; S1607-N1611 PolarHBondContact O-ND2 3.47Å; Q1608-N1611 PolarHBondContact O-N 3.25Å; N1611-R1615 WeakPolarHBondContact O-CG 3.3Å; N1611-R1615 PolarHBondContact O-N 3.42Å
1612	H	91.8	Very high	86.5	Confident	59 Å²	59	59.5 Å²	59.5	27%	0.273	31%	0.31	S	S	.	.	H	α-helix	trans	-71	-43.9	170.3	-173	67	0	0	0	111.5	Q1608 C1609 R1610 R1615 L1616	Q1608-H1612 PolarHBondContact O-N 3.16Å; Q1608-H1612 VanDerWaalsContact O-N 3.14Å; C1609-H1612 WeakPolarHBondContact O-CB 3.37Å; C1609-H1612 PolarHBondContact O-N 3.49Å; R1610-H1612 PolarHBondContact O-N 3.32Å; H1612-R1615 PolarHBondContact O-N 3.1Å; H1612-L1616 WeakPolarHBondContact O-CG 3.42Å; H1612-L1616 PolarHBondContact O-N 3.32Å
1613	F	91.8	Very high	86.1	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-68.4	-40.1	174.7	-72	-67.9	0	0	0	113.3	L1495 A1499 L1573 F1576 R1577 V1580 C1609 R1610 R1615 L1616 L1617	L1495-F1613 HydrophobicContact CB-CZ 4.46Å; L1495-F1613 HydrophobicContact CD2-CE2 3.87Å; L1495-F1613 HydrophobicContact CD2-CZ 3.68Å; A1499-F1613 HydrophobicContact CB-CE1 3.62Å; A1499-F1613 HydrophobicContact CB-CZ 4.03Å; L1573-F1613 HydrophobicContact CD2-CD1 4.01Å; L1573-F1613 HydrophobicContact CD2-CE1 3.96Å; F1576-F1613 HydrophobicContact CB-CD1 4.16Å; F1576-F1613 HydrophobicContact CB-CE1 3.6Å; F1576-F1613 HydrophobicContact CB-CE2 4.21Å; F1576-F1613 HydrophobicContact CB-CZ 3.64Å; F1576-F1613 HydrophobicContact CD2-CE1 4.07Å; F1576-F1613 HydrophobicContact CD2-CZ 4.31Å; F1576-F1613 HydrophobicContact CG-CE1 4.33Å; F1576-F1613 HydrophobicContact CG-CZ 4.36Å; R1577-F1613 HydrophobicContact CB-CB 3.95Å; R1577-F1613 HydrophobicContact CB-CG 4.44Å; R1577-F1613 HydrophobicContact CG-CB 4.34Å; V1580-F1613 HydrophobicContact CG2-CD2 4.3Å; C1609-F1613 WeakPolarHBondContact O-CD2 3.41Å; C1609-F1613 PolarHBondContact O-N 3.23Å; R1610-F1613 CarbonylContact O-C 3.56Å; R1610-F1613 WeakPolarHBondContact O-CA 3.26Å; R1610-F1613 PolarHBondContact O-N 3.26Å; F1613-R1615 PolarHBondContact O-N 2.66Å; F1613-L1616 HydrophobicContact CD1-CD1 4.11Å; F1613-L1616 HydrophobicContact CE1-CD1 4.32Å; F1613-L1616 PolarHBondContact O-N 2.61Å; F1613-L1616 VanDerWaalsContact O-N 3.08Å; F1613-L1617 WeakPolarHBondContact O-CG 3.33Å; F1613-L1617 PolarHBondContact O-N 2.81Å
1614	D	89	Confident	85.7	Confident	41 Å²	41	66.2 Å²	66.2	22%	0.219	35%	0.345	C	S	.	.	H	α-helix	trans	-55	-39.8	173.1	-73.6	-44.2	0	0	0	110.5	R1577 R1610 S1618	R1577-D1614 IonicContact CZ-OD1 3.45Å; R1577-D1614 IonicContact NE-OD1 2.72Å; R1577-D1614 PolarHBondContact NE-OD1 3.14Å; R1577-D1614 IonicContact NH2-OD1 3.36Å; R1577-D1614 PolarHBondContact NH2-OD1 2.84Å; R1610-D1614 IonicContact CZ-OD2 3.65Å; R1610-D1614 IonicContact NE-OD2 3.79Å; R1610-D1614 PolarHBondContact NE-OD2 3.13Å; R1610-D1614 IonicContact NH2-OD2 2.86Å; R1610-D1614 PolarHBondContact NH2-OD2 3.17Å; R1610-D1614 VanDerWaalsContact NH2-OD2 3.08Å; R1610-D1614 PolarHBondContact O-N 2.88Å; D1614-S1618 PolarHBondContact O-N 2.88Å
1615	R	90.2	Very high	85.1	Confident	188 Å²	188	68.5 Å²	68.5	71%	0.709	36%	0.356	S	S	*	.	H	α-helix	trans	-73.2	-33.7	173.6	-77.2	-179.7	179	165.1	1	114.9	N1611 H1612 F1613 S1618 H1619	N1611-R1615 WeakPolarHBondContact O-CG 3.3Å; N1611-R1615 PolarHBondContact O-N 3.42Å; H1612-R1615 PolarHBondContact O-N 3.1Å; F1613-R1615 PolarHBondContact O-N 2.66Å; R1615-S1618 PolarHBondContact O-OG 2.77Å; R1615-S1618 VanDerWaalsContact O-OG 3.13Å; R1615-H1619 PolarHBondContact O-CE1 3.38Å; R1615-H1619 PolarHBondContact O-ND1 3.49Å
1616	L	89.1	Confident	84.5	Confident	47 Å²	47	72.2 Å²	72.2	25%	0.246	38%	0.376	C	S	.	.	H	α-helix	trans	-69.3	-41.4	176.8	-74.3	172.1	0	0	0	110.8	I1503 L1573 H1612 F1613 H1619	I1503-L1616 HydrophobicContact CD1-CD1 4.11Å; I1503-L1616 HydrophobicContact CD1-CD2 3.85Å; L1573-L1616 HydrophobicContact CD1-CB 4.44Å; L1573-L1616 HydrophobicContact CD2-CD1 4.22Å; H1612-L1616 WeakPolarHBondContact O-CG 3.42Å; H1612-L1616 PolarHBondContact O-N 3.32Å; F1613-L1616 HydrophobicContact CD1-CD1 4.11Å; F1613-L1616 HydrophobicContact CE1-CD1 4.32Å; F1613-L1616 PolarHBondContact O-N 2.61Å; F1613-L1616 VanDerWaalsContact O-N 3.08Å; L1616-H1619 PolarHBondContact O-N 3.47Å
1617	L	88.3	Confident	84.1	Confident	13 Å²	13	77.2 Å²	77.2	7%	0.068	40%	0.403	C	S	.	.	H	α-helix	trans	-65.2	-38.8	177.4	-67.9	168.1	0	0	0	111.5	Y1570 L1573 R1577 F1613 H1619 S1620 A1623	Y1570-L1617 HydrophobicContact CD2-CD2 3.61Å; Y1570-L1617 HydrophobicContact CE2-CD2 3.65Å; L1573-L1617 HydrophobicContact CB-CD2 3.61Å; L1573-L1617 HydrophobicContact CB-CG 4.34Å; L1573-L1617 HydrophobicContact CD1-CD2 4.49Å; R1577-L1617 VanDerWaalsContact CD-CD1 3.47Å; F1613-L1617 WeakPolarHBondContact O-CG 3.33Å; F1613-L1617 PolarHBondContact O-N 2.81Å; L1617-H1619 PolarHBondContact O-N 2.72Å; L1617-S1620 PolarHBondContact O-N 3.41Å; L1617-A1623 WeakPolarHBondContact O-CB 3.14Å
1618	S	85.4	Confident	83.6	Confident	63 Å²	63	77.1 Å²	77.1	44%	0.441	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	7.5	178.2	84.6	0	0	0	0	115.6	D1614 R1615	D1614-S1618 PolarHBondContact O-N 2.88Å; R1615-S1618 PolarHBondContact O-OG 2.77Å; R1615-S1618 VanDerWaalsContact O-OG 3.13Å
1619	H	81.4	Confident	82.7	Confident	162 Å²	162	78.1 Å²	78.1	75%	0.75	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	0.7	174.1	-68	72.6	0	0	0	112.8	R1615 L1616 L1617	R1615-H1619 PolarHBondContact O-CE1 3.38Å; R1615-H1619 PolarHBondContact O-ND1 3.49Å; L1616-H1619 PolarHBondContact O-N 3.47Å; L1617-H1619 PolarHBondContact O-N 2.72Å
1620	S	80.3	Confident	81.8	Confident	14 Å²	14	81.8 Å²	81.8	10%	0.098	43%	0.432	C	S	.	.	S	Bend	trans	-93.6	144.8	174.6	179.1	0	0	0	0	110.7	E1566 L1617 F1622 A1623	E1566-S1620 VanDerWaalsContact OE1-CA 3.29Å; E1566-S1620 WeakPolarHBondContact OE1-CA 3.49Å; E1566-S1620 WeakPolarHBondContact OE1-CB 3.48Å; E1566-S1620 PolarHBondContact OE1-OG 3.33Å; L1617-S1620 PolarHBondContact O-N 3.41Å; S1620-F1622 VanDerWaalsContact C-N 3.26Å; S1620-F1622 PolarHBondContact O-N 3.01Å; S1620-A1623 PolarHBondContact O-N 3.28Å; S1620-A1623 VanDerWaalsContact O-N 3.08Å
1621	A	72.6	Confident	81.1	Confident	69 Å²	69	82.8 Å²	82.8	57%	0.57	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-58.2	-39.5	177.6	0	0	0	0	0	111.8	E1566 A1623 M1624	E1566-A1621 PolarHBondContact OE1-N 3.19Å; A1621-A1623 PolarHBondContact O-N 3.38Å; A1621-M1624 CarbonylContact O-C 3.52Å; A1621-M1624 PolarHBondContact O-N 3.12Å; A1621-M1624 VanDerWaalsContact O-N 3.12Å
1622	F	75.3	Confident	80	Confident	111 Å²	111	82.8 Å²	82.8	49%	0.487	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-65.7	-3.2	177.8	-69.4	-83.3	0	0	0	115	E1566 A1567 Y1570 S1620	E1566-F1622 HydrophobicContact CB-CD2 4.43Å; E1566-F1622 HydrophobicContact CB-CE2 4.15Å; E1566-F1622 HydrophobicContact CG-CD2 4.16Å; E1566-F1622 HydrophobicContact CG-CE2 4.37Å; A1567-F1622 HydrophobicContact CB-CE2 4.08Å; A1567-F1622 HydrophobicContact CB-CZ 3.96Å; Y1570-F1622 HydrophobicContact CD1-CB 3.74Å; Y1570-F1622 HydrophobicContact CD1-CG 4.44Å; Y1570-F1622 HydrophobicContact CD2-CB 3.95Å; Y1570-F1622 HydrophobicContact CE1-CB 3.93Å; Y1570-F1622 HydrophobicContact CE2-CB 4.16Å; Y1570-F1622 HydrophobicContact CG-CB 3.75Å; Y1570-F1622 PolarHBondContact OH-O 3.02Å; S1620-F1622 VanDerWaalsContact C-N 3.26Å; S1620-F1622 PolarHBondContact O-N 3.01Å
1623	A	75.9	Confident	78.2	Confident	43 Å²	43	83.6 Å²	83.6	36%	0.355	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-106	-12	174.7	0	0	0	0	0	114.4	Y1570 L1617 S1620 A1621	Y1570-A1623 HydrophobicContact CE2-CB 4.06Å; L1617-A1623 WeakPolarHBondContact O-CB 3.14Å; S1620-A1623 PolarHBondContact O-N 3.28Å; S1620-A1623 VanDerWaalsContact O-N 3.08Å; A1621-A1623 PolarHBondContact O-N 3.38Å
1624	M	73.3	Confident	76.1	Confident	147 Å²	147	88.3 Å²	88.3	72%	0.724	49%	0.493	S	S	*	.			trans	-135.9	103.1	177.9	-87.5	-156.7	-55.7	0	0	110.8	A1621	A1621-M1624 CarbonylContact O-C 3.52Å; A1621-M1624 PolarHBondContact O-N 3.12Å; A1621-M1624 VanDerWaalsContact O-N 3.12Å
1625	V	75.3	Confident	73.9	Confident	108 Å²	108	96.9 Å²	96.9	66%	0.655	52%	0.523	S	S	*	.			trans	-93.4	114.4	167.4	-177.3	0	0	0	0	108.3	L1627	V1625-L1627 HydrophobicContact CG1-CD2 4.09Å; V1625-L1627 PolarHBondContact O-N 3.13Å
1626	D	77	Confident	71.4	Confident	95 Å²	95	93 Å²	93	51%	0.508	52%	0.52	S	S	.	.			trans	-84.6	90.2	176.9	-174.2	-5.5	0	0	0	110.4	G1628 K1629 L1630	D1626-G1628 PolarHBondContact O-N 2.82Å; D1626-G1628 VanDerWaalsContact O-N 3.17Å; D1626-G1628 WeakPolarHBondContact OD1-CA 3.39Å; D1626-G1628 PolarHBondContact OD1-N 3.16Å; D1626-K1629 HydrophobicContact CB-CB 4.28Å; D1626-K1629 HydrophobicContact CB-CG 4.5Å; D1626-K1629 WeakPolarHBondContact O-CB 3.44Å; D1626-K1629 PolarHBondContact O-N 2.85Å; D1626-K1629 PolarHBondContact OD1-N 3.19Å; D1626-L1630 PolarHBondContact O-N 3.31Å
1627	L	79.5	Confident	68.9	Low	106 Å²	106	97.5 Å²	97.5	56%	0.555	55%	0.55	S	S	*	.	H	α-helix	trans	-58.2	-25	175.8	-56.9	176.7	0	0	0	112.6	V1625 K1629 L1630 F1631	V1625-L1627 HydrophobicContact CG1-CD2 4.09Å; V1625-L1627 PolarHBondContact O-N 3.13Å; L1627-K1629 VanDerWaalsContact C-N 3.32Å; L1627-L1630 HydrophobicContact CD2-CD2 4.48Å; L1627-L1630 PolarHBondContact O-N 3.28Å; L1627-F1631 HydrophobicContact CB-CD2 4.29Å; L1627-F1631 HydrophobicContact CB-CE2 4.3Å; L1627-F1631 HydrophobicContact CD2-CE2 4.13Å; L1627-F1631 VanDerWaalsContact O-CD2 3.28Å; L1627-F1631 WeakPolarHBondContact O-CD2 3.49Å; L1627-F1631 PolarHBondContact O-N 3.07Å; L1627-F1631 VanDerWaalsContact O-N 3.14Å
1628	G	76.3	Confident	66.3	Low	56 Å²	56	101.9 Å²	101.9	58%	0.577	58%	0.58	S	S	*	*	H	α-helix	trans	-71.6	-26.8	176.6	0	0	0	0	0	113.2	D1626 S1632	D1626-G1628 PolarHBondContact O-N 2.82Å; D1626-G1628 VanDerWaalsContact O-N 3.17Å; D1626-G1628 WeakPolarHBondContact OD1-CA 3.39Å; D1626-G1628 PolarHBondContact OD1-N 3.16Å; G1628-S1632 WeakPolarHBondContact O-CB 3.46Å
1629	K	73.8	Confident	63.8	Low	154 Å²	154	105.8 Å²	105.8	67%	0.67	60%	0.602	S	S	*	*	H	α-helix	trans	-80.4	-48.9	166.1	-82.7	-173.4	166.8	-159.5	0	112	D1626 L1627 F1631 S1632	D1626-K1629 HydrophobicContact CB-CB 4.28Å; D1626-K1629 HydrophobicContact CB-CG 4.5Å; D1626-K1629 WeakPolarHBondContact O-CB 3.44Å; D1626-K1629 PolarHBondContact O-N 2.85Å; D1626-K1629 PolarHBondContact OD1-N 3.19Å; L1627-K1629 VanDerWaalsContact C-N 3.32Å; K1629-F1631 PolarHBondContact O-N 3.25Å; K1629-F1631 VanDerWaalsContact O-N 3.1Å; K1629-S1632 WeakPolarHBondContact O-CB 3.27Å; K1629-S1632 PolarHBondContact O-N 2.86Å; K1629-S1632 PolarHBondContact O-OG 2.98Å; K1629-S1632 VanDerWaalsContact O-OG 3.05Å
1630	L	69.9	Low	61.4	Low	85 Å²	85	100.8 Å²	100.8	45%	0.445	59%	0.594	S	S	.	*	H	α-helix	trans	-55.3	-35.4	-174.8	-159.9	75.8	0	0	0	112.3	D1626 L1627	D1626-L1630 PolarHBondContact O-N 3.31Å; L1627-L1630 HydrophobicContact CD2-CD2 4.48Å; L1627-L1630 PolarHBondContact O-N 3.28Å
1631	F	75.2	Confident	59.4	Low	100 Å²	100	107.2 Å²	107.2	44%	0.439	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.2	18.2	178.7	-54	-55.3	0	0	0	114.1	L1627 K1629 G1633 L1634	L1627-F1631 HydrophobicContact CB-CD2 4.29Å; L1627-F1631 HydrophobicContact CB-CE2 4.3Å; L1627-F1631 HydrophobicContact CD2-CE2 4.13Å; L1627-F1631 VanDerWaalsContact O-CD2 3.28Å; L1627-F1631 WeakPolarHBondContact O-CD2 3.49Å; L1627-F1631 PolarHBondContact O-N 3.07Å; L1627-F1631 VanDerWaalsContact O-N 3.14Å; K1629-F1631 PolarHBondContact O-N 3.25Å; K1629-F1631 VanDerWaalsContact O-N 3.1Å; F1631-G1633 VanDerWaalsContact C-N 3.28Å; F1631-G1633 PolarHBondContact O-N 3.15Å; F1631-L1634 HydrophobicContact CB-CB 4.28Å; F1631-L1634 HydrophobicContact CD1-CD1 3.94Å; F1631-L1634 PolarHBondContact O-N 3.13Å
1632	S	68.4	Low	57.6	Low	78 Å²	78	106.8 Å²	106.8	55%	0.545	64%	0.637	S	S	.	*	S	Bend	trans	-66.7	-26.5	-175.1	62.7	0	0	0	0	114.3	G1628 K1629	G1628-S1632 WeakPolarHBondContact O-CB 3.46Å; K1629-S1632 WeakPolarHBondContact O-CB 3.27Å; K1629-S1632 PolarHBondContact O-N 2.86Å; K1629-S1632 PolarHBondContact O-OG 2.98Å; K1629-S1632 VanDerWaalsContact O-OG 3.05Å
1633	G	54	Low	55.5	Low	76 Å²	76	111.8 Å²	111.8	78%	0.784	66%	0.659	S	S	*	*	S	Bend	trans	-77.2	-26.4	170.1	0	0	0	0	0	113.6	F1631 R1635	F1631-G1633 VanDerWaalsContact C-N 3.28Å; F1631-G1633 PolarHBondContact O-N 3.15Å; G1633-R1635 PolarHBondContact O-N 2.98Å
1634	L	48.2	Very low	53.5	Low	99 Å²	99	125 Å²	125	52%	0.518	70%	0.7	S	S	.	*			trans	-80.1	52	179.1	-90	160.8	0	0	0	112.3	T17 F1631 T1636	T17-L1634 HydrophobicContact CG2-CD1 4.31Å; F1631-L1634 HydrophobicContact CB-CB 4.28Å; F1631-L1634 HydrophobicContact CD1-CD1 3.94Å; F1631-L1634 PolarHBondContact O-N 3.13Å; L1634-T1636 PolarHBondContact O-N 2.85Å
1635	R	42	Very low	52.5	Low	220 Å²	220	123.9 Å²	123.9	83%	0.83	70%	0.699	S	S	*	*			trans	-74.3	71.6	170.2	-75.1	-167.3	174.6	-153.8	-0.1	111.5	G1633	G1633-R1635 PolarHBondContact O-N 2.98Å
1636	T	38.6	Very low	51.3	Low	106 Å²	106	124.7 Å²	124.7	65%	0.65	70%	0.701	S	S	*	*			trans	-51.8	139.3	162.3	51.1	0	0	0	0	110.2	L1634 C1638	L1634-T1636 PolarHBondContact O-N 2.85Å; T1636-C1638 PolarHBondContact O-N 3.42Å
1637	T	37.1	Very low	49.8	Very low	142 Å²	142	126.3 Å²	126.3	87%	0.871	71%	0.712	S	S	*	*	S	Bend	trans	-78.1	48.3	-169.8	41.5	0	0	0	0	113.4
1638	C	32.7	Very low	48.1	Very low	105 Å²	105	127.5 Å²	127.5	71%	0.709	72%	0.721	S	S	*	*			trans	-109.1	55.3	-173.1	-71.5	0	0	0	0	112.5	T1636 G1640	T1636-C1638 PolarHBondContact O-N 3.42Å; C1638-G1640 PolarHBondContact O-N 3.5Å
1639	T	33.7	Very low	46.3	Very low	146 Å²	146	132 Å²	132	90%	0.896	73%	0.73	S	S	*	*			trans	-75.3	56.6	174.8	48.8	0	0	0	0	113
1640	G	31.3	Very low	44.5	Very low	57 Å²	57	130.5 Å²	130.5	59%	0.588	73%	0.734	S	S	*	*			trans	-85.6	129.3	167.3	0	0	0	0	0	110.9	C1638 G1642	C1638-G1640 PolarHBondContact O-N 3.5Å; G1640-G1642 VanDerWaalsContact C-N 3.27Å; G1640-G1642 PolarHBondContact O-N 3.17Å
1641	P	37	Very low	42.7	Very low	149 Å²	149	133.8 Å²	133.8	97%	0.968	75%	0.754	S	S	*	*	S	Bend	trans	-76.9	73.7	-179.5	31.9	-35.4	0	0	0	111.2
1642	G	35.9	Very low	40.2	Very low	59 Å²	59	136.4 Å²	136.4	61%	0.608	78%	0.779	S	S	*	*			trans	-132.5	-14.6	-162	0	0	0	0	0	119.1	G1640	G1640-G1642 VanDerWaalsContact C-N 3.27Å; G1640-G1642 PolarHBondContact O-N 3.17Å
1643	F	29.9	Very low	37.8	Very low	217 Å²	217	141.3 Å²	141.3	95%	0.952	80%	0.798	S	S	*	*			trans	-140.2	134.6	176.7	-90.7	-80.8	0	0	0	112.6
1644	R	33.6	Very low	36.4	Very low	319 Å²	319	147.2 Å²	147.2	100%	1.204	80%	0.799	S	S	*	*			trans	-163.8	0	178.9	-151.9	-173.9	-161	-157.5	6.6	110.9

Retrieved 1,644 of 1,644 residues in 975.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).