A0A087X043_HUMAN Loading...

Glutamate receptor

Member of the ionotropic glutamate receptor family, which plays a crucial role in synaptic organization and signal transduction in the central nervous system. Although it shares structural features with ionotropic glutamate receptors, does not bind glutamate as a primary ligand. Promotes synaptogenesis and mediates the D-Serine-dependent long term depression signals and AMPA receptor endocytosis of cerebellar parallel fiber-Purkinje cell (PF-PC) synapses through the NRX1B-CBLN1-GRID2 triad complex. In the presence of neurexins and cerebellins, forms cation-selective channels that are proposed to be gated by glycine and D-serine. However, recent research disputes this ligand-gated cation channel activity. Cation-selective ion channel activity can be triggered by GRM1 in Purkinje cells. Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A087X043, Species HUMAN (Homo sapiens, Human), Gene GRID2, Length 926 aa.

						>A0A087X043_HUMAN|A0A087X043|GRID2
ACELMNQGILALVSSIGCTSAGSLQSLADAMHIPHLFIQRSTAGTPRSGCGLTRSNRNDDYTLSVRPPVYLHDVILRVVTEYAWQKFIIFYDSEYDIRGIQEFLDKVSQQGMDVALQKVENNINKMITTLFDTMRIEELNRYRDTLRRAILVMNPATAKSFITEVVETNLVAFDCHWIIINEEINDVDVQELVRRSIGRLTIIRQTFPVPQNISQRCFRGNHRISSTLCDPKDPFAQNMEISNLYIYDTVLLLANAFHKKLEDRKWHSMASLSCIRKNSKPWQGGRSMLETIKKGGVSGLTGELEFGENGGNPNVHFEILGTNYGEELGRGVRKLGCWNPVTGLNGSLTDKKLENNMRGVVLRVVTVLEEPFVMVSENVLGKPKKYQGFSIDVLDALSNYLGFNYEIYVAPDHKYGSPQEDGTWNGLVGELVFKRADIGISALTITPDRENVVDFTTRYMDYSVGVLLRRAEKTVDMFACLAPFDLSLWACIAGTVLLVGLLVYLLNWLNPPRLQMGSMTSTTLYNSMWFVYGSFVQQGGEVPYTTLATRMMMGAWWLFALIVISSYTANLAAFLTITRIESSIQSLQDLSKQTEIPYGTVLDSAVYEHVRMKGLNPFERDSMYSQMWRMINRSNGSENNVLESQAGIQKVKYGNYAFVWDAAVLEYVAINDPDCSFYTIGNTVADRGYGIALQHGSPYRDVFSQRILELQQNGDMDILKHKWWPKNGQCDLYSSVDTKQKGGALDIKSFAGVFCILAAGIVLSCFIAMLETWWNKRKGSRVPSKEDDKEIDLEHLHRRVNSLCTDDDSPHKQFSTSSIDLTPLDIDTLPTRQALEQISDFRNTHITTTTFIPEQIQTLSRTLSAKAASGFTFGNVPEHRTGPFRHRAPNGGFFRSPIKTMSSIPYQPTPTLGLNLGNDPDRGTSI
					

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	A	85.8	Confident	88.5	Confident	49 Å²	49	56.2 Å²	56.2	41%	0.405	31%	0.31	S	S	.	.				0	-73.9	0	0	0	0	0	0	111.6	E3 L4 M5 L24 L27	A1-E3 VanDerWaalsContact C-N 3.29Å; A1-E3 PolarHBondContact O-N 3.03Å; A1-L4 WeakPolarHBondContact O-CB 3.49Å; A1-L4 PolarHBondContact O-N 3.39Å; A1-M5 PolarHBondContact O-N 3.38Å; A1-M5 VanDerWaalsContact O-N 3.12Å; A1-L24 HydrophobicContact CB-CD2 3.83Å; A1-L27 HydrophobicContact CB-CD2 4.17Å
2	C	88.4	Confident	88.9	Confident	44 Å²	44	52.7 Å²	52.7	30%	0.297	29%	0.291	S	S	.	.	H	α-helix	trans	-60.8	-28.5	-173.3	-70.2	0	0	0	0	115.9	M5 N6 C274	C2-M5 PolarHBondContact O-N 3.38Å; C2-N6 PolarHBondContact O-N 3.27Å; C2-N6 PolarHBondContact O-ND2 3.48Å; C2-C274 WeakPolarHBondContact CA-SG 3.38Å; C2-C274 HydrophobicContact CB-CB 3.88Å; C2-C274 WeakPolarHBondContact CB-SG 3.26Å; C2-C274 WeakPolarHBondContact SG-CB 3.32Å; C2-C274 CovalentContact SG-SG 2.03Å; C2-C274 PolarHBondContact SG-SG 3.48Å
3	E	90.4	Very high	89.3	Confident	144 Å²	144	53.3 Å²	53.3	67%	0.673	30%	0.297	S	S	*	.	H	α-helix	trans	-66	-41.4	173.1	-64.6	158.5	147.3	0	0	111.9	A1 M5 N6 Q7	A1-E3 VanDerWaalsContact C-N 3.29Å; A1-E3 PolarHBondContact O-N 3.03Å; E3-M5 VanDerWaalsContact C-N 3.31Å; E3-M5 PolarHBondContact O-N 3.41Å; E3-N6 WeakPolarHBondContact O-CB 3.46Å; E3-N6 PolarHBondContact O-N 3.02Å; E3-Q7 WeakPolarHBondContact O-CG 3.19Å; E3-Q7 PolarHBondContact O-N 3Å
4	L	89.7	Confident	89.5	Confident	71 Å²	71	50.2 Å²	50.2	37%	0.372	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-38.7	173.5	-54.6	174.2	0	0	0	110.8	A1 Q7 G8 I9 L12	A1-L4 WeakPolarHBondContact O-CB 3.49Å; A1-L4 PolarHBondContact O-N 3.39Å; L4-Q7 PolarHBondContact O-N 3.37Å; L4-G8 PolarHBondContact O-N 3.08Å; L4-I9 HydrophobicContact CB-CD1 4.12Å; L4-I9 HydrophobicContact CB-CG2 4.03Å; L4-L12 HydrophobicContact CD1-CD1 4.26Å
5	M	88.1	Confident	89.6	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-65.6	-39.2	174.8	-64.5	-175.1	171.4	0	0	111.9	A1 C2 E3 G8 I9 L12 L27 M31 I33 L272	A1-M5 PolarHBondContact O-N 3.38Å; A1-M5 VanDerWaalsContact O-N 3.12Å; C2-M5 PolarHBondContact O-N 3.38Å; E3-M5 VanDerWaalsContact C-N 3.31Å; E3-M5 PolarHBondContact O-N 3.41Å; M5-G8 PolarHBondContact O-N 3.41Å; M5-I9 HydrophobicContact CG-CD1 4.21Å; M5-L12 HydrophobicContact CE-CD2 4.42Å; M5-L27 HydrophobicContact CE-CD2 4.01Å; M5-L27 HydrophobicContact CE-CG 3.91Å; M5-L27 HydrophobicContact SD-CD1 4.32Å; M5-L27 HydrophobicContact SD-CD2 3.96Å; M5-L27 HydrophobicContact SD-CG 3.97Å; M5-M31 HydrophobicContact SD-CG 4.35Å; M5-I33 HydrophobicContact CE-CD1 3.79Å; M5-I33 HydrophobicContact CG-CD1 3.78Å; M5-I33 HydrophobicContact SD-CD1 4.03Å; M5-L272 CarbonylContact C-O 3.2Å; M5-L272 HydrophobicContact CB-CB 4.36Å; M5-L272 WeakPolarHBondContact CB-O 3.41Å; M5-L272 PolarHBondContact O-N 2.99Å
6	N	87.8	Confident	89.6	Confident	73 Å²	73	49.3 Å²	49.3	39%	0.39	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-37.1	172.1	-72.9	-34.7	0	0	0	112.2	C2 E3 G8 S271 L272 S273	C2-N6 PolarHBondContact O-N 3.27Å; C2-N6 PolarHBondContact O-ND2 3.48Å; E3-N6 WeakPolarHBondContact O-CB 3.46Å; E3-N6 PolarHBondContact O-N 3.02Å; N6-G8 VanDerWaalsContact C-N 3.32Å; N6-S271 WeakPolarHBondContact O-CB 3.27Å; N6-S271 PolarHBondContact O-OG 2.82Å; N6-L272 PolarHBondContact N-O 3.01Å; N6-L272 PolarHBondContact OD1-O 3.48Å; N6-S273 WeakPolarHBondContact OD1-CA 3.39Å
7	Q	88.6	Confident	89.3	Confident	149 Å²	149	47.9 Å²	47.9	70%	0.696	28%	0.277	S	S	*	.	H	α-helix	trans	-68.8	-30.4	175	-72	168.5	-6.2	0	0	112.5	E3 L4	E3-Q7 WeakPolarHBondContact O-CG 3.19Å; E3-Q7 PolarHBondContact O-N 3Å; L4-Q7 PolarHBondContact O-N 3.37Å
8	G	86.6	Confident	88.8	Confident	13 Å²	13	47.7 Å²	47.7	13%	0.134	28%	0.278	C	S	.	.			trans	96.1	109.2	-178.9	0	0	0	0	0	111.7	L4 M5 N6 A270	L4-G8 PolarHBondContact O-N 3.08Å; M5-G8 PolarHBondContact O-N 3.41Å; N6-G8 VanDerWaalsContact C-N 3.32Å; G8-A270 WeakPolarHBondContact CA-O 3.19Å
9	I	89.6	Confident	88.4	Confident	32 Å²	32	52 Å²	52	16%	0.164	31%	0.305	C	S	.	.			trans	-125	153.2	-179.8	52.1	169.6	0	0	0	111.5	L4 M5 L12 I33	L4-I9 HydrophobicContact CB-CD1 4.12Å; L4-I9 HydrophobicContact CB-CG2 4.03Å; M5-I9 HydrophobicContact CG-CD1 4.21Å; I9-L12 HydrophobicContact CD1-CB 4.19Å; I9-L12 HydrophobicContact CD1-CD1 4.3Å; I9-I33 HydrophobicContact CD1-CD1 4.4Å; I9-I33 HydrophobicContact CD1-CG2 4.26Å; I9-I33 HydrophobicContact CG1-CD1 4.13Å
10	L	87.8	Confident	88.2	Confident	23 Å²	23	52.7 Å²	52.7	12%	0.12	31%	0.313	C	S	.	.	S	Bend	trans	-97	-24.7	-179.7	-63.7	164.6	0	0	0	113.1	F257 W266 M269 W282	L10-F257 HydrophobicContact CB-CE1 3.65Å; L10-F257 HydrophobicContact CB-CZ 3.87Å; L10-F257 HydrophobicContact CD1-CD1 4.19Å; L10-F257 HydrophobicContact CD1-CE1 3.45Å; L10-F257 VanDerWaalsContact CD1-CE1 3.45Å; L10-F257 HydrophobicContact CD1-CZ 4.02Å; L10-F257 HydrophobicContact CG-CE1 4.14Å; L10-W266 HydrophobicContact CD1-CH2 3.5Å; L10-W266 VanDerWaalsContact CD1-CH2 3.5Å; L10-W266 HydrophobicContact CD1-CZ2 4.09Å; L10-W266 HydrophobicContact CD1-CZ3 4.38Å; L10-W266 HydrophobicContact CD2-CH2 4.35Å; L10-W266 HydrophobicContact CD2-CZ2 4.44Å; L10-M269 HydrophobicContact CD1-CG 4.08Å; L10-M269 HydrophobicContact CD1-SD 4.1Å; L10-M269 HydrophobicContact CD2-CG 3.49Å; L10-M269 VanDerWaalsContact CD2-CG 3.49Å; L10-M269 HydrophobicContact CG-CG 3.62Å; L10-M269 HydrophobicContact CG-SD 4.06Å; L10-W282 HydrophobicContact CB-CH2 4.39Å; L10-W282 HydrophobicContact CD2-CH2 3.58Å; L10-W282 HydrophobicContact CD2-CZ2 3.6Å; L10-W282 WeakPolarHBondContact O-CZ3 3.49Å
11	A	91.3	Very high	88.1	Confident	19 Å²	19	50.1 Å²	50.1	16%	0.157	30%	0.298	C	S	.	.			trans	-154.3	156.6	172.7	0	0	0	0	0	109	P34 L36 L253	A11-P34 CarbonylContact C-O 3.52Å; A11-P34 VanDerWaalsContact CA-O 3.26Å; A11-P34 WeakPolarHBondContact CA-O 3.24Å; A11-P34 HydrophobicContact CB-CB 4.39Å; A11-L36 HydrophobicContact CB-CD1 4.14Å; A11-L253 HydrophobicContact CB-CD2 3.85Å
12	L	92.5	Very high	88.1	Confident	14 Å²	14	49.2 Å²	49.2	7%	0.073	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.1	172.6	179.1	64.8	0	0	0	108.8	L4 M5 I9 I33 P34 H35 L36	L4-L12 HydrophobicContact CD1-CD1 4.26Å; M5-L12 HydrophobicContact CE-CD2 4.42Å; I9-L12 HydrophobicContact CD1-CB 4.19Å; I9-L12 HydrophobicContact CD1-CD1 4.3Å; L12-I33 HydrophobicContact CB-CG2 4.14Å; L12-P34 PolarHBondContact N-O 3.21Å; L12-H35 CarbonylContact O-C 3.59Å; L12-H35 VanDerWaalsContact O-CA 3.31Å; L12-H35 WeakPolarHBondContact O-CA 3.39Å; L12-L36 PolarHBondContact O-N 2.8Å
13	V	94.3	Very high	88.1	Confident	61 Å²	61	51.2 Å²	51.2	37%	0.37	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	135.1	168.9	-176.3	0	0	0	0	108.3	L36 I38 T249 L253	V13-L36 WeakPolarHBondContact CA-O 3.14Å; V13-L36 HydrophobicContact CG2-CB 4.43Å; V13-I38 HydrophobicContact CG1-CD1 4.09Å; V13-T249 HydrophobicContact CG1-CG2 3.95Å; V13-T249 HydrophobicContact CG2-CG2 3.79Å; V13-L253 HydrophobicContact CG2-CD1 3.57Å
14	S	92.5	Very high	88.1	Confident	10 Å²	10	46 Å²	46	7%	0.07	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	140.6	174.3	72	0	0	0	0	111.8	H35 L36 I38	S14-H35 PolarHBondContact OG-NE2 3.24Å; S14-L36 PolarHBondContact N-O 3.02Å; S14-I38 WeakPolarHBondContact O-CB 3.42Å; S14-I38 PolarHBondContact O-N 3.46Å
15	S	91.5	Very high	88.1	Confident	40 Å²	40	42.8 Å²	42.8	28%	0.28	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	87.9	174.9	-178	0	0	0	0	108.6	I38	S15-I38 WeakPolarHBondContact CA-O 3.38Å
16	I	89.1	Confident	88.1	Confident	45 Å²	45	46.5 Å²	46.5	23%	0.231	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	165.8	-166	60.1	-179.9	0	0	0	112	A21 L24 F37 I38 R40	I16-A21 HydrophobicContact CD1-CB 4.4Å; I16-L24 HydrophobicContact CD1-CD1 3.57Å; I16-L24 HydrophobicContact CD1-CG 4.18Å; I16-F37 HydrophobicContact CG1-CD2 4.18Å; I16-F37 HydrophobicContact CG1-CE2 3.77Å; I16-I38 PolarHBondContact N-O 2.84Å; I16-R40 PolarHBondContact O-N 2.93Å; I16-R40 VanDerWaalsContact O-N 3.15Å
17	G	84.4	Confident	88.1	Confident	26 Å²	26	44.8 Å²	44.8	27%	0.268	28%	0.284	S	S	.	.			trans	-77.6	163.6	171.1	0	0	0	0	0	113.2	T19 S20 A21	G17-T19 PolarHBondContact O-N 2.95Å; G17-T19 VanDerWaalsContact O-N 3.15Å; G17-S20 PolarHBondContact O-N 3.07Å; G17-A21 PolarHBondContact O-N 3.4Å
18	C	81	Confident	88.2	Confident	44 Å²	44	37.7 Å²	37.7	30%	0.297	25%	0.251	S	S	.	.	H	α-helix	trans	-58.6	-30.2	-173.4	-56.7	0	0	0	0	114.6	S20 A21 Q39 C50	C18-S20 PolarHBondContact O-N 3.14Å; C18-A21 PolarHBondContact O-N 3.42Å; C18-Q39 PolarHBondContact SG-NE2 2.95Å; C18-C50 VanDerWaalsContact CA-SG 3.5Å; C18-C50 HydrophobicContact CB-CB 3.7Å; C18-C50 WeakPolarHBondContact CB-SG 3.46Å; C18-C50 WeakPolarHBondContact SG-CA 3.39Å; C18-C50 WeakPolarHBondContact SG-CB 3.41Å; C18-C50 CovalentContact SG-SG 2.04Å; C18-C50 PolarHBondContact SG-SG 3.01Å
19	T	79.7	Confident	88.3	Confident	130 Å²	130	38.2 Å²	38.2	80%	0.798	25%	0.251	S	S	*	.	H	α-helix	trans	-61	-39	-176.3	48.1	0	0	0	0	113.3	G17	G17-T19 PolarHBondContact O-N 2.95Å; G17-T19 VanDerWaalsContact O-N 3.15Å
20	S	85	Confident	88.2	Confident	65 Å²	65	39.9 Å²	39.9	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-92	-15.6	176.9	-56	0	0	0	0	113.3	G17 C18 S23 L24	G17-S20 PolarHBondContact O-N 3.07Å; C18-S20 PolarHBondContact O-N 3.14Å; S20-S23 PolarHBondContact O-N 2.8Å; S20-L24 PolarHBondContact O-N 3.32Å
21	A	86	Confident	88.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-42.7	-176.1	0	0	0	0	0	112.7	I16 G17 C18 S23 L24 Q25 F37 L52	I16-A21 HydrophobicContact CD1-CB 4.4Å; G17-A21 PolarHBondContact O-N 3.4Å; C18-A21 PolarHBondContact O-N 3.42Å; A21-S23 VanDerWaalsContact C-N 3.33Å; A21-S23 PolarHBondContact O-N 2.87Å; A21-L24 PolarHBondContact O-N 3.32Å; A21-Q25 WeakPolarHBondContact O-CB 3.35Å; A21-Q25 PolarHBondContact O-N 3.38Å; A21-F37 HydrophobicContact CB-CD2 4.17Å; A21-F37 HydrophobicContact CB-CE1 4.26Å; A21-F37 HydrophobicContact CB-CE2 3.62Å; A21-F37 HydrophobicContact CB-CZ 3.66Å; A21-L52 HydrophobicContact CB-CD2 4.02Å
22	G	86.4	Confident	88.2	Confident	30 Å²	30	41.1 Å²	41.1	31%	0.309	27%	0.271	S	S	.	.	H	α-helix	trans	-62.4	-36.7	177.8	0	0	0	0	0	113.6	Q25 S26	G22-Q25 PolarHBondContact O-N 3.42Å; G22-S26 WeakPolarHBondContact O-CB 3.47Å; G22-S26 PolarHBondContact O-N 3.03Å
23	S	87.6	Confident	88.2	Confident	86 Å²	86	40.6 Å²	40.6	60%	0.601	27%	0.268	S	S	*	.	H	α-helix	trans	-69	-37.7	176.2	-55	0	0	0	0	112.5	S20 A21 L27	S20-S23 PolarHBondContact O-N 2.8Å; A21-S23 VanDerWaalsContact C-N 3.33Å; A21-S23 PolarHBondContact O-N 2.87Å; S23-L27 WeakPolarHBondContact O-CB 3.3Å; S23-L27 PolarHBondContact O-N 3.37Å
24	L	90.1	Very high	88.1	Confident	35 Å²	35	37.7 Å²	37.7	18%	0.183	25%	0.251	C	S	.	.	H	α-helix	trans	-72.5	-36.8	173.1	-69.1	-166	0	0	0	112.5	A1 I16 S20 A21 L27 A28	A1-L24 HydrophobicContact CB-CD2 3.83Å; I16-L24 HydrophobicContact CD1-CD1 3.57Å; I16-L24 HydrophobicContact CD1-CG 4.18Å; S20-L24 PolarHBondContact O-N 3.32Å; A21-L24 PolarHBondContact O-N 3.32Å; L24-L27 PolarHBondContact O-N 3.47Å; L24-A28 VanDerWaalsContact O-CB 3.23Å; L24-A28 WeakPolarHBondContact O-CB 3.46Å; L24-A28 PolarHBondContact O-N 2.92Å
25	Q	89.8	Confident	88.1	Confident	3 Å²	3	37.2 Å²	37.2	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-56.8	-57.9	172.2	174.4	-178	4.8	0	0	110.1	A21 G22 L27 A28 D29 L52 T53	A21-Q25 WeakPolarHBondContact O-CB 3.35Å; A21-Q25 PolarHBondContact O-N 3.38Å; G22-Q25 PolarHBondContact O-N 3.42Å; Q25-L27 PolarHBondContact O-N 2.82Å; Q25-L27 VanDerWaalsContact O-N 3.17Å; Q25-A28 PolarHBondContact O-N 3.42Å; Q25-D29 WeakPolarHBondContact CG-OD2 3.36Å; Q25-D29 PolarHBondContact NE2-OD2 2.99Å; Q25-D29 WeakPolarHBondContact O-CB 3.39Å; Q25-D29 VanDerWaalsContact O-CG 3.23Å; Q25-D29 PolarHBondContact O-N 2.94Å; Q25-L52 HydrophobicContact CB-CD2 4.47Å; Q25-T53 PolarHBondContact NE2-O 3.34Å
26	S	88.1	Confident	88.2	Confident	78 Å²	78	35.3 Å²	35.3	55%	0.545	23%	0.234	S	C	.	.	H	α-helix	trans	-55	-38.7	-177.7	-177.9	0	0	0	0	112.3	G22 A30	G22-S26 WeakPolarHBondContact O-CB 3.47Å; G22-S26 PolarHBondContact O-N 3.03Å; S26-A30 WeakPolarHBondContact O-CB 3.29Å; S26-A30 PolarHBondContact O-N 3.31Å
27	L	88.6	Confident	88.4	Confident	38 Å²	38	33.5 Å²	33.5	20%	0.199	22%	0.224	C	C	.	.	H	α-helix	trans	-72	-40.7	175.4	-178.1	64.4	0	0	0	113.4	A1 M5 S23 L24 Q25 M31 C274	A1-L27 HydrophobicContact CB-CD2 4.17Å; M5-L27 HydrophobicContact CE-CD2 4.01Å; M5-L27 HydrophobicContact CE-CG 3.91Å; M5-L27 HydrophobicContact SD-CD1 4.32Å; M5-L27 HydrophobicContact SD-CD2 3.96Å; M5-L27 HydrophobicContact SD-CG 3.97Å; S23-L27 WeakPolarHBondContact O-CB 3.3Å; S23-L27 PolarHBondContact O-N 3.37Å; L24-L27 PolarHBondContact O-N 3.47Å; Q25-L27 PolarHBondContact O-N 2.82Å; Q25-L27 VanDerWaalsContact O-N 3.17Å; L27-M31 HydrophobicContact CD1-CG 4.03Å; L27-M31 WeakPolarHBondContact O-CB 3.45Å; L27-M31 WeakPolarHBondContact O-CG 3.31Å; L27-M31 PolarHBondContact O-N 2.81Å; L27-C274 HydrophobicContact CD1-CB 4.27Å
28	A	90.1	Very high	88.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.9	-46.5	178.5	0	0	0	0	0	111.5	L24 Q25 M31 H32 I33 H35	L24-A28 VanDerWaalsContact O-CB 3.23Å; L24-A28 WeakPolarHBondContact O-CB 3.46Å; L24-A28 PolarHBondContact O-N 2.92Å; Q25-A28 PolarHBondContact O-N 3.42Å; A28-M31 PolarHBondContact O-N 3.3Å; A28-H32 PolarHBondContact O-N 2.89Å; A28-I33 PolarHBondContact O-N 3.46Å; A28-H35 HydrophobicContact CB-CB 3.48Å; A28-H35 VanDerWaalsContact CB-CB 3.48Å
29	D	89.2	Confident	89.2	Confident	24 Å²	24	31 Å²	31	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-46	179.3	-61.8	-10.8	0	0	0	110	Q25 M31 H32 Y61 T62	Q25-D29 WeakPolarHBondContact CG-OD2 3.36Å; Q25-D29 PolarHBondContact NE2-OD2 2.99Å; Q25-D29 WeakPolarHBondContact O-CB 3.39Å; Q25-D29 VanDerWaalsContact O-CG 3.23Å; Q25-D29 PolarHBondContact O-N 2.94Å; D29-M31 VanDerWaalsContact C-N 3.28Å; D29-M31 PolarHBondContact O-N 3.43Å; D29-H32 PolarHBondContact O-CD2 3.4Å; D29-H32 PolarHBondContact O-N 3.34Å; D29-Y61 WeakPolarHBondContact OD1-CA 3.49Å; D29-Y61 WeakPolarHBondContact OD1-CB 3.39Å; D29-Y61 PolarHBondContact OD1-N 3.46Å; D29-T62 PolarHBondContact OD1-N 2.85Å; D29-T62 PolarHBondContact OD1-OG1 3.18Å
30	A	88	Confident	89.5	Confident	66 Å²	66	29.9 Å²	29.9	55%	0.545	18%	0.183	S	C	.	.	H	α-helix	trans	-63.8	-26.4	177.3	0	0	0	0	0	114.7	S26	S26-A30 WeakPolarHBondContact O-CB 3.29Å; S26-A30 PolarHBondContact O-N 3.31Å
31	M	88.4	Confident	89.1	Confident	15 Å²	15	27.7 Å²	27.7	7%	0.074	17%	0.167	C	C	.	.	H	α-helix	trans	-102.4	-0.6	-177.5	-57.1	-60	-69.5	0	0	113.4	M5 L27 A28 D29 I33 L272 P281 W282	M5-M31 HydrophobicContact SD-CG 4.35Å; L27-M31 HydrophobicContact CD1-CG 4.03Å; L27-M31 WeakPolarHBondContact O-CB 3.45Å; L27-M31 WeakPolarHBondContact O-CG 3.31Å; L27-M31 PolarHBondContact O-N 2.81Å; A28-M31 PolarHBondContact O-N 3.3Å; D29-M31 VanDerWaalsContact C-N 3.28Å; D29-M31 PolarHBondContact O-N 3.43Å; M31-I33 HydrophobicContact CB-CD1 4.42Å; M31-L272 HydrophobicContact CB-CD1 4.04Å; M31-L272 HydrophobicContact CE-CB 3.65Å; M31-L272 HydrophobicContact CE-CD1 3.92Å; M31-L272 HydrophobicContact CE-CG 4.29Å; M31-P281 WeakPolarHBondContact O-CA 3.41Å; M31-P281 WeakPolarHBondContact O-CB 3.48Å; M31-W282 PolarHBondContact O-N 2.99Å
32	H	90.6	Very high	88.5	Confident	54 Å²	54	31.2 Å²	31.2	25%	0.25	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	44.5	-170.8	-61.1	-179.9	0	0	0	113.4	A28 D29 Y61 P281 W282 G285	A28-H32 PolarHBondContact O-N 2.89Å; D29-H32 PolarHBondContact O-CD2 3.4Å; D29-H32 PolarHBondContact O-N 3.34Å; H32-Y61 HydrophobicContact CB-CD1 4.37Å; H32-Y61 HydrophobicContact CB-CE1 3.74Å; H32-Y61 HydrophobicContact CB-CE2 4.03Å; H32-Y61 AromaticContact CD2-CE2 3.32Å; H32-Y61 WeakPolarHBondContact CD2-CE2 3.5Å; H32-Y61 AromaticContact CD2-CZ 3.55Å; H32-Y61 PolarHBondContact CD2-OH 2.95Å; H32-Y61 AromaticContact CG-CE2 3.71Å; H32-Y61 AromaticContact CG-CZ 3.43Å; H32-Y61 VanDerWaalsContact CG-CZ 3.43Å; H32-Y61 PolarHBondContact ND1-OH 2.95Å; H32-Y61 AromaticContact NE2-CE2 3.99Å; H32-P281 HydrophobicContact CB-CB 3.93Å; H32-W282 WeakPolarHBondContact CB-O 3.47Å; H32-G285 WeakPolarHBondContact O-CA 3.27Å
33	I	91.1	Very high	88	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.015	20%	0.202	C	C	.	.			trans	-103.4	122	173.9	-72.6	171.6	0	0	0	109.2	M5 I9 L12 A28 M31 H35 L272	M5-I33 HydrophobicContact CE-CD1 3.79Å; M5-I33 HydrophobicContact CG-CD1 3.78Å; M5-I33 HydrophobicContact SD-CD1 4.03Å; I9-I33 HydrophobicContact CD1-CD1 4.4Å; I9-I33 HydrophobicContact CD1-CG2 4.26Å; I9-I33 HydrophobicContact CG1-CD1 4.13Å; L12-I33 HydrophobicContact CB-CG2 4.14Å; A28-I33 PolarHBondContact O-N 3.46Å; M31-I33 HydrophobicContact CB-CD1 4.42Å; I33-H35 PolarHBondContact O-N 3.01Å; I33-L272 HydrophobicContact CD1-CD1 3.76Å; I33-L272 HydrophobicContact CG1-CD1 4.19Å
34	P	93.1	Very high	87.6	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.183	C	C	.	.			trans	-55.5	122.7	173.2	-22.7	32	0	0	0	111.1	A11 L12 M288 L289 I292	A11-P34 CarbonylContact C-O 3.52Å; A11-P34 VanDerWaalsContact CA-O 3.26Å; A11-P34 WeakPolarHBondContact CA-O 3.24Å; A11-P34 HydrophobicContact CB-CB 4.39Å; L12-P34 PolarHBondContact N-O 3.21Å; P34-M288 HydrophobicContact CG-CB 4Å; P34-M288 HydrophobicContact CG-CG 4.1Å; P34-L289 HydrophobicContact CB-CB 4.44Å; P34-L289 HydrophobicContact CB-CD1 3.98Å; P34-L289 HydrophobicContact CG-CB 4.15Å; P34-I292 HydrophobicContact CB-CD1 3.92Å; P34-I292 HydrophobicContact CG-CD1 4.41Å
35	H	92.9	Very high	87.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115.9	-175.5	169.7	-134.4	0	0	0	110.3	L12 S14 A28 I33 Y61 T62 L63	L12-H35 CarbonylContact O-C 3.59Å; L12-H35 VanDerWaalsContact O-CA 3.31Å; L12-H35 WeakPolarHBondContact O-CA 3.39Å; S14-H35 PolarHBondContact OG-NE2 3.24Å; A28-H35 HydrophobicContact CB-CB 3.48Å; A28-H35 VanDerWaalsContact CB-CB 3.48Å; I33-H35 PolarHBondContact O-N 3.01Å; H35-Y61 PolarHBondContact N-O 3.33Å; H35-T62 WeakPolarHBondContact ND1-CG2 3.4Å; H35-T62 PolarHBondContact ND1-OG1 3.25Å; H35-T62 CarbonylContact O-C 3.54Å; H35-T62 WeakPolarHBondContact O-CA 3.35Å; H35-L63 PolarHBondContact O-N 3.48Å
36	L	94	Very high	87.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	104.2	178.9	-67.5	89.9	0	0	0	108.2	A11 L12 V13 S14 V65 T249 L252 L253 I292 F306	A11-L36 HydrophobicContact CB-CD1 4.14Å; L12-L36 PolarHBondContact O-N 2.8Å; V13-L36 WeakPolarHBondContact CA-O 3.14Å; V13-L36 HydrophobicContact CG2-CB 4.43Å; S14-L36 PolarHBondContact N-O 3.02Å; L36-V65 HydrophobicContact CB-CG2 3.83Å; L36-V65 HydrophobicContact CD2-CG2 4.36Å; L36-T249 HydrophobicContact CB-CG2 4.08Å; L36-T249 HydrophobicContact CD2-CG2 3.8Å; L36-L252 HydrophobicContact CD2-CD2 4.4Å; L36-L253 HydrophobicContact CD1-CD2 4.07Å; L36-I292 HydrophobicContact CD1-CD1 4.36Å; L36-I292 HydrophobicContact CD2-CG2 4.04Å; L36-F306 HydrophobicContact CD2-CZ 4.49Å
37	F	92.9	Very high	87.3	Confident	7 Å²	7	25 Å²	25	3%	0.031	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.9	-176.8	171.4	-122.1	0	0	0	111	I16 A21 Q39 C50 L52 T62 L63 V65	I16-F37 HydrophobicContact CG1-CD2 4.18Å; I16-F37 HydrophobicContact CG1-CE2 3.77Å; A21-F37 HydrophobicContact CB-CD2 4.17Å; A21-F37 HydrophobicContact CB-CE1 4.26Å; A21-F37 HydrophobicContact CB-CE2 3.62Å; A21-F37 HydrophobicContact CB-CZ 3.66Å; F37-Q39 HydrophobicContact CE1-CB 4.01Å; F37-Q39 HydrophobicContact CZ-CB 3.77Å; F37-Q39 HydrophobicContact CZ-CG 4.18Å; F37-C50 HydrophobicContact CE1-CB 4.44Å; F37-L52 HydrophobicContact CD1-CD1 3.89Å; F37-L52 HydrophobicContact CE1-CD1 4.16Å; F37-T62 HydrophobicContact CB-CG2 4.11Å; F37-L63 PolarHBondContact N-O 3.27Å; F37-V65 PolarHBondContact O-N 3Å
38	I	92.8	Very high	87	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115	172.7	-57.4	167.5	0	0	0	106.8	V13 S14 S15 I16 R40 V65 I246	V13-I38 HydrophobicContact CG1-CD1 4.09Å; S14-I38 WeakPolarHBondContact O-CB 3.42Å; S14-I38 PolarHBondContact O-N 3.46Å; S15-I38 WeakPolarHBondContact CA-O 3.38Å; I16-I38 PolarHBondContact N-O 2.84Å; I38-R40 PolarHBondContact O-N 2.68Å; I38-V65 HydrophobicContact CG1-CB 3.82Å; I38-V65 HydrophobicContact CG1-CG1 4.13Å; I38-V65 HydrophobicContact CG1-CG2 3.94Å; I38-I246 HydrophobicContact CD1-CB 4.26Å; I38-I246 HydrophobicContact CD1-CG1 3.46Å; I38-I246 VanDerWaalsContact CD1-CG1 3.46Å
39	Q	89.5	Confident	86.5	Confident	16 Å²	16	26.4 Å²	26.4	8%	0.075	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.8	176.7	-174.2	-174.7	5.5	0	0	110	C18 F37 S48 C50 R66	C18-Q39 PolarHBondContact SG-NE2 2.95Å; F37-Q39 HydrophobicContact CE1-CB 4.01Å; F37-Q39 HydrophobicContact CZ-CB 3.77Å; F37-Q39 HydrophobicContact CZ-CG 4.18Å; Q39-S48 PolarHBondContact NE2-O 3.21Å; Q39-C50 VanDerWaalsContact CD-SG 3.51Å; Q39-C50 PolarHBondContact NE2-SG 2.94Å; Q39-R66 WeakPolarHBondContact O-CD 3.43Å; Q39-R66 PolarHBondContact O-NH1 3.03Å; Q39-R66 VanDerWaalsContact O-NH1 3.08Å
40	R	85.9	Confident	85.9	Confident	108 Å²	108	26.6 Å²	26.6	41%	0.408	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-88	145.3	169.2	-159.4	171.7	-169.4	-170.6	-2.3	110.5	I16 I38 E240	I16-R40 PolarHBondContact O-N 2.93Å; I16-R40 VanDerWaalsContact O-N 3.15Å; I38-R40 PolarHBondContact O-N 2.68Å; R40-E240 IonicContact CZ-OE1 3.92Å; R40-E240 IonicContact CZ-OE2 2.88Å; R40-E240 IonicContact NE-OE1 3.22Å; R40-E240 IonicContact NE-OE2 2.67Å; R40-E240 PolarHBondContact NE-OE2 3.46Å; R40-E240 VanDerWaalsContact NH2-CD 3.27Å; R40-E240 IonicContact NH2-OE1 2.8Å; R40-E240 PolarHBondContact NH2-OE1 2.89Å; R40-E240 IonicContact NH2-OE2 3.69Å; R40-E240 PolarHBondContact NH2-OE2 2.94Å; R40-E240 VanDerWaalsContact NH2-OE2 3.07Å
41	S	77.1	Confident	84.9	Confident	19 Å²	19	27.2 Å²	27.2	13%	0.133	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-68.9	152.8	169.5	51	0	0	0	0	111.1	T45 E183	S41-T45 WeakPolarHBondContact CB-O 3.39Å; S41-E183 VanDerWaalsContact CB-OE2 3.26Å; S41-E183 WeakPolarHBondContact CB-OE2 3.48Å; S41-E183 PolarHBondContact OG-OE2 3.27Å
42	T	72.6	Confident	84.2	Confident	73 Å²	73	28 Å²	28	45%	0.448	19%	0.191	S	C	.	.	S	Bend	trans	-91.8	113.2	170.8	33.9	0	0	0	0	108.8	G44 T45	T42-G44 PolarHBondContact O-N 3.32Å; T42-T45 PolarHBondContact O-N 3.31Å; T42-T45 PolarHBondContact O-OG1 3.22Å; T42-T45 PolarHBondContact OG1-OG1 3.06Å
43	A	74.9	Confident	83.1	Confident	71 Å²	71	30.3 Å²	30.3	59%	0.587	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	38.9	177.2	0	0	0	0	0	114.7	T45 N154	A43-T45 VanDerWaalsContact C-N 3.26Å; A43-T45 PolarHBondContact O-N 3.29Å; A43-N154 PolarHBondContact O-ND2 2.83Å
44	G	79.5	Confident	81.9	Confident	21 Å²	21	35.2 Å²	35.2	22%	0.216	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	11.2	179.5	0	0	0	0	0	115.6	T42 N181	T42-G44 PolarHBondContact O-N 3.32Å; G44-N181 PolarHBondContact O-ND2 3.18Å
45	T	85.3	Confident	80.3	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-76.2	156.1	171.2	65.3	0	0	0	0	111.6	S41 T42 A43 D92 E94 N154	S41-T45 WeakPolarHBondContact CB-O 3.39Å; T42-T45 PolarHBondContact O-N 3.31Å; T42-T45 PolarHBondContact O-OG1 3.22Å; T42-T45 PolarHBondContact OG1-OG1 3.06Å; A43-T45 VanDerWaalsContact C-N 3.26Å; A43-T45 PolarHBondContact O-N 3.29Å; T45-D92 HydrophobicContact CG2-CB 3.91Å; T45-E94 HydrophobicContact CG2-CB 4.05Å; T45-N154 HydrophobicContact CG2-CB 4.24Å
46	P	88.1	Confident	78.5	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.013	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-60.4	145.4	178.4	-21.1	33.4	0	0	0	111.6	L71 Y95 V152 I180 N181	P46-L71 HydrophobicContact CB-CD1 3.86Å; P46-Y95 HydrophobicContact CB-CE2 4.17Å; P46-Y95 WeakPolarHBondContact O-CD2 3.13Å; P46-Y95 VanDerWaalsContact O-CE2 3.25Å; P46-Y95 WeakPolarHBondContact O-CE2 3.46Å; P46-V152 HydrophobicContact CB-CG1 4.36Å; P46-V152 HydrophobicContact CG-CG1 3.99Å; P46-I180 WeakPolarHBondContact CG-O 3.32Å; P46-N181 HydrophobicContact CG-CB 4.15Å
47	R	87.9	Confident	76.7	Confident	7 Å²	7	55.1 Å²	55.1	3%	0.026	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-65.7	141	-179.8	-65.8	-173.8	-57.5	135.6	-2.9	112	P67 V69 E182	R47-P67 PolarHBondContact NH1-O 3.18Å; R47-P67 PolarHBondContact NH2-O 3.25Å; R47-V69 HydrophobicContact CB-CG2 3.83Å; R47-V69 WeakPolarHBondContact O-CG1 3.46Å; R47-E182 WeakPolarHBondContact CD-OE2 3.41Å; R47-E182 VanDerWaalsContact CG-OE2 3.27Å; R47-E182 WeakPolarHBondContact CG-OE2 3.26Å; R47-E182 IonicContact CZ-OE1 3.94Å; R47-E182 IonicContact CZ-OE2 3.37Å; R47-E182 IonicContact NE-OE1 2.66Å; R47-E182 PolarHBondContact NE-OE1 3.31Å; R47-E182 IonicContact NE-OE2 2.72Å; R47-E182 PolarHBondContact NE-OE2 3.49Å; R47-E182 IonicContact NH2-OE1 3.37Å; R47-E182 PolarHBondContact NH2-OE1 3Å; R47-E182 IonicContact NH2-OE2 2.74Å
48	S	84.1	Confident	75.2	Confident	16 Å²	16	61.1 Å²	61.1	11%	0.112	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-95.6	163.8	159.1	67.7	0	0	0	0	110.6	Q39 C50 D96	Q39-S48 PolarHBondContact NE2-O 3.21Å; S48-C50 PolarHBondContact O-N 3.4Å; S48-D96 PolarHBondContact OG-OD2 3.35Å
49	G	78.1	Confident	74	Confident	51 Å²	51	64.9 Å²	64.9	53%	0.526	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-72.3	121.9	177.8	0	0	0	0	0	112.5	G51	G49-G51 PolarHBondContact O-N 3Å
50	C	77.5	Confident	73.7	Confident	27 Å²	27	65.7 Å²	65.7	18%	0.182	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-71.8	120.9	170.8	-59.9	0	0	0	0	110.9	C18 F37 Q39 S48 L52	C18-C50 VanDerWaalsContact CA-SG 3.5Å; C18-C50 HydrophobicContact CB-CB 3.7Å; C18-C50 WeakPolarHBondContact CB-SG 3.46Å; C18-C50 WeakPolarHBondContact SG-CA 3.39Å; C18-C50 WeakPolarHBondContact SG-CB 3.41Å; C18-C50 CovalentContact SG-SG 2.04Å; C18-C50 PolarHBondContact SG-SG 3.01Å; F37-C50 HydrophobicContact CE1-CB 4.44Å; Q39-C50 VanDerWaalsContact CD-SG 3.51Å; Q39-C50 PolarHBondContact NE2-SG 2.94Å; S48-C50 PolarHBondContact O-N 3.4Å; C50-L52 HydrophobicContact CB-CG 4.32Å; C50-L52 PolarHBondContact O-N 2.94Å
51	G	67.6	Low	74	Confident	79 Å²	79	61.1 Å²	61.1	81%	0.814	37%	0.365	S	S	*	.			trans	-72.2	65	172.2	0	0	0	0	0	113.4	G49	G49-G51 PolarHBondContact O-N 3Å
52	L	73.3	Confident	74.6	Confident	31 Å²	31	60.7 Å²	60.7	16%	0.162	36%	0.361	C	S	.	.			trans	-66.8	130.9	171.5	-67.6	174.8	0	0	0	109.9	A21 Q25 F37 C50 R54	A21-L52 HydrophobicContact CB-CD2 4.02Å; Q25-L52 HydrophobicContact CB-CD2 4.47Å; F37-L52 HydrophobicContact CD1-CD1 3.89Å; F37-L52 HydrophobicContact CE1-CD1 4.16Å; C50-L52 HydrophobicContact CB-CG 4.32Å; C50-L52 PolarHBondContact O-N 2.94Å; L52-R54 PolarHBondContact O-N 3.4Å
53	T	66.7	Low	75.5	Confident	104 Å²	104	57.5 Å²	57.5	64%	0.638	34%	0.342	S	S	*	.			trans	-79.7	84.4	-176.4	50.6	0	0	0	0	110.1	Q25	Q25-T53 PolarHBondContact NE2-O 3.34Å
54	R	66.5	Low	76.3	Confident	105 Å²	105	55 Å²	55	40%	0.396	32%	0.32	S	S	.	.			trans	-76.6	125.9	176	-69.9	-173.8	167.3	170.7	-6.9	111.2	L52 D60 N309	L52-R54 PolarHBondContact O-N 3.4Å; R54-D60 WeakPolarHBondContact CA-OD2 3.38Å; R54-D60 WeakPolarHBondContact CB-OD2 3.39Å; R54-D60 WeakPolarHBondContact CG-OD2 3.47Å; R54-N309 PolarHBondContact NE-O 3.24Å; R54-N309 PolarHBondContact NH1-O 3.42Å; R54-N309 VanDerWaalsContact NH1-O 3.09Å; R54-N309 PolarHBondContact NH2-O 3Å
55	S	58.3	Low	76.9	Confident	54 Å²	54	54 Å²	54	38%	0.378	31%	0.309	S	S	.	.			trans	-86	142	176.2	-170	0	0	0	0	109.8	R57 D60	S55-R57 PolarHBondContact O-N 3.33Å; S55-D60 WeakPolarHBondContact CB-OD1 3.45Å; S55-D60 PolarHBondContact N-OD1 3.41Å; S55-D60 PolarHBondContact N-OD2 2.97Å
56	N	55.4	Low	77.2	Confident	183 Å²	183	54.1 Å²	54.1	98%	0.979	31%	0.31	S	S	*	.	S	Bend	trans	-78.8	30.7	171.2	-131.3	21.7	0	0	0	111.9
57	R	56.1	Low	77.2	Confident	182 Å²	182	54 Å²	54	69%	0.687	31%	0.309	S	S	*	.	S	Bend	trans	-126.8	162.8	179.7	-64.7	-175.9	172.3	-178.6	-2.2	109.4	S55 D59	S55-R57 PolarHBondContact O-N 3.33Å; R57-D59 HydrophobicContact CB-CB 4.35Å; R57-D59 WeakPolarHBondContact CB-OD2 3.25Å; R57-D59 WeakPolarHBondContact CD-OD2 3.44Å; R57-D59 PolarHBondContact O-N 3.29Å
58	N	61.3	Low	77.1	Confident	133 Å²	133	56.3 Å²	56.3	71%	0.711	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	25	178.3	-67.3	-33	0	0	0	114.2	R286	N58-R286 PolarHBondContact O-NH1 2.83Å
59	D	67.5	Low	77.3	Confident	78 Å²	78	56.4 Å²	56.4	42%	0.417	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-9.3	-169.3	-54	-30.1	0	0	0	112.6	R57 Y61	R57-D59 HydrophobicContact CB-CB 4.35Å; R57-D59 WeakPolarHBondContact CB-OD2 3.25Å; R57-D59 WeakPolarHBondContact CD-OD2 3.44Å; R57-D59 PolarHBondContact O-N 3.29Å; D59-Y61 WeakPolarHBondContact O-CD2 3.23Å
60	D	84.9	Confident	77.8	Confident	33 Å²	33	56.7 Å²	56.7	18%	0.176	31%	0.31	C	S	.	.			trans	-72.5	125.4	175.8	-74.6	24.9	0	0	0	111.3	R54 S55 R286	R54-D60 WeakPolarHBondContact CA-OD2 3.38Å; R54-D60 WeakPolarHBondContact CB-OD2 3.39Å; R54-D60 WeakPolarHBondContact CG-OD2 3.47Å; S55-D60 WeakPolarHBondContact CB-OD1 3.45Å; S55-D60 PolarHBondContact N-OD1 3.41Å; S55-D60 PolarHBondContact N-OD2 2.97Å; D60-R286 PolarHBondContact O-NH1 2.95Å
61	Y	90.4	Very high	78.2	Confident	12 Å²	12	55.7 Å²	55.7	5%	0.047	30%	0.303	C	S	.	.			trans	-113.9	-3.6	174.7	-73.8	-96.8	0	0	0	113.7	D29 H32 H35 D59 R286 L289	D29-Y61 WeakPolarHBondContact OD1-CA 3.49Å; D29-Y61 WeakPolarHBondContact OD1-CB 3.39Å; D29-Y61 PolarHBondContact OD1-N 3.46Å; H32-Y61 HydrophobicContact CB-CD1 4.37Å; H32-Y61 HydrophobicContact CB-CE1 3.74Å; H32-Y61 HydrophobicContact CB-CE2 4.03Å; H32-Y61 AromaticContact CD2-CE2 3.32Å; H32-Y61 WeakPolarHBondContact CD2-CE2 3.5Å; H32-Y61 AromaticContact CD2-CZ 3.55Å; H32-Y61 PolarHBondContact CD2-OH 2.95Å; H32-Y61 AromaticContact CG-CE2 3.71Å; H32-Y61 AromaticContact CG-CZ 3.43Å; H32-Y61 VanDerWaalsContact CG-CZ 3.43Å; H32-Y61 PolarHBondContact ND1-OH 2.95Å; H32-Y61 AromaticContact NE2-CE2 3.99Å; H35-Y61 PolarHBondContact N-O 3.33Å; D59-Y61 WeakPolarHBondContact O-CD2 3.23Å; Y61-R286 HydrophobicContact CE1-CB 4.24Å; Y61-L289 HydrophobicContact CD1-CB 4.47Å; Y61-L289 HydrophobicContact CD1-CD2 3.91Å; Y61-L289 HydrophobicContact CE1-CD2 4.35Å; Y61-L289 HydrophobicContact CG-CD2 4.34Å; Y61-L289 WeakPolarHBondContact O-CD1 3.39Å
62	T	90.8	Very high	79.2	Confident	10 Å²	10	53.3 Å²	53.3	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	124.8	179.8	-63.6	0	0	0	0	112.5	D29 H35 F37	D29-T62 PolarHBondContact OD1-N 2.85Å; D29-T62 PolarHBondContact OD1-OG1 3.18Å; H35-T62 WeakPolarHBondContact ND1-CG2 3.4Å; H35-T62 PolarHBondContact ND1-OG1 3.25Å; H35-T62 CarbonylContact O-C 3.54Å; H35-T62 WeakPolarHBondContact O-CA 3.35Å; F37-T62 HydrophobicContact CB-CG2 4.11Å
63	L	91.5	Very high	80	Confident	7 Å²	7	54 Å²	54	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	130.5	175.4	-60.7	176.1	0	0	0	110.4	H35 F37 V65 L289 I292 F306 G310	H35-L63 PolarHBondContact O-N 3.48Å; F37-L63 PolarHBondContact N-O 3.27Å; L63-V65 PolarHBondContact O-N 3.33Å; L63-L289 HydrophobicContact CD1-CD1 3.84Å; L63-L289 HydrophobicContact CD2-CD1 4.31Å; L63-L289 HydrophobicContact CG-CD1 3.89Å; L63-I292 HydrophobicContact CD1-CG2 3.89Å; L63-F306 HydrophobicContact CB-CD1 4.22Å; L63-F306 HydrophobicContact CB-CE1 3.83Å; L63-F306 HydrophobicContact CB-CE2 4.26Å; L63-F306 HydrophobicContact CB-CZ 3.85Å; L63-F306 HydrophobicContact CD1-CD2 3.89Å; L63-F306 HydrophobicContact CD1-CE2 3.75Å; L63-F306 HydrophobicContact CD1-CG 4.41Å; L63-F306 HydrophobicContact CD1-CZ 4.2Å; L63-F306 HydrophobicContact CD2-CG 4.43Å; L63-G310 CarbonylContact C-O 3.5Å; L63-G310 WeakPolarHBondContact CA-O 3.29Å
64	S	91.2	Very high	81.1	Confident	17 Å²	17	49.1 Å²	49.1	12%	0.119	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	99.9	178.9	-57.1	0	0	0	0	110.3	G310 N312	S64-G310 PolarHBondContact N-O 3.14Å; S64-N312 PolarHBondContact O-N 3.14Å
65	V	92.4	Very high	82.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.			trans	-64.4	-44.1	-177.9	-179.7	0	0	0	0	111.4	L36 F37 I38 L63 Y245 T249 L304 F306 N312	L36-V65 HydrophobicContact CB-CG2 3.83Å; L36-V65 HydrophobicContact CD2-CG2 4.36Å; F37-V65 PolarHBondContact O-N 3Å; I38-V65 HydrophobicContact CG1-CB 3.82Å; I38-V65 HydrophobicContact CG1-CG1 4.13Å; I38-V65 HydrophobicContact CG1-CG2 3.94Å; L63-V65 PolarHBondContact O-N 3.33Å; V65-Y245 HydrophobicContact CG1-CD1 3.87Å; V65-Y245 HydrophobicContact CG1-CG 4.3Å; V65-T249 VanDerWaalsContact CG1-OG1 3.31Å; V65-T249 WeakPolarHBondContact CG1-OG1 3.34Å; V65-L304 HydrophobicContact CG1-CD1 4.07Å; V65-L304 HydrophobicContact CG1-CD2 4.23Å; V65-F306 HydrophobicContact CG2-CZ 4.21Å; V65-N312 WeakPolarHBondContact O-CB 3.22Å; V65-N312 PolarHBondContact O-ND2 2.95Å
66	R	90.6	Very high	83.9	Confident	5 Å²	5	42.8 Å²	42.8	2%	0.019	21%	0.214	C	C	.	.	S	Bend	trans	-80.7	131.2	177.5	-159.3	169.9	-177.1	172	-0	108.6	Q39 E183 S242 Y245	Q39-R66 WeakPolarHBondContact O-CD 3.43Å; Q39-R66 PolarHBondContact O-NH1 3.03Å; Q39-R66 VanDerWaalsContact O-NH1 3.08Å; R66-E183 IonicContact CZ-OE1 3.38Å; R66-E183 VanDerWaalsContact CZ-OE1 3.22Å; R66-E183 IonicContact NH1-OE1 2.72Å; R66-E183 PolarHBondContact NH1-OE1 2.99Å; R66-E183 IonicContact NH2-OE1 2.7Å; R66-E183 PolarHBondContact NH2-OE1 3.29Å; R66-S242 PolarHBondContact NH1-OG 2.88Å; R66-Y245 HydrophobicContact CB-CD2 4.41Å; R66-Y245 HydrophobicContact CG-CD2 3.89Å; R66-Y245 HydrophobicContact CG-CE2 3.75Å
67	P	89.3	Confident	85.5	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-57.6	158.7	-176.6	-28.4	35.2	0	0	0	114.5	R47 Y245 N312 N314 V315	R47-P67 PolarHBondContact NH1-O 3.18Å; R47-P67 PolarHBondContact NH2-O 3.25Å; P67-Y245 WeakPolarHBondContact CD-OH 3.16Å; P67-N312 WeakPolarHBondContact CA-O 3.4Å; P67-N312 HydrophobicContact CG-CB 4.31Å; P67-N314 WeakPolarHBondContact CG-O 3.31Å; P67-V315 HydrophobicContact CB-CB 3.85Å; P67-V315 HydrophobicContact CB-CG1 4.45Å; P67-V315 HydrophobicContact CB-CG2 4.36Å; P67-V315 HydrophobicContact CG-CB 3.98Å; P67-V315 HydrophobicContact CG-CG2 4.46Å
68	P	86.6	Confident	87.2	Confident	55 Å²	55	30.1 Å²	30.1	36%	0.357	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-51.7	158.1	169.5	-24.7	33.2	0	0	0	113.4	Y70 N312	P68-Y70 HydrophobicContact CB-CD2 4.2Å; P68-Y70 HydrophobicContact CB-CE2 3.74Å; P68-Y70 HydrophobicContact CG-CE2 4.04Å; P68-Y70 VanDerWaalsContact O-CD2 3.29Å; P68-Y70 WeakPolarHBondContact O-CD2 3.48Å; P68-Y70 PolarHBondContact O-N 2.96Å; P68-Y70 VanDerWaalsContact O-N 3.15Å; P68-N312 VanDerWaalsContact CD-O 3.23Å; P68-N312 WeakPolarHBondContact CD-O 3.41Å
69	V	87.3	Confident	88.6	Confident	18 Å²	18	23.8 Å²	23.8	11%	0.109	12%	0.119	C	C	.	.			trans	-84.5	89.7	-178.1	179.6	0	0	0	0	110	R47 L71 H72	R47-V69 HydrophobicContact CB-CG2 3.83Å; R47-V69 WeakPolarHBondContact O-CG1 3.46Å; V69-L71 VanDerWaalsContact C-N 3.27Å; V69-L71 HydrophobicContact CG1-CB 4.16Å; V69-L71 HydrophobicContact CG1-CD1 3.84Å; V69-L71 HydrophobicContact CG1-CG 3.77Å; V69-L71 PolarHBondContact O-N 2.81Å; V69-H72 PolarHBondContact O-CE1 3.3Å; V69-H72 PolarHBondContact O-ND1 3.22Å; V69-H72 VanDerWaalsContact O-ND1 3.11Å
70	Y	88.1	Confident	89.6	Confident	57 Å²	57	22.6 Å²	22.6	22%	0.224	12%	0.115	C	C	.	.			trans	-82.3	5	178.4	-72.6	-80.2	0	0	0	114.6	P68 H72 D73 V74 V315 W338 P340	P68-Y70 HydrophobicContact CB-CD2 4.2Å; P68-Y70 HydrophobicContact CB-CE2 3.74Å; P68-Y70 HydrophobicContact CG-CE2 4.04Å; P68-Y70 VanDerWaalsContact O-CD2 3.29Å; P68-Y70 WeakPolarHBondContact O-CD2 3.48Å; P68-Y70 PolarHBondContact O-N 2.96Å; P68-Y70 VanDerWaalsContact O-N 3.15Å; Y70-H72 PolarHBondContact O-N 3.4Å; Y70-H72 VanDerWaalsContact O-N 3.09Å; Y70-D73 PolarHBondContact O-N 3.32Å; Y70-V74 WeakPolarHBondContact O-CG2 3.36Å; Y70-V74 PolarHBondContact O-N 3.44Å; Y70-V315 HydrophobicContact CD2-CG1 3.7Å; Y70-V315 HydrophobicContact CE2-CG1 4.07Å; Y70-W338 AromaticContact CD1-CH2 3.84Å; Y70-W338 HydrophobicContact CD1-CH2 3.84Å; Y70-W338 HydrophobicContact CD1-CZ3 4.41Å; Y70-W338 HydrophobicContact CG-CH2 4.02Å; Y70-W338 HydrophobicContact CG-CZ3 4.14Å; Y70-P340 HydrophobicContact CD1-CB 4.47Å; Y70-P340 HydrophobicContact CD1-CG 4.15Å; Y70-P340 HydrophobicContact CD2-CG 3.99Å; Y70-P340 HydrophobicContact CE1-CB 3.97Å; Y70-P340 HydrophobicContact CE1-CG 3.91Å; Y70-P340 HydrophobicContact CE2-CG 3.72Å; Y70-P340 HydrophobicContact CG-CG 4.17Å
71	L	87.4	Confident	89.7	Confident	6 Å²	6	23.9 Å²	23.9	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-51.9	-39.1	-174.4	-57.7	178.8	0	0	0	112.6	P46 V69 D73 V74 I75 I180 E182 F317	P46-L71 HydrophobicContact CB-CD1 3.86Å; V69-L71 VanDerWaalsContact C-N 3.27Å; V69-L71 HydrophobicContact CG1-CB 4.16Å; V69-L71 HydrophobicContact CG1-CD1 3.84Å; V69-L71 HydrophobicContact CG1-CG 3.77Å; V69-L71 PolarHBondContact O-N 2.81Å; L71-D73 PolarHBondContact O-N 2.86Å; L71-V74 PolarHBondContact O-N 3.3Å; L71-I75 WeakPolarHBondContact O-CD1 3.39Å; L71-I75 WeakPolarHBondContact O-CG1 3.44Å; L71-I75 PolarHBondContact O-N 2.93Å; L71-I180 HydrophobicContact CB-CD1 3.91Å; L71-I180 HydrophobicContact CD2-CD1 3.75Å; L71-I180 HydrophobicContact CD2-CG1 3.98Å; L71-I180 HydrophobicContact CG-CD1 4.35Å; L71-E182 HydrophobicContact CD2-CG 3.88Å; L71-F317 HydrophobicContact CD2-CE1 3.51Å; L71-F317 HydrophobicContact CD2-CZ 3.75Å
72	H	87.4	Confident	89.4	Confident	28 Å²	28	24.8 Å²	24.8	13%	0.13	12%	0.123	C	C	.	.	H	α-helix	trans	-59.9	-44.3	178.2	58.9	-94.3	0	0	0	113.3	V69 Y70 L76 E102 F103	V69-H72 PolarHBondContact O-CE1 3.3Å; V69-H72 PolarHBondContact O-ND1 3.22Å; V69-H72 VanDerWaalsContact O-ND1 3.11Å; Y70-H72 PolarHBondContact O-N 3.4Å; Y70-H72 VanDerWaalsContact O-N 3.09Å; H72-L76 WeakPolarHBondContact O-CB 3.47Å; H72-L76 PolarHBondContact O-N 3.04Å; H72-E102 IonicContact NE2-OE1 2.71Å; H72-F103 HydrophobicContact CB-CB 3.85Å; H72-F103 WeakPolarHBondContact O-CD2 3.34Å
73	D	89.6	Confident	89.2	Confident	47 Å²	47	27.6 Å²	27.6	25%	0.251	15%	0.147	S	C	.	.	H	α-helix	trans	-72.6	-35.5	179.3	-75.8	-24.4	0	0	0	111.6	Y70 L71 L76 R77 K106 W338	Y70-D73 PolarHBondContact O-N 3.32Å; L71-D73 PolarHBondContact O-N 2.86Å; D73-L76 PolarHBondContact O-N 3.36Å; D73-R77 WeakPolarHBondContact O-CB 3.06Å; D73-R77 PolarHBondContact O-N 3.24Å; D73-K106 IonicContact OD1-NZ 3.07Å; D73-K106 PolarHBondContact OD1-NZ 3.06Å; D73-W338 HydrophobicContact CB-CH2 4.29Å; D73-W338 HydrophobicContact CB-CZ2 3.88Å
74	V	91.1	Very high	89	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.4	-47.3	175.2	-170.8	0	0	0	0	110.6	Y70 L71 L76 R77 V78 I203 F317 W338	Y70-V74 WeakPolarHBondContact O-CG2 3.36Å; Y70-V74 PolarHBondContact O-N 3.44Å; L71-V74 PolarHBondContact O-N 3.3Å; V74-L76 PolarHBondContact O-N 3.23Å; V74-R77 PolarHBondContact O-N 3.4Å; V74-V78 HydrophobicContact CG1-CG2 4.47Å; V74-V78 VanDerWaalsContact O-CG2 3.25Å; V74-V78 WeakPolarHBondContact O-CG2 3.45Å; V74-V78 PolarHBondContact O-N 3.07Å; V74-I203 HydrophobicContact CB-CG2 4.5Å; V74-I203 HydrophobicContact CG1-CD1 4.41Å; V74-I203 HydrophobicContact CG1-CG2 3.59Å; V74-F317 HydrophobicContact CG2-CD2 3.84Å; V74-F317 HydrophobicContact CG2-CE2 4.14Å; V74-F317 HydrophobicContact CG2-CG 4.07Å; V74-W338 HydrophobicContact CG1-CB 4.49Å; V74-W338 HydrophobicContact CG1-CG 4.47Å; V74-W338 HydrophobicContact CG2-CD2 3.67Å; V74-W338 HydrophobicContact CG2-CE3 3.53Å; V74-W338 HydrophobicContact CG2-CG 4.2Å; V74-W338 HydrophobicContact CG2-CH2 4.27Å; V74-W338 HydrophobicContact CG2-CZ2 4.38Å; V74-W338 HydrophobicContact CG2-CZ3 3.85Å
75	I	91.3	Very high	88.7	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-48.3	176.1	-60.2	157.9	0	0	0	109.5	L71 R77 V78 V79 F103 I150 I180	L71-I75 WeakPolarHBondContact O-CD1 3.39Å; L71-I75 WeakPolarHBondContact O-CG1 3.44Å; L71-I75 PolarHBondContact O-N 2.93Å; I75-R77 VanDerWaalsContact C-N 3.31Å; I75-R77 PolarHBondContact O-N 2.84Å; I75-V78 PolarHBondContact O-N 3.17Å; I75-V78 VanDerWaalsContact O-N 3.1Å; I75-V79 HydrophobicContact CG2-CG2 3.79Å; I75-V79 WeakPolarHBondContact O-CB 3.41Å; I75-V79 VanDerWaalsContact O-CG2 3.29Å; I75-V79 WeakPolarHBondContact O-CG2 3.5Å; I75-V79 PolarHBondContact O-N 3.44Å; I75-F103 HydrophobicContact CB-CD2 4.2Å; I75-F103 HydrophobicContact CB-CE2 3.82Å; I75-F103 HydrophobicContact CB-CZ 4.36Å; I75-F103 HydrophobicContact CG2-CD2 4.21Å; I75-F103 HydrophobicContact CG2-CE1 4.34Å; I75-F103 HydrophobicContact CG2-CE2 3.42Å; I75-F103 VanDerWaalsContact CG2-CE2 3.42Å; I75-F103 HydrophobicContact CG2-CZ 3.49Å; I75-F103 VanDerWaalsContact CG2-CZ 3.49Å; I75-I150 HydrophobicContact CG2-CD1 3.77Å; I75-I180 HydrophobicContact CD1-CD1 3.94Å; I75-I180 HydrophobicContact CD1-CG2 4.06Å; I75-I180 HydrophobicContact CG1-CD1 3.5Å; I75-I180 HydrophobicContact CG1-CG2 4.23Å
76	L	90.9	Very high	88.5	Confident	21 Å²	21	37 Å²	37	11%	0.11	19%	0.188	C	C	.	.	H	α-helix	trans	-59.4	-41.8	-178.7	-174.2	62.3	0	0	0	111.9	H72 D73 V74 T80 F103 K106 V107 M112	H72-L76 WeakPolarHBondContact O-CB 3.47Å; H72-L76 PolarHBondContact O-N 3.04Å; D73-L76 PolarHBondContact O-N 3.36Å; V74-L76 PolarHBondContact O-N 3.23Å; L76-T80 HydrophobicContact CD1-CG2 4.29Å; L76-T80 WeakPolarHBondContact O-CB 3.3Å; L76-T80 VanDerWaalsContact O-CG2 3.32Å; L76-T80 WeakPolarHBondContact O-CG2 3.42Å; L76-T80 PolarHBondContact O-N 2.97Å; L76-T80 PolarHBondContact O-OG1 3.44Å; L76-F103 HydrophobicContact CB-CD2 4.1Å; L76-F103 HydrophobicContact CB-CE2 4.02Å; L76-F103 HydrophobicContact CD1-CE2 4.28Å; L76-K106 HydrophobicContact CD2-CB 3.86Å; L76-K106 HydrophobicContact CD2-CD 3.8Å; L76-K106 HydrophobicContact CD2-CG 4.32Å; L76-V107 HydrophobicContact CD1-CG2 3.9Å; L76-M112 HydrophobicContact CD1-CE 4.33Å
77	R	90.8	Very high	88.6	Confident	97 Å²	97	36.9 Å²	36.9	37%	0.366	19%	0.187	S	C	.	.	H	α-helix	trans	-67.3	-36.2	176.6	-166.5	68	-172.4	101.1	11.6	112.4	D73 V74 I75 T80 E81 L344	D73-R77 WeakPolarHBondContact O-CB 3.06Å; D73-R77 PolarHBondContact O-N 3.24Å; V74-R77 PolarHBondContact O-N 3.4Å; I75-R77 VanDerWaalsContact C-N 3.31Å; I75-R77 PolarHBondContact O-N 2.84Å; R77-T80 WeakPolarHBondContact CA-OG1 3.04Å; R77-T80 PolarHBondContact O-OG1 3.01Å; R77-E81 IonicContact CZ-OE1 2.71Å; R77-E81 IonicContact NH1-OE1 3.74Å; R77-E81 PolarHBondContact NH1-OE1 2.98Å; R77-E81 IonicContact NH2-OE1 3.26Å; R77-E81 PolarHBondContact NH2-OE1 3.29Å; R77-E81 WeakPolarHBondContact O-CB 3.4Å; R77-E81 WeakPolarHBondContact O-CG 3.32Å; R77-E81 PolarHBondContact O-N 2.82Å; R77-E81 VanDerWaalsContact O-N 3.15Å; R77-L344 HydrophobicContact CG-CB 3.93Å; R77-L344 HydrophobicContact CG-CD2 4.33Å
78	V	91	Very high	88.9	Confident	2 Å²	2	37 Å²	37	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-70.4	-45.8	176.7	171.6	0	0	0	0	111.9	V74 I75 E81 Y82 I178 I203 I319 L348	V74-V78 HydrophobicContact CG1-CG2 4.47Å; V74-V78 VanDerWaalsContact O-CG2 3.25Å; V74-V78 WeakPolarHBondContact O-CG2 3.45Å; V74-V78 PolarHBondContact O-N 3.07Å; I75-V78 PolarHBondContact O-N 3.17Å; I75-V78 VanDerWaalsContact O-N 3.1Å; V78-E81 PolarHBondContact O-N 3.49Å; V78-Y82 HydrophobicContact CG1-CD2 3.72Å; V78-Y82 HydrophobicContact CG1-CE2 3.68Å; V78-Y82 VanDerWaalsContact O-CD2 3.25Å; V78-Y82 WeakPolarHBondContact O-CD2 3.33Å; V78-Y82 PolarHBondContact O-N 3.1Å; V78-Y82 VanDerWaalsContact O-N 3.09Å; V78-I178 HydrophobicContact CG1-CD1 3.95Å; V78-I203 HydrophobicContact CB-CD1 4.33Å; V78-I203 HydrophobicContact CG1-CD1 4.36Å; V78-I203 HydrophobicContact CG2-CD1 3.89Å; V78-I319 HydrophobicContact CG2-CD1 3.78Å; V78-I319 HydrophobicContact CG2-CG1 4.41Å; V78-L348 HydrophobicContact CB-CD1 4.12Å; V78-L348 HydrophobicContact CG1-CD1 4.18Å; V78-L348 HydrophobicContact CG2-CD1 3.72Å
79	V	91	Very high	89.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-40.8	179.7	168.1	0	0	0	0	111.1	I75 Y82 A83 W84 F87 M112 I150 I178	I75-V79 HydrophobicContact CG2-CG2 3.79Å; I75-V79 WeakPolarHBondContact O-CB 3.41Å; I75-V79 VanDerWaalsContact O-CG2 3.29Å; I75-V79 WeakPolarHBondContact O-CG2 3.5Å; I75-V79 PolarHBondContact O-N 3.44Å; V79-Y82 PolarHBondContact O-N 2.94Å; V79-A83 PolarHBondContact O-N 2.71Å; V79-W84 HydrophobicContact CG1-CB 3.86Å; V79-W84 HydrophobicContact CG2-CE3 4.42Å; V79-W84 PolarHBondContact O-N 2.93Å; V79-W84 VanDerWaalsContact O-N 3.11Å; V79-F87 HydrophobicContact CG1-CD1 4.37Å; V79-F87 HydrophobicContact CG1-CE1 3.57Å; V79-F87 HydrophobicContact CG1-CZ 3.85Å; V79-F87 HydrophobicContact CG2-CZ 4.44Å; V79-M112 HydrophobicContact CG1-SD 3.81Å; V79-I150 HydrophobicContact CG2-CD1 3.84Å; V79-I178 HydrophobicContact CG2-CD1 4.34Å
80	T	87.9	Confident	89.6	Confident	53 Å²	53	33.7 Å²	33.7	33%	0.325	17%	0.167	S	C	.	.	H	α-helix	trans	-70.3	-40	176.5	50.1	0	0	0	0	113.2	L76 R77 Y82 A83	L76-T80 HydrophobicContact CD1-CG2 4.29Å; L76-T80 WeakPolarHBondContact O-CB 3.3Å; L76-T80 VanDerWaalsContact O-CG2 3.32Å; L76-T80 WeakPolarHBondContact O-CG2 3.42Å; L76-T80 PolarHBondContact O-N 2.97Å; L76-T80 PolarHBondContact O-OG1 3.44Å; R77-T80 WeakPolarHBondContact CA-OG1 3.04Å; R77-T80 PolarHBondContact O-OG1 3.01Å; T80-Y82 VanDerWaalsContact C-N 3.32Å; T80-Y82 PolarHBondContact O-N 3.13Å; T80-A83 PolarHBondContact O-N 3.02Å
81	E	86.4	Confident	89.8	Confident	61 Å²	61	32.8 Å²	32.8	29%	0.285	16%	0.163	S	C	.	.	H	α-helix	trans	-63.1	-35	173.4	-75.7	-75	112.8	0	0	113.1	R77 V78 A83 L344 L348	R77-E81 IonicContact CZ-OE1 2.71Å; R77-E81 IonicContact NH1-OE1 3.74Å; R77-E81 PolarHBondContact NH1-OE1 2.98Å; R77-E81 IonicContact NH2-OE1 3.26Å; R77-E81 PolarHBondContact NH2-OE1 3.29Å; R77-E81 WeakPolarHBondContact O-CB 3.4Å; R77-E81 WeakPolarHBondContact O-CG 3.32Å; R77-E81 PolarHBondContact O-N 2.82Å; R77-E81 VanDerWaalsContact O-N 3.15Å; V78-E81 PolarHBondContact O-N 3.49Å; E81-A83 PolarHBondContact O-N 3.34Å; E81-L344 HydrophobicContact CG-CD2 3.65Å; E81-L348 HydrophobicContact CB-CB 4.35Å; E81-L348 HydrophobicContact CB-CD1 4Å; E81-L348 HydrophobicContact CG-CD1 4.2Å
82	Y	85.8	Confident	89.9	Confident	31 Å²	31	33.1 Å²	33.1	12%	0.122	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	2	173.6	-71.8	-55.6	0	0	0	113.7	V78 V79 T80 W84 H176 R199 T201 L335 L348	V78-Y82 HydrophobicContact CG1-CD2 3.72Å; V78-Y82 HydrophobicContact CG1-CE2 3.68Å; V78-Y82 VanDerWaalsContact O-CD2 3.25Å; V78-Y82 WeakPolarHBondContact O-CD2 3.33Å; V78-Y82 PolarHBondContact O-N 3.1Å; V78-Y82 VanDerWaalsContact O-N 3.09Å; V79-Y82 PolarHBondContact O-N 2.94Å; T80-Y82 VanDerWaalsContact C-N 3.32Å; T80-Y82 PolarHBondContact O-N 3.13Å; Y82-W84 PolarHBondContact O-N 3.37Å; Y82-W84 VanDerWaalsContact O-N 3.15Å; Y82-H176 AromaticContact CD2-CE1 3.76Å; Y82-H176 AromaticContact CE1-CE1 3.88Å; Y82-H176 AromaticContact CE2-CE1 3.58Å; Y82-H176 AromaticContact CG-CE1 4Å; Y82-H176 AromaticContact CZ-CE1 3.64Å; Y82-R199 PolarHBondContact OH-NH2 2.94Å; Y82-T201 HydrophobicContact CE2-CG2 4.46Å; Y82-T201 PolarHBondContact OH-OG1 3.38Å; Y82-L335 WeakPolarHBondContact OH-CD1 3.28Å; Y82-L348 HydrophobicContact CE1-CB 4.16Å; Y82-L348 WeakPolarHBondContact CE1-O 3.41Å; Y82-L348 HydrophobicContact CE2-CB 4.32Å; Y82-L348 PolarHBondContact OH-O 3.08Å
83	A	85	Confident	89.8	Confident	68 Å²	68	33 Å²	33	56%	0.562	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	35.5	-177.5	0	0	0	0	0	114.1	V79 T80 E81 Q85	V79-A83 PolarHBondContact O-N 2.71Å; T80-A83 PolarHBondContact O-N 3.02Å; E81-A83 PolarHBondContact O-N 3.34Å; A83-Q85 PolarHBondContact O-N 2.69Å
84	W	88.2	Confident	89.6	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.008	18%	0.18	C	C	.	.			trans	-66.7	126.5	177.8	-78.9	26.7	0	0	0	110.4	V79 Y82 F87 R148 I150 H176 I178	V79-W84 HydrophobicContact CG1-CB 3.86Å; V79-W84 HydrophobicContact CG2-CE3 4.42Å; V79-W84 PolarHBondContact O-N 2.93Å; V79-W84 VanDerWaalsContact O-N 3.11Å; Y82-W84 PolarHBondContact O-N 3.37Å; Y82-W84 VanDerWaalsContact O-N 3.15Å; W84-F87 HydrophobicContact CB-CD1 4.13Å; W84-F87 HydrophobicContact CE3-CB 3.5Å; W84-F87 AromaticContact CE3-CD1 3.81Å; W84-F87 HydrophobicContact CE3-CD1 3.81Å; W84-F87 HydrophobicContact CE3-CD2 4.28Å; W84-F87 AromaticContact CE3-CG 3.63Å; W84-F87 HydrophobicContact CE3-CG 3.63Å; W84-F87 HydrophobicContact CZ3-CB 3.69Å; W84-F87 HydrophobicContact CZ3-CD2 4.42Å; W84-F87 HydrophobicContact CZ3-CG 4.06Å; W84-R148 HydrophobicContact CD2-CB 4.14Å; W84-R148 HydrophobicContact CD2-CG 4.32Å; W84-R148 HydrophobicContact CE3-CB 3.99Å; W84-R148 HydrophobicContact CH2-CB 3.83Å; W84-R148 HydrophobicContact CH2-CG 4.49Å; W84-R148 HydrophobicContact CZ2-CB 4.01Å; W84-R148 HydrophobicContact CZ2-CG 4.16Å; W84-R148 HydrophobicContact CZ3-CB 3.83Å; W84-I150 HydrophobicContact CH2-CG1 4.47Å; W84-I150 HydrophobicContact CZ3-CD1 4.23Å; W84-I150 HydrophobicContact CZ3-CG1 3.75Å; W84-H176 AromaticContact CE2-ND1 3.88Å; W84-H176 WeakPolarHBondContact CH2-O 3.47Å; W84-H176 HydrophobicContact CZ2-CB 3.92Å; W84-H176 AromaticContact CZ2-CG 3.67Å; W84-H176 AromaticContact CZ2-ND1 3.51Å; W84-H176 AromaticContact NE1-ND1 3.63Å; W84-I178 HydrophobicContact CD2-CD1 4.46Å; W84-I178 HydrophobicContact CE3-CD1 4.22Å; W84-I178 HydrophobicContact CH2-CD1 3.46Å; W84-I178 VanDerWaalsContact CH2-CD1 3.46Å; W84-I178 HydrophobicContact CH2-CG1 3.71Å; W84-I178 HydrophobicContact CZ2-CD1 3.69Å; W84-I178 HydrophobicContact CZ2-CG1 4Å; W84-I178 HydrophobicContact CZ3-CD1 3.75Å; W84-I178 HydrophobicContact CZ3-CG1 4.39Å
85	Q	84.4	Confident	89.4	Confident	125 Å²	125	36.8 Å²	36.8	58%	0.584	18%	0.183	S	C	*	.			trans	-106.7	-24.5	177.3	-66.2	-60.3	-50.9	0	0	113.6	A83 M112 D113	A83-Q85 PolarHBondContact O-N 2.69Å; Q85-M112 WeakPolarHBondContact O-CA 3.43Å; Q85-D113 PolarHBondContact O-N 2.68Å
86	K	89.2	Confident	89.2	Confident	95 Å²	95	38.9 Å²	38.9	41%	0.413	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	131	179.9	-175.2	177.6	-176.7	-161.2	0	110	D113	K86-D113 VanDerWaalsContact CA-O 3.26Å; K86-D113 WeakPolarHBondContact CA-O 3.4Å; K86-D113 HydrophobicContact CB-CB 4.27Å; K86-D113 WeakPolarHBondContact CD-OD2 3.48Å; K86-D113 WeakPolarHBondContact CE-OD2 3.33Å; K86-D113 HydrophobicContact CG-CB 4Å
87	F	92.4	Very high	88.8	Confident	3 Å²	3	41 Å²	41	1%	0.013	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	169.6	-179.6	56.4	-88.2	0	0	0	112.8	V79 W84 I89 F103 V107 M112 D113 V114 A115 R148 I150	V79-F87 HydrophobicContact CG1-CD1 4.37Å; V79-F87 HydrophobicContact CG1-CE1 3.57Å; V79-F87 HydrophobicContact CG1-CZ 3.85Å; V79-F87 HydrophobicContact CG2-CZ 4.44Å; W84-F87 HydrophobicContact CB-CD1 4.13Å; W84-F87 HydrophobicContact CE3-CB 3.5Å; W84-F87 AromaticContact CE3-CD1 3.81Å; W84-F87 HydrophobicContact CE3-CD1 3.81Å; W84-F87 HydrophobicContact CE3-CD2 4.28Å; W84-F87 AromaticContact CE3-CG 3.63Å; W84-F87 HydrophobicContact CE3-CG 3.63Å; W84-F87 HydrophobicContact CZ3-CB 3.69Å; W84-F87 HydrophobicContact CZ3-CD2 4.42Å; W84-F87 HydrophobicContact CZ3-CG 4.06Å; F87-I89 HydrophobicContact CD2-CG1 4.18Å; F87-I89 HydrophobicContact CE2-CD1 4.22Å; F87-I89 HydrophobicContact CE2-CG1 4.06Å; F87-F103 HydrophobicContact CE2-CE1 4.16Å; F87-F103 HydrophobicContact CE2-CZ 4.16Å; F87-F103 HydrophobicContact CZ-CE1 4.22Å; F87-F103 AromaticContact CZ-CZ 3.95Å; F87-F103 HydrophobicContact CZ-CZ 3.95Å; F87-V107 HydrophobicContact CZ-CG1 4.38Å; F87-M112 HydrophobicContact CE1-CB 4.49Å; F87-M112 HydrophobicContact CE1-SD 3.97Å; F87-D113 PolarHBondContact N-O 3.32Å; F87-D113 VanDerWaalsContact N-O 3.09Å; F87-V114 HydrophobicContact CD1-CG2 4.12Å; F87-V114 HydrophobicContact CD2-CG1 4.27Å; F87-V114 HydrophobicContact CD2-CG2 4.04Å; F87-V114 HydrophobicContact CE1-CG2 3.63Å; F87-V114 HydrophobicContact CE2-CB 4.41Å; F87-V114 HydrophobicContact CE2-CG1 3.95Å; F87-V114 HydrophobicContact CE2-CG2 3.54Å; F87-V114 HydrophobicContact CG-CG2 4.32Å; F87-V114 HydrophobicContact CZ-CG2 3.32Å; F87-V114 WeakPolarHBondContact O-CA 3.47Å; F87-A115 PolarHBondContact O-N 2.62Å; F87-A115 VanDerWaalsContact O-N 3.08Å; F87-R148 WeakPolarHBondContact CA-O 3.46Å; F87-R148 HydrophobicContact CB-CB 3.86Å; F87-R148 VanDerWaalsContact CB-O 3.28Å; F87-R148 WeakPolarHBondContact CB-O 3.47Å; F87-I150 HydrophobicContact CD2-CD1 3.67Å; F87-I150 HydrophobicContact CD2-CG1 4.03Å; F87-I150 HydrophobicContact CE2-CD1 3.52Å; F87-I150 HydrophobicContact CE2-CG1 4.36Å; F87-I150 HydrophobicContact CZ-CD1 4.37Å
88	I	94.1	Very high	88.5	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.1	175.8	-174.5	160.7	0	0	0	110.9	F90 A115 Q117 Y142 R148 A149 I150	I88-F90 HydrophobicContact CB-CE2 4.36Å; I88-F90 HydrophobicContact CD1-CE1 4.21Å; I88-F90 HydrophobicContact CD1-CE2 4.01Å; I88-F90 HydrophobicContact CD1-CZ 3.65Å; I88-F90 HydrophobicContact CG1-CD2 4.37Å; I88-F90 HydrophobicContact CG1-CE2 3.92Å; I88-F90 HydrophobicContact CG1-CZ 4.05Å; I88-F90 HydrophobicContact CG2-CD2 4.24Å; I88-F90 HydrophobicContact CG2-CE2 3.54Å; I88-F90 HydrophobicContact CG2-CZ 4.22Å; I88-A115 CarbonylContact C-O 3.56Å; I88-A115 WeakPolarHBondContact CA-O 3.48Å; I88-A115 HydrophobicContact CB-CB 4.15Å; I88-A115 HydrophobicContact CD1-CB 4.11Å; I88-A115 HydrophobicContact CG1-CB 3.9Å; I88-Q117 HydrophobicContact CD1-CB 4.03Å; I88-Q117 HydrophobicContact CG1-CB 4.36Å; I88-Y142 HydrophobicContact CD1-CE2 4.09Å; I88-R148 PolarHBondContact N-O 3.15Å; I88-A149 HydrophobicContact CG2-CB 3.94Å; I88-A149 CarbonylContact O-C 3.46Å; I88-A149 WeakPolarHBondContact O-CA 3.45Å; I88-I150 PolarHBondContact O-N 3.45Å
89	I	94.9	Very high	88.1	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.015	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.1	172.6	-46.7	179.2	0	0	0	109	F87 I100 F103 L104 V114 A115 L116 Q117 I150 V152	F87-I89 HydrophobicContact CD2-CG1 4.18Å; F87-I89 HydrophobicContact CE2-CD1 4.22Å; F87-I89 HydrophobicContact CE2-CG1 4.06Å; I89-I100 HydrophobicContact CD1-CD1 4.34Å; I89-F103 HydrophobicContact CD1-CD1 4.2Å; I89-F103 HydrophobicContact CD1-CE1 3.75Å; I89-L104 HydrophobicContact CD1-CD2 4.27Å; I89-V114 HydrophobicContact CD1-CG1 3.8Å; I89-V114 HydrophobicContact CG1-CG1 3.86Å; I89-A115 PolarHBondContact N-O 2.65Å; I89-L116 HydrophobicContact CB-CD2 3.93Å; I89-L116 HydrophobicContact CD1-CD2 3.89Å; I89-L116 HydrophobicContact CG1-CD2 4.19Å; I89-Q117 PolarHBondContact O-N 3.13Å; I89-I150 WeakPolarHBondContact CA-O 3.34Å; I89-I150 HydrophobicContact CG1-CB 4.34Å; I89-I150 HydrophobicContact CG1-CD1 4.49Å; I89-I150 HydrophobicContact CG2-CB 4.31Å; I89-V152 HydrophobicContact CG2-CG2 3.77Å
90	F	94.4	Very high	87.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.9	170.1	-67.3	-84.5	0	0	0	110.1	I88 Q117 V119 L146 A149 I150 L151 V152 M153 F161	I88-F90 HydrophobicContact CB-CE2 4.36Å; I88-F90 HydrophobicContact CD1-CE1 4.21Å; I88-F90 HydrophobicContact CD1-CE2 4.01Å; I88-F90 HydrophobicContact CD1-CZ 3.65Å; I88-F90 HydrophobicContact CG1-CD2 4.37Å; I88-F90 HydrophobicContact CG1-CE2 3.92Å; I88-F90 HydrophobicContact CG1-CZ 4.05Å; I88-F90 HydrophobicContact CG2-CD2 4.24Å; I88-F90 HydrophobicContact CG2-CE2 3.54Å; I88-F90 HydrophobicContact CG2-CZ 4.22Å; F90-Q117 VanDerWaalsContact CA-O 3.32Å; F90-Q117 WeakPolarHBondContact CA-O 3.24Å; F90-Q117 HydrophobicContact CD1-CB 3.79Å; F90-Q117 HydrophobicContact CD1-CG 3.78Å; F90-Q117 HydrophobicContact CE1-CB 3.76Å; F90-Q117 HydrophobicContact CE1-CG 3.54Å; F90-V119 HydrophobicContact CB-CG2 3.95Å; F90-V119 HydrophobicContact CD1-CG2 3.92Å; F90-V119 HydrophobicContact CG-CG2 4.38Å; F90-L146 HydrophobicContact CE2-CD2 3.82Å; F90-L146 HydrophobicContact CZ-CD2 3.55Å; F90-A149 HydrophobicContact CD2-CB 4.29Å; F90-A149 HydrophobicContact CE2-CB 4.17Å; F90-I150 PolarHBondContact N-O 3.22Å; F90-L151 HydrophobicContact CB-CD2 3.73Å; F90-L151 HydrophobicContact CD2-CD2 3.75Å; F90-L151 HydrophobicContact CG-CD2 4.08Å; F90-V152 PolarHBondContact O-N 3Å; F90-M153 HydrophobicContact CB-CE 3.56Å; F90-F161 HydrophobicContact CD1-CE1 4.24Å; F90-F161 HydrophobicContact CD1-CE2 4.14Å; F90-F161 AromaticContact CD1-CZ 3.61Å; F90-F161 HydrophobicContact CD1-CZ 3.61Å; F90-F161 HydrophobicContact CD2-CE1 4.05Å; F90-F161 HydrophobicContact CD2-CZ 4.1Å; F90-F161 HydrophobicContact CE1-CE1 4.38Å; F90-F161 HydrophobicContact CE1-CE2 4.13Å; F90-F161 AromaticContact CE1-CZ 3.5Å; F90-F161 HydrophobicContact CE1-CZ 3.5Å; F90-F161 HydrophobicContact CE2-CE1 4.18Å; F90-F161 HydrophobicContact CE2-CZ 4.01Å; F90-F161 HydrophobicContact CG-CE1 4.07Å; F90-F161 AromaticContact CG-CZ 3.91Å; F90-F161 HydrophobicContact CG-CZ 3.91Å; F90-F161 HydrophobicContact CZ-CE1 4.36Å; F90-F161 AromaticContact CZ-CZ 3.72Å; F90-F161 HydrophobicContact CZ-CZ 3.72Å
91	Y	92.6	Very high	87.9	Confident	38 Å²	38	48.4 Å²	48.4	15%	0.149	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.2	177.5	64.2	-83.3	0	0	0	112.2	I97 L116 Q117 K118 V119 V152	Y91-I97 HydrophobicContact CE1-CD1 4.06Å; Y91-I97 HydrophobicContact CE2-CD1 4.28Å; Y91-L116 HydrophobicContact CE1-CB 4.48Å; Y91-Q117 WeakPolarHBondContact CD1-O 3.26Å; Y91-Q117 PolarHBondContact N-O 3.32Å; Y91-Q117 VanDerWaalsContact N-O 3.14Å; Y91-K118 HydrophobicContact CE1-CB 4.23Å; Y91-K118 HydrophobicContact CE2-CB 3.95Å; Y91-K118 HydrophobicContact CE2-CD 4.24Å; Y91-K118 HydrophobicContact CE2-CG 4.12Å; Y91-V119 PolarHBondContact O-N 3.35Å; Y91-V152 WeakPolarHBondContact CA-O 3.36Å
92	D	89.6	Confident	87.9	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.064	25%	0.245	C	C	.	.			trans	-69.3	162.3	-178.9	-141.5	-38.7	0	0	0	112.3	T45 E94 Y95 V152 M153 N154 T157	T45-D92 HydrophobicContact CG2-CB 3.91Å; D92-E94 VanDerWaalsContact C-N 3.26Å; D92-E94 PolarHBondContact O-N 3.01Å; D92-Y95 PolarHBondContact O-N 3.08Å; D92-V152 PolarHBondContact N-O 3.02Å; D92-M153 HydrophobicContact CB-CB 3.66Å; D92-N154 PolarHBondContact OD2-N 3.44Å; D92-T157 VanDerWaalsContact OD2-CB 3.28Å; D92-T157 WeakPolarHBondContact OD2-CB 3.27Å; D92-T157 PolarHBondContact OD2-OG1 2.88Å
93	S	85.7	Confident	88.1	Confident	26 Å²	26	48.8 Å²	48.8	18%	0.182	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-29	-178.6	67	0	0	0	0	113.6	K118 N121	S93-K118 PolarHBondContact O-NZ 2.79Å; S93-N121 VanDerWaalsContact CB-OD1 3.24Å; S93-N121 WeakPolarHBondContact CB-OD1 3.46Å; S93-N121 PolarHBondContact OG-OD1 3.48Å
94	E	84.8	Confident	88.4	Confident	112 Å²	112	47.6 Å²	47.6	52%	0.523	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.1	176.6	-63.8	-65.6	136	0	0	114.1	T45 D92	T45-E94 HydrophobicContact CG2-CB 4.05Å; D92-E94 VanDerWaalsContact C-N 3.26Å; D92-E94 PolarHBondContact O-N 3.01Å
95	Y	87.8	Confident	88.6	Confident	15 Å²	15	51.4 Å²	51.4	6%	0.059	24%	0.244	C	C	.	.			trans	-85.4	126.4	-178.5	-175.6	-101.8	0	0	0	112.6	P46 D92 I97 I100 V152	P46-Y95 HydrophobicContact CB-CE2 4.17Å; P46-Y95 WeakPolarHBondContact O-CD2 3.13Å; P46-Y95 VanDerWaalsContact O-CE2 3.25Å; P46-Y95 WeakPolarHBondContact O-CE2 3.46Å; D92-Y95 PolarHBondContact O-N 3.08Å; Y95-I97 PolarHBondContact O-N 2.99Å; Y95-I97 VanDerWaalsContact O-N 3.13Å; Y95-I100 HydrophobicContact CE1-CG2 4.2Å; Y95-V152 HydrophobicContact CD1-CG1 4.11Å; Y95-V152 HydrophobicContact CD2-CG1 4.03Å; Y95-V152 HydrophobicContact CE1-CG1 3.84Å; Y95-V152 HydrophobicContact CE2-CG1 3.75Å; Y95-V152 HydrophobicContact CG-CG1 4.21Å
96	D	85.9	Confident	88.9	Confident	48 Å²	48	47.9 Å²	47.9	26%	0.257	23%	0.226	S	C	.	.			trans	-77.7	97.4	174.6	178.9	6.5	0	0	0	110.9	S48 R98 G99	S48-D96 PolarHBondContact OG-OD2 3.35Å; D96-R98 PolarHBondContact O-N 3.19Å; D96-R98 WeakPolarHBondContact OD1-CB 3.42Å; D96-R98 WeakPolarHBondContact OD1-CG 3.43Å; D96-R98 IonicContact OD1-CZ 3.73Å; D96-R98 PolarHBondContact OD1-N 2.04Å; D96-R98 IonicContact OD1-NE 3.67Å; D96-R98 PolarHBondContact OD1-NE 3.03Å; D96-R98 IonicContact OD1-NH2 2.75Å; D96-R98 IonicContact OD2-CZ 3.23Å; D96-R98 IonicContact OD2-NE 3.7Å; D96-R98 PolarHBondContact OD2-NE 3.13Å; D96-R98 IonicContact OD2-NH2 2.86Å; D96-R98 PolarHBondContact OD2-NH2 3Å; D96-G99 PolarHBondContact O-N 3.16Å
97	I	84	Confident	89	Confident	66 Å²	66	43.5 Å²	43.5	34%	0.338	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-51.4	-21.5	-177.9	-162.9	171.9	0	0	0	114.6	Y91 Y95 G99 I100 L116	Y91-I97 HydrophobicContact CE1-CD1 4.06Å; Y91-I97 HydrophobicContact CE2-CD1 4.28Å; Y95-I97 PolarHBondContact O-N 2.99Å; Y95-I97 VanDerWaalsContact O-N 3.13Å; I97-G99 PolarHBondContact O-N 3.44Å; I97-G99 VanDerWaalsContact O-N 3.16Å; I97-I100 HydrophobicContact CG1-CD1 4.19Å; I97-I100 HydrophobicContact CG1-CG1 4.11Å; I97-I100 WeakPolarHBondContact O-CG1 3.07Å; I97-I100 PolarHBondContact O-N 3.4Å; I97-I100 VanDerWaalsContact O-N 3.08Å; I97-L116 HydrophobicContact CD1-CD1 4.4Å
98	R	83.4	Confident	88.9	Confident	174 Å²	174	47.7 Å²	47.7	66%	0.657	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-60.5	-24.2	173.7	-61.8	176.7	-63.9	172.6	5.4	112.2	D96 I100 Q101	D96-R98 PolarHBondContact O-N 3.19Å; D96-R98 WeakPolarHBondContact OD1-CB 3.42Å; D96-R98 WeakPolarHBondContact OD1-CG 3.43Å; D96-R98 IonicContact OD1-CZ 3.73Å; D96-R98 PolarHBondContact OD1-N 2.04Å; D96-R98 IonicContact OD1-NE 3.67Å; D96-R98 PolarHBondContact OD1-NE 3.03Å; D96-R98 IonicContact OD1-NH2 2.75Å; D96-R98 IonicContact OD2-CZ 3.23Å; D96-R98 IonicContact OD2-NE 3.7Å; D96-R98 PolarHBondContact OD2-NE 3.13Å; D96-R98 IonicContact OD2-NH2 2.86Å; D96-R98 PolarHBondContact OD2-NH2 3Å; R98-I100 PolarHBondContact O-N 2.88Å; R98-Q101 WeakPolarHBondContact O-CB 3.33Å; R98-Q101 PolarHBondContact O-N 3.18Å; R98-Q101 VanDerWaalsContact O-N 3.16Å
99	G	82	Confident	88.8	Confident	15 Å²	15	55.2 Å²	55.2	16%	0.155	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-61.9	-18.6	174.1	0	0	0	0	0	115.3	D96 I97	D96-G99 PolarHBondContact O-N 3.16Å; I97-G99 PolarHBondContact O-N 3.44Å; I97-G99 VanDerWaalsContact O-N 3.16Å
100	I	87.6	Confident	88.5	Confident	3 Å²	3	60 Å²	60	2%	0.015	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-110.5	7	174.4	61.6	166.7	0	0	0	113.8	I89 Y95 I97 R98 E102 F103 L104 L116	I89-I100 HydrophobicContact CD1-CD1 4.34Å; Y95-I100 HydrophobicContact CE1-CG2 4.2Å; I97-I100 HydrophobicContact CG1-CD1 4.19Å; I97-I100 HydrophobicContact CG1-CG1 4.11Å; I97-I100 WeakPolarHBondContact O-CG1 3.07Å; I97-I100 PolarHBondContact O-N 3.4Å; I97-I100 VanDerWaalsContact O-N 3.08Å; R98-I100 PolarHBondContact O-N 2.88Å; I100-E102 PolarHBondContact O-N 2.94Å; I100-F103 HydrophobicContact CB-CB 4.44Å; I100-F103 WeakPolarHBondContact O-CB 3.44Å; I100-F103 PolarHBondContact O-N 2.9Å; I100-L104 HydrophobicContact CD1-CD1 4.04Å; I100-L104 HydrophobicContact CG1-CD1 4.1Å; I100-L104 WeakPolarHBondContact O-CG 3.37Å; I100-L104 PolarHBondContact O-N 2.99Å; I100-L116 HydrophobicContact CD1-CD2 3.99Å
101	Q	87.9	Confident	88.2	Confident	116 Å²	116	63 Å²	63	54%	0.542	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-50.9	-178.2	-175.3	-179.6	-24.9	0	0	111.8	R98 F103 L104 D105	R98-Q101 WeakPolarHBondContact O-CB 3.33Å; R98-Q101 PolarHBondContact O-N 3.18Å; R98-Q101 VanDerWaalsContact O-N 3.16Å; Q101-F103 PolarHBondContact O-N 2.94Å; Q101-L104 PolarHBondContact O-N 3.25Å; Q101-L104 VanDerWaalsContact O-N 3.08Å; Q101-D105 PolarHBondContact O-N 2.98Å
102	E	86.7	Confident	88.1	Confident	100 Å²	100	62 Å²	62	47%	0.467	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-30.6	178.8	-170.6	-178	155.4	0	0	112.6	H72 I100 K106	H72-E102 IonicContact NE2-OE1 2.71Å; I100-E102 PolarHBondContact O-N 2.94Å; E102-K106 HydrophobicContact CG-CD 4.24Å; E102-K106 WeakPolarHBondContact O-CB 3.42Å; E102-K106 VanDerWaalsContact O-CG 3.27Å; E102-K106 WeakPolarHBondContact O-CG 3.4Å; E102-K106 PolarHBondContact O-N 3.3Å; E102-K106 WeakPolarHBondContact OE1-CE 3.31Å; E102-K106 IonicContact OE1-NZ 2.69Å; E102-K106 PolarHBondContact OE1-NZ 3.35Å
103	F	90.3	Very high	88.1	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-50.5	171.5	174.3	-102.4	0	0	0	110.7	H72 I75 L76 F87 I89 I100 Q101 D105 K106 V107	H72-F103 HydrophobicContact CB-CB 3.85Å; H72-F103 WeakPolarHBondContact O-CD2 3.34Å; I75-F103 HydrophobicContact CB-CD2 4.2Å; I75-F103 HydrophobicContact CB-CE2 3.82Å; I75-F103 HydrophobicContact CB-CZ 4.36Å; I75-F103 HydrophobicContact CG2-CD2 4.21Å; I75-F103 HydrophobicContact CG2-CE1 4.34Å; I75-F103 HydrophobicContact CG2-CE2 3.42Å; I75-F103 VanDerWaalsContact CG2-CE2 3.42Å; I75-F103 HydrophobicContact CG2-CZ 3.49Å; I75-F103 VanDerWaalsContact CG2-CZ 3.49Å; L76-F103 HydrophobicContact CB-CD2 4.1Å; L76-F103 HydrophobicContact CB-CE2 4.02Å; L76-F103 HydrophobicContact CD1-CE2 4.28Å; F87-F103 HydrophobicContact CE2-CE1 4.16Å; F87-F103 HydrophobicContact CE2-CZ 4.16Å; F87-F103 HydrophobicContact CZ-CE1 4.22Å; F87-F103 AromaticContact CZ-CZ 3.95Å; F87-F103 HydrophobicContact CZ-CZ 3.95Å; I89-F103 HydrophobicContact CD1-CD1 4.2Å; I89-F103 HydrophobicContact CD1-CE1 3.75Å; I100-F103 HydrophobicContact CB-CB 4.44Å; I100-F103 WeakPolarHBondContact O-CB 3.44Å; I100-F103 PolarHBondContact O-N 2.9Å; Q101-F103 PolarHBondContact O-N 2.94Å; F103-D105 VanDerWaalsContact C-N 3.33Å; F103-D105 PolarHBondContact O-N 3.48Å; F103-K106 PolarHBondContact O-N 2.93Å; F103-V107 HydrophobicContact CD1-CG2 4.11Å; F103-V107 HydrophobicContact CD2-CG2 4Å; F103-V107 HydrophobicContact CE1-CG2 3.76Å; F103-V107 HydrophobicContact CE2-CG2 3.64Å; F103-V107 HydrophobicContact CG-CG2 4.23Å; F103-V107 HydrophobicContact CZ-CG2 3.52Å; F103-V107 VanDerWaalsContact O-CB 3.26Å; F103-V107 WeakPolarHBondContact O-CB 3.47Å; F103-V107 WeakPolarHBondContact O-CG2 3.34Å; F103-V107 PolarHBondContact O-N 3.03Å
104	L	91.4	Very high	88.4	Confident	43 Å²	43	66.2 Å²	66.2	23%	0.225	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-38	-179.7	-65.4	166.7	0	0	0	112.1	I89 I100 Q101 V107 S108 V114 L116	I89-L104 HydrophobicContact CD1-CD2 4.27Å; I100-L104 HydrophobicContact CD1-CD1 4.04Å; I100-L104 HydrophobicContact CG1-CD1 4.1Å; I100-L104 WeakPolarHBondContact O-CG 3.37Å; I100-L104 PolarHBondContact O-N 2.99Å; Q101-L104 PolarHBondContact O-N 3.25Å; Q101-L104 VanDerWaalsContact O-N 3.08Å; L104-V107 PolarHBondContact O-N 3.16Å; L104-S108 VanDerWaalsContact O-CB 3.23Å; L104-S108 WeakPolarHBondContact O-CB 3.47Å; L104-S108 PolarHBondContact O-N 3.18Å; L104-V114 HydrophobicContact CD2-CG1 4.01Å; L104-L116 HydrophobicContact CD1-CD1 3.8Å; L104-L116 HydrophobicContact CD1-CD2 4.31Å; L104-L116 HydrophobicContact CD2-CD2 4.08Å
105	D	90.9	Very high	88.7	Confident	82 Å²	82	62.9 Å²	62.9	44%	0.439	34%	0.336	S	S	.	.	H	α-helix	trans	-63.5	-46.8	174.6	-69.9	-34.5	0	0	0	111.6	Q101 F103 Q109	Q101-D105 PolarHBondContact O-N 2.98Å; F103-D105 VanDerWaalsContact C-N 3.33Å; F103-D105 PolarHBondContact O-N 3.48Å; D105-Q109 VanDerWaalsContact O-CG 3.26Å; D105-Q109 WeakPolarHBondContact O-CG 3.17Å; D105-Q109 PolarHBondContact O-N 3.3Å; D105-Q109 PolarHBondContact O-NE2 3.42Å
106	K	91.2	Very high	88.9	Confident	50 Å²	50	65.6 Å²	65.6	22%	0.217	35%	0.351	C	S	.	.	H	α-helix	trans	-63.1	-38.8	175.4	-74.2	168.1	175.1	167.5	0	112.1	D73 L76 E102 F103 Q110	D73-K106 IonicContact OD1-NZ 3.07Å; D73-K106 PolarHBondContact OD1-NZ 3.06Å; L76-K106 HydrophobicContact CD2-CB 3.86Å; L76-K106 HydrophobicContact CD2-CD 3.8Å; L76-K106 HydrophobicContact CD2-CG 4.32Å; E102-K106 HydrophobicContact CG-CD 4.24Å; E102-K106 WeakPolarHBondContact O-CB 3.42Å; E102-K106 VanDerWaalsContact O-CG 3.27Å; E102-K106 WeakPolarHBondContact O-CG 3.4Å; E102-K106 PolarHBondContact O-N 3.3Å; E102-K106 WeakPolarHBondContact OE1-CE 3.31Å; E102-K106 IonicContact OE1-NZ 2.69Å; E102-K106 PolarHBondContact OE1-NZ 3.35Å; F103-K106 PolarHBondContact O-N 2.93Å; K106-Q110 WeakPolarHBondContact O-CG 3.29Å; K106-Q110 PolarHBondContact O-N 3.49Å
107	V	91.6	Very high	89.2	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.018	35%	0.354	C	S	.	.	H	α-helix	trans	-70.8	-42.8	-179.5	162.6	0	0	0	0	112	L76 F87 F103 L104 Q109 Q110 G111 M112 V114	L76-V107 HydrophobicContact CD1-CG2 3.9Å; F87-V107 HydrophobicContact CZ-CG1 4.38Å; F103-V107 HydrophobicContact CD1-CG2 4.11Å; F103-V107 HydrophobicContact CD2-CG2 4Å; F103-V107 HydrophobicContact CE1-CG2 3.76Å; F103-V107 HydrophobicContact CE2-CG2 3.64Å; F103-V107 HydrophobicContact CG-CG2 4.23Å; F103-V107 HydrophobicContact CZ-CG2 3.52Å; F103-V107 VanDerWaalsContact O-CB 3.26Å; F103-V107 WeakPolarHBondContact O-CB 3.47Å; F103-V107 WeakPolarHBondContact O-CG2 3.34Å; F103-V107 PolarHBondContact O-N 3.03Å; L104-V107 PolarHBondContact O-N 3.16Å; V107-Q109 VanDerWaalsContact C-N 3.34Å; V107-Q109 PolarHBondContact O-N 3.09Å; V107-Q110 CarbonylContact O-C 3.47Å; V107-Q110 WeakPolarHBondContact O-CA 3.39Å; V107-Q110 PolarHBondContact O-N 2.77Å; V107-G111 PolarHBondContact O-N 3.24Å; V107-M112 HydrophobicContact CB-CE 4.16Å; V107-M112 HydrophobicContact CG1-CB 3.72Å; V107-M112 HydrophobicContact CG1-CE 4.08Å; V107-M112 HydrophobicContact CG1-SD 4.45Å; V107-M112 HydrophobicContact CG2-CE 3.94Å; V107-M112 PolarHBondContact O-N 3.25Å; V107-V114 HydrophobicContact CG1-CG2 3.56Å
108	S	89.8	Confident	89.6	Confident	91 Å²	91	67.9 Å²	67.9	64%	0.636	36%	0.357	S	S	*	.	H	α-helix	trans	-61.7	-41.1	175.4	-179.1	0	0	0	0	111.6	L104 Q110 G111	L104-S108 VanDerWaalsContact O-CB 3.23Å; L104-S108 WeakPolarHBondContact O-CB 3.47Å; L104-S108 PolarHBondContact O-N 3.18Å; S108-Q110 PolarHBondContact O-N 2.98Å; S108-G111 PolarHBondContact O-N 2.89Å
109	Q	91.6	Very high	89.9	Confident	162 Å²	162	59.6 Å²	59.6	76%	0.757	33%	0.326	S	S	*	.	H	α-helix	trans	-62.1	-24.4	173.2	-71.1	167.9	41.9	0	0	113.6	D105 V107	D105-Q109 VanDerWaalsContact O-CG 3.26Å; D105-Q109 WeakPolarHBondContact O-CG 3.17Å; D105-Q109 PolarHBondContact O-N 3.3Å; D105-Q109 PolarHBondContact O-NE2 3.42Å; V107-Q109 VanDerWaalsContact C-N 3.34Å; V107-Q109 PolarHBondContact O-N 3.09Å
110	Q	90.1	Very high	90.1	Very high	104 Å²	104	63.9 Å²	63.9	49%	0.486	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-0.5	175.9	-68.5	179.4	6	0	0	113.4	K106 V107 S108 M112	K106-Q110 WeakPolarHBondContact O-CG 3.29Å; K106-Q110 PolarHBondContact O-N 3.49Å; V107-Q110 CarbonylContact O-C 3.47Å; V107-Q110 WeakPolarHBondContact O-CA 3.39Å; V107-Q110 PolarHBondContact O-N 2.77Å; S108-Q110 PolarHBondContact O-N 2.98Å; Q110-M112 HydrophobicContact CB-CE 3.66Å; Q110-M112 HydrophobicContact CG-CE 4.45Å
111	G	88.1	Confident	89.9	Confident	63 Å²	63	70.1 Å²	70.1	65%	0.649	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	14.1	173.8	0	0	0	0	0	115.9	V107 S108	V107-G111 PolarHBondContact O-N 3.24Å; S108-G111 PolarHBondContact O-N 2.89Å
112	M	90.1	Very high	89.9	Confident	18 Å²	18	68.6 Å²	68.6	9%	0.089	37%	0.371	C	S	.	.			trans	-77.9	142.8	178.2	-73.2	177.3	-87.2	0	0	112.4	L76 V79 Q85 F87 V107 Q110	L76-M112 HydrophobicContact CD1-CE 4.33Å; V79-M112 HydrophobicContact CG1-SD 3.81Å; Q85-M112 WeakPolarHBondContact O-CA 3.43Å; F87-M112 HydrophobicContact CE1-CB 4.49Å; F87-M112 HydrophobicContact CE1-SD 3.97Å; V107-M112 HydrophobicContact CB-CE 4.16Å; V107-M112 HydrophobicContact CG1-CB 3.72Å; V107-M112 HydrophobicContact CG1-CE 4.08Å; V107-M112 HydrophobicContact CG1-SD 4.45Å; V107-M112 HydrophobicContact CG2-CE 3.94Å; V107-M112 PolarHBondContact O-N 3.25Å; Q110-M112 HydrophobicContact CB-CE 3.66Å; Q110-M112 HydrophobicContact CG-CE 4.45Å
113	D	89.3	Confident	90	Very high	94 Å²	94	64.4 Å²	64.4	50%	0.503	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.1	178.1	179.3	23.3	0	0	0	110.9	Q85 K86 F87	Q85-D113 PolarHBondContact O-N 2.68Å; K86-D113 VanDerWaalsContact CA-O 3.26Å; K86-D113 WeakPolarHBondContact CA-O 3.4Å; K86-D113 HydrophobicContact CB-CB 4.27Å; K86-D113 WeakPolarHBondContact CD-OD2 3.48Å; K86-D113 WeakPolarHBondContact CE-OD2 3.33Å; K86-D113 HydrophobicContact CG-CB 4Å; F87-D113 PolarHBondContact N-O 3.32Å; F87-D113 VanDerWaalsContact N-O 3.09Å
114	V	92.1	Very high	89.9	Confident	32 Å²	32	68.4 Å²	68.4	19%	0.194	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	118.1	-172.7	178.5	0	0	0	0	112.3	F87 I89 L104 V107 L116	F87-V114 HydrophobicContact CD1-CG2 4.12Å; F87-V114 HydrophobicContact CD2-CG1 4.27Å; F87-V114 HydrophobicContact CD2-CG2 4.04Å; F87-V114 HydrophobicContact CE1-CG2 3.63Å; F87-V114 HydrophobicContact CE2-CB 4.41Å; F87-V114 HydrophobicContact CE2-CG1 3.95Å; F87-V114 HydrophobicContact CE2-CG2 3.54Å; F87-V114 HydrophobicContact CG-CG2 4.32Å; F87-V114 HydrophobicContact CZ-CG2 3.32Å; F87-V114 WeakPolarHBondContact O-CA 3.47Å; I89-V114 HydrophobicContact CD1-CG1 3.8Å; I89-V114 HydrophobicContact CG1-CG1 3.86Å; L104-V114 HydrophobicContact CD2-CG1 4.01Å; V107-V114 HydrophobicContact CG1-CG2 3.56Å; V114-L116 HydrophobicContact CG1-CD2 4.4Å
115	A	91.6	Very high	89.7	Confident	42 Å²	42	72 Å²	72	35%	0.347	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	143.4	169	0	0	0	0	0	111.2	F87 I88 I89	F87-A115 PolarHBondContact O-N 2.62Å; F87-A115 VanDerWaalsContact O-N 3.08Å; I88-A115 CarbonylContact C-O 3.56Å; I88-A115 WeakPolarHBondContact CA-O 3.48Å; I88-A115 HydrophobicContact CB-CB 4.15Å; I88-A115 HydrophobicContact CD1-CB 4.11Å; I88-A115 HydrophobicContact CG1-CB 3.9Å; I89-A115 PolarHBondContact N-O 2.65Å
116	L	92.4	Very high	89.5	Confident	72 Å²	72	69.2 Å²	69.2	38%	0.377	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125	174.5	-63.7	177.5	0	0	0	109.4	I89 Y91 I97 I100 L104 V114	I89-L116 HydrophobicContact CB-CD2 3.93Å; I89-L116 HydrophobicContact CD1-CD2 3.89Å; I89-L116 HydrophobicContact CG1-CD2 4.19Å; Y91-L116 HydrophobicContact CE1-CB 4.48Å; I97-L116 HydrophobicContact CD1-CD1 4.4Å; I100-L116 HydrophobicContact CD1-CD2 3.99Å; L104-L116 HydrophobicContact CD1-CD1 3.8Å; L104-L116 HydrophobicContact CD1-CD2 4.31Å; L104-L116 HydrophobicContact CD2-CD2 4.08Å; V114-L116 HydrophobicContact CG1-CD2 4.4Å
117	Q	91.1	Very high	89.3	Confident	70 Å²	70	67.1 Å²	67.1	33%	0.327	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	121.8	-179.9	-176.7	57.7	56.2	0	0	110.7	I88 I89 F90 Y91 M126	I88-Q117 HydrophobicContact CD1-CB 4.03Å; I88-Q117 HydrophobicContact CG1-CB 4.36Å; I89-Q117 PolarHBondContact O-N 3.13Å; F90-Q117 VanDerWaalsContact CA-O 3.32Å; F90-Q117 WeakPolarHBondContact CA-O 3.24Å; F90-Q117 HydrophobicContact CD1-CB 3.79Å; F90-Q117 HydrophobicContact CD1-CG 3.78Å; F90-Q117 HydrophobicContact CE1-CB 3.76Å; F90-Q117 HydrophobicContact CE1-CG 3.54Å; Y91-Q117 WeakPolarHBondContact CD1-O 3.26Å; Y91-Q117 PolarHBondContact N-O 3.32Å; Y91-Q117 VanDerWaalsContact N-O 3.14Å; Q117-M126 HydrophobicContact CG-CE 3.78Å
118	K	91.6	Very high	89	Confident	91 Å²	91	70.2 Å²	70.2	40%	0.396	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	136.3	168.6	-178.6	161.7	171.8	137.3	0	109.3	Y91 S93 M126	Y91-K118 HydrophobicContact CE1-CB 4.23Å; Y91-K118 HydrophobicContact CE2-CB 3.95Å; Y91-K118 HydrophobicContact CE2-CD 4.24Å; Y91-K118 HydrophobicContact CE2-CG 4.12Å; S93-K118 PolarHBondContact O-NZ 2.79Å; K118-M126 WeakPolarHBondContact O-CE 3.42Å
119	V	90.8	Very high	88.9	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-88.7	134.3	167.3	-178.1	0	0	0	0	108.8	F90 Y91 I123 M126 M153 T157 F161	F90-V119 HydrophobicContact CB-CG2 3.95Å; F90-V119 HydrophobicContact CD1-CG2 3.92Å; F90-V119 HydrophobicContact CG-CG2 4.38Å; Y91-V119 PolarHBondContact O-N 3.35Å; V119-I123 HydrophobicContact CG1-CD1 4.37Å; V119-I123 HydrophobicContact CG1-CG1 3.84Å; V119-M126 HydrophobicContact CG1-SD 4.44Å; V119-M153 HydrophobicContact CG2-CE 3.76Å; V119-T157 HydrophobicContact CG1-CG2 4.24Å; V119-F161 HydrophobicContact CG1-CD2 4.22Å; V119-F161 HydrophobicContact CG2-CD2 4.25Å; V119-F161 HydrophobicContact CG2-CE2 4.27Å
120	E	87.2	Confident	88.6	Confident	106 Å²	106	61.9 Å²	61.9	50%	0.495	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-88.9	151.3	171.8	-64.4	-162	168.2	0	0	111.5	N122 I123 M126	E120-N122 PolarHBondContact O-N 2.82Å; E120-I123 PolarHBondContact O-N 2.95Å; E120-M126 HydrophobicContact CB-CB 4.41Å
121	N	82.7	Confident	88.4	Confident	134 Å²	134	60.7 Å²	60.7	72%	0.717	33%	0.331	S	S	*	.	S	Bend	trans	-61.3	-15.5	178.7	-58	22.6	0	0	0	113.2	S93	S93-N121 VanDerWaalsContact CB-OD1 3.24Å; S93-N121 WeakPolarHBondContact CB-OD1 3.46Å; S93-N121 PolarHBondContact OG-OD1 3.48Å
122	N	87.8	Confident	88.2	Confident	83 Å²	83	64 Å²	64	44%	0.444	33%	0.334	S	S	.	.			trans	-112.1	83.7	169.3	-172.3	-25.2	0	0	0	109.4	E120 N124 K125 M126	E120-N122 PolarHBondContact O-N 2.82Å; N122-N124 PolarHBondContact O-N 3.31Å; N122-K125 HydrophobicContact CB-CB 4.18Å; N122-K125 VanDerWaalsContact CG-CB 3.48Å; N122-K125 PolarHBondContact O-N 3.25Å; N122-K125 VanDerWaalsContact OD1-CB 3.31Å; N122-K125 WeakPolarHBondContact OD1-CB 3.37Å; N122-K125 PolarHBondContact OD1-N 3.42Å; N122-M126 PolarHBondContact O-N 2.76Å
123	I	88.2	Confident	88	Confident	13 Å²	13	68 Å²	68	7%	0.067	36%	0.359	C	S	.	.	H	α-helix	trans	-59.6	-44.2	-176.5	-66.8	164.8	0	0	0	111.3	V119 E120 K125 M126 I127 T157 F161 E164	V119-I123 HydrophobicContact CG1-CD1 4.37Å; V119-I123 HydrophobicContact CG1-CG1 3.84Å; E120-I123 PolarHBondContact O-N 2.95Å; I123-K125 PolarHBondContact O-N 2.91Å; I123-M126 WeakPolarHBondContact O-CB 3.37Å; I123-M126 PolarHBondContact O-N 3.08Å; I123-I127 HydrophobicContact CG2-CD1 3.9Å; I123-I127 PolarHBondContact O-N 2.99Å; I123-T157 HydrophobicContact CD1-CG2 4.3Å; I123-F161 HydrophobicContact CD1-CB 4.12Å; I123-F161 HydrophobicContact CG2-CD2 4.1Å; I123-E164 HydrophobicContact CG2-CB 3.83Å; I123-E164 HydrophobicContact CG2-CG 4.11Å
124	N	88.1	Confident	87.8	Confident	83 Å²	83	66.9 Å²	66.9	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-56.1	-50.7	178.1	-52.7	71.2	0	0	0	110.7	N122 M126 I127 T128 E164	N122-N124 PolarHBondContact O-N 3.31Å; N124-M126 PolarHBondContact O-N 3.42Å; N124-I127 PolarHBondContact O-N 3.42Å; N124-T128 WeakPolarHBondContact O-CG2 3.4Å; N124-T128 PolarHBondContact O-N 3.27Å; N124-T128 PolarHBondContact O-OG1 3.02Å; N124-E164 WeakPolarHBondContact CA-OE1 3.43Å; N124-E164 WeakPolarHBondContact CB-OE1 3.42Å; N124-E164 VanDerWaalsContact CG-OE1 3.31Å; N124-E164 PolarHBondContact ND2-OE1 3.41Å; N124-E164 PolarHBondContact ND2-OE2 3.23Å
125	K	87.2	Confident	87.6	Confident	118 Å²	118	74.3 Å²	74.3	51%	0.513	38%	0.376	S	S	.	.	H	α-helix	trans	-63.4	-39.7	178.2	-174.6	-171.1	173.5	-162	0	112.3	N122 I123 I127 T128 T129	N122-K125 HydrophobicContact CB-CB 4.18Å; N122-K125 VanDerWaalsContact CG-CB 3.48Å; N122-K125 PolarHBondContact O-N 3.25Å; N122-K125 VanDerWaalsContact OD1-CB 3.31Å; N122-K125 WeakPolarHBondContact OD1-CB 3.37Å; N122-K125 PolarHBondContact OD1-N 3.42Å; I123-K125 PolarHBondContact O-N 2.91Å; K125-I127 VanDerWaalsContact C-N 3.28Å; K125-I127 PolarHBondContact O-N 3.17Å; K125-T128 PolarHBondContact O-OG1 3.19Å; K125-T129 WeakPolarHBondContact O-CB 3.26Å; K125-T129 PolarHBondContact O-N 3.11Å; K125-T129 PolarHBondContact O-OG1 2.7Å
126	M	87.4	Confident	87	Confident	24 Å²	24	78.5 Å²	78.5	12%	0.118	39%	0.391	C	S	.	.	H	α-helix	trans	-59.1	-42.5	175.3	173.1	-176.2	167.2	0	0	110.9	Q117 K118 V119 E120 N122 I123 N124 L130	Q117-M126 HydrophobicContact CG-CE 3.78Å; K118-M126 WeakPolarHBondContact O-CE 3.42Å; V119-M126 HydrophobicContact CG1-SD 4.44Å; E120-M126 HydrophobicContact CB-CB 4.41Å; N122-M126 PolarHBondContact O-N 2.76Å; I123-M126 WeakPolarHBondContact O-CB 3.37Å; I123-M126 PolarHBondContact O-N 3.08Å; N124-M126 PolarHBondContact O-N 3.42Å; M126-L130 PolarHBondContact O-N 2.78Å; M126-L130 VanDerWaalsContact O-N 3.09Å
127	I	87.1	Confident	86.4	Confident	6 Å²	6	81.9 Å²	81.9	3%	0.031	41%	0.405	C	S	.	.	H	α-helix	trans	-75.3	-42.4	-179.1	-75.8	168.2	0	0	0	112.2	I123 N124 K125 T129 L130 F131 E164 V165 T168 L170	I123-I127 HydrophobicContact CG2-CD1 3.9Å; I123-I127 PolarHBondContact O-N 2.99Å; N124-I127 PolarHBondContact O-N 3.42Å; K125-I127 VanDerWaalsContact C-N 3.28Å; K125-I127 PolarHBondContact O-N 3.17Å; I127-T129 VanDerWaalsContact C-N 3.34Å; I127-T129 PolarHBondContact O-N 3.13Å; I127-L130 WeakPolarHBondContact O-CB 3.35Å; I127-L130 PolarHBondContact O-N 2.8Å; I127-L130 VanDerWaalsContact O-N 3.14Å; I127-F131 HydrophobicContact CG2-CD2 3.97Å; I127-F131 HydrophobicContact CG2-CE2 3.57Å; I127-F131 WeakPolarHBondContact O-CD2 3.46Å; I127-F131 PolarHBondContact O-N 2.76Å; I127-F131 VanDerWaalsContact O-N 3.11Å; I127-E164 HydrophobicContact CB-CG 4.47Å; I127-E164 HydrophobicContact CD1-CB 3.91Å; I127-E164 HydrophobicContact CD1-CG 3.61Å; I127-V165 HydrophobicContact CD1-CG2 3.54Å; I127-T168 HydrophobicContact CG2-CG2 3.95Å; I127-L170 HydrophobicContact CD1-CD1 4.41Å; I127-L170 HydrophobicContact CG1-CD1 4.26Å; I127-L170 HydrophobicContact CG2-CD1 3.87Å
128	T	86.1	Confident	85.9	Confident	69 Å²	69	82.8 Å²	82.8	42%	0.423	41%	0.409	S	S	.	.	H	α-helix	trans	-61.6	-43.4	173.1	63.1	0	0	0	0	111.2	N124 K125 L130 F131 D132	N124-T128 WeakPolarHBondContact O-CG2 3.4Å; N124-T128 PolarHBondContact O-N 3.27Å; N124-T128 PolarHBondContact O-OG1 3.02Å; K125-T128 PolarHBondContact O-OG1 3.19Å; T128-L130 PolarHBondContact O-N 3.47Å; T128-F131 PolarHBondContact O-N 3.17Å; T128-F131 VanDerWaalsContact O-N 3.08Å; T128-D132 VanDerWaalsContact O-CG 3.26Å; T128-D132 PolarHBondContact O-N 3.39Å
129	T	86.1	Confident	85.5	Confident	60 Å²	60	79.5 Å²	79.5	37%	0.368	40%	0.396	S	S	.	.	H	α-helix	trans	-60.5	-33	175.9	-55.4	0	0	0	0	111.9	K125 I127 D132 T133	K125-T129 WeakPolarHBondContact O-CB 3.26Å; K125-T129 PolarHBondContact O-N 3.11Å; K125-T129 PolarHBondContact O-OG1 2.7Å; I127-T129 VanDerWaalsContact C-N 3.34Å; I127-T129 PolarHBondContact O-N 3.13Å; T129-D132 PolarHBondContact O-N 3.37Å; T129-T133 HydrophobicContact CG2-CG2 4.16Å; T129-T133 WeakPolarHBondContact O-CB 3.42Å; T129-T133 VanDerWaalsContact O-CG2 3.28Å; T129-T133 WeakPolarHBondContact O-CG2 3.48Å; T129-T133 PolarHBondContact O-N 2.99Å; T129-T133 VanDerWaalsContact O-N 3.1Å; T129-T133 PolarHBondContact O-OG1 3.08Å
130	L	85.3	Confident	85	Confident	18 Å²	18	83.4 Å²	83.4	9%	0.094	42%	0.417	C	S	.	.	H	α-helix	trans	-67.5	-42.1	175.1	-170.6	146.5	0	0	0	111.8	M126 I127 T128 M134 L139 Y142	M126-L130 PolarHBondContact O-N 2.78Å; M126-L130 VanDerWaalsContact O-N 3.09Å; I127-L130 WeakPolarHBondContact O-CB 3.35Å; I127-L130 PolarHBondContact O-N 2.8Å; I127-L130 VanDerWaalsContact O-N 3.14Å; T128-L130 PolarHBondContact O-N 3.47Å; L130-M134 HydrophobicContact CD1-CE 3.92Å; L130-M134 HydrophobicContact CD1-SD 4.36Å; L130-M134 HydrophobicContact CD2-CE 4.48Å; L130-M134 HydrophobicContact CD2-SD 3.87Å; L130-M134 HydrophobicContact CG-CE 3.86Å; L130-M134 HydrophobicContact CG-CG 4.38Å; L130-M134 HydrophobicContact CG-SD 3.85Å; L130-M134 WeakPolarHBondContact O-CB 3.36Å; L130-M134 WeakPolarHBondContact O-CG 3.41Å; L130-M134 PolarHBondContact O-N 3.45Å; L130-M134 VanDerWaalsContact O-N 3.12Å; L130-L139 HydrophobicContact CD2-CD1 3.62Å; L130-Y142 HydrophobicContact CD1-CD1 3.98Å; L130-Y142 HydrophobicContact CD1-CE1 3.43Å; L130-Y142 VanDerWaalsContact CD1-CE1 3.43Å; L130-Y142 HydrophobicContact CD1-CE2 4.33Å; L130-Y142 HydrophobicContact CD2-CD1 3.93Å; L130-Y142 HydrophobicContact CD2-CE1 4.05Å; L130-Y142 HydrophobicContact CG-CE1 4.42Å
131	F	85.4	Confident	84.6	Confident	79 Å²	79	86.9 Å²	86.9	35%	0.346	43%	0.425	S	S	.	.	H	α-helix	trans	-66.4	-38.4	172.4	-70.5	-66.6	0	0	0	113	I127 T128 T133 L139 T168 L170	I127-F131 HydrophobicContact CG2-CD2 3.97Å; I127-F131 HydrophobicContact CG2-CE2 3.57Å; I127-F131 WeakPolarHBondContact O-CD2 3.46Å; I127-F131 PolarHBondContact O-N 2.76Å; I127-F131 VanDerWaalsContact O-N 3.11Å; T128-F131 PolarHBondContact O-N 3.17Å; T128-F131 VanDerWaalsContact O-N 3.08Å; F131-T133 VanDerWaalsContact C-N 3.31Å; F131-T133 PolarHBondContact O-N 3.25Å; F131-L139 HydrophobicContact CD1-CD1 4.15Å; F131-L139 HydrophobicContact CD1-CD2 3.85Å; F131-L139 HydrophobicContact CE1-CD1 4.11Å; F131-L139 HydrophobicContact CE1-CD2 3.94Å; F131-T168 HydrophobicContact CE2-CG2 4.18Å; F131-L170 HydrophobicContact CE1-CD2 3.75Å; F131-L170 HydrophobicContact CE1-CG 4.41Å; F131-L170 HydrophobicContact CE2-CD1 4.37Å; F131-L170 HydrophobicContact CE2-CD2 4.38Å; F131-L170 HydrophobicContact CE2-CG 4.31Å; F131-L170 HydrophobicContact CZ-CD1 4.23Å; F131-L170 HydrophobicContact CZ-CD2 3.54Å; F131-L170 HydrophobicContact CZ-CG 3.69Å
132	D	84.8	Confident	84.7	Confident	133 Å²	133	81.9 Å²	81.9	71%	0.711	40%	0.397	S	S	*	.	H	α-helix	trans	-69.9	-25.4	-179.9	-68.3	-35.4	0	0	0	113.2	T128 T129	T128-D132 VanDerWaalsContact O-CG 3.26Å; T128-D132 PolarHBondContact O-N 3.39Å; T129-D132 PolarHBondContact O-N 3.37Å
133	T	85.6	Confident	84.4	Confident	101 Å²	101	82.9 Å²	82.9	62%	0.62	39%	0.394	S	S	*	.	H	α-helix	trans	-108.2	-27.3	-171.5	57.2	0	0	0	0	115.3	T129 F131	T129-T133 HydrophobicContact CG2-CG2 4.16Å; T129-T133 WeakPolarHBondContact O-CB 3.42Å; T129-T133 VanDerWaalsContact O-CG2 3.28Å; T129-T133 WeakPolarHBondContact O-CG2 3.48Å; T129-T133 PolarHBondContact O-N 2.99Å; T129-T133 VanDerWaalsContact O-N 3.1Å; T129-T133 PolarHBondContact O-OG1 3.08Å; F131-T133 VanDerWaalsContact C-N 3.31Å; F131-T133 PolarHBondContact O-N 3.25Å
134	M	85.8	Confident	84	Confident	70 Å²	70	85.9 Å²	85.9	35%	0.345	41%	0.41	S	S	.	.	S	Bend	trans	-91.6	143.8	-179.6	-65	-167.7	-179.8	0	0	112.6	L130 E138	L130-M134 HydrophobicContact CD1-CE 3.92Å; L130-M134 HydrophobicContact CD1-SD 4.36Å; L130-M134 HydrophobicContact CD2-CE 4.48Å; L130-M134 HydrophobicContact CD2-SD 3.87Å; L130-M134 HydrophobicContact CG-CE 3.86Å; L130-M134 HydrophobicContact CG-CG 4.38Å; L130-M134 HydrophobicContact CG-SD 3.85Å; L130-M134 WeakPolarHBondContact O-CB 3.36Å; L130-M134 WeakPolarHBondContact O-CG 3.41Å; L130-M134 PolarHBondContact O-N 3.45Å; L130-M134 VanDerWaalsContact O-N 3.12Å; M134-E138 HydrophobicContact CB-CB 4.39Å
135	R	86.8	Confident	83.8	Confident	188 Å²	188	83.2 Å²	83.2	71%	0.709	40%	0.397	S	S	*	.			trans	-74.7	156.4	169	-61	175.9	-179.3	178.3	2.7	110.6	E137 E138 L139	R135-E137 PolarHBondContact O-N 2.83Å; R135-E137 VanDerWaalsContact O-N 3.13Å; R135-E138 HydrophobicContact CB-CG 4.37Å; R135-E138 VanDerWaalsContact CB-OE2 3.31Å; R135-E138 WeakPolarHBondContact CB-OE2 3.37Å; R135-E138 WeakPolarHBondContact CG-OE2 3.22Å; R135-E138 PolarHBondContact N-OE2 3.35Å; R135-E138 WeakPolarHBondContact O-CA 3.32Å; R135-E138 WeakPolarHBondContact O-CB 3.31Å; R135-E138 PolarHBondContact O-N 3Å; R135-L139 WeakPolarHBondContact O-CB 3.46Å; R135-L139 PolarHBondContact O-N 3.46Å
136	I	80.1	Confident	83.7	Confident	130 Å²	130	77.7 Å²	77.7	67%	0.667	37%	0.373	S	S	*	.	H	α-helix	trans	-53.7	-37.8	179.7	-59.6	170.2	0	0	0	112.3	N140	I136-N140 WeakPolarHBondContact O-CB 3.19Å; I136-N140 VanDerWaalsContact O-CG 3.28Å; I136-N140 PolarHBondContact O-N 2.79Å; I136-N140 PolarHBondContact O-ND2 3.26Å
137	E	78.8	Confident	83.6	Confident	144 Å²	144	81.7 Å²	81.7	67%	0.673	39%	0.387	S	S	*	.	H	α-helix	trans	-64.7	-39.2	174.9	-65.5	176.8	-155.8	0	0	113.3	R135 R141	R135-E137 PolarHBondContact O-N 2.83Å; R135-E137 VanDerWaalsContact O-N 3.13Å; E137-R141 WeakPolarHBondContact O-CG 3.45Å; E137-R141 PolarHBondContact O-N 2.74Å
138	E	82.1	Confident	83.8	Confident	88 Å²	88	86.3 Å²	86.3	41%	0.411	40%	0.404	S	S	.	.	H	α-helix	trans	-76	-41.5	-179.4	-63.7	165.6	148.7	0	0	110	M134 R135 N140 R141 Y142	M134-E138 HydrophobicContact CB-CB 4.39Å; R135-E138 HydrophobicContact CB-CG 4.37Å; R135-E138 VanDerWaalsContact CB-OE2 3.31Å; R135-E138 WeakPolarHBondContact CB-OE2 3.37Å; R135-E138 WeakPolarHBondContact CG-OE2 3.22Å; R135-E138 PolarHBondContact N-OE2 3.35Å; R135-E138 WeakPolarHBondContact O-CA 3.32Å; R135-E138 WeakPolarHBondContact O-CB 3.31Å; R135-E138 PolarHBondContact O-N 3Å; E138-N140 VanDerWaalsContact C-N 3.35Å; E138-N140 PolarHBondContact O-N 3.13Å; E138-R141 WeakPolarHBondContact O-CB 3.43Å; E138-R141 PolarHBondContact O-N 2.83Å; E138-Y142 PolarHBondContact O-N 3.3Å
139	L	82.7	Confident	84.2	Confident	23 Å²	23	83 Å²	83	12%	0.12	38%	0.384	C	S	.	.	H	α-helix	trans	-58.3	-43.4	171.2	-178.6	65.4	0	0	0	111.5	L130 F131 R135 R141 Y142 R143 L170	L130-L139 HydrophobicContact CD2-CD1 3.62Å; F131-L139 HydrophobicContact CD1-CD1 4.15Å; F131-L139 HydrophobicContact CD1-CD2 3.85Å; F131-L139 HydrophobicContact CE1-CD1 4.11Å; F131-L139 HydrophobicContact CE1-CD2 3.94Å; R135-L139 WeakPolarHBondContact O-CB 3.46Å; R135-L139 PolarHBondContact O-N 3.46Å; L139-R141 PolarHBondContact O-N 2.92Å; L139-Y142 WeakPolarHBondContact O-CB 3.3Å; L139-Y142 PolarHBondContact O-N 2.99Å; L139-Y142 VanDerWaalsContact O-N 3.13Å; L139-R143 VanDerWaalsContact O-CG 3.28Å; L139-R143 WeakPolarHBondContact O-CG 3.43Å; L139-R143 PolarHBondContact O-N 2.84Å; L139-L170 HydrophobicContact CD1-CD2 3.87Å
140	N	78.9	Confident	84.6	Confident	82 Å²	82	80.2 Å²	80.2	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-66.2	-35.3	176.3	-77.2	-21.4	0	0	0	112.5	I136 E138 D144	I136-N140 WeakPolarHBondContact O-CB 3.19Å; I136-N140 VanDerWaalsContact O-CG 3.28Å; I136-N140 PolarHBondContact O-N 2.79Å; I136-N140 PolarHBondContact O-ND2 3.26Å; E138-N140 VanDerWaalsContact C-N 3.35Å; E138-N140 PolarHBondContact O-N 3.13Å; N140-D144 PolarHBondContact O-N 3.43Å; N140-D144 VanDerWaalsContact O-N 3.1Å
141	R	79.7	Confident	85.1	Confident	178 Å²	178	79.4 Å²	79.4	67%	0.672	36%	0.362	S	S	*	.	H	α-helix	trans	-66.7	-36.3	169.5	-68.5	174.6	-173	173.4	6.5	112.1	E137 E138 L139 D144 T145	E137-R141 WeakPolarHBondContact O-CG 3.45Å; E137-R141 PolarHBondContact O-N 2.74Å; E138-R141 WeakPolarHBondContact O-CB 3.43Å; E138-R141 PolarHBondContact O-N 2.83Å; L139-R141 PolarHBondContact O-N 2.92Å; R141-D144 WeakPolarHBondContact O-CB 3.44Å; R141-D144 PolarHBondContact O-N 3.19Å; R141-T145 PolarHBondContact O-N 3.43Å
142	Y	84.2	Confident	85.5	Confident	29 Å²	29	75.8 Å²	75.8	11%	0.114	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-46	175.9	-175.3	-111.3	0	0	0	111.4	I88 L130 E138 L139 D144 T145 L146	I88-Y142 HydrophobicContact CD1-CE2 4.09Å; L130-Y142 HydrophobicContact CD1-CD1 3.98Å; L130-Y142 HydrophobicContact CD1-CE1 3.43Å; L130-Y142 VanDerWaalsContact CD1-CE1 3.43Å; L130-Y142 HydrophobicContact CD1-CE2 4.33Å; L130-Y142 HydrophobicContact CD2-CD1 3.93Å; L130-Y142 HydrophobicContact CD2-CE1 4.05Å; L130-Y142 HydrophobicContact CG-CE1 4.42Å; E138-Y142 PolarHBondContact O-N 3.3Å; L139-Y142 WeakPolarHBondContact O-CB 3.3Å; L139-Y142 PolarHBondContact O-N 2.99Å; L139-Y142 VanDerWaalsContact O-N 3.13Å; Y142-D144 VanDerWaalsContact C-N 3.26Å; Y142-D144 PolarHBondContact O-N 2.93Å; Y142-T145 WeakPolarHBondContact CA-OG1 3.25Å; Y142-T145 CarbonylContact O-C 3.55Å; Y142-T145 WeakPolarHBondContact O-CA 3.28Å; Y142-T145 PolarHBondContact O-N 3.11Å; Y142-T145 PolarHBondContact O-OG1 3.36Å; Y142-L146 HydrophobicContact CD1-CD1 3.9Å; Y142-L146 HydrophobicContact CD1-CG 4.17Å; Y142-L146 HydrophobicContact CE1-CD1 3.68Å; Y142-L146 HydrophobicContact CE1-CD2 4.05Å; Y142-L146 HydrophobicContact CE1-CG 3.94Å; Y142-L146 WeakPolarHBondContact O-CG 3.46Å; Y142-L146 PolarHBondContact O-N 2.86Å
143	R	82.7	Confident	85.8	Confident	105 Å²	105	69.5 Å²	69.5	40%	0.396	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-37	173.3	-65.3	171.7	86.6	-166.9	9.7	112.2	L139 L146 R147 N169 L170	L139-R143 VanDerWaalsContact O-CG 3.28Å; L139-R143 WeakPolarHBondContact O-CG 3.43Å; L139-R143 PolarHBondContact O-N 2.84Å; R143-L146 PolarHBondContact O-N 3.36Å; R143-R147 PolarHBondContact O-N 3.31Å; R143-N169 PolarHBondContact NH2-O 3.36Å; R143-L170 HydrophobicContact CG-CD2 4.36Å; R143-L170 WeakPolarHBondContact CG-O 3.42Å
144	D	79.1	Confident	86.1	Confident	75 Å²	75	66.6 Å²	66.6	40%	0.401	29%	0.294	S	S	.	.	H	α-helix	trans	-65.1	-41.1	172.5	-166.1	66.1	0	0	0	112.6	N140 R141 Y142 L146 R147	N140-D144 PolarHBondContact O-N 3.43Å; N140-D144 VanDerWaalsContact O-N 3.1Å; R141-D144 WeakPolarHBondContact O-CB 3.44Å; R141-D144 PolarHBondContact O-N 3.19Å; Y142-D144 VanDerWaalsContact C-N 3.26Å; Y142-D144 PolarHBondContact O-N 2.93Å; D144-L146 VanDerWaalsContact C-N 3.34Å; D144-L146 PolarHBondContact O-N 3.09Å; D144-R147 WeakPolarHBondContact O-CB 3.29Å; D144-R147 WeakPolarHBondContact O-CG 3.36Å; D144-R147 PolarHBondContact O-N 2.97Å; D144-R147 IonicContact OD1-CZ 3.92Å; D144-R147 IonicContact OD1-NE 2.91Å; D144-R147 PolarHBondContact OD1-NE 3.24Å; D144-R147 IonicContact OD1-NH2 3.04Å; D144-R147 PolarHBondContact OD1-NH2 2.94Å
145	T	83.6	Confident	86.3	Confident	28 Å²	28	63.7 Å²	63.7	17%	0.172	28%	0.28	C	S	.	.	H	α-helix	trans	-69	-28.4	172.7	55.1	0	0	0	0	114.1	R141 Y142 R147	R141-T145 PolarHBondContact O-N 3.43Å; Y142-T145 WeakPolarHBondContact CA-OG1 3.25Å; Y142-T145 CarbonylContact O-C 3.55Å; Y142-T145 WeakPolarHBondContact O-CA 3.28Å; Y142-T145 PolarHBondContact O-N 3.11Å; Y142-T145 PolarHBondContact O-OG1 3.36Å; T145-R147 PolarHBondContact O-N 3.38Å
146	L	86.2	Confident	86.5	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-67.6	-16.2	174.8	-72.3	178.7	0	0	0	113.5	F90 Y142 R143 D144 R148 L170 V171	F90-L146 HydrophobicContact CE2-CD2 3.82Å; F90-L146 HydrophobicContact CZ-CD2 3.55Å; Y142-L146 HydrophobicContact CD1-CD1 3.9Å; Y142-L146 HydrophobicContact CD1-CG 4.17Å; Y142-L146 HydrophobicContact CE1-CD1 3.68Å; Y142-L146 HydrophobicContact CE1-CD2 4.05Å; Y142-L146 HydrophobicContact CE1-CG 3.94Å; Y142-L146 WeakPolarHBondContact O-CG 3.46Å; Y142-L146 PolarHBondContact O-N 2.86Å; R143-L146 PolarHBondContact O-N 3.36Å; D144-L146 VanDerWaalsContact C-N 3.34Å; D144-L146 PolarHBondContact O-N 3.09Å; L146-R148 PolarHBondContact O-N 3.34Å; L146-R148 VanDerWaalsContact O-N 3.1Å; L146-L170 HydrophobicContact CD1-CB 3.96Å; L146-V171 HydrophobicContact CB-CG1 4.02Å; L146-V171 HydrophobicContact CD1-CG1 4.23Å
147	R	84.6	Confident	87	Confident	108 Å²	108	52.3 Å²	52.3	41%	0.408	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-23.5	177.1	-64.4	-179.4	-161.7	-102.7	6.3	113.3	R143 D144 T145 D174 C175 H176	R143-R147 PolarHBondContact O-N 3.31Å; D144-R147 WeakPolarHBondContact O-CB 3.29Å; D144-R147 WeakPolarHBondContact O-CG 3.36Å; D144-R147 PolarHBondContact O-N 2.97Å; D144-R147 IonicContact OD1-CZ 3.92Å; D144-R147 IonicContact OD1-NE 2.91Å; D144-R147 PolarHBondContact OD1-NE 3.24Å; D144-R147 IonicContact OD1-NH2 3.04Å; D144-R147 PolarHBondContact OD1-NH2 2.94Å; T145-R147 PolarHBondContact O-N 3.38Å; R147-D174 VanDerWaalsContact CD-OD2 3.29Å; R147-D174 WeakPolarHBondContact CD-OD2 3.34Å; R147-D174 IonicContact CZ-OD2 2.82Å; R147-D174 IonicContact NE-OD2 2.74Å; R147-D174 IonicContact NH1-OD1 2.74Å; R147-D174 IonicContact NH1-OD2 3.18Å; R147-D174 PolarHBondContact NH1-OD2 2.85Å; R147-C175 CarbonylContact O-C 3.57Å; R147-C175 WeakPolarHBondContact O-CA 3.48Å; R147-H176 PolarHBondContact O-N 2.93Å
148	R	91.4	Very high	87.7	Confident	104 Å²	104	45.5 Å²	45.5	39%	0.392	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	101.8	-179.8	-65.1	-179	-168.8	-121.1	0.8	109.7	W84 F87 I88 L146	W84-R148 HydrophobicContact CD2-CB 4.14Å; W84-R148 HydrophobicContact CD2-CG 4.32Å; W84-R148 HydrophobicContact CE3-CB 3.99Å; W84-R148 HydrophobicContact CH2-CB 3.83Å; W84-R148 HydrophobicContact CH2-CG 4.49Å; W84-R148 HydrophobicContact CZ2-CB 4.01Å; W84-R148 HydrophobicContact CZ2-CG 4.16Å; W84-R148 HydrophobicContact CZ3-CB 3.83Å; F87-R148 WeakPolarHBondContact CA-O 3.46Å; F87-R148 HydrophobicContact CB-CB 3.86Å; F87-R148 VanDerWaalsContact CB-O 3.28Å; F87-R148 WeakPolarHBondContact CB-O 3.47Å; I88-R148 PolarHBondContact N-O 3.15Å; L146-R148 PolarHBondContact O-N 3.34Å; L146-R148 VanDerWaalsContact O-N 3.1Å
149	A	94.7	Very high	88.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.4	-170.2	0	0	0	0	0	112.5	I88 F90 H176 W177 I178	I88-A149 HydrophobicContact CG2-CB 3.94Å; I88-A149 CarbonylContact O-C 3.46Å; I88-A149 WeakPolarHBondContact O-CA 3.45Å; F90-A149 HydrophobicContact CD2-CB 4.29Å; F90-A149 HydrophobicContact CE2-CB 4.17Å; A149-H176 PolarHBondContact N-O 3.43Å; A149-H176 VanDerWaalsContact N-O 3.11Å; A149-W177 HydrophobicContact CB-CE3 3.7Å; A149-W177 HydrophobicContact CB-CZ3 3.66Å; A149-W177 CarbonylContact O-C 3.6Å; A149-W177 WeakPolarHBondContact O-CA 3.37Å; A149-I178 PolarHBondContact O-N 3.06Å
150	I	95.3	Very high	88.7	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	126.7	173.2	-48.4	-172.5	0	0	0	108.6	I75 V79 W84 F87 I88 I89 F90 V152 I178 I180	I75-I150 HydrophobicContact CG2-CD1 3.77Å; V79-I150 HydrophobicContact CG2-CD1 3.84Å; W84-I150 HydrophobicContact CH2-CG1 4.47Å; W84-I150 HydrophobicContact CZ3-CD1 4.23Å; W84-I150 HydrophobicContact CZ3-CG1 3.75Å; F87-I150 HydrophobicContact CD2-CD1 3.67Å; F87-I150 HydrophobicContact CD2-CG1 4.03Å; F87-I150 HydrophobicContact CE2-CD1 3.52Å; F87-I150 HydrophobicContact CE2-CG1 4.36Å; F87-I150 HydrophobicContact CZ-CD1 4.37Å; I88-I150 PolarHBondContact O-N 3.45Å; I89-I150 WeakPolarHBondContact CA-O 3.34Å; I89-I150 HydrophobicContact CG1-CB 4.34Å; I89-I150 HydrophobicContact CG1-CD1 4.49Å; I89-I150 HydrophobicContact CG2-CB 4.31Å; F90-I150 PolarHBondContact N-O 3.22Å; I150-V152 HydrophobicContact CG2-CG2 4.16Å; I150-I178 CarbonylContact C-O 3.59Å; I150-I178 VanDerWaalsContact CA-O 3.3Å; I150-I178 WeakPolarHBondContact CA-O 3.38Å; I150-I178 HydrophobicContact CG1-CB 4.32Å; I150-I178 HydrophobicContact CG1-CD1 4.49Å; I150-I178 HydrophobicContact CG2-CB 4.38Å; I150-I178 HydrophobicContact CG2-CG2 4.37Å; I150-I180 HydrophobicContact CG2-CG2 4.43Å
151	L	95	Very high	89.3	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.8	179.3	-51	-170.3	0	0	0	110.4	F90 M153 A158 F161 I162 W177 I178 I179 I180	F90-L151 HydrophobicContact CB-CD2 3.73Å; F90-L151 HydrophobicContact CD2-CD2 3.75Å; F90-L151 HydrophobicContact CG-CD2 4.08Å; L151-M153 HydrophobicContact CB-CE 4Å; L151-M153 HydrophobicContact CB-CG 4.25Å; L151-M153 HydrophobicContact CB-SD 4.28Å; L151-M153 HydrophobicContact CD2-CE 4.02Å; L151-M153 HydrophobicContact CG-CE 4.45Å; L151-A158 HydrophobicContact CD1-CB 4.21Å; L151-F161 HydrophobicContact CD1-CD1 4.32Å; L151-F161 HydrophobicContact CD2-CD1 4.12Å; L151-F161 HydrophobicContact CD2-CE1 3.99Å; L151-I162 HydrophobicContact CD1-CD1 3.76Å; L151-I162 HydrophobicContact CD1-CG1 3.89Å; L151-W177 HydrophobicContact CD1-CE3 4.12Å; L151-W177 HydrophobicContact CD1-CZ3 4.5Å; L151-W177 HydrophobicContact CD2-CE3 4.18Å; L151-W177 HydrophobicContact CD2-CZ3 4.17Å; L151-W177 HydrophobicContact CG-CE3 4.22Å; L151-I178 PolarHBondContact N-O 2.86Å; L151-I179 HydrophobicContact CB-CG1 4.22Å; L151-I179 HydrophobicContact CD1-CD1 4.33Å; L151-I179 HydrophobicContact CD1-CG1 4.09Å; L151-I179 HydrophobicContact CG-CG1 4.33Å; L151-I180 PolarHBondContact O-N 2.92Å; L151-I180 VanDerWaalsContact O-N 3.15Å
152	V	93.2	Very high	89.9	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	72.9	-178.7	-170.5	0	0	0	0	108.7	P46 I89 F90 Y91 D92 Y95 I150 I180	P46-V152 HydrophobicContact CB-CG1 4.36Å; P46-V152 HydrophobicContact CG-CG1 3.99Å; I89-V152 HydrophobicContact CG2-CG2 3.77Å; F90-V152 PolarHBondContact O-N 3Å; Y91-V152 WeakPolarHBondContact CA-O 3.36Å; D92-V152 PolarHBondContact N-O 3.02Å; Y95-V152 HydrophobicContact CD1-CG1 4.11Å; Y95-V152 HydrophobicContact CD2-CG1 4.03Å; Y95-V152 HydrophobicContact CE1-CG1 3.84Å; Y95-V152 HydrophobicContact CE2-CG1 3.75Å; Y95-V152 HydrophobicContact CG-CG1 4.21Å; I150-V152 HydrophobicContact CG2-CG2 4.16Å; V152-I180 HydrophobicContact CG2-CG2 3.98Å
153	M	91.6	Very high	90.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.163	C	C	.	.	S	Bend	trans	-153.6	174.1	-168	62.3	-173.8	66.9	0	0	113.3	F90 D92 V119 L151 T157 A158 N181	F90-M153 HydrophobicContact CB-CE 3.56Å; D92-M153 HydrophobicContact CB-CB 3.66Å; V119-M153 HydrophobicContact CG2-CE 3.76Å; L151-M153 HydrophobicContact CB-CE 4Å; L151-M153 HydrophobicContact CB-CG 4.25Å; L151-M153 HydrophobicContact CB-SD 4.28Å; L151-M153 HydrophobicContact CD2-CE 4.02Å; L151-M153 HydrophobicContact CG-CE 4.45Å; M153-T157 HydrophobicContact SD-CG2 4.02Å; M153-A158 HydrophobicContact CG-CB 3.86Å; M153-A158 VanDerWaalsContact SD-CA 3.54Å; M153-A158 HydrophobicContact SD-CB 3.91Å; M153-N181 PolarHBondContact O-ND2 2.93Å
154	N	91.3	Very high	90.6	Very high	40 Å²	40	28.8 Å²	28.8	21%	0.214	15%	0.151	C	C	.	.			trans	-63.5	140.2	172	171.6	-27.7	0	0	0	109.8	A43 T45 D92 A156 T157 A158	A43-N154 PolarHBondContact O-ND2 2.83Å; T45-N154 HydrophobicContact CG2-CB 4.24Å; D92-N154 PolarHBondContact OD2-N 3.44Å; N154-A156 PolarHBondContact O-N 3.01Å; N154-A156 VanDerWaalsContact OD1-CB 3.31Å; N154-A156 WeakPolarHBondContact OD1-CB 3.35Å; N154-A156 PolarHBondContact OD1-N 3.37Å; N154-T157 WeakPolarHBondContact O-CB 3.39Å; N154-T157 PolarHBondContact O-N 3.5Å; N154-A158 PolarHBondContact O-N 3.47Å
155	P	90.6	Very high	91.2	Very high	10 Å²	10	25.3 Å²	25.3	7%	0.065	13%	0.133	C	C	.	.	H	α-helix	trans	-54.5	-33.3	177.3	-26.6	36.1	0	0	0	114.4	A158 K159 I184 D188	P155-A158 PolarHBondContact O-N 2.77Å; P155-K159 WeakPolarHBondContact O-CB 3.48Å; P155-K159 VanDerWaalsContact O-CG 3.25Å; P155-K159 WeakPolarHBondContact O-CG 3.43Å; P155-K159 PolarHBondContact O-N 2.95Å; P155-I184 HydrophobicContact CB-CD1 4.25Å; P155-I184 HydrophobicContact CB-CG1 4.22Å; P155-I184 HydrophobicContact CG-CB 4.1Å; P155-I184 HydrophobicContact CG-CD1 4.17Å; P155-I184 HydrophobicContact CG-CG1 3.9Å; P155-D188 HydrophobicContact CB-CB 4.11Å
156	A	90.3	Very high	91.3	Very high	51 Å²	51	25.2 Å²	25.2	42%	0.421	13%	0.132	S	C	.	.	H	α-helix	trans	-63.1	-48	172.7	0	0	0	0	0	112	N154 A158 K159 S160	N154-A156 PolarHBondContact O-N 3.01Å; N154-A156 VanDerWaalsContact OD1-CB 3.31Å; N154-A156 WeakPolarHBondContact OD1-CB 3.35Å; N154-A156 PolarHBondContact OD1-N 3.37Å; A156-A158 VanDerWaalsContact C-N 3.33Å; A156-A158 PolarHBondContact O-N 3.01Å; A156-K159 PolarHBondContact O-N 3.41Å; A156-S160 PolarHBondContact O-N 2.95Å; A156-S160 VanDerWaalsContact O-N 3.08Å; A156-S160 PolarHBondContact O-OG 2.92Å
157	T	91.7	Very high	91.4	Very high	28 Å²	28	31.7 Å²	31.7	17%	0.172	16%	0.163	C	C	.	.	H	α-helix	trans	-59.9	-44.2	175	-44	0	0	0	0	110.9	D92 V119 I123 M153 N154 K159 S160 F161	D92-T157 VanDerWaalsContact OD2-CB 3.28Å; D92-T157 WeakPolarHBondContact OD2-CB 3.27Å; D92-T157 PolarHBondContact OD2-OG1 2.88Å; V119-T157 HydrophobicContact CG1-CG2 4.24Å; I123-T157 HydrophobicContact CD1-CG2 4.3Å; M153-T157 HydrophobicContact SD-CG2 4.02Å; N154-T157 WeakPolarHBondContact O-CB 3.39Å; N154-T157 PolarHBondContact O-N 3.5Å; T157-K159 PolarHBondContact O-N 3.15Å; T157-S160 PolarHBondContact O-N 3.29Å; T157-F161 VanDerWaalsContact O-CB 3.23Å; T157-F161 WeakPolarHBondContact O-CB 3.45Å; T157-F161 PolarHBondContact O-N 3.45Å
158	A	92.8	Very high	91.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-42	177.5	0	0	0	0	0	112.6	L151 M153 N154 P155 A156 F161 I162 L192	L151-A158 HydrophobicContact CD1-CB 4.21Å; M153-A158 HydrophobicContact CG-CB 3.86Å; M153-A158 VanDerWaalsContact SD-CA 3.54Å; M153-A158 HydrophobicContact SD-CB 3.91Å; N154-A158 PolarHBondContact O-N 3.47Å; P155-A158 PolarHBondContact O-N 2.77Å; A156-A158 VanDerWaalsContact C-N 3.33Å; A156-A158 PolarHBondContact O-N 3.01Å; A158-F161 PolarHBondContact O-N 3.44Å; A158-I162 WeakPolarHBondContact O-CB 3.37Å; A158-I162 WeakPolarHBondContact O-CG1 3.46Å; A158-I162 PolarHBondContact O-N 2.89Å; A158-L192 HydrophobicContact CB-CD2 4.09Å
159	K	92.7	Very high	91	Very high	30 Å²	30	28.9 Å²	28.9	13%	0.13	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-46.8	177.2	-75.7	-177.9	-57.5	-176.7	0	111.8	P155 A156 T157 T163 D188 E191 L192	P155-K159 WeakPolarHBondContact O-CB 3.48Å; P155-K159 VanDerWaalsContact O-CG 3.25Å; P155-K159 WeakPolarHBondContact O-CG 3.43Å; P155-K159 PolarHBondContact O-N 2.95Å; A156-K159 PolarHBondContact O-N 3.41Å; T157-K159 PolarHBondContact O-N 3.15Å; K159-T163 WeakPolarHBondContact O-CB 3.2Å; K159-T163 PolarHBondContact O-N 3.49Å; K159-T163 VanDerWaalsContact O-N 3.12Å; K159-T163 PolarHBondContact O-OG1 3.38Å; K159-D188 WeakPolarHBondContact CE-OD1 3.47Å; K159-D188 IonicContact NZ-OD1 3.65Å; K159-D188 PolarHBondContact NZ-OD1 2.91Å; K159-E191 HydrophobicContact CD-CB 3.9Å; K159-E191 HydrophobicContact CD-CG 3.93Å; K159-E191 VanDerWaalsContact CD-OE2 3.24Å; K159-E191 WeakPolarHBondContact CD-OE2 3.32Å; K159-E191 WeakPolarHBondContact CE-OE2 3.37Å; K159-E191 IonicContact NZ-OE2 3.46Å; K159-E191 PolarHBondContact NZ-OE2 2.88Å; K159-L192 HydrophobicContact CB-CD2 4.28Å; K159-L192 HydrophobicContact CD-CG 4.26Å; K159-L192 HydrophobicContact CG-CD1 4.5Å; K159-L192 HydrophobicContact CG-CD2 3.41Å; K159-L192 VanDerWaalsContact CG-CD2 3.41Å; K159-L192 HydrophobicContact CG-CG 3.58Å
160	S	92.4	Very high	90.4	Very high	68 Å²	68	29.1 Å²	29.1	48%	0.476	17%	0.166	S	C	.	.	H	α-helix	trans	-64.4	-43.9	176.1	-60.5	0	0	0	0	111.9	A156 T157 T163 E164	A156-S160 PolarHBondContact O-N 2.95Å; A156-S160 VanDerWaalsContact O-N 3.08Å; A156-S160 PolarHBondContact O-OG 2.92Å; T157-S160 PolarHBondContact O-N 3.29Å; S160-T163 PolarHBondContact O-N 2.98Å; S160-E164 PolarHBondContact O-N 2.86Å
161	F	93	Very high	89.7	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.009	17%	0.17	C	C	.	.	H	α-helix	trans	-61.9	-50.2	-179.8	-178.5	-102.2	0	0	0	112.4	F90 V119 I123 L151 T157 A158 T163 E164 V165 W177	F90-F161 HydrophobicContact CD1-CE1 4.24Å; F90-F161 HydrophobicContact CD1-CE2 4.14Å; F90-F161 AromaticContact CD1-CZ 3.61Å; F90-F161 HydrophobicContact CD1-CZ 3.61Å; F90-F161 HydrophobicContact CD2-CE1 4.05Å; F90-F161 HydrophobicContact CD2-CZ 4.1Å; F90-F161 HydrophobicContact CE1-CE1 4.38Å; F90-F161 HydrophobicContact CE1-CE2 4.13Å; F90-F161 AromaticContact CE1-CZ 3.5Å; F90-F161 HydrophobicContact CE1-CZ 3.5Å; F90-F161 HydrophobicContact CE2-CE1 4.18Å; F90-F161 HydrophobicContact CE2-CZ 4.01Å; F90-F161 HydrophobicContact CG-CE1 4.07Å; F90-F161 AromaticContact CG-CZ 3.91Å; F90-F161 HydrophobicContact CG-CZ 3.91Å; F90-F161 HydrophobicContact CZ-CE1 4.36Å; F90-F161 AromaticContact CZ-CZ 3.72Å; F90-F161 HydrophobicContact CZ-CZ 3.72Å; V119-F161 HydrophobicContact CG1-CD2 4.22Å; V119-F161 HydrophobicContact CG2-CD2 4.25Å; V119-F161 HydrophobicContact CG2-CE2 4.27Å; I123-F161 HydrophobicContact CD1-CB 4.12Å; I123-F161 HydrophobicContact CG2-CD2 4.1Å; L151-F161 HydrophobicContact CD1-CD1 4.32Å; L151-F161 HydrophobicContact CD2-CD1 4.12Å; L151-F161 HydrophobicContact CD2-CE1 3.99Å; T157-F161 VanDerWaalsContact O-CB 3.23Å; T157-F161 WeakPolarHBondContact O-CB 3.45Å; T157-F161 PolarHBondContact O-N 3.45Å; A158-F161 PolarHBondContact O-N 3.44Å; F161-T163 VanDerWaalsContact C-N 3.27Å; F161-T163 PolarHBondContact O-N 2.95Å; F161-E164 PolarHBondContact O-N 3.3Å; F161-V165 HydrophobicContact CD1-CG2 4.38Å; F161-V165 HydrophobicContact CD2-CG2 4.2Å; F161-V165 HydrophobicContact CE1-CG2 4.06Å; F161-V165 HydrophobicContact CE2-CG2 3.86Å; F161-V165 HydrophobicContact CG-CG2 4.44Å; F161-V165 HydrophobicContact CZ-CG2 3.78Å; F161-V165 WeakPolarHBondContact O-CB 3.47Å; F161-V165 WeakPolarHBondContact O-CG2 3.36Å; F161-V165 PolarHBondContact O-N 2.92Å; F161-W177 HydrophobicContact CE1-CZ3 4.19Å
162	I	92	Very high	88.6	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-38.7	176.9	-72.3	174	0	0	0	111	L151 A158 V166 W177 I179 L192 R195	L151-I162 HydrophobicContact CD1-CD1 3.76Å; L151-I162 HydrophobicContact CD1-CG1 3.89Å; A158-I162 WeakPolarHBondContact O-CB 3.37Å; A158-I162 WeakPolarHBondContact O-CG1 3.46Å; A158-I162 PolarHBondContact O-N 2.89Å; I162-V166 HydrophobicContact CG2-CG2 4.38Å; I162-V166 VanDerWaalsContact O-CB 3.28Å; I162-V166 WeakPolarHBondContact O-CB 3.33Å; I162-V166 VanDerWaalsContact O-CG2 3.23Å; I162-V166 WeakPolarHBondContact O-CG2 3.46Å; I162-V166 PolarHBondContact O-N 3.37Å; I162-W177 HydrophobicContact CD1-CD2 4.47Å; I162-W177 HydrophobicContact CG1-CE3 4.45Å; I162-I179 HydrophobicContact CD1-CD1 3.94Å; I162-L192 HydrophobicContact CD1-CD2 3.95Å; I162-R195 HydrophobicContact CG2-CB 4.37Å
163	T	91.1	Very high	87.4	Confident	21 Å²	21	37 Å²	37	13%	0.129	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-52.9	178.9	-53.9	0	0	0	0	111.2	K159 S160 F161 V165 V166 E167 R195	K159-T163 WeakPolarHBondContact O-CB 3.2Å; K159-T163 PolarHBondContact O-N 3.49Å; K159-T163 VanDerWaalsContact O-N 3.12Å; K159-T163 PolarHBondContact O-OG1 3.38Å; S160-T163 PolarHBondContact O-N 2.98Å; F161-T163 VanDerWaalsContact C-N 3.27Å; F161-T163 PolarHBondContact O-N 2.95Å; T163-V165 PolarHBondContact O-N 3.25Å; T163-V166 PolarHBondContact O-N 2.66Å; T163-E167 HydrophobicContact CG2-CG 4.34Å; T163-E167 VanDerWaalsContact CG2-OE1 3.23Å; T163-E167 WeakPolarHBondContact CG2-OE1 3.34Å; T163-E167 WeakPolarHBondContact O-CG 3.49Å; T163-E167 PolarHBondContact O-N 3.35Å; T163-R195 WeakPolarHBondContact OG1-CD 3.45Å; T163-R195 PolarHBondContact OG1-NH1 3.36Å
164	E	91.1	Very high	86.5	Confident	33 Å²	33	40 Å²	40	15%	0.154	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-42	-178.6	-164.5	74.9	180	0	0	111.9	I123 N124 I127 S160 F161 V166 E167 T168	I123-E164 HydrophobicContact CG2-CB 3.83Å; I123-E164 HydrophobicContact CG2-CG 4.11Å; N124-E164 WeakPolarHBondContact CA-OE1 3.43Å; N124-E164 WeakPolarHBondContact CB-OE1 3.42Å; N124-E164 VanDerWaalsContact CG-OE1 3.31Å; N124-E164 PolarHBondContact ND2-OE1 3.41Å; N124-E164 PolarHBondContact ND2-OE2 3.23Å; I127-E164 HydrophobicContact CB-CG 4.47Å; I127-E164 HydrophobicContact CD1-CB 3.91Å; I127-E164 HydrophobicContact CD1-CG 3.61Å; S160-E164 PolarHBondContact O-N 2.86Å; F161-E164 PolarHBondContact O-N 3.3Å; E164-V166 VanDerWaalsContact C-N 3.3Å; E164-V166 PolarHBondContact O-N 2.99Å; E164-E167 PolarHBondContact O-N 2.98Å; E164-T168 WeakPolarHBondContact O-CB 3.21Å; E164-T168 WeakPolarHBondContact O-CG2 3.08Å; E164-T168 PolarHBondContact O-N 3.45Å; E164-T168 PolarHBondContact O-OG1 2.91Å
165	V	90	Very high	86.2	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-68.2	-29.7	179.8	176	0	0	0	0	111.9	I127 F161 T163 L170 V171 W177	I127-V165 HydrophobicContact CD1-CG2 3.54Å; F161-V165 HydrophobicContact CD1-CG2 4.38Å; F161-V165 HydrophobicContact CD2-CG2 4.2Å; F161-V165 HydrophobicContact CE1-CG2 4.06Å; F161-V165 HydrophobicContact CE2-CG2 3.86Å; F161-V165 HydrophobicContact CG-CG2 4.44Å; F161-V165 HydrophobicContact CZ-CG2 3.78Å; F161-V165 WeakPolarHBondContact O-CB 3.47Å; F161-V165 WeakPolarHBondContact O-CG2 3.36Å; F161-V165 PolarHBondContact O-N 2.92Å; T163-V165 PolarHBondContact O-N 3.25Å; V165-L170 HydrophobicContact CG1-CB 3.79Å; V165-L170 PolarHBondContact O-N 3.2Å; V165-V171 HydrophobicContact CG1-CB 4.37Å; V165-V171 HydrophobicContact CG1-CG1 3.59Å; V165-V171 HydrophobicContact CG1-CG2 4.04Å; V165-W177 HydrophobicContact CG1-CH2 4.18Å
166	V	87.1	Confident	86.1	Confident	27 Å²	27	38.5 Å²	38.5	16%	0.164	22%	0.217	C	C	.	.	H	α-helix	trans	-75.3	-50.6	172.1	161.5	0	0	0	0	111.4	I162 T163 E164 T168 N169 V171 I197	I162-V166 HydrophobicContact CG2-CG2 4.38Å; I162-V166 VanDerWaalsContact O-CB 3.28Å; I162-V166 WeakPolarHBondContact O-CB 3.33Å; I162-V166 VanDerWaalsContact O-CG2 3.23Å; I162-V166 WeakPolarHBondContact O-CG2 3.46Å; I162-V166 PolarHBondContact O-N 3.37Å; T163-V166 PolarHBondContact O-N 2.66Å; E164-V166 VanDerWaalsContact C-N 3.3Å; E164-V166 PolarHBondContact O-N 2.99Å; V166-T168 VanDerWaalsContact C-N 3.28Å; V166-T168 PolarHBondContact O-N 3.46Å; V166-N169 PolarHBondContact O-N 3.24Å; V166-V171 HydrophobicContact CG2-CG2 3.95Å; V166-I197 HydrophobicContact CB-CD1 4.42Å; V166-I197 HydrophobicContact CG1-CD1 3.59Å; V166-I197 HydrophobicContact CG1-CG1 4Å; V166-I197 HydrophobicContact CG2-CB 4.08Å; V166-I197 HydrophobicContact CG2-CD1 4.08Å; V166-I197 HydrophobicContact CG2-CG1 3.9Å
167	E	87.3	Confident	86.2	Confident	137 Å²	137	36 Å²	36	64%	0.64	20%	0.197	S	C	*	.	H	α-helix	trans	-64.3	-33	-177.4	-71.4	179	-171.8	0	0	112.1	T163 E164 N169	T163-E167 HydrophobicContact CG2-CG 4.34Å; T163-E167 VanDerWaalsContact CG2-OE1 3.23Å; T163-E167 WeakPolarHBondContact CG2-OE1 3.34Å; T163-E167 WeakPolarHBondContact O-CG 3.49Å; T163-E167 PolarHBondContact O-N 3.35Å; E164-E167 PolarHBondContact O-N 2.98Å; E167-N169 VanDerWaalsContact C-N 3.26Å; E167-N169 PolarHBondContact O-N 3.28Å; E167-N169 PolarHBondContact O-ND2 3.08Å
168	T	85.1	Confident	86.3	Confident	43 Å²	43	34.7 Å²	34.7	26%	0.264	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	4.6	172.9	58.2	0	0	0	0	114.5	I127 F131 E164 V166 L170	I127-T168 HydrophobicContact CG2-CG2 3.95Å; F131-T168 HydrophobicContact CE2-CG2 4.18Å; E164-T168 WeakPolarHBondContact O-CB 3.21Å; E164-T168 WeakPolarHBondContact O-CG2 3.08Å; E164-T168 PolarHBondContact O-N 3.45Å; E164-T168 PolarHBondContact O-OG1 2.91Å; V166-T168 VanDerWaalsContact C-N 3.28Å; V166-T168 PolarHBondContact O-N 3.46Å; T168-L170 PolarHBondContact O-N 2.88Å; T168-L170 VanDerWaalsContact O-N 3.16Å
169	N	82.4	Confident	86.4	Confident	110 Å²	110	34.9 Å²	34.9	59%	0.588	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	28.2	-179.7	-68.1	-87.6	0	0	0	114.5	R143 V166 E167 V171	R143-N169 PolarHBondContact NH2-O 3.36Å; V166-N169 PolarHBondContact O-N 3.24Å; E167-N169 VanDerWaalsContact C-N 3.26Å; E167-N169 PolarHBondContact O-N 3.28Å; E167-N169 PolarHBondContact O-ND2 3.08Å; N169-V171 PolarHBondContact O-N 3.45Å
170	L	83	Confident	86.4	Confident	5 Å²	5	33.5 Å²	33.5	3%	0.026	18%	0.184	C	C	.	.			trans	-69.4	-20.9	176.6	-81.4	175.6	0	0	0	112.7	I127 F131 L139 R143 L146 V165 T168	I127-L170 HydrophobicContact CD1-CD1 4.41Å; I127-L170 HydrophobicContact CG1-CD1 4.26Å; I127-L170 HydrophobicContact CG2-CD1 3.87Å; F131-L170 HydrophobicContact CE1-CD2 3.75Å; F131-L170 HydrophobicContact CE1-CG 4.41Å; F131-L170 HydrophobicContact CE2-CD1 4.37Å; F131-L170 HydrophobicContact CE2-CD2 4.38Å; F131-L170 HydrophobicContact CE2-CG 4.31Å; F131-L170 HydrophobicContact CZ-CD1 4.23Å; F131-L170 HydrophobicContact CZ-CD2 3.54Å; F131-L170 HydrophobicContact CZ-CG 3.69Å; L139-L170 HydrophobicContact CD1-CD2 3.87Å; R143-L170 HydrophobicContact CG-CD2 4.36Å; R143-L170 WeakPolarHBondContact CG-O 3.42Å; L146-L170 HydrophobicContact CD1-CB 3.96Å; V165-L170 HydrophobicContact CG1-CB 3.79Å; V165-L170 PolarHBondContact O-N 3.2Å; T168-L170 PolarHBondContact O-N 2.88Å; T168-L170 VanDerWaalsContact O-N 3.16Å
171	V	80.2	Confident	86.4	Confident	13 Å²	13	30.4 Å²	30.4	8%	0.079	16%	0.162	C	C	.	.	S	Bend	trans	-121.3	152.3	179.9	-70.2	0	0	0	0	112.6	L146 V165 V166 N169 C175 W177	L146-V171 HydrophobicContact CB-CG1 4.02Å; L146-V171 HydrophobicContact CD1-CG1 4.23Å; V165-V171 HydrophobicContact CG1-CB 4.37Å; V165-V171 HydrophobicContact CG1-CG1 3.59Å; V165-V171 HydrophobicContact CG1-CG2 4.04Å; V166-V171 HydrophobicContact CG2-CG2 3.95Å; N169-V171 PolarHBondContact O-N 3.45Å; V171-C175 HydrophobicContact CB-CB 4.33Å; V171-W177 HydrophobicContact CB-CZ2 4.38Å; V171-W177 HydrophobicContact CG1-CH2 4Å; V171-W177 HydrophobicContact CG1-CZ2 3.84Å; V171-W177 HydrophobicContact CG2-CZ2 4.19Å
172	A	72.4	Confident	86.2	Confident	49 Å²	49	30.5 Å²	30.5	41%	0.405	16%	0.162	S	C	.	.			trans	-109.8	174.6	176.5	0	0	0	0	0	111.7	D174 C175	A172-D174 WeakPolarHBondContact CB-OD1 3.32Å; A172-D174 PolarHBondContact O-N 3.27Å; A172-D174 VanDerWaalsContact O-N 3.12Å; A172-C175 PolarHBondContact O-N 3.5Å; A172-C175 PolarHBondContact O-SG 2.95Å
173	F	67.9	Low	86	Confident	107 Å²	107	32.4 Å²	32.4	47%	0.469	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.2	-177	69.5	-91.9	0	0	0	114.3	C175 G198 D701	F173-C175 VanDerWaalsContact C-N 3.35Å; F173-G198 WeakPolarHBondContact O-CA 3.42Å; F173-D701 WeakPolarHBondContact CE2-OD2 3.42Å
174	D	72.4	Confident	85.9	Confident	63 Å²	63	31.7 Å²	31.7	34%	0.337	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.7	-176.9	72.2	-50.8	0	0	0	113.4	R147 A172	R147-D174 VanDerWaalsContact CD-OD2 3.29Å; R147-D174 WeakPolarHBondContact CD-OD2 3.34Å; R147-D174 IonicContact CZ-OD2 2.82Å; R147-D174 IonicContact NE-OD2 2.74Å; R147-D174 IonicContact NH1-OD1 2.74Å; R147-D174 IonicContact NH1-OD2 3.18Å; R147-D174 PolarHBondContact NH1-OD2 2.85Å; A172-D174 WeakPolarHBondContact CB-OD1 3.32Å; A172-D174 PolarHBondContact O-N 3.27Å; A172-D174 VanDerWaalsContact O-N 3.12Å
175	C	84	Confident	85.7	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.007	17%	0.172	C	C	.	.			trans	-62.2	144.8	178.5	67.4	0	0	0	0	112.2	R147 V171 A172 F173 W177 I197 G198 R199	R147-C175 CarbonylContact O-C 3.57Å; R147-C175 WeakPolarHBondContact O-CA 3.48Å; V171-C175 HydrophobicContact CB-CB 4.33Å; A172-C175 PolarHBondContact O-N 3.5Å; A172-C175 PolarHBondContact O-SG 2.95Å; F173-C175 VanDerWaalsContact C-N 3.35Å; C175-W177 PolarHBondContact SG-NE1 3.38Å; C175-I197 PolarHBondContact SG-O 3.35Å; C175-I197 VanDerWaalsContact SG-O 3.35Å; C175-G198 CarbonylContact O-C 3.54Å; C175-G198 WeakPolarHBondContact O-CA 3.5Å; C175-R199 PolarHBondContact O-N 3.45Å
176	H	88.8	Confident	85.4	Confident	18 Å²	18	36.2 Å²	36.2	8%	0.083	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	111.6	178.1	-172.9	-173.2	0	0	0	110.3	Y82 W84 R147 A149 R199 T201	Y82-H176 AromaticContact CD2-CE1 3.76Å; Y82-H176 AromaticContact CE1-CE1 3.88Å; Y82-H176 AromaticContact CE2-CE1 3.58Å; Y82-H176 AromaticContact CG-CE1 4Å; Y82-H176 AromaticContact CZ-CE1 3.64Å; W84-H176 AromaticContact CE2-ND1 3.88Å; W84-H176 WeakPolarHBondContact CH2-O 3.47Å; W84-H176 HydrophobicContact CZ2-CB 3.92Å; W84-H176 AromaticContact CZ2-CG 3.67Å; W84-H176 AromaticContact CZ2-ND1 3.51Å; W84-H176 AromaticContact NE1-ND1 3.63Å; R147-H176 PolarHBondContact O-N 2.93Å; A149-H176 PolarHBondContact N-O 3.43Å; A149-H176 VanDerWaalsContact N-O 3.11Å; H176-R199 WeakPolarHBondContact CA-O 3.35Å; H176-R199 HydrophobicContact CB-CB 4.26Å; H176-R199 PolarHBondContact CD2-O 3Å; H176-R199 WeakPolarHBondContact NE2-CD 3.04Å; H176-T201 PolarHBondContact NE2-OG1 3.29Å
177	W	92.3	Very high	85.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	135.2	176.1	-53.6	97.3	0	0	0	111.3	A149 L151 F161 I162 V165 V171 C175 I197 R199 L200 T201	A149-W177 HydrophobicContact CB-CE3 3.7Å; A149-W177 HydrophobicContact CB-CZ3 3.66Å; A149-W177 CarbonylContact O-C 3.6Å; A149-W177 WeakPolarHBondContact O-CA 3.37Å; L151-W177 HydrophobicContact CD1-CE3 4.12Å; L151-W177 HydrophobicContact CD1-CZ3 4.5Å; L151-W177 HydrophobicContact CD2-CE3 4.18Å; L151-W177 HydrophobicContact CD2-CZ3 4.17Å; L151-W177 HydrophobicContact CG-CE3 4.22Å; F161-W177 HydrophobicContact CE1-CZ3 4.19Å; I162-W177 HydrophobicContact CD1-CD2 4.47Å; I162-W177 HydrophobicContact CG1-CE3 4.45Å; V165-W177 HydrophobicContact CG1-CH2 4.18Å; V171-W177 HydrophobicContact CB-CZ2 4.38Å; V171-W177 HydrophobicContact CG1-CH2 4Å; V171-W177 HydrophobicContact CG1-CZ2 3.84Å; V171-W177 HydrophobicContact CG2-CZ2 4.19Å; C175-W177 PolarHBondContact SG-NE1 3.38Å; W177-I197 PolarHBondContact NE1-O 3.1Å; W177-R199 PolarHBondContact N-O 3.21Å; W177-L200 HydrophobicContact CB-CB 4.5Å; W177-L200 HydrophobicContact CB-CD1 3.71Å; W177-T201 PolarHBondContact O-N 3.43Å
178	I	94.6	Very high	85.5	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	107.3	164.5	-59.8	173.6	0	0	0	107.7	V78 V79 W84 A149 I150 L151 T201 I203	V78-I178 HydrophobicContact CG1-CD1 3.95Å; V79-I178 HydrophobicContact CG2-CD1 4.34Å; W84-I178 HydrophobicContact CD2-CD1 4.46Å; W84-I178 HydrophobicContact CE3-CD1 4.22Å; W84-I178 HydrophobicContact CH2-CD1 3.46Å; W84-I178 VanDerWaalsContact CH2-CD1 3.46Å; W84-I178 HydrophobicContact CH2-CG1 3.71Å; W84-I178 HydrophobicContact CZ2-CD1 3.69Å; W84-I178 HydrophobicContact CZ2-CG1 4Å; W84-I178 HydrophobicContact CZ3-CD1 3.75Å; W84-I178 HydrophobicContact CZ3-CG1 4.39Å; A149-I178 PolarHBondContact O-N 3.06Å; I150-I178 CarbonylContact C-O 3.59Å; I150-I178 VanDerWaalsContact CA-O 3.3Å; I150-I178 WeakPolarHBondContact CA-O 3.38Å; I150-I178 HydrophobicContact CG1-CB 4.32Å; I150-I178 HydrophobicContact CG1-CD1 4.49Å; I150-I178 HydrophobicContact CG2-CB 4.38Å; I150-I178 HydrophobicContact CG2-CG2 4.37Å; L151-I178 PolarHBondContact N-O 2.86Å; I178-T201 WeakPolarHBondContact CA-O 3.33Å; I178-I203 HydrophobicContact CG2-CD1 3.67Å; I178-I203 HydrophobicContact CG2-CG1 4.36Å
179	I	94.9	Very high	85.7	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.4	173.7	-57.9	-179.1	0	0	0	108.1	L151 I162 L192 L200 T201 I202 I203	L151-I179 HydrophobicContact CB-CG1 4.22Å; L151-I179 HydrophobicContact CD1-CD1 4.33Å; L151-I179 HydrophobicContact CD1-CG1 4.09Å; L151-I179 HydrophobicContact CG-CG1 4.33Å; I162-I179 HydrophobicContact CD1-CD1 3.94Å; I179-L192 HydrophobicContact CD1-CB 4.48Å; I179-L192 HydrophobicContact CD1-CD1 3.79Å; I179-L192 HydrophobicContact CD1-CD2 3.74Å; I179-L192 HydrophobicContact CD1-CG 4.22Å; I179-L200 HydrophobicContact CB-CD1 4.41Å; I179-L200 HydrophobicContact CD1-CD1 3.59Å; I179-L200 HydrophobicContact CD1-CD2 4.49Å; I179-L200 HydrophobicContact CG1-CD1 3.66Å; I179-T201 PolarHBondContact N-O 3.06Å; I179-I202 HydrophobicContact CB-CG1 4.45Å; I179-I202 CarbonylContact O-C 3.57Å; I179-I202 WeakPolarHBondContact O-CA 3.32Å; I179-I203 PolarHBondContact O-N 3.28Å
180	I	92.6	Very high	85.9	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.1	175	-175.1	164	0	0	0	111.4	P46 L71 I75 I150 L151 V152 I203	P46-I180 WeakPolarHBondContact CG-O 3.32Å; L71-I180 HydrophobicContact CB-CD1 3.91Å; L71-I180 HydrophobicContact CD2-CD1 3.75Å; L71-I180 HydrophobicContact CD2-CG1 3.98Å; L71-I180 HydrophobicContact CG-CD1 4.35Å; I75-I180 HydrophobicContact CD1-CD1 3.94Å; I75-I180 HydrophobicContact CD1-CG2 4.06Å; I75-I180 HydrophobicContact CG1-CD1 3.5Å; I75-I180 HydrophobicContact CG1-CG2 4.23Å; I150-I180 HydrophobicContact CG2-CG2 4.43Å; L151-I180 PolarHBondContact O-N 2.92Å; L151-I180 VanDerWaalsContact O-N 3.15Å; V152-I180 HydrophobicContact CG2-CG2 3.98Å; I180-I203 HydrophobicContact CB-CB 4.1Å; I180-I203 HydrophobicContact CB-CD1 4.39Å; I180-I203 HydrophobicContact CD1-CB 4.13Å; I180-I203 HydrophobicContact CD1-CD1 4.17Å; I180-I203 HydrophobicContact CD1-CG2 3.78Å; I180-I203 HydrophobicContact CG1-CB 3.9Å; I180-I203 HydrophobicContact CG1-CG2 3.94Å
181	N	91.8	Very high	86.2	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.011	19%	0.191	C	C	.	.			trans	-154.2	133.5	173	-166.1	-44.9	0	0	0	109.1	G44 P46 M153 E183 I184 I203 R204	G44-N181 PolarHBondContact O-ND2 3.18Å; P46-N181 HydrophobicContact CG-CB 4.15Å; M153-N181 PolarHBondContact O-ND2 2.93Å; N181-E183 VanDerWaalsContact C-N 3.29Å; N181-E183 PolarHBondContact O-N 2.91Å; N181-E183 PolarHBondContact OD1-N 3Å; N181-I184 HydrophobicContact CB-CB 4.46Å; N181-I184 WeakPolarHBondContact O-CG2 3.41Å; N181-I203 PolarHBondContact N-O 3.38Å; N181-I203 VanDerWaalsContact N-O 3.15Å; N181-R204 WeakPolarHBondContact O-CA 3.32Å; N181-R204 WeakPolarHBondContact O-CB 3.2Å
182	E	89.7	Confident	86.7	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.019	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-31.5	-179.1	-66.5	174.2	122.6	0	0	112.5	R47 L71 Q205 I241 F317	R47-E182 WeakPolarHBondContact CD-OE2 3.41Å; R47-E182 VanDerWaalsContact CG-OE2 3.27Å; R47-E182 WeakPolarHBondContact CG-OE2 3.26Å; R47-E182 IonicContact CZ-OE1 3.94Å; R47-E182 IonicContact CZ-OE2 3.37Å; R47-E182 IonicContact NE-OE1 2.66Å; R47-E182 PolarHBondContact NE-OE1 3.31Å; R47-E182 IonicContact NE-OE2 2.72Å; R47-E182 PolarHBondContact NE-OE2 3.49Å; R47-E182 IonicContact NH2-OE1 3.37Å; R47-E182 PolarHBondContact NH2-OE1 3Å; R47-E182 IonicContact NH2-OE2 2.74Å; L71-E182 HydrophobicContact CD2-CG 3.88Å; E182-Q205 HydrophobicContact CB-CB 4.05Å; E182-Q205 HydrophobicContact CG-CB 4.4Å; E182-Q205 PolarHBondContact O-N 3.45Å; E182-I241 WeakPolarHBondContact O-CD1 3.49Å; E182-F317 HydrophobicContact CG-CE1 4.11Å; E182-F317 HydrophobicContact CG-CZ 4.5Å
183	E	86.9	Confident	87.4	Confident	41 Å²	41	33.4 Å²	33.4	19%	0.192	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	17.4	-164	-62.9	-179.2	162.2	0	0	113.7	S41 R66 N181 I241	S41-E183 VanDerWaalsContact CB-OE2 3.26Å; S41-E183 WeakPolarHBondContact CB-OE2 3.48Å; S41-E183 PolarHBondContact OG-OE2 3.27Å; R66-E183 IonicContact CZ-OE1 3.38Å; R66-E183 VanDerWaalsContact CZ-OE1 3.22Å; R66-E183 IonicContact NH1-OE1 2.72Å; R66-E183 PolarHBondContact NH1-OE1 2.99Å; R66-E183 IonicContact NH2-OE1 2.7Å; R66-E183 PolarHBondContact NH2-OE1 3.29Å; N181-E183 VanDerWaalsContact C-N 3.29Å; N181-E183 PolarHBondContact O-N 2.91Å; N181-E183 PolarHBondContact OD1-N 3Å; E183-I241 HydrophobicContact CG-CB 4.24Å; E183-I241 HydrophobicContact CG-CD1 4Å; E183-I241 HydrophobicContact CG-CG1 4.19Å
184	I	88.7	Confident	88.2	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.026	19%	0.186	C	C	.	.			trans	-82.7	117.2	-176.2	-167.9	174.5	0	0	0	113.6	P155 N181 D188 V189 L192 I202 R204	P155-I184 HydrophobicContact CB-CD1 4.25Å; P155-I184 HydrophobicContact CB-CG1 4.22Å; P155-I184 HydrophobicContact CG-CB 4.1Å; P155-I184 HydrophobicContact CG-CD1 4.17Å; P155-I184 HydrophobicContact CG-CG1 3.9Å; N181-I184 HydrophobicContact CB-CB 4.46Å; N181-I184 WeakPolarHBondContact O-CG2 3.41Å; I184-D188 HydrophobicContact CD1-CB 4.18Å; I184-D188 HydrophobicContact CG1-CB 3.67Å; I184-V189 HydrophobicContact CD1-CG2 4.37Å; I184-V189 HydrophobicContact CG1-CG2 4.32Å; I184-L192 HydrophobicContact CD1-CD1 3.57Å; I184-I202 HydrophobicContact CD1-CG2 4.23Å; I184-I202 HydrophobicContact CG2-CG2 4.05Å; I184-R204 HydrophobicContact CG2-CB 3.5Å; I184-R204 HydrophobicContact CG2-CG 4.35Å; I184-R204 VanDerWaalsContact O-CD 3.3Å; I184-R204 WeakPolarHBondContact O-CD 3.25Å; I184-R204 PolarHBondContact O-NH1 3.05Å; I184-R204 VanDerWaalsContact O-NH1 3.16Å
185	N	86.7	Confident	88.8	Confident	51 Å²	51	40.4 Å²	40.4	27%	0.273	19%	0.187	S	C	.	.			trans	-81.1	172.2	-178.7	64.9	65	0	0	0	113.1	V187 D188 V189	N185-V187 VanDerWaalsContact C-N 3.31Å; N185-V187 PolarHBondContact O-N 2.96Å; N185-V187 WeakPolarHBondContact OD1-CA 3.44Å; N185-V187 WeakPolarHBondContact OD1-CB 3.5Å; N185-V187 PolarHBondContact OD1-N 2.85Å; N185-D188 PolarHBondContact ND2-OD2 3.49Å; N185-D188 PolarHBondContact OD1-N 2.89Å; N185-D188 PolarHBondContact OD1-OD2 3.27Å; N185-V189 VanDerWaalsContact O-CG2 3.31Å; N185-V189 WeakPolarHBondContact O-CG2 3.45Å; N185-V189 PolarHBondContact O-N 2.71Å; N185-V189 VanDerWaalsContact O-N 3.14Å
186	D	85.2	Confident	88.8	Confident	80 Å²	80	40.6 Å²	40.6	43%	0.428	19%	0.189	S	C	.	.	H	α-helix	trans	-68.3	-24.7	-177.8	-69.2	-31.2	0	0	0	114.2	Q190 R204	D186-Q190 WeakPolarHBondContact O-CG 3.31Å; D186-Q190 PolarHBondContact O-N 3.49Å; D186-R204 IonicContact OD1-CZ 2.83Å; D186-R204 IonicContact OD1-NH1 3.2Å; D186-R204 PolarHBondContact OD1-NH1 3.47Å; D186-R204 IonicContact OD1-NH2 2.83Å; D186-R204 PolarHBondContact OD1-NH2 3.12Å
187	V	86.1	Confident	88.2	Confident	91 Å²	91	42.9 Å²	42.9	55%	0.552	20%	0.201	S	C	*	.	H	α-helix	trans	-74.3	-45.1	178.2	-175.6	0	0	0	0	110.2	N185 V189 Q190 E191	N185-V187 VanDerWaalsContact C-N 3.31Å; N185-V187 PolarHBondContact O-N 2.96Å; N185-V187 WeakPolarHBondContact OD1-CA 3.44Å; N185-V187 WeakPolarHBondContact OD1-CB 3.5Å; N185-V187 PolarHBondContact OD1-N 2.85Å; V187-V189 VanDerWaalsContact C-N 3.31Å; V187-V189 PolarHBondContact O-N 3.12Å; V187-Q190 PolarHBondContact O-N 2.83Å; V187-E191 WeakPolarHBondContact O-CB 3.23Å; V187-E191 PolarHBondContact O-N 2.98Å
188	D	89	Confident	87.5	Confident	26 Å²	26	43 Å²	43	14%	0.139	20%	0.202	C	C	.	.	H	α-helix	trans	-60	-42	172.9	-74.8	-43.6	0	0	0	111.6	P155 K159 I184 N185 E191 L192	P155-D188 HydrophobicContact CB-CB 4.11Å; K159-D188 WeakPolarHBondContact CE-OD1 3.47Å; K159-D188 IonicContact NZ-OD1 3.65Å; K159-D188 PolarHBondContact NZ-OD1 2.91Å; I184-D188 HydrophobicContact CD1-CB 4.18Å; I184-D188 HydrophobicContact CG1-CB 3.67Å; N185-D188 PolarHBondContact ND2-OD2 3.49Å; N185-D188 PolarHBondContact OD1-N 2.89Å; N185-D188 PolarHBondContact OD1-OD2 3.27Å; D188-E191 PolarHBondContact O-N 3.26Å; D188-L192 WeakPolarHBondContact O-CB 3.38Å; D188-L192 WeakPolarHBondContact O-CD1 3.46Å; D188-L192 VanDerWaalsContact O-CG 3.28Å; D188-L192 WeakPolarHBondContact O-CG 3.25Å; D188-L192 PolarHBondContact O-N 2.92Å
189	V	89.6	Confident	87	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.036	21%	0.212	C	C	.	.	H	α-helix	trans	-56.5	-50.7	173.4	164.8	0	0	0	0	111	I184 N185 V187 E191 V193 I202 L320 V332	I184-V189 HydrophobicContact CD1-CG2 4.37Å; I184-V189 HydrophobicContact CG1-CG2 4.32Å; N185-V189 VanDerWaalsContact O-CG2 3.31Å; N185-V189 WeakPolarHBondContact O-CG2 3.45Å; N185-V189 PolarHBondContact O-N 2.71Å; N185-V189 VanDerWaalsContact O-N 3.14Å; V187-V189 VanDerWaalsContact C-N 3.31Å; V187-V189 PolarHBondContact O-N 3.12Å; V189-E191 PolarHBondContact O-N 3.1Å; V189-V193 WeakPolarHBondContact O-CB 3.44Å; V189-V193 WeakPolarHBondContact O-CG2 3.29Å; V189-V193 PolarHBondContact O-N 3.05Å; V189-V193 VanDerWaalsContact O-N 3.1Å; V189-I202 HydrophobicContact CB-CD1 4.19Å; V189-I202 HydrophobicContact CG1-CD1 4.01Å; V189-I202 HydrophobicContact CG2-CD1 3.86Å; V189-I202 HydrophobicContact CG2-CG2 4.4Å; V189-L320 HydrophobicContact CG2-CD1 4.5Å; V189-V332 HydrophobicContact CG1-CB 4.39Å; V189-V332 HydrophobicContact CG1-CG1 4.29Å; V189-V332 HydrophobicContact CG1-CG2 3.84Å
190	Q	87.9	Confident	86.8	Confident	137 Å²	137	45.7 Å²	45.7	64%	0.64	21%	0.212	S	C	*	.	H	α-helix	trans	-63.4	-40.6	178.5	-72.8	176.1	19.8	0	0	112.5	D186 V187 V193 R194	D186-Q190 WeakPolarHBondContact O-CG 3.31Å; D186-Q190 PolarHBondContact O-N 3.49Å; V187-Q190 PolarHBondContact O-N 2.83Å; Q190-V193 PolarHBondContact O-N 2.7Å; Q190-R194 PolarHBondContact O-N 3.22Å
191	E	88.2	Confident	86.7	Confident	62 Å²	62	45.6 Å²	45.6	29%	0.29	21%	0.211	S	C	.	.	H	α-helix	trans	-69.5	-41.8	-178.9	-162.6	-175	168.4	0	0	112.2	K159 V187 D188 V189 V193 R194 R195	K159-E191 HydrophobicContact CD-CB 3.9Å; K159-E191 HydrophobicContact CD-CG 3.93Å; K159-E191 VanDerWaalsContact CD-OE2 3.24Å; K159-E191 WeakPolarHBondContact CD-OE2 3.32Å; K159-E191 WeakPolarHBondContact CE-OE2 3.37Å; K159-E191 IonicContact NZ-OE2 3.46Å; K159-E191 PolarHBondContact NZ-OE2 2.88Å; V187-E191 WeakPolarHBondContact O-CB 3.23Å; V187-E191 PolarHBondContact O-N 2.98Å; D188-E191 PolarHBondContact O-N 3.26Å; V189-E191 PolarHBondContact O-N 3.1Å; E191-V193 VanDerWaalsContact C-N 3.28Å; E191-V193 PolarHBondContact O-N 2.79Å; E191-R194 PolarHBondContact O-N 2.98Å; E191-R195 WeakPolarHBondContact O-CB 3.47Å; E191-R195 WeakPolarHBondContact O-CG 3.49Å; E191-R195 PolarHBondContact O-N 2.62Å; E191-R195 IonicContact OE1-CZ 3.6Å; E191-R195 IonicContact OE1-NE 3.61Å; E191-R195 PolarHBondContact OE1-NE 3.47Å; E191-R195 IonicContact OE1-NH2 2.72Å; E191-R195 PolarHBondContact OE1-NH2 3.02Å
192	L	90.3	Very high	86.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-36.9	173.4	-75.9	161.2	0	0	0	112	A158 K159 I162 I179 I184 D188 R194 R195 S196 L200	A158-L192 HydrophobicContact CB-CD2 4.09Å; K159-L192 HydrophobicContact CB-CD2 4.28Å; K159-L192 HydrophobicContact CD-CG 4.26Å; K159-L192 HydrophobicContact CG-CD1 4.5Å; K159-L192 HydrophobicContact CG-CD2 3.41Å; K159-L192 VanDerWaalsContact CG-CD2 3.41Å; K159-L192 HydrophobicContact CG-CG 3.58Å; I162-L192 HydrophobicContact CD1-CD2 3.95Å; I179-L192 HydrophobicContact CD1-CB 4.48Å; I179-L192 HydrophobicContact CD1-CD1 3.79Å; I179-L192 HydrophobicContact CD1-CD2 3.74Å; I179-L192 HydrophobicContact CD1-CG 4.22Å; I184-L192 HydrophobicContact CD1-CD1 3.57Å; D188-L192 WeakPolarHBondContact O-CB 3.38Å; D188-L192 WeakPolarHBondContact O-CD1 3.46Å; D188-L192 VanDerWaalsContact O-CG 3.28Å; D188-L192 WeakPolarHBondContact O-CG 3.25Å; D188-L192 PolarHBondContact O-N 2.92Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R195 PolarHBondContact O-N 2.83Å; L192-S196 VanDerWaalsContact O-CB 3.24Å; L192-S196 WeakPolarHBondContact O-CB 3.3Å; L192-S196 PolarHBondContact O-N 2.92Å; L192-S196 PolarHBondContact O-OG 3.15Å; L192-L200 HydrophobicContact CB-CD2 4.04Å
193	V	87.4	Confident	87	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-73.3	-27.1	178.4	172.2	0	0	0	0	112	V189 Q190 E191 L200 T322 R330 V332	V189-V193 WeakPolarHBondContact O-CB 3.44Å; V189-V193 WeakPolarHBondContact O-CG2 3.29Å; V189-V193 PolarHBondContact O-N 3.05Å; V189-V193 VanDerWaalsContact O-N 3.1Å; Q190-V193 PolarHBondContact O-N 2.7Å; E191-V193 VanDerWaalsContact C-N 3.28Å; E191-V193 PolarHBondContact O-N 2.79Å; V193-L200 HydrophobicContact CG2-CD2 3.77Å; V193-T322 HydrophobicContact CG1-CG2 4.28Å; V193-T322 HydrophobicContact CG2-CG2 4.43Å; V193-R330 HydrophobicContact CG1-CB 3.65Å; V193-R330 WeakPolarHBondContact CG1-O 3.39Å; V193-R330 WeakPolarHBondContact O-CD 3.47Å; V193-V332 HydrophobicContact CB-CG2 4.27Å; V193-V332 HydrophobicContact CG1-CG2 4.19Å; V193-V332 HydrophobicContact CG2-CG2 3.44Å; V193-V332 VanDerWaalsContact CG2-CG2 3.44Å
194	R	84.5	Confident	87.2	Confident	222 Å²	222	44.9 Å²	44.9	84%	0.838	21%	0.207	S	C	*	.	H	α-helix	trans	-75.2	-35.7	168.8	-107.8	-166.8	69.8	91.6	3.4	113.8	Q190 E191 L192	Q190-R194 PolarHBondContact O-N 3.22Å; E191-R194 PolarHBondContact O-N 2.98Å; L192-R194 VanDerWaalsContact C-N 3.33Å
195	R	86.1	Confident	87.3	Confident	95 Å²	95	45 Å²	45	36%	0.358	21%	0.207	S	C	.	.	H	α-helix	trans	-85.6	-28.8	-177	-71.1	171.9	178.7	-86.8	3.7	113.4	I162 T163 E191 L192	I162-R195 HydrophobicContact CG2-CB 4.37Å; T163-R195 WeakPolarHBondContact OG1-CD 3.45Å; T163-R195 PolarHBondContact OG1-NH1 3.36Å; E191-R195 WeakPolarHBondContact O-CB 3.47Å; E191-R195 WeakPolarHBondContact O-CG 3.49Å; E191-R195 PolarHBondContact O-N 2.62Å; E191-R195 IonicContact OE1-CZ 3.6Å; E191-R195 IonicContact OE1-NE 3.61Å; E191-R195 PolarHBondContact OE1-NE 3.47Å; E191-R195 IonicContact OE1-NH2 2.72Å; E191-R195 PolarHBondContact OE1-NH2 3.02Å; L192-R195 PolarHBondContact O-N 2.83Å
196	S	83.8	Confident	87.4	Confident	5 Å²	5	44.1 Å²	44.1	4%	0.035	20%	0.203	C	C	.	.			trans	-79.2	136.1	-177.9	52	0	0	0	0	112.9	L192 L200 R330	L192-S196 VanDerWaalsContact O-CB 3.24Å; L192-S196 WeakPolarHBondContact O-CB 3.3Å; L192-S196 PolarHBondContact O-N 2.92Å; L192-S196 PolarHBondContact O-OG 3.15Å; S196-L200 WeakPolarHBondContact OG-CD2 3.35Å; S196-R330 PolarHBondContact O-NH1 3.36Å
197	I	76.9	Confident	87.4	Confident	65 Å²	65	42.1 Å²	42.1	33%	0.333	19%	0.191	S	C	.	.			trans	-87.9	155.8	159.3	-69.1	-175.8	0	0	0	108.6	V166 C175 W177	V166-I197 HydrophobicContact CB-CD1 4.42Å; V166-I197 HydrophobicContact CG1-CD1 3.59Å; V166-I197 HydrophobicContact CG1-CG1 4Å; V166-I197 HydrophobicContact CG2-CB 4.08Å; V166-I197 HydrophobicContact CG2-CD1 4.08Å; V166-I197 HydrophobicContact CG2-CG1 3.9Å; C175-I197 PolarHBondContact SG-O 3.35Å; C175-I197 VanDerWaalsContact SG-O 3.35Å; W177-I197 PolarHBondContact NE1-O 3.1Å
198	G	77.1	Confident	86.9	Confident	2 Å²	2	40.8 Å²	40.8	2%	0.021	18%	0.184	C	C	.	.	S	Bend	trans	72	-161.5	178.1	0	0	0	0	0	114.7	F173 C175 Y324 R330	F173-G198 WeakPolarHBondContact O-CA 3.42Å; C175-G198 CarbonylContact O-C 3.54Å; C175-G198 WeakPolarHBondContact O-CA 3.5Å; G198-Y324 PolarHBondContact O-OH 3.35Å; G198-R330 VanDerWaalsContact O-CZ 3.28Å; G198-R330 PolarHBondContact O-NH1 2.86Å; G198-R330 PolarHBondContact O-NH2 2.8Å
199	R	83.8	Confident	86	Confident	58 Å²	58	42.7 Å²	42.7	22%	0.219	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	135.8	-177.7	-176.2	-177.9	-178.1	105.4	8.5	109.8	Y82 C175 H176 W177 L348 D350	Y82-R199 PolarHBondContact OH-NH2 2.94Å; C175-R199 PolarHBondContact O-N 3.45Å; H176-R199 WeakPolarHBondContact CA-O 3.35Å; H176-R199 HydrophobicContact CB-CB 4.26Å; H176-R199 PolarHBondContact CD2-O 3Å; H176-R199 WeakPolarHBondContact NE2-CD 3.04Å; W177-R199 PolarHBondContact N-O 3.21Å; R199-L348 PolarHBondContact NH2-O 3.01Å; R199-D350 IonicContact CZ-OD2 3.11Å; R199-D350 IonicContact NH1-OD2 2.71Å; R199-D350 PolarHBondContact NH1-OD2 3.4Å; R199-D350 IonicContact NH2-OD2 2.72Å; R199-D350 PolarHBondContact NH2-OD2 2.59Å
200	L	89.8	Confident	84.9	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121.4	174.5	168.1	61.4	0	0	0	110.4	W177 I179 L192 V193 S196 I202 G321 T322	W177-L200 HydrophobicContact CB-CB 4.5Å; W177-L200 HydrophobicContact CB-CD1 3.71Å; I179-L200 HydrophobicContact CB-CD1 4.41Å; I179-L200 HydrophobicContact CD1-CD1 3.59Å; I179-L200 HydrophobicContact CD1-CD2 4.49Å; I179-L200 HydrophobicContact CG1-CD1 3.66Å; L192-L200 HydrophobicContact CB-CD2 4.04Å; V193-L200 HydrophobicContact CG2-CD2 3.77Å; S196-L200 WeakPolarHBondContact OG-CD2 3.35Å; L200-I202 HydrophobicContact CD1-CG1 3.89Å; L200-I202 HydrophobicContact CD2-CD1 4.09Å; L200-I202 HydrophobicContact CD2-CG1 4.27Å; L200-I202 HydrophobicContact CG-CD1 4.27Å; L200-I202 HydrophobicContact CG-CG1 3.92Å; L200-G321 WeakPolarHBondContact O-CA 3.5Å; L200-T322 HydrophobicContact CB-CG2 3.77Å; L200-T322 PolarHBondContact N-OG1 3.47Å; L200-T322 PolarHBondContact O-N 3.26Å
201	T	91.9	Very high	83.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.9	166.5	-57.3	0	0	0	0	108.6	Y82 H176 W177 I178 I179 I203 I319 L320	Y82-T201 HydrophobicContact CE2-CG2 4.46Å; Y82-T201 PolarHBondContact OH-OG1 3.38Å; H176-T201 PolarHBondContact NE2-OG1 3.29Å; W177-T201 PolarHBondContact O-N 3.43Å; I178-T201 WeakPolarHBondContact CA-O 3.33Å; I179-T201 PolarHBondContact N-O 3.06Å; T201-I203 HydrophobicContact CG2-CG1 4.41Å; T201-I319 HydrophobicContact CG2-CG2 3.64Å; T201-L320 CarbonylContact C-O 3.59Å; T201-L320 VanDerWaalsContact CA-O 3.29Å; T201-L320 WeakPolarHBondContact CA-O 3.38Å
202	I	93.4	Very high	83	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.7	174	-55.3	176.1	0	0	0	109.2	I179 I184 V189 L200 I319 L320	I179-I202 HydrophobicContact CB-CG1 4.45Å; I179-I202 CarbonylContact O-C 3.57Å; I179-I202 WeakPolarHBondContact O-CA 3.32Å; I184-I202 HydrophobicContact CD1-CG2 4.23Å; I184-I202 HydrophobicContact CG2-CG2 4.05Å; V189-I202 HydrophobicContact CB-CD1 4.19Å; V189-I202 HydrophobicContact CG1-CD1 4.01Å; V189-I202 HydrophobicContact CG2-CD1 3.86Å; V189-I202 HydrophobicContact CG2-CG2 4.4Å; L200-I202 HydrophobicContact CD1-CG1 3.89Å; L200-I202 HydrophobicContact CD2-CD1 4.09Å; L200-I202 HydrophobicContact CD2-CG1 4.27Å; L200-I202 HydrophobicContact CG-CD1 4.27Å; L200-I202 HydrophobicContact CG-CG1 3.92Å; I202-I319 WeakPolarHBondContact O-CA 3.42Å; I202-L320 HydrophobicContact CB-CB 4.33Å; I202-L320 PolarHBondContact N-O 2.9Å; I202-L320 PolarHBondContact O-N 3.01Å
203	I	93.8	Very high	81.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.7	178.8	-55.4	170.5	0	0	0	107.8	V74 V78 I178 I179 I180 N181 T201 F317 I319	V74-I203 HydrophobicContact CB-CG2 4.5Å; V74-I203 HydrophobicContact CG1-CD1 4.41Å; V74-I203 HydrophobicContact CG1-CG2 3.59Å; V78-I203 HydrophobicContact CB-CD1 4.33Å; V78-I203 HydrophobicContact CG1-CD1 4.36Å; V78-I203 HydrophobicContact CG2-CD1 3.89Å; I178-I203 HydrophobicContact CG2-CD1 3.67Å; I178-I203 HydrophobicContact CG2-CG1 4.36Å; I179-I203 PolarHBondContact O-N 3.28Å; I180-I203 HydrophobicContact CB-CB 4.1Å; I180-I203 HydrophobicContact CB-CD1 4.39Å; I180-I203 HydrophobicContact CD1-CB 4.13Å; I180-I203 HydrophobicContact CD1-CD1 4.17Å; I180-I203 HydrophobicContact CD1-CG2 3.78Å; I180-I203 HydrophobicContact CG1-CB 3.9Å; I180-I203 HydrophobicContact CG1-CG2 3.94Å; N181-I203 PolarHBondContact N-O 3.38Å; N181-I203 VanDerWaalsContact N-O 3.15Å; T201-I203 HydrophobicContact CG2-CG1 4.41Å; I203-F317 HydrophobicContact CG2-CD1 4.14Å; I203-I319 HydrophobicContact CG1-CG1 4.44Å; I203-I319 HydrophobicContact CG1-CG2 4.43Å
204	R	91.8	Very high	80.7	Confident	30 Å²	30	59.6 Å²	59.6	11%	0.113	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	159.7	-179.9	71.8	175	178.6	-173.8	-2.1	113.7	N181 I184 D186 F317 E318	N181-R204 WeakPolarHBondContact O-CA 3.32Å; N181-R204 WeakPolarHBondContact O-CB 3.2Å; I184-R204 HydrophobicContact CG2-CB 3.5Å; I184-R204 HydrophobicContact CG2-CG 4.35Å; I184-R204 VanDerWaalsContact O-CD 3.3Å; I184-R204 WeakPolarHBondContact O-CD 3.25Å; I184-R204 PolarHBondContact O-NH1 3.05Å; I184-R204 VanDerWaalsContact O-NH1 3.16Å; D186-R204 IonicContact OD1-CZ 2.83Å; D186-R204 IonicContact OD1-NH1 3.2Å; D186-R204 PolarHBondContact OD1-NH1 3.47Å; D186-R204 IonicContact OD1-NH2 2.83Å; D186-R204 PolarHBondContact OD1-NH2 3.12Å; R204-F317 CarbonylContact O-C 3.57Å; R204-F317 VanDerWaalsContact O-CA 3.24Å; R204-F317 WeakPolarHBondContact O-CA 3.36Å; R204-F317 WeakPolarHBondContact O-CD1 3.5Å; R204-E318 HydrophobicContact CG-CG 3.81Å; R204-E318 IonicContact CZ-OE1 2.71Å; R204-E318 VanDerWaalsContact CZ-OE1 3.26Å; R204-E318 PolarHBondContact N-O 2.87Å; R204-E318 VanDerWaalsContact N-O 3.15Å; R204-E318 IonicContact NE-OE1 2.72Å; R204-E318 PolarHBondContact NE-OE1 2.81Å; R204-E318 IonicContact NH2-OE1 2.66Å; R204-E318 PolarHBondContact NH2-OE1 3.5Å; R204-E318 PolarHBondContact O-N 2.88Å
205	Q	90.4	Very high	79.8	Confident	9 Å²	9	53.9 Å²	53.9	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	141.3	171.5	-170.5	175.1	3.4	0	0	109.2	E182 F207 I241 Y245 V315	E182-Q205 HydrophobicContact CB-CB 4.05Å; E182-Q205 HydrophobicContact CG-CB 4.4Å; E182-Q205 PolarHBondContact O-N 3.45Å; Q205-F207 HydrophobicContact CG-CE1 4.23Å; Q205-F207 HydrophobicContact CG-CZ 4.03Å; Q205-F207 VanDerWaalsContact NE2-CE1 3.31Å; Q205-I241 HydrophobicContact CB-CD1 4.15Å; Q205-Y245 PolarHBondContact NE2-OH 2.68Å; Q205-V315 HydrophobicContact CG-CG2 4.34Å
206	T	88.3	Confident	79.1	Confident	31 Å²	31	52.6 Å²	52.6	19%	0.19	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.1	176.2	-169.5	0	0	0	0	110.1	H316 E318	T206-H316 HydrophobicContact CG2-CB 3.88Å; T206-H316 PolarHBondContact N-O 2.76Å; T206-E318 HydrophobicContact CG2-CB 4Å; T206-E318 HydrophobicContact CG2-CG 4.24Å; T206-E318 PolarHBondContact OG1-OE2 3.25Å
207	F	86	Confident	78.6	Confident	38 Å²	38	53.9 Å²	53.9	17%	0.167	28%	0.282	C	S	.	.			trans	-111.8	129.7	179.8	-58.2	-67.9	0	0	0	109.6	Q205 V209 I241 L244 Y245 T301	Q205-F207 HydrophobicContact CG-CE1 4.23Å; Q205-F207 HydrophobicContact CG-CZ 4.03Å; Q205-F207 VanDerWaalsContact NE2-CE1 3.31Å; F207-V209 WeakPolarHBondContact O-CG2 3.21Å; F207-V209 PolarHBondContact O-N 3.4Å; F207-V209 VanDerWaalsContact O-N 3.16Å; F207-I241 HydrophobicContact CE2-CD1 4Å; F207-I241 HydrophobicContact CE2-CG1 4.03Å; F207-I241 HydrophobicContact CE2-CG2 4.38Å; F207-I241 HydrophobicContact CZ-CD1 4.05Å; F207-I241 HydrophobicContact CZ-CG1 4.19Å; F207-I241 HydrophobicContact CZ-CG2 3.72Å; F207-L244 HydrophobicContact CD2-CD1 4.04Å; F207-L244 HydrophobicContact CE2-CD1 3.68Å; F207-L244 HydrophobicContact CZ-CD1 4.32Å; F207-Y245 HydrophobicContact CE1-CE2 4.28Å; F207-Y245 HydrophobicContact CZ-CE2 4.37Å; F207-T301 HydrophobicContact CD1-CG2 4.05Å; F207-T301 WeakPolarHBondContact CD1-O 3.31Å; F207-T301 HydrophobicContact CE1-CG2 3.78Å; F207-T301 HydrophobicContact CZ-CG2 4.28Å
208	P	74.6	Confident	78.5	Confident	63 Å²	63	55.9 Å²	55.9	41%	0.409	29%	0.288	S	S	.	.			trans	-70.5	113.5	-177.3	27.3	-32.9	0	0	0	110.6
209	V	70.4	Confident	78.2	Confident	66 Å²	66	56.9 Å²	56.9	40%	0.4	29%	0.291	S	S	.	.			trans	-104.9	128.2	178.1	-169.3	0	0	0	0	110.3	F207 R216	F207-V209 WeakPolarHBondContact O-CG2 3.21Å; F207-V209 PolarHBondContact O-N 3.4Å; F207-V209 VanDerWaalsContact O-N 3.16Å; V209-R216 HydrophobicContact CG1-CG 3.71Å
210	P	67.2	Low	77.3	Confident	42 Å²	42	57 Å²	57	27%	0.273	31%	0.311	S	S	.	.			trans	-55.7	139.7	174.8	-26.9	35.1	0	0	0	112.6	N212 Q215 R219	P210-N212 VanDerWaalsContact C-N 3.29Å; P210-N212 PolarHBondContact O-N 2.86Å; P210-Q215 HydrophobicContact CB-CB 4.48Å; P210-R219 VanDerWaalsContact CD-CZ 3.44Å
211	Q	65.5	Low	76.2	Confident	194 Å²	194	65.8 Å²	65.8	91%	0.907	36%	0.358	S	S	*	.	S	Bend	trans	-68.9	-28.5	179.4	-64.7	176.1	-7.3	0	0	112.4	I213	Q211-I213 PolarHBondContact O-N 2.69Å
212	N	69.6	Low	75.4	Confident	93 Å²	93	69.9 Å²	69.9	50%	0.497	38%	0.377	S	S	.	.			trans	-75	113.7	178.5	-72.7	-33.5	0	0	0	111.4	P210 S214 Q215 R216	P210-N212 VanDerWaalsContact C-N 3.29Å; P210-N212 PolarHBondContact O-N 2.86Å; N212-S214 PolarHBondContact O-N 3.11Å; N212-Q215 HydrophobicContact CB-CB 4.01Å; N212-Q215 HydrophobicContact CB-CG 4.08Å; N212-Q215 PolarHBondContact ND2-OE1 2.92Å; N212-Q215 CarbonylContact O-C 3.58Å; N212-Q215 PolarHBondContact O-N 2.86Å; N212-R216 PolarHBondContact O-N 3.48Å; N212-R216 VanDerWaalsContact O-N 3.08Å
213	I	66.6	Low	74.7	Confident	141 Å²	141	78.3 Å²	78.3	72%	0.723	41%	0.408	S	S	*	.	H	α-helix	trans	-54.5	-40.4	179.8	-62	169.3	0	0	0	111.8	Q211 Q215 R216	Q211-I213 PolarHBondContact O-N 2.69Å; I213-Q215 VanDerWaalsContact C-N 3.31Å; I213-Q215 PolarHBondContact O-N 3.11Å; I213-R216 VanDerWaalsContact O-CB 3.26Å; I213-R216 WeakPolarHBondContact O-CB 3.46Å; I213-R216 PolarHBondContact O-N 2.85Å
214	S	63.3	Low	74	Confident	93 Å²	93	78.6 Å²	78.6	65%	0.65	41%	0.41	S	S	*	.	H	α-helix	trans	-65.6	-28.1	177.4	50.6	0	0	0	0	114.2	N212	N212-S214 PolarHBondContact O-N 3.11Å
215	Q	65.6	Low	73.4	Confident	102 Å²	102	79.9 Å²	79.9	48%	0.477	42%	0.423	S	S	.	.	H	α-helix	trans	-94.2	-3.6	177.1	-64.1	175.9	-34	0	0	112.4	P210 N212 I213 F218	P210-Q215 HydrophobicContact CB-CB 4.48Å; N212-Q215 HydrophobicContact CB-CB 4.01Å; N212-Q215 HydrophobicContact CB-CG 4.08Å; N212-Q215 PolarHBondContact ND2-OE1 2.92Å; N212-Q215 CarbonylContact O-C 3.58Å; N212-Q215 PolarHBondContact O-N 2.86Å; I213-Q215 VanDerWaalsContact C-N 3.31Å; I213-Q215 PolarHBondContact O-N 3.11Å; Q215-F218 VanDerWaalsContact O-O 3.04Å
216	R	70.8	Confident	72.6	Confident	69 Å²	69	83.5 Å²	83.5	26%	0.26	45%	0.449	S	S	.	.	H	α-helix	trans	-64.5	-44.7	-178.4	-156.9	-179.1	-156.8	126.7	21.1	111.6	V209 N212 I213 R219 C229 P231	V209-R216 HydrophobicContact CG1-CG 3.71Å; N212-R216 PolarHBondContact O-N 3.48Å; N212-R216 VanDerWaalsContact O-N 3.08Å; I213-R216 VanDerWaalsContact O-CB 3.26Å; I213-R216 WeakPolarHBondContact O-CB 3.46Å; I213-R216 PolarHBondContact O-N 2.85Å; R216-R219 PolarHBondContact O-NE 3.47Å; R216-R219 VanDerWaalsContact O-NE 3.1Å; R216-C229 WeakPolarHBondContact CD-O 3.26Å; R216-C229 PolarHBondContact NE-O 3Å; R216-P231 VanDerWaalsContact CZ-CD 3.46Å
217	C	74.3	Confident	72.1	Confident	32 Å²	32	84.8 Å²	84.8	22%	0.216	46%	0.458	C	S	.	.	S	Bend	trans	-102.4	4.7	-175	-40.7	0	0	0	0	114	I224 C229	C217-I224 PolarHBondContact O-N 3.21Å; C217-C229 WeakPolarHBondContact CA-SG 3.45Å; C217-C229 HydrophobicContact CB-CB 3.73Å; C217-C229 WeakPolarHBondContact CB-SG 3.23Å; C217-C229 PolarHBondContact N-SG 3.48Å; C217-C229 WeakPolarHBondContact SG-CB 3.16Å; C217-C229 CovalentContact SG-SG 2.03Å; C217-C229 PolarHBondContact SG-SG 3.32Å
218	F	74.1	Confident	71.6	Confident	106 Å²	106	84.8 Å²	84.8	47%	0.465	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	104.7	173.6	-77.4	-86.9	0	0	0	107.9	Q215 H222 R223	Q215-F218 VanDerWaalsContact O-O 3.04Å; F218-H222 WeakPolarHBondContact CA-O 3.5Å; F218-R223 HydrophobicContact CD1-CB 4.02Å; F218-R223 HydrophobicContact CD1-CG 4.21Å; F218-R223 HydrophobicContact CE1-CB 3.71Å; F218-R223 HydrophobicContact CE1-CG 3.7Å; F218-R223 HydrophobicContact CE2-CG 4.37Å; F218-R223 HydrophobicContact CZ-CB 4.33Å; F218-R223 HydrophobicContact CZ-CG 3.79Å
219	R	71.6	Confident	71.5	Confident	24 Å²	24	82.6 Å²	82.6	9%	0.091	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112.1	-177.8	-59	-54.9	-164	98.6	12.4	108.3	P210 R216 H222 I224 S298	P210-R219 VanDerWaalsContact CD-CZ 3.44Å; R216-R219 PolarHBondContact O-NE 3.47Å; R216-R219 VanDerWaalsContact O-NE 3.1Å; R219-H222 PolarHBondContact N-O 2.87Å; R219-H222 WeakPolarHBondContact O-CB 3.34Å; R219-H222 PolarHBondContact O-N 3.13Å; R219-H222 VanDerWaalsContact O-N 3.14Å; R219-I224 HydrophobicContact CB-CD1 4.19Å; R219-I224 HydrophobicContact CG-CD1 3.56Å; R219-I224 HydrophobicContact CG-CG1 4.45Å; R219-S298 WeakPolarHBondContact CB-O 3.3Å
220	G	64.3	Low	71.7	Confident	61 Å²	61	83 Å²	83	63%	0.629	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	-141.3	-160.5	0	0	0	0	0	111.4	H222	G220-H222 PolarHBondContact O-N 3.28Å
221	N	67.4	Low	71.7	Confident	186 Å²	186	83.9 Å²	83.9	100%	0.995	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	9.9	176.7	-66.5	-10	0	0	0	113.6
222	H	73.9	Confident	71.9	Confident	86 Å²	86	82.7 Å²	82.7	40%	0.398	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	140	-177	-179.7	51.6	0	0	0	112.3	F218 R219 G220 Y247	F218-H222 WeakPolarHBondContact CA-O 3.5Å; R219-H222 PolarHBondContact N-O 2.87Å; R219-H222 WeakPolarHBondContact O-CB 3.34Å; R219-H222 PolarHBondContact O-N 3.13Å; R219-H222 VanDerWaalsContact O-N 3.14Å; G220-H222 PolarHBondContact O-N 3.28Å; H222-Y247 AromaticContact NE2-CE1 3.71Å; H222-Y247 AromaticContact NE2-CZ 3.28Å; H222-Y247 VanDerWaalsContact NE2-CZ 3.28Å; H222-Y247 PolarHBondContact NE2-OH 2.85Å
223	R	79.1	Confident	72.3	Confident	179 Å²	179	80.3 Å²	80.3	68%	0.675	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	118	177.6	-174.5	179.8	177.6	175.4	-1	110.3	F218	F218-R223 HydrophobicContact CD1-CB 4.02Å; F218-R223 HydrophobicContact CD1-CG 4.21Å; F218-R223 HydrophobicContact CE1-CB 3.71Å; F218-R223 HydrophobicContact CE1-CG 3.7Å; F218-R223 HydrophobicContact CE2-CG 4.37Å; F218-R223 HydrophobicContact CZ-CB 4.33Å; F218-R223 HydrophobicContact CZ-CG 3.79Å
224	I	80.2	Confident	72.6	Confident	6 Å²	6	77.6 Å²	77.6	3%	0.031	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-84.9	150.4	175.9	-56.6	-175	0	0	0	109.3	C217 R219 L228 C229 L300	C217-I224 PolarHBondContact O-N 3.21Å; R219-I224 HydrophobicContact CB-CD1 4.19Å; R219-I224 HydrophobicContact CG-CD1 3.56Å; R219-I224 HydrophobicContact CG-CG1 4.45Å; I224-L228 HydrophobicContact CG2-CB 4Å; I224-C229 HydrophobicContact CG2-CB 4.47Å; I224-L300 HydrophobicContact CD1-CD2 3.99Å; I224-L300 HydrophobicContact CG2-CD2 3.91Å
225	S	78.9	Confident	73.2	Confident	56 Å²	56	79.5 Å²	79.5	39%	0.392	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-58.7	140.1	171.2	-175.6	0	0	0	0	110.7	T227 L228 C229	S225-T227 PolarHBondContact O-N 3.2Å; S225-T227 PolarHBondContact OG-N 2.89Å; S225-T227 PolarHBondContact OG-OG1 3.39Å; S225-L228 PolarHBondContact O-N 2.92Å; S225-L228 VanDerWaalsContact O-N 3.11Å; S225-C229 VanDerWaalsContact O-CB 3.31Å; S225-C229 WeakPolarHBondContact O-CB 3.35Å; S225-C229 PolarHBondContact O-N 3.21Å
226	S	72.9	Confident	73.5	Confident	85 Å²	85	76 Å²	76	59%	0.594	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-57.5	-37.7	175.5	46.2	0	0	0	0	112.2	L228 C229 D230	S226-L228 VanDerWaalsContact C-N 3.25Å; S226-L228 PolarHBondContact O-N 3.31Å; S226-C229 PolarHBondContact O-N 3.01Å; S226-D230 PolarHBondContact O-N 2.92Å
227	T	77.7	Confident	73.5	Confident	59 Å²	59	77 Å²	77	36%	0.362	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-68.1	-17.5	178.9	56.4	0	0	0	0	114.8	S225 D233	S225-T227 PolarHBondContact O-N 3.2Å; S225-T227 PolarHBondContact OG-N 2.89Å; S225-T227 PolarHBondContact OG-OG1 3.39Å; T227-D233 WeakPolarHBondContact CA-OD2 3.48Å; T227-D233 WeakPolarHBondContact CB-OD2 3.31Å
228	L	76.1	Confident	73.6	Confident	38 Å²	38	81.6 Å²	81.6	20%	0.199	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-100.9	-3.2	174.1	-66	174.2	0	0	0	112.1	I224 S225 S226 F235 M239 Y247 L300	I224-L228 HydrophobicContact CG2-CB 4Å; S225-L228 PolarHBondContact O-N 2.92Å; S225-L228 VanDerWaalsContact O-N 3.11Å; S226-L228 VanDerWaalsContact C-N 3.25Å; S226-L228 PolarHBondContact O-N 3.31Å; L228-F235 HydrophobicContact CD2-CD1 4.2Å; L228-F235 HydrophobicContact CD2-CE1 3.89Å; L228-M239 HydrophobicContact CD2-CE 4.4Å; L228-M239 HydrophobicContact CD2-SD 3.92Å; L228-Y247 HydrophobicContact CD1-CD2 4.13Å; L228-Y247 HydrophobicContact CD1-CE2 3.81Å; L228-L300 HydrophobicContact CB-CD2 4.38Å; L228-L300 WeakPolarHBondContact O-CD2 3.46Å
229	C	72.6	Confident	73.8	Confident	16 Å²	16	78.7 Å²	78.7	11%	0.108	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-36.6	-169.1	168.7	0	0	0	0	113	R216 C217 I224 S225 S226 P231	R216-C229 WeakPolarHBondContact CD-O 3.26Å; R216-C229 PolarHBondContact NE-O 3Å; C217-C229 WeakPolarHBondContact CA-SG 3.45Å; C217-C229 HydrophobicContact CB-CB 3.73Å; C217-C229 WeakPolarHBondContact CB-SG 3.23Å; C217-C229 PolarHBondContact N-SG 3.48Å; C217-C229 WeakPolarHBondContact SG-CB 3.16Å; C217-C229 CovalentContact SG-SG 2.03Å; C217-C229 PolarHBondContact SG-SG 3.32Å; I224-C229 HydrophobicContact CG2-CB 4.47Å; S225-C229 VanDerWaalsContact O-CB 3.31Å; S225-C229 WeakPolarHBondContact O-CB 3.35Å; S225-C229 PolarHBondContact O-N 3.21Å; S226-C229 PolarHBondContact O-N 3.01Å; C229-P231 WeakPolarHBondContact O-CD 3.42Å
230	D	73.4	Confident	74.4	Confident	74 Å²	74	80.9 Å²	80.9	40%	0.396	44%	0.436	S	S	.	.			trans	-79.4	115.4	177.9	-167.1	-14	0	0	0	110.1	S226 K232 D233	S226-D230 PolarHBondContact O-N 2.92Å; D230-K232 PolarHBondContact O-N 3.08Å; D230-K232 VanDerWaalsContact O-N 3.09Å; D230-K232 WeakPolarHBondContact OD1-CB 3.39Å; D230-K232 PolarHBondContact OD1-N 2.83Å; D230-D233 WeakPolarHBondContact O-CB 3.32Å; D230-D233 PolarHBondContact O-N 3.02Å; D230-D233 VanDerWaalsContact O-N 3.07Å
231	P	67.9	Low	75.5	Confident	62 Å²	62	78.6 Å²	78.6	40%	0.403	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-5.4	175.9	33.9	-42	0	0	0	113.2	R216 C229 Q237	R216-P231 VanDerWaalsContact CZ-CD 3.46Å; C229-P231 WeakPolarHBondContact O-CD 3.42Å; P231-Q237 WeakPolarHBondContact O-CG 3.48Å; P231-Q237 PolarHBondContact O-NE2 3.33Å
232	K	69.6	Low	76.5	Confident	168 Å²	168	69.8 Å²	69.8	73%	0.73	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-9.7	172.7	-60.3	-176.1	176.6	-174.1	0	113.4	D230 P234	D230-K232 PolarHBondContact O-N 3.08Å; D230-K232 VanDerWaalsContact O-N 3.09Å; D230-K232 WeakPolarHBondContact OD1-CB 3.39Å; D230-K232 PolarHBondContact OD1-N 2.83Å; K232-P234 WeakPolarHBondContact O-CD 3.18Å
233	D	77.8	Confident	77.3	Confident	44 Å²	44	68.4 Å²	68.4	24%	0.235	36%	0.358	C	S	.	.	S	Bend	trans	-73.5	121.9	175.7	-166.3	-40.7	0	0	0	109.5	T227 D230 F235 A236 Q237	T227-D233 WeakPolarHBondContact CA-OD2 3.48Å; T227-D233 WeakPolarHBondContact CB-OD2 3.31Å; D230-D233 WeakPolarHBondContact O-CB 3.32Å; D230-D233 PolarHBondContact O-N 3.02Å; D230-D233 VanDerWaalsContact O-N 3.07Å; D233-F235 PolarHBondContact O-N 2.88Å; D233-F235 VanDerWaalsContact O-N 3.11Å; D233-F235 VanDerWaalsContact OD1-CB 3.23Å; D233-F235 WeakPolarHBondContact OD1-CB 3.17Å; D233-F235 PolarHBondContact OD1-N 2.93Å; D233-A236 HydrophobicContact CB-CB 4.3Å; D233-A236 PolarHBondContact O-N 3.14Å; D233-Q237 PolarHBondContact O-N 3.48Å; D233-Q237 VanDerWaalsContact O-N 3.13Å
234	P	73.4	Confident	77.7	Confident	83 Å²	83	61.2 Å²	61.2	54%	0.539	33%	0.333	S	S	.	.	H	α-helix	trans	-57.8	-23.4	176.9	-25.1	35.3	0	0	0	113.7	K232 N238	K232-P234 WeakPolarHBondContact O-CD 3.18Å; P234-N238 PolarHBondContact O-N 3.04Å; P234-N238 PolarHBondContact O-ND2 3Å
235	F	76	Confident	78.3	Confident	133 Å²	133	61 Å²	61	58%	0.583	33%	0.331	S	S	*	.	H	α-helix	trans	-69.3	-40.7	174.2	-172.5	-96.3	0	0	0	111.9	L228 D233	L228-F235 HydrophobicContact CD2-CD1 4.2Å; L228-F235 HydrophobicContact CD2-CE1 3.89Å; D233-F235 PolarHBondContact O-N 2.88Å; D233-F235 VanDerWaalsContact O-N 3.11Å; D233-F235 VanDerWaalsContact OD1-CB 3.23Å; D233-F235 WeakPolarHBondContact OD1-CB 3.17Å; D233-F235 PolarHBondContact OD1-N 2.93Å
236	A	72.3	Confident	79	Confident	28 Å²	28	61 Å²	61	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-70.6	-37.6	176.9	0	0	0	0	0	112.1	D233 N238 M239	D233-A236 HydrophobicContact CB-CB 4.3Å; D233-A236 PolarHBondContact O-N 3.14Å; A236-N238 VanDerWaalsContact C-N 3.34Å; A236-N238 PolarHBondContact O-N 3.44Å; A236-M239 PolarHBondContact O-N 3.45Å
237	Q	70.5	Confident	79.8	Confident	92 Å²	92	59.6 Å²	59.6	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-67.5	-30.5	179.9	-67.8	-177	-4.9	0	0	113.8	P231 D233	P231-Q237 WeakPolarHBondContact O-CG 3.48Å; P231-Q237 PolarHBondContact O-NE2 3.33Å; D233-Q237 PolarHBondContact O-N 3.48Å; D233-Q237 VanDerWaalsContact O-N 3.13Å
238	N	75.1	Confident	80.4	Confident	127 Å²	127	56.8 Å²	56.8	68%	0.679	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	8.9	-178.2	-69.1	-50.7	0	0	0	113.8	P234 A236	P234-N238 PolarHBondContact O-N 3.04Å; P234-N238 PolarHBondContact O-ND2 3Å; A236-N238 VanDerWaalsContact C-N 3.34Å; A236-N238 PolarHBondContact O-N 3.44Å
239	M	79.7	Confident	81.3	Confident	46 Å²	46	55 Å²	55	23%	0.227	28%	0.282	C	S	.	.			trans	-86.6	118.5	-174.4	-169.9	165.8	-179	0	0	111.8	L228 A236 I241 N243 L244	L228-M239 HydrophobicContact CD2-CE 4.4Å; L228-M239 HydrophobicContact CD2-SD 3.92Å; A236-M239 PolarHBondContact O-N 3.45Å; M239-I241 PolarHBondContact O-N 3.02Å; M239-N243 HydrophobicContact CE-CB 3.6Å; M239-N243 HydrophobicContact CG-CB 3.99Å; M239-L244 HydrophobicContact CE-CD2 4.14Å; M239-L244 HydrophobicContact CG-CD2 4.05Å; M239-L244 HydrophobicContact SD-CD2 3.69Å
240	E	84.1	Confident	82.2	Confident	69 Å²	69	58.6 Å²	58.6	32%	0.322	30%	0.303	S	S	.	.			trans	-51.2	137.9	173.2	-75.3	179.5	-140.1	0	0	111.5	R40 S242 N243 L244	R40-E240 IonicContact CZ-OE1 3.92Å; R40-E240 IonicContact CZ-OE2 2.88Å; R40-E240 IonicContact NE-OE1 3.22Å; R40-E240 IonicContact NE-OE2 2.67Å; R40-E240 PolarHBondContact NE-OE2 3.46Å; R40-E240 VanDerWaalsContact NH2-CD 3.27Å; R40-E240 IonicContact NH2-OE1 2.8Å; R40-E240 PolarHBondContact NH2-OE1 2.89Å; R40-E240 IonicContact NH2-OE2 3.69Å; R40-E240 PolarHBondContact NH2-OE2 2.94Å; R40-E240 VanDerWaalsContact NH2-OE2 3.07Å; E240-S242 PolarHBondContact O-N 2.88Å; E240-S242 VanDerWaalsContact O-N 3.15Å; E240-N243 WeakPolarHBondContact O-CA 3.42Å; E240-N243 WeakPolarHBondContact O-CB 3.3Å; E240-N243 PolarHBondContact O-N 3.21Å; E240-L244 PolarHBondContact O-N 2.96Å
241	I	87.8	Confident	83	Confident	14 Å²	14	56.5 Å²	56.5	7%	0.072	29%	0.292	C	S	.	.	H	α-helix	trans	-55.5	-35.5	176.2	-67.7	-174.3	0	0	0	111.7	E182 E183 Q205 F207 M239 N243 L244 Y245	E182-I241 WeakPolarHBondContact O-CD1 3.49Å; E183-I241 HydrophobicContact CG-CB 4.24Å; E183-I241 HydrophobicContact CG-CD1 4Å; E183-I241 HydrophobicContact CG-CG1 4.19Å; Q205-I241 HydrophobicContact CB-CD1 4.15Å; F207-I241 HydrophobicContact CE2-CD1 4Å; F207-I241 HydrophobicContact CE2-CG1 4.03Å; F207-I241 HydrophobicContact CE2-CG2 4.38Å; F207-I241 HydrophobicContact CZ-CD1 4.05Å; F207-I241 HydrophobicContact CZ-CG1 4.19Å; F207-I241 HydrophobicContact CZ-CG2 3.72Å; M239-I241 PolarHBondContact O-N 3.02Å; I241-N243 PolarHBondContact O-N 3.2Å; I241-L244 WeakPolarHBondContact O-CB 3.47Å; I241-L244 PolarHBondContact O-N 3.03Å; I241-L244 VanDerWaalsContact O-N 3.14Å; I241-Y245 HydrophobicContact CG2-CD2 3.76Å; I241-Y245 HydrophobicContact CG2-CE2 3.57Å; I241-Y245 WeakPolarHBondContact O-CD2 3.34Å; I241-Y245 PolarHBondContact O-N 3.32Å
242	S	88.7	Confident	84.2	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-51.5	-38.7	172.1	-52.7	0	0	0	0	112.6	R66 E240 I246	R66-S242 PolarHBondContact NH1-OG 2.88Å; E240-S242 PolarHBondContact O-N 2.88Å; E240-S242 VanDerWaalsContact O-N 3.15Å; S242-I246 WeakPolarHBondContact O-CG1 3.43Å; S242-I246 PolarHBondContact O-N 2.83Å; S242-I246 VanDerWaalsContact O-N 3.09Å
243	N	89.2	Confident	85.3	Confident	57 Å²	57	46.4 Å²	46.4	31%	0.305	24%	0.243	S	C	.	.	H	α-helix	trans	-77.2	-30.8	-178.4	-60.8	-23.9	0	0	0	112.6	M239 E240 I241 I246 Y247	M239-N243 HydrophobicContact CE-CB 3.6Å; M239-N243 HydrophobicContact CG-CB 3.99Å; E240-N243 WeakPolarHBondContact O-CA 3.42Å; E240-N243 WeakPolarHBondContact O-CB 3.3Å; E240-N243 PolarHBondContact O-N 3.21Å; I241-N243 PolarHBondContact O-N 3.2Å; N243-I246 PolarHBondContact O-N 2.98Å; N243-Y247 PolarHBondContact O-N 3.14Å
244	L	88.9	Confident	85.9	Confident	28 Å²	28	47 Å²	47	15%	0.147	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-45.4	172	-56.6	176.4	0	0	0	110.3	F207 M239 E240 I241 I246 Y247 D248 L300 T301	F207-L244 HydrophobicContact CD2-CD1 4.04Å; F207-L244 HydrophobicContact CE2-CD1 3.68Å; F207-L244 HydrophobicContact CZ-CD1 4.32Å; M239-L244 HydrophobicContact CE-CD2 4.14Å; M239-L244 HydrophobicContact CG-CD2 4.05Å; M239-L244 HydrophobicContact SD-CD2 3.69Å; E240-L244 PolarHBondContact O-N 2.96Å; I241-L244 WeakPolarHBondContact O-CB 3.47Å; I241-L244 PolarHBondContact O-N 3.03Å; I241-L244 VanDerWaalsContact O-N 3.14Å; L244-I246 VanDerWaalsContact C-N 3.33Å; L244-I246 PolarHBondContact O-N 3.04Å; L244-Y247 WeakPolarHBondContact O-CB 3.36Å; L244-Y247 PolarHBondContact O-N 2.99Å; L244-D248 PolarHBondContact O-N 3.4Å; L244-D248 VanDerWaalsContact O-N 3.15Å; L244-L300 HydrophobicContact CD2-CB 4.37Å; L244-L300 HydrophobicContact CD2-CD1 3.95Å; L244-T301 HydrophobicContact CB-CG2 3.67Å
245	Y	91.4	Very high	86.7	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-66.6	-30	174.4	-75.9	-67.2	0	0	0	113.3	V65 R66 P67 Q205 F207 I241 T249 T301	V65-Y245 HydrophobicContact CG1-CD1 3.87Å; V65-Y245 HydrophobicContact CG1-CG 4.3Å; R66-Y245 HydrophobicContact CB-CD2 4.41Å; R66-Y245 HydrophobicContact CG-CD2 3.89Å; R66-Y245 HydrophobicContact CG-CE2 3.75Å; P67-Y245 WeakPolarHBondContact CD-OH 3.16Å; Q205-Y245 PolarHBondContact NE2-OH 2.68Å; F207-Y245 HydrophobicContact CE1-CE2 4.28Å; F207-Y245 HydrophobicContact CZ-CE2 4.37Å; I241-Y245 HydrophobicContact CG2-CD2 3.76Å; I241-Y245 HydrophobicContact CG2-CE2 3.57Å; I241-Y245 WeakPolarHBondContact O-CD2 3.34Å; I241-Y245 PolarHBondContact O-N 3.32Å; Y245-T249 VanDerWaalsContact O-CB 3.27Å; Y245-T249 WeakPolarHBondContact O-CB 3.39Å; Y245-T249 PolarHBondContact O-N 3.43Å; Y245-T249 PolarHBondContact O-OG1 2.6Å; Y245-T301 HydrophobicContact CD1-CG2 3.85Å; Y245-T301 HydrophobicContact CD2-CG2 4.24Å; Y245-T301 HydrophobicContact CE1-CG2 3.75Å; Y245-T301 HydrophobicContact CE2-CG2 4.15Å; Y245-T301 HydrophobicContact CG-CG2 4.1Å
246	I	92.9	Very high	87.4	Confident	56 Å²	56	39.6 Å²	39.6	29%	0.287	22%	0.215	S	C	.	.	H	α-helix	trans	-63.7	-45.2	171.2	-70.7	167.5	0	0	0	110.7	I38 S242 N243 L244 T249 V250	I38-I246 HydrophobicContact CD1-CB 4.26Å; I38-I246 HydrophobicContact CD1-CG1 3.46Å; I38-I246 VanDerWaalsContact CD1-CG1 3.46Å; S242-I246 WeakPolarHBondContact O-CG1 3.43Å; S242-I246 PolarHBondContact O-N 2.83Å; S242-I246 VanDerWaalsContact O-N 3.09Å; N243-I246 PolarHBondContact O-N 2.98Å; L244-I246 VanDerWaalsContact C-N 3.33Å; L244-I246 PolarHBondContact O-N 3.04Å; I246-T249 WeakPolarHBondContact O-CB 3.44Å; I246-T249 PolarHBondContact O-N 2.72Å; I246-V250 WeakPolarHBondContact O-CG2 3.37Å; I246-V250 PolarHBondContact O-N 3.41Å
247	Y	90.8	Very high	88.2	Confident	57 Å²	57	41 Å²	41	22%	0.224	22%	0.216	C	C	.	.	H	α-helix	trans	-58.4	-50.2	177.8	-176.3	-87.3	0	0	0	111.4	H222 L228 N243 L244 T249 V250 L251 L300	H222-Y247 AromaticContact NE2-CE1 3.71Å; H222-Y247 AromaticContact NE2-CZ 3.28Å; H222-Y247 VanDerWaalsContact NE2-CZ 3.28Å; H222-Y247 PolarHBondContact NE2-OH 2.85Å; L228-Y247 HydrophobicContact CD1-CD2 4.13Å; L228-Y247 HydrophobicContact CD1-CE2 3.81Å; N243-Y247 PolarHBondContact O-N 3.14Å; L244-Y247 WeakPolarHBondContact O-CB 3.36Å; L244-Y247 PolarHBondContact O-N 2.99Å; Y247-T249 VanDerWaalsContact C-N 3.3Å; Y247-T249 PolarHBondContact O-N 3.44Å; Y247-V250 PolarHBondContact O-N 3.37Å; Y247-L251 PolarHBondContact O-N 2.96Å; Y247-L300 HydrophobicContact CD1-CD1 3.6Å; Y247-L300 HydrophobicContact CD1-CG 3.74Å; Y247-L300 HydrophobicContact CD2-CD1 4.34Å; Y247-L300 HydrophobicContact CE1-CD1 4.21Å; Y247-L300 HydrophobicContact CE1-CG 4.09Å; Y247-L300 HydrophobicContact CG-CD1 3.69Å; Y247-L300 HydrophobicContact CG-CG 4.35Å
248	D	90.9	Very high	89.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.4	-32.1	-179.6	-65.8	-9.9	0	0	0	112	L244 L251 L252 G299 L300 T301 L304	L244-D248 PolarHBondContact O-N 3.4Å; L244-D248 VanDerWaalsContact O-N 3.15Å; D248-L251 PolarHBondContact O-N 2.92Å; D248-L252 WeakPolarHBondContact O-CB 3.38Å; D248-L252 PolarHBondContact O-N 2.97Å; D248-G299 VanDerWaalsContact OD1-CA 3.27Å; D248-G299 WeakPolarHBondContact OD1-CA 3.43Å; D248-L300 PolarHBondContact OD1-N 2.81Å; D248-L300 PolarHBondContact OD2-N 3.29Å; D248-T301 VanDerWaalsContact OD2-CB 3.31Å; D248-T301 WeakPolarHBondContact OD2-CB 3.33Å; D248-T301 WeakPolarHBondContact OD2-CG2 3.21Å; D248-T301 PolarHBondContact OD2-N 3.2Å; D248-T301 PolarHBondContact OD2-OG1 2.88Å; D248-L304 HydrophobicContact CB-CD2 3.79Å
249	T	93.6	Very high	89.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-41.5	172.8	-62.3	0	0	0	0	112.3	V13 L36 V65 Y245 I246 Y247 L252 L253	V13-T249 HydrophobicContact CG1-CG2 3.95Å; V13-T249 HydrophobicContact CG2-CG2 3.79Å; L36-T249 HydrophobicContact CB-CG2 4.08Å; L36-T249 HydrophobicContact CD2-CG2 3.8Å; V65-T249 VanDerWaalsContact CG1-OG1 3.31Å; V65-T249 WeakPolarHBondContact CG1-OG1 3.34Å; Y245-T249 VanDerWaalsContact O-CB 3.27Å; Y245-T249 WeakPolarHBondContact O-CB 3.39Å; Y245-T249 PolarHBondContact O-N 3.43Å; Y245-T249 PolarHBondContact O-OG1 2.6Å; I246-T249 WeakPolarHBondContact O-CB 3.44Å; I246-T249 PolarHBondContact O-N 2.72Å; Y247-T249 VanDerWaalsContact C-N 3.3Å; Y247-T249 PolarHBondContact O-N 3.44Å; T249-L252 PolarHBondContact O-N 2.88Å; T249-L253 HydrophobicContact CG2-CD1 4.19Å; T249-L253 WeakPolarHBondContact O-CB 3.5Å; T249-L253 WeakPolarHBondContact O-CG 3.3Å; T249-L253 PolarHBondContact O-N 2.83Å
250	V	92.8	Very high	90.1	Very high	91 Å²	91	38.1 Å²	38.1	55%	0.552	20%	0.196	S	C	*	.	H	α-helix	trans	-67.6	-41	177	172.9	0	0	0	0	110.7	I246 Y247 L253 A254	I246-V250 WeakPolarHBondContact O-CG2 3.37Å; I246-V250 PolarHBondContact O-N 3.41Å; Y247-V250 PolarHBondContact O-N 3.37Å; V250-L253 PolarHBondContact O-N 2.92Å; V250-A254 WeakPolarHBondContact O-CB 3.39Å; V250-A254 PolarHBondContact O-N 2.99Å
251	L	90.5	Very high	90.2	Very high	31 Å²	31	40 Å²	40	16%	0.162	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-44.6	174.5	-178	61.1	0	0	0	111.8	Y247 D248 A254 N255 V297	Y247-L251 PolarHBondContact O-N 2.96Å; D248-L251 PolarHBondContact O-N 2.92Å; L251-A254 PolarHBondContact O-N 2.97Å; L251-N255 PolarHBondContact O-N 3.39Å; L251-V297 HydrophobicContact CD2-CB 4.3Å; L251-V297 HydrophobicContact CD2-CG2 4.35Å; L251-V297 HydrophobicContact CG-CB 4.29Å; L251-V297 HydrophobicContact CG-CG1 4.36Å; L251-V297 HydrophobicContact CG-CG2 4.3Å
252	L	92.6	Very high	90.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-45.6	176.2	178.9	60.5	0	0	0	112.3	L36 D248 T249 N255 A256 I292 G295 V297 L304 F306	L36-L252 HydrophobicContact CD2-CD2 4.4Å; D248-L252 WeakPolarHBondContact O-CB 3.38Å; D248-L252 PolarHBondContact O-N 2.97Å; T249-L252 PolarHBondContact O-N 2.88Å; L252-N255 PolarHBondContact O-N 3.47Å; L252-A256 WeakPolarHBondContact O-CB 3.46Å; L252-A256 PolarHBondContact O-N 3.41Å; L252-I292 HydrophobicContact CD2-CG2 4.07Å; L252-I292 HydrophobicContact CG-CG2 4.36Å; L252-G295 VanDerWaalsContact CD1-C 3.42Å; L252-G295 WeakPolarHBondContact CD1-O 3.44Å; L252-V297 HydrophobicContact CB-CG1 4.45Å; L252-V297 HydrophobicContact CB-CG2 3.85Å; L252-V297 HydrophobicContact CD1-CG1 4.11Å; L252-V297 HydrophobicContact CD1-CG2 4.34Å; L252-L304 HydrophobicContact CB-CD2 4.33Å; L252-L304 HydrophobicContact CD2-CD2 4.03Å; L252-L304 HydrophobicContact CD2-CG 4.28Å; L252-F306 HydrophobicContact CD2-CD2 4.45Å; L252-F306 HydrophobicContact CD2-CE2 3.61Å; L252-F306 HydrophobicContact CD2-CZ 4.32Å
253	L	93	Very high	90	Very high	18 Å²	18	48.9 Å²	48.9	9%	0.094	25%	0.251	C	S	.	.	H	α-helix	trans	-63.9	-42.6	177.5	-76.2	171.9	0	0	0	111.5	A11 V13 L36 T249 V250 N255 A256 F257 I292	A11-L253 HydrophobicContact CB-CD2 3.85Å; V13-L253 HydrophobicContact CG2-CD1 3.57Å; L36-L253 HydrophobicContact CD1-CD2 4.07Å; T249-L253 HydrophobicContact CG2-CD1 4.19Å; T249-L253 WeakPolarHBondContact O-CB 3.5Å; T249-L253 WeakPolarHBondContact O-CG 3.3Å; T249-L253 PolarHBondContact O-N 2.83Å; V250-L253 PolarHBondContact O-N 2.92Å; L253-N255 VanDerWaalsContact C-N 3.34Å; L253-N255 PolarHBondContact O-N 3.21Å; L253-A256 PolarHBondContact O-N 2.93Å; L253-F257 HydrophobicContact CB-CD2 4.43Å; L253-F257 HydrophobicContact CB-CE2 4.06Å; L253-F257 WeakPolarHBondContact O-CD2 3.32Å; L253-F257 WeakPolarHBondContact O-CG 3.43Å; L253-F257 PolarHBondContact O-N 3.01Å; L253-I292 HydrophobicContact CD2-CD1 3.82Å; L253-I292 HydrophobicContact CD2-CG1 4.22Å
254	A	90.8	Very high	89.6	Confident	55 Å²	55	57 Å²	57	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-59	-44	175.3	0	0	0	0	0	112	V250 L251 F257 H258	V250-A254 WeakPolarHBondContact O-CB 3.39Å; V250-A254 PolarHBondContact O-N 2.99Å; L251-A254 PolarHBondContact O-N 2.97Å; A254-F257 PolarHBondContact O-N 2.56Å; A254-H258 WeakPolarHBondContact O-CB 3.36Å; A254-H258 PolarHBondContact O-N 2.93Å
255	N	89.8	Confident	89.2	Confident	61 Å²	61	61.4 Å²	61.4	33%	0.326	30%	0.296	S	S	.	.	H	α-helix	trans	-62.6	-45.7	175.2	-168	24.2	0	0	0	111.9	L251 L252 L253 F257 H258 K259 G295 V297	L251-N255 PolarHBondContact O-N 3.39Å; L252-N255 PolarHBondContact O-N 3.47Å; L253-N255 VanDerWaalsContact C-N 3.34Å; L253-N255 PolarHBondContact O-N 3.21Å; N255-F257 PolarHBondContact O-N 2.87Å; N255-H258 PolarHBondContact O-N 2.91Å; N255-K259 WeakPolarHBondContact O-CB 3.3Å; N255-K259 PolarHBondContact O-N 2.93Å; N255-G295 PolarHBondContact ND2-O 3.01Å; N255-V297 HydrophobicContact CB-CG1 4.01Å
256	A	90.7	Very high	88.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-38.6	177.6	0	0	0	0	0	112.7	L252 L253 K260 M288 I292	L252-A256 WeakPolarHBondContact O-CB 3.46Å; L252-A256 PolarHBondContact O-N 3.41Å; L253-A256 PolarHBondContact O-N 2.93Å; A256-K260 WeakPolarHBondContact O-CG 3.49Å; A256-K260 PolarHBondContact O-N 2.8Å; A256-M288 HydrophobicContact CB-CE 4.05Å; A256-I292 HydrophobicContact CB-CG1 3.78Å
257	F	88.4	Confident	88.1	Confident	58 Å²	58	67.5 Å²	67.5	25%	0.254	32%	0.319	S	S	.	.	H	α-helix	trans	-66.8	-45.6	173.6	-70.2	-51	0	0	0	112.3	L10 L253 A254 N255 K259 K260 L261 W266 M288	L10-F257 HydrophobicContact CB-CE1 3.65Å; L10-F257 HydrophobicContact CB-CZ 3.87Å; L10-F257 HydrophobicContact CD1-CD1 4.19Å; L10-F257 HydrophobicContact CD1-CE1 3.45Å; L10-F257 VanDerWaalsContact CD1-CE1 3.45Å; L10-F257 HydrophobicContact CD1-CZ 4.02Å; L10-F257 HydrophobicContact CG-CE1 4.14Å; L253-F257 HydrophobicContact CB-CD2 4.43Å; L253-F257 HydrophobicContact CB-CE2 4.06Å; L253-F257 WeakPolarHBondContact O-CD2 3.32Å; L253-F257 WeakPolarHBondContact O-CG 3.43Å; L253-F257 PolarHBondContact O-N 3.01Å; A254-F257 PolarHBondContact O-N 2.56Å; N255-F257 PolarHBondContact O-N 2.87Å; F257-K259 PolarHBondContact O-N 2.91Å; F257-K260 PolarHBondContact O-N 3.28Å; F257-L261 WeakPolarHBondContact O-CG 3.06Å; F257-L261 PolarHBondContact O-N 3.21Å; F257-L261 VanDerWaalsContact O-N 3.1Å; F257-W266 HydrophobicContact CD1-CZ3 4.3Å; F257-M288 HydrophobicContact CD1-CE 3.52Å; F257-M288 HydrophobicContact CD1-SD 4.45Å; F257-M288 HydrophobicContact CE1-CE 3.3Å; F257-M288 HydrophobicContact CE1-SD 4.28Å; F257-M288 HydrophobicContact CG-CE 4.31Å; F257-M288 HydrophobicContact CZ-CE 3.98Å
258	H	88.5	Confident	87.5	Confident	108 Å²	108	69.3 Å²	69.3	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-56.9	-50.7	176.9	-178.2	45.7	0	0	0	111	A254 N255 K260 L261 E262	A254-H258 WeakPolarHBondContact O-CB 3.36Å; A254-H258 PolarHBondContact O-N 2.93Å; N255-H258 PolarHBondContact O-N 2.91Å; H258-K260 VanDerWaalsContact C-N 3.31Å; H258-K260 PolarHBondContact O-N 3.43Å; H258-L261 WeakPolarHBondContact O-CB 3.1Å; H258-L261 PolarHBondContact O-N 3.05Å; H258-E262 PolarHBondContact O-N 3.16Å
259	K	88.3	Confident	87	Confident	85 Å²	85	74.7 Å²	74.7	37%	0.37	37%	0.366	S	S	.	.	H	α-helix	trans	-58.5	-38.2	176.5	-167.8	168.8	-174.1	170.4	0	112.8	N255 F257 L261 E262 D263 T291 K294	N255-K259 WeakPolarHBondContact O-CB 3.3Å; N255-K259 PolarHBondContact O-N 2.93Å; F257-K259 PolarHBondContact O-N 2.91Å; K259-L261 VanDerWaalsContact C-N 3.34Å; K259-L261 PolarHBondContact O-N 2.91Å; K259-E262 PolarHBondContact O-N 3.48Å; K259-D263 WeakPolarHBondContact O-CB 3.38Å; K259-D263 PolarHBondContact O-N 2.64Å; K259-T291 HydrophobicContact CB-CG2 4.48Å; K259-T291 HydrophobicContact CD-CG2 4.34Å; K259-T291 HydrophobicContact CG-CG2 4.45Å; K259-K294 PolarHBondContact NZ-O 2.91Å
260	K	87.7	Confident	86.1	Confident	11 Å²	11	76.2 Å²	76.2	5%	0.048	38%	0.378	C	S	.	.	H	α-helix	trans	-65.2	-32.4	174.4	-83.4	-50.7	-158.9	-165	0	114.2	A256 F257 H258 W266 S287 M288 T291	A256-K260 WeakPolarHBondContact O-CG 3.49Å; A256-K260 PolarHBondContact O-N 2.8Å; F257-K260 PolarHBondContact O-N 3.28Å; H258-K260 VanDerWaalsContact C-N 3.31Å; H258-K260 PolarHBondContact O-N 3.43Å; K260-W266 HydrophobicContact CB-CE3 4.25Å; K260-S287 VanDerWaalsContact CE-O 3.24Å; K260-S287 WeakPolarHBondContact CE-O 3.29Å; K260-S287 PolarHBondContact NZ-O 3.39Å; K260-S287 PolarHBondContact NZ-OG 3.4Å; K260-M288 HydrophobicContact CG-SD 3.94Å; K260-T291 HydrophobicContact CD-CG2 4.17Å; K260-T291 WeakPolarHBondContact CE-OG1 3.46Å; K260-T291 HydrophobicContact CG-CG2 4.18Å; K260-T291 PolarHBondContact NZ-OG1 3.21Å
261	L	87	Confident	85.7	Confident	109 Å²	109	76.3 Å²	76.3	57%	0.571	38%	0.383	S	S	*	.	H	α-helix	trans	-73.4	-42.4	176.1	-65.8	168	0	0	0	110.8	F257 H258 K259 R264 W266	F257-L261 WeakPolarHBondContact O-CG 3.06Å; F257-L261 PolarHBondContact O-N 3.21Å; F257-L261 VanDerWaalsContact O-N 3.1Å; H258-L261 WeakPolarHBondContact O-CB 3.1Å; H258-L261 PolarHBondContact O-N 3.05Å; K259-L261 VanDerWaalsContact C-N 3.34Å; K259-L261 PolarHBondContact O-N 2.91Å; L261-R264 PolarHBondContact O-N 2.9Å; L261-W266 HydrophobicContact CD2-CE3 4.17Å; L261-W266 HydrophobicContact CD2-CZ3 4.44Å
262	E	87.2	Confident	85.3	Confident	133 Å²	133	75.4 Å²	75.4	62%	0.621	38%	0.378	S	S	*	.	H	α-helix	trans	-62.9	-47.1	174.8	-65.8	-169.2	125.9	0	0	112.7	H258 K259 R264	H258-E262 PolarHBondContact O-N 3.16Å; K259-E262 PolarHBondContact O-N 3.48Å; E262-R264 PolarHBondContact O-N 2.91Å
263	D	85.1	Confident	84.9	Confident	67 Å²	67	77 Å²	77	36%	0.358	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.2	178.2	-112.2	-26.3	0	0	0	113.4	K259 K265	K259-D263 WeakPolarHBondContact O-CB 3.38Å; K259-D263 PolarHBondContact O-N 2.64Å; D263-K265 HydrophobicContact CB-CB 4.25Å; D263-K265 HydrophobicContact CB-CD 4.06Å; D263-K265 HydrophobicContact CB-CG 4.33Å; D263-K265 WeakPolarHBondContact O-CG 3.43Å; D263-K265 PolarHBondContact O-N 2.99Å; D263-K265 IonicContact OD1-NZ 2.74Å; D263-K265 PolarHBondContact OD1-NZ 3.03Å; D263-K265 IonicContact OD2-NZ 3.18Å
264	R	81.5	Confident	84.3	Confident	228 Å²	228	77.8 Å²	77.8	86%	0.86	40%	0.396	S	S	*	.			trans	55.5	4.8	-167.8	-56.3	-176.1	-178.3	-175.7	-0.2	115.2	L261 E262 W266	L261-R264 PolarHBondContact O-N 2.9Å; E262-R264 PolarHBondContact O-N 2.91Å; R264-W266 PolarHBondContact O-N 2.98Å
265	K	79.8	Confident	83.7	Confident	120 Å²	120	82.8 Å²	82.8	52%	0.522	41%	0.413	S	S	.	.			trans	-84.4	48.5	178.1	-64	157.5	-161.7	151	0	111	D263	D263-K265 HydrophobicContact CB-CB 4.25Å; D263-K265 HydrophobicContact CB-CD 4.06Å; D263-K265 HydrophobicContact CB-CG 4.33Å; D263-K265 WeakPolarHBondContact O-CG 3.43Å; D263-K265 PolarHBondContact O-N 2.99Å; D263-K265 IonicContact OD1-NZ 2.74Å; D263-K265 PolarHBondContact OD1-NZ 3.03Å; D263-K265 IonicContact OD2-NZ 3.18Å
266	W	78.6	Confident	83.1	Confident	106 Å²	106	88.8 Å²	88.8	40%	0.402	43%	0.431	S	S	.	.			trans	-79.6	140.3	178.4	-179.5	-99.6	0	0	0	111	L10 F257 K260 L261 R264	L10-W266 HydrophobicContact CD1-CH2 3.5Å; L10-W266 VanDerWaalsContact CD1-CH2 3.5Å; L10-W266 HydrophobicContact CD1-CZ2 4.09Å; L10-W266 HydrophobicContact CD1-CZ3 4.38Å; L10-W266 HydrophobicContact CD2-CH2 4.35Å; L10-W266 HydrophobicContact CD2-CZ2 4.44Å; F257-W266 HydrophobicContact CD1-CZ3 4.3Å; K260-W266 HydrophobicContact CB-CE3 4.25Å; L261-W266 HydrophobicContact CD2-CE3 4.17Å; L261-W266 HydrophobicContact CD2-CZ3 4.44Å; R264-W266 PolarHBondContact O-N 2.98Å
267	H	81.8	Confident	81.9	Confident	80 Å²	80	98.9 Å²	98.9	37%	0.37	48%	0.475	S	S	.	.			trans	-118.9	131	169.5	-63.2	-91.9	0	0	0	108.5	W282 S287	H267-W282 HydrophobicContact CB-CZ2 4.26Å; H267-S287 PolarHBondContact NE2-OG 3.41Å
268	S	79.3	Confident	80.9	Confident	94 Å²	94	103.5 Å²	103.5	66%	0.657	50%	0.503	S	S	*	.			trans	-58.2	146.5	177.2	-56.5	0	0	0	0	112.2	W282	S268-W282 PolarHBondContact O-NE1 3Å
269	M	79.9	Confident	80.3	Confident	114 Å²	114	100.1 Å²	100.1	56%	0.562	49%	0.491	S	S	*	.			trans	-57.9	138.6	169.6	-66.8	179.3	-69.5	0	0	110.1	L10	L10-M269 HydrophobicContact CD1-CG 4.08Å; L10-M269 HydrophobicContact CD1-SD 4.1Å; L10-M269 HydrophobicContact CD2-CG 3.49Å; L10-M269 VanDerWaalsContact CD2-CG 3.49Å; L10-M269 HydrophobicContact CG-CG 3.62Å; L10-M269 HydrophobicContact CG-SD 4.06Å
270	A	75.6	Confident	80	Confident	32 Å²	32	104.5 Å²	104.5	26%	0.264	51%	0.511	S	S	.	.			trans	-111.4	129.8	175.2	0	0	0	0	0	110	G8 L272 W282	G8-A270 WeakPolarHBondContact CA-O 3.19Å; A270-L272 HydrophobicContact CB-CD2 3.81Å; A270-L272 HydrophobicContact CB-CG 4.25Å; A270-L272 PolarHBondContact O-N 3.27Å; A270-W282 HydrophobicContact CB-CG 4.31Å
271	S	82.9	Confident	80	Confident	92 Å²	92	105.8 Å²	105.8	64%	0.643	52%	0.52	S	S	*	.			trans	-72	118.1	164.5	176.3	0	0	0	0	108.5	N6	N6-S271 WeakPolarHBondContact O-CB 3.27Å; N6-S271 PolarHBondContact O-OG 2.82Å
272	L	83.9	Confident	80.1	Confident	13 Å²	13	101.4 Å²	101.4	7%	0.068	50%	0.496	C	S	.	.			trans	-122.1	125.9	-173.3	-62.9	-169.5	0	0	0	111.8	M5 N6 M31 I33 A270 W282	M5-L272 CarbonylContact C-O 3.2Å; M5-L272 HydrophobicContact CB-CB 4.36Å; M5-L272 WeakPolarHBondContact CB-O 3.41Å; M5-L272 PolarHBondContact O-N 2.99Å; N6-L272 PolarHBondContact N-O 3.01Å; N6-L272 PolarHBondContact OD1-O 3.48Å; M31-L272 HydrophobicContact CB-CD1 4.04Å; M31-L272 HydrophobicContact CE-CB 3.65Å; M31-L272 HydrophobicContact CE-CD1 3.92Å; M31-L272 HydrophobicContact CE-CG 4.29Å; I33-L272 HydrophobicContact CD1-CD1 3.76Å; I33-L272 HydrophobicContact CG1-CD1 4.19Å; A270-L272 HydrophobicContact CB-CD2 3.81Å; A270-L272 HydrophobicContact CB-CG 4.25Å; A270-L272 PolarHBondContact O-N 3.27Å; L272-W282 HydrophobicContact CD1-CB 4.12Å
273	S	82.8	Confident	80.1	Confident	33 Å²	33	102 Å²	102	23%	0.231	50%	0.499	C	S	.	.			trans	-99.1	109.2	-178.4	-170.8	0	0	0	0	112.3	N6 I275 S279	N6-S273 WeakPolarHBondContact OD1-CA 3.39Å; S273-I275 PolarHBondContact O-N 3.37Å; S273-S279 WeakPolarHBondContact O-CB 3.46Å; S273-S279 PolarHBondContact O-OG 3.36Å
274	C	80.7	Confident	80.2	Confident	35 Å²	35	98.9 Å²	98.9	24%	0.236	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-32.4	179.2	-64	0	0	0	0	114.9	C2 L27	C2-C274 WeakPolarHBondContact CA-SG 3.38Å; C2-C274 HydrophobicContact CB-CB 3.88Å; C2-C274 WeakPolarHBondContact CB-SG 3.26Å; C2-C274 WeakPolarHBondContact SG-CB 3.32Å; C2-C274 CovalentContact SG-SG 2.03Å; C2-C274 PolarHBondContact SG-SG 3.48Å; L27-C274 HydrophobicContact CD1-CB 4.27Å
275	I	78.6	Confident	80.5	Confident	159 Å²	159	88 Å²	88	82%	0.815	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-14.1	-163	-57.3	174.1	0	0	0	111.9	S273	S273-I275 PolarHBondContact O-N 3.37Å
276	R	76.3	Confident	81	Confident	187 Å²	187	85.8 Å²	85.8	71%	0.706	43%	0.429	S	S	*	.			trans	-88.8	120.3	-177.8	-68.6	-178.7	175.5	-167.6	-0.9	111.1	N278 S279	R276-N278 PolarHBondContact O-N 3.05Å; R276-S279 PolarHBondContact O-N 2.92Å; R276-S279 PolarHBondContact O-OG 3.16Å
277	K	66.4	Low	81.5	Confident	212 Å²	212	82.4 Å²	82.4	92%	0.922	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-21.4	179.6	-69.7	-172.6	175	-176.2	0	115.8
278	N	68	Low	81.9	Confident	155 Å²	155	78.9 Å²	78.9	83%	0.829	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	18.9	-176.9	-62.4	11.6	0	0	0	113	R276 K280	R276-N278 PolarHBondContact O-N 3.05Å; N278-K280 PolarHBondContact O-N 3.37Å
279	S	75.8	Confident	82.5	Confident	38 Å²	38	74.7 Å²	74.7	27%	0.266	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-63	124.2	174	-76.6	0	0	0	0	110.8	S273 R276	S273-S279 WeakPolarHBondContact O-CB 3.46Å; S273-S279 PolarHBondContact O-OG 3.36Å; R276-S279 PolarHBondContact O-N 2.92Å; R276-S279 PolarHBondContact O-OG 3.16Å
280	K	82.3	Confident	83	Confident	177 Å²	177	71.7 Å²	71.7	77%	0.77	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-80.7	137.1	173.7	-65.7	-174.4	178.4	-176.3	0	109.7	N278	N278-K280 PolarHBondContact O-N 3.37Å
281	P	86.9	Confident	83.7	Confident	38 Å²	38	71 Å²	71	25%	0.247	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-72	158.9	177.4	31.2	-36.5	0	0	0	111.9	M31 H32 Q283	M31-P281 WeakPolarHBondContact O-CA 3.41Å; M31-P281 WeakPolarHBondContact O-CB 3.48Å; H32-P281 HydrophobicContact CB-CB 3.93Å; P281-Q283 PolarHBondContact O-N 2.88Å; P281-Q283 PolarHBondContact O-NE2 2.89Å
282	W	89.5	Confident	84.2	Confident	16 Å²	16	66.6 Å²	66.6	6%	0.061	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-70.1	120.6	-175.3	179.9	49.8	0	0	0	112.2	L10 M31 H32 H267 S268 A270 L272 G284 G285 M288	L10-W282 HydrophobicContact CB-CH2 4.39Å; L10-W282 HydrophobicContact CD2-CH2 3.58Å; L10-W282 HydrophobicContact CD2-CZ2 3.6Å; L10-W282 WeakPolarHBondContact O-CZ3 3.49Å; M31-W282 PolarHBondContact O-N 2.99Å; H32-W282 WeakPolarHBondContact CB-O 3.47Å; H267-W282 HydrophobicContact CB-CZ2 4.26Å; S268-W282 PolarHBondContact O-NE1 3Å; A270-W282 HydrophobicContact CB-CG 4.31Å; L272-W282 HydrophobicContact CD1-CB 4.12Å; W282-G284 PolarHBondContact O-N 3.3Å; W282-G285 VanDerWaalsContact CE3-N 3.32Å; W282-G285 PolarHBondContact O-N 2.88Å; W282-G285 VanDerWaalsContact O-N 3.12Å; W282-M288 HydrophobicContact CH2-CB 3.96Å; W282-M288 HydrophobicContact CH2-CG 4.33Å; W282-M288 HydrophobicContact CZ3-CB 4.05Å; W282-M288 HydrophobicContact CZ3-CG 4.5Å
283	Q	86.2	Confident	84.5	Confident	147 Å²	147	68.3 Å²	68.3	69%	0.687	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-23	-177.6	-55.3	-59.7	-74.1	0	0	113	P281 G285	P281-Q283 PolarHBondContact O-N 2.88Å; P281-Q283 PolarHBondContact O-NE2 2.89Å; Q283-G285 VanDerWaalsContact C-N 3.3Å
284	G	87.2	Confident	84.7	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.01	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.6	173.8	0	0	0	0	0	114.3	W282 R286 S287 M288	W282-G284 PolarHBondContact O-N 3.3Å; G284-R286 PolarHBondContact O-N 3.36Å; G284-S287 WeakPolarHBondContact O-CB 3.39Å; G284-S287 PolarHBondContact O-N 2.97Å; G284-M288 PolarHBondContact O-N 3.32Å
285	G	88.9	Confident	84.9	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-52.5	-57.2	-170.2	0	0	0	0	0	114.3	H32 W282 Q283 S287 M288 L289	H32-G285 WeakPolarHBondContact O-CA 3.27Å; W282-G285 VanDerWaalsContact CE3-N 3.32Å; W282-G285 PolarHBondContact O-N 2.88Å; W282-G285 VanDerWaalsContact O-N 3.12Å; Q283-G285 VanDerWaalsContact C-N 3.3Å; G285-S287 VanDerWaalsContact C-N 3.33Å; G285-S287 PolarHBondContact O-N 2.84Å; G285-M288 PolarHBondContact O-N 3.03Å; G285-M288 VanDerWaalsContact O-N 3.17Å; G285-L289 WeakPolarHBondContact O-CB 3.27Å; G285-L289 PolarHBondContact O-N 2.87Å
286	R	89.4	Confident	85.3	Confident	72 Å²	72	66.3 Å²	66.3	27%	0.272	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-37.9	-176.8	-165.2	75.1	-160.2	-172	9.6	111.5	N58 D60 Y61 G284 M288 L289 E290	N58-R286 PolarHBondContact O-NH1 2.83Å; D60-R286 PolarHBondContact O-NH1 2.95Å; Y61-R286 HydrophobicContact CE1-CB 4.24Å; G284-R286 PolarHBondContact O-N 3.36Å; R286-M288 VanDerWaalsContact C-N 3.28Å; R286-M288 PolarHBondContact O-N 3.43Å; R286-L289 PolarHBondContact O-N 3.4Å; R286-E290 HydrophobicContact CG-CG 4.39Å; R286-E290 IonicContact CZ-OE1 3.45Å; R286-E290 IonicContact NE-OE1 3.27Å; R286-E290 PolarHBondContact NE-OE1 3.28Å; R286-E290 IonicContact NH2-OE1 2.77Å; R286-E290 PolarHBondContact NH2-OE1 3.13Å; R286-E290 WeakPolarHBondContact O-CB 3.18Å; R286-E290 VanDerWaalsContact O-CG 3.3Å; R286-E290 WeakPolarHBondContact O-CG 3.48Å; R286-E290 PolarHBondContact O-N 3.04Å
287	S	90.1	Very high	85.9	Confident	36 Å²	36	58 Å²	58	25%	0.252	29%	0.29	S	S	.	.	H	α-helix	trans	-60.1	-38.3	174.9	-178	0	0	0	0	111.6	K260 H267 G284 G285 T291	K260-S287 VanDerWaalsContact CE-O 3.24Å; K260-S287 WeakPolarHBondContact CE-O 3.29Å; K260-S287 PolarHBondContact NZ-O 3.39Å; K260-S287 PolarHBondContact NZ-OG 3.4Å; H267-S287 PolarHBondContact NE2-OG 3.41Å; G284-S287 WeakPolarHBondContact O-CB 3.39Å; G284-S287 PolarHBondContact O-N 2.97Å; G285-S287 VanDerWaalsContact C-N 3.33Å; G285-S287 PolarHBondContact O-N 2.84Å; S287-T291 PolarHBondContact O-OG1 2.66Å
288	M	90.1	Very high	86.9	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.03	25%	0.254	C	S	.	.	H	α-helix	trans	-73.8	-48.4	175.3	-170.1	63.9	-166.2	0	0	111.9	P34 A256 F257 K260 W282 G284 G285 R286 E290 T291 I292	P34-M288 HydrophobicContact CG-CB 4Å; P34-M288 HydrophobicContact CG-CG 4.1Å; A256-M288 HydrophobicContact CB-CE 4.05Å; F257-M288 HydrophobicContact CD1-CE 3.52Å; F257-M288 HydrophobicContact CD1-SD 4.45Å; F257-M288 HydrophobicContact CE1-CE 3.3Å; F257-M288 HydrophobicContact CE1-SD 4.28Å; F257-M288 HydrophobicContact CG-CE 4.31Å; F257-M288 HydrophobicContact CZ-CE 3.98Å; K260-M288 HydrophobicContact CG-SD 3.94Å; W282-M288 HydrophobicContact CH2-CB 3.96Å; W282-M288 HydrophobicContact CH2-CG 4.33Å; W282-M288 HydrophobicContact CZ3-CB 4.05Å; W282-M288 HydrophobicContact CZ3-CG 4.5Å; G284-M288 PolarHBondContact O-N 3.32Å; G285-M288 PolarHBondContact O-N 3.03Å; G285-M288 VanDerWaalsContact O-N 3.17Å; R286-M288 VanDerWaalsContact C-N 3.28Å; R286-M288 PolarHBondContact O-N 3.43Å; M288-E290 PolarHBondContact O-N 3.02Å; M288-T291 WeakPolarHBondContact O-CA 3.47Å; M288-T291 WeakPolarHBondContact O-CB 3.34Å; M288-T291 PolarHBondContact O-N 3.17Å; M288-I292 HydrophobicContact CE-CD1 3.94Å; M288-I292 HydrophobicContact CE-CG1 3.96Å; M288-I292 HydrophobicContact CG-CD1 3.98Å; M288-I292 WeakPolarHBondContact O-CG1 3.16Å; M288-I292 PolarHBondContact O-N 3.1Å
289	L	90.9	Very high	87.7	Confident	5 Å²	5	41.7 Å²	41.7	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-53.6	-49	178.7	-174.6	72.7	0	0	0	112.3	P34 Y61 L63 G285 R286 T291 I292 K293	P34-L289 HydrophobicContact CB-CB 4.44Å; P34-L289 HydrophobicContact CB-CD1 3.98Å; P34-L289 HydrophobicContact CG-CB 4.15Å; Y61-L289 HydrophobicContact CD1-CB 4.47Å; Y61-L289 HydrophobicContact CD1-CD2 3.91Å; Y61-L289 HydrophobicContact CE1-CD2 4.35Å; Y61-L289 HydrophobicContact CG-CD2 4.34Å; Y61-L289 WeakPolarHBondContact O-CD1 3.39Å; L63-L289 HydrophobicContact CD1-CD1 3.84Å; L63-L289 HydrophobicContact CD2-CD1 4.31Å; L63-L289 HydrophobicContact CG-CD1 3.89Å; G285-L289 WeakPolarHBondContact O-CB 3.27Å; G285-L289 PolarHBondContact O-N 2.87Å; R286-L289 PolarHBondContact O-N 3.4Å; L289-T291 PolarHBondContact O-N 3.43Å; L289-I292 PolarHBondContact O-N 3.17Å; L289-K293 WeakPolarHBondContact O-CB 3.38Å; L289-K293 PolarHBondContact O-N 3.2Å
290	E	89.8	Confident	88.1	Confident	52 Å²	52	40.9 Å²	40.9	24%	0.243	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-24.9	177.7	-70.6	-68	144.8	0	0	113.1	R286 M288 K294	R286-E290 HydrophobicContact CG-CG 4.39Å; R286-E290 IonicContact CZ-OE1 3.45Å; R286-E290 IonicContact NE-OE1 3.27Å; R286-E290 PolarHBondContact NE-OE1 3.28Å; R286-E290 IonicContact NH2-OE1 2.77Å; R286-E290 PolarHBondContact NH2-OE1 3.13Å; R286-E290 WeakPolarHBondContact O-CB 3.18Å; R286-E290 VanDerWaalsContact O-CG 3.3Å; R286-E290 WeakPolarHBondContact O-CG 3.48Å; R286-E290 PolarHBondContact O-N 3.04Å; M288-E290 PolarHBondContact O-N 3.02Å; E290-K294 WeakPolarHBondContact O-CB 3.25Å; E290-K294 WeakPolarHBondContact O-CD 3.19Å; E290-K294 VanDerWaalsContact O-CG 3.29Å; E290-K294 WeakPolarHBondContact O-CG 3.3Å; E290-K294 PolarHBondContact O-N 2.99Å; E290-K294 VanDerWaalsContact OE2-CE 3.29Å; E290-K294 WeakPolarHBondContact OE2-CE 3.44Å; E290-K294 IonicContact OE2-NZ 2.8Å; E290-K294 PolarHBondContact OE2-NZ 3.25Å
291	T	91.4	Very high	88.3	Confident	16 Å²	16	33 Å²	33	10%	0.098	17%	0.174	C	C	.	.	H	α-helix	trans	-82.4	-38.3	177.7	-51.4	0	0	0	0	111.2	K259 K260 S287 M288 L289 K294 G295	K259-T291 HydrophobicContact CB-CG2 4.48Å; K259-T291 HydrophobicContact CD-CG2 4.34Å; K259-T291 HydrophobicContact CG-CG2 4.45Å; K260-T291 HydrophobicContact CD-CG2 4.17Å; K260-T291 WeakPolarHBondContact CE-OG1 3.46Å; K260-T291 HydrophobicContact CG-CG2 4.18Å; K260-T291 PolarHBondContact NZ-OG1 3.21Å; S287-T291 PolarHBondContact O-OG1 2.66Å; M288-T291 WeakPolarHBondContact O-CA 3.47Å; M288-T291 WeakPolarHBondContact O-CB 3.34Å; M288-T291 PolarHBondContact O-N 3.17Å; L289-T291 PolarHBondContact O-N 3.43Å; T291-K294 CarbonylContact O-C 3.52Å; T291-K294 PolarHBondContact O-N 2.89Å; T291-G295 WeakPolarHBondContact O-CA 3.45Å; T291-G295 PolarHBondContact O-N 3.35Å; T291-G295 VanDerWaalsContact O-N 3.09Å
292	I	92.2	Very high	88.2	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.6	-47.7	171.2	-64.6	165	0	0	0	109.9	P34 L36 L63 L252 L253 A256 M288 L289 K294 G295 F306	P34-I292 HydrophobicContact CB-CD1 3.92Å; P34-I292 HydrophobicContact CG-CD1 4.41Å; L36-I292 HydrophobicContact CD1-CD1 4.36Å; L36-I292 HydrophobicContact CD2-CG2 4.04Å; L63-I292 HydrophobicContact CD1-CG2 3.89Å; L252-I292 HydrophobicContact CD2-CG2 4.07Å; L252-I292 HydrophobicContact CG-CG2 4.36Å; L253-I292 HydrophobicContact CD2-CD1 3.82Å; L253-I292 HydrophobicContact CD2-CG1 4.22Å; A256-I292 HydrophobicContact CB-CG1 3.78Å; M288-I292 HydrophobicContact CE-CD1 3.94Å; M288-I292 HydrophobicContact CE-CG1 3.96Å; M288-I292 HydrophobicContact CG-CD1 3.98Å; M288-I292 WeakPolarHBondContact O-CG1 3.16Å; M288-I292 PolarHBondContact O-N 3.1Å; L289-I292 PolarHBondContact O-N 3.17Å; I292-K294 PolarHBondContact O-N 2.85Å; I292-G295 PolarHBondContact O-N 3.45Å; I292-G295 VanDerWaalsContact O-N 3.12Å; I292-F306 HydrophobicContact CG2-CE2 4.27Å
293	K	90.4	Very high	88.1	Confident	50 Å²	50	35.6 Å²	35.6	22%	0.217	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-30.9	178.7	-162.9	177.3	-172.7	174.6	0	113.3	L289 F306 G307 E308	L289-K293 WeakPolarHBondContact O-CB 3.38Å; L289-K293 PolarHBondContact O-N 3.2Å; K293-F306 HydrophobicContact CG-CB 4Å; K293-G307 WeakPolarHBondContact CE-O 3.33Å; K293-G307 PolarHBondContact NZ-O 3.2Å; K293-E308 PolarHBondContact NZ-O 3.27Å
294	K	88.6	Confident	88.3	Confident	137 Å²	137	28.6 Å²	28.6	60%	0.596	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	20.4	179.5	-60.9	169.4	-167.2	161.1	0	113	K259 E290 T291 I292	K259-K294 PolarHBondContact NZ-O 2.91Å; E290-K294 WeakPolarHBondContact O-CB 3.25Å; E290-K294 WeakPolarHBondContact O-CD 3.19Å; E290-K294 VanDerWaalsContact O-CG 3.29Å; E290-K294 WeakPolarHBondContact O-CG 3.3Å; E290-K294 PolarHBondContact O-N 2.99Å; E290-K294 VanDerWaalsContact OE2-CE 3.29Å; E290-K294 WeakPolarHBondContact OE2-CE 3.44Å; E290-K294 IonicContact OE2-NZ 2.8Å; E290-K294 PolarHBondContact OE2-NZ 3.25Å; T291-K294 CarbonylContact O-C 3.52Å; T291-K294 PolarHBondContact O-N 2.89Å; I292-K294 PolarHBondContact O-N 2.85Å
295	G	83.9	Confident	88.5	Confident	4 Å²	4	33.1 Å²	33.1	4%	0.041	17%	0.173	C	C	.	.			trans	-114.7	13.6	-171.8	0	0	0	0	0	114.9	L252 N255 T291 I292	L252-G295 VanDerWaalsContact CD1-C 3.42Å; L252-G295 WeakPolarHBondContact CD1-O 3.44Å; N255-G295 PolarHBondContact ND2-O 3.01Å; T291-G295 WeakPolarHBondContact O-CA 3.45Å; T291-G295 PolarHBondContact O-N 3.35Å; T291-G295 VanDerWaalsContact O-N 3.09Å; I292-G295 PolarHBondContact O-N 3.45Å; I292-G295 VanDerWaalsContact O-N 3.12Å
296	G	86.8	Confident	88.5	Confident	43 Å²	43	33.8 Å²	33.8	44%	0.443	18%	0.176	S	C	.	.			trans	-46.4	149.6	-166.6	0	0	0	0	0	116	L304	G296-L304 WeakPolarHBondContact CA-O 3.21Å
297	V	89.1	Confident	88.3	Confident	12 Å²	12	31.6 Å²	31.6	7%	0.073	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.2	-169.2	-64.8	0	0	0	0	112.9	L251 L252 N255 L304	L251-V297 HydrophobicContact CD2-CB 4.3Å; L251-V297 HydrophobicContact CD2-CG2 4.35Å; L251-V297 HydrophobicContact CG-CB 4.29Å; L251-V297 HydrophobicContact CG-CG1 4.36Å; L251-V297 HydrophobicContact CG-CG2 4.3Å; L252-V297 HydrophobicContact CB-CG1 4.45Å; L252-V297 HydrophobicContact CB-CG2 3.85Å; L252-V297 HydrophobicContact CD1-CG1 4.11Å; L252-V297 HydrophobicContact CD1-CG2 4.34Å; N255-V297 HydrophobicContact CB-CG1 4.01Å; V297-L304 HydrophobicContact CG2-CB 4.19Å; V297-L304 HydrophobicContact CG2-CD2 4.49Å; V297-L304 PolarHBondContact N-O 2.94Å; V297-L304 VanDerWaalsContact N-O 3.11Å; V297-L304 PolarHBondContact O-N 3.18Å
298	S	87.3	Confident	87.8	Confident	26 Å²	26	39 Å²	39	18%	0.182	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	112.4	169.2	-164	0	0	0	0	109.3	R219 E303	R219-S298 WeakPolarHBondContact CB-O 3.3Å; S298-E303 WeakPolarHBondContact CA-OE2 3.44Å; S298-E303 WeakPolarHBondContact CB-OE1 3.3Å; S298-E303 WeakPolarHBondContact CB-OE2 3.39Å; S298-E303 PolarHBondContact OG-OE1 3.34Å
299	G	84.6	Confident	87.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.			trans	-123.9	-153.8	-171.3	0	0	0	0	0	114.5	D248 G302	D248-G299 VanDerWaalsContact OD1-CA 3.27Å; D248-G299 WeakPolarHBondContact OD1-CA 3.43Å; G299-G302 PolarHBondContact N-O 3.16Å
300	L	83.8	Confident	86.9	Confident	21 Å²	21	43.5 Å²	43.5	11%	0.11	23%	0.232	C	C	.	.	S	Bend	trans	-71	-37.1	173.8	-67	177.6	0	0	0	111.8	I224 L228 L244 Y247 D248 G302	I224-L300 HydrophobicContact CD1-CD2 3.99Å; I224-L300 HydrophobicContact CG2-CD2 3.91Å; L228-L300 HydrophobicContact CB-CD2 4.38Å; L228-L300 WeakPolarHBondContact O-CD2 3.46Å; L244-L300 HydrophobicContact CD2-CB 4.37Å; L244-L300 HydrophobicContact CD2-CD1 3.95Å; Y247-L300 HydrophobicContact CD1-CD1 3.6Å; Y247-L300 HydrophobicContact CD1-CG 3.74Å; Y247-L300 HydrophobicContact CD2-CD1 4.34Å; Y247-L300 HydrophobicContact CE1-CD1 4.21Å; Y247-L300 HydrophobicContact CE1-CG 4.09Å; Y247-L300 HydrophobicContact CG-CD1 3.69Å; Y247-L300 HydrophobicContact CG-CG 4.35Å; D248-L300 PolarHBondContact OD1-N 2.81Å; D248-L300 PolarHBondContact OD2-N 3.29Å; L300-G302 VanDerWaalsContact C-N 3.34Å
301	T	87.2	Confident	86.7	Confident	12 Å²	12	41.1 Å²	41.1	7%	0.074	22%	0.222	C	C	.	.	S	Bend	trans	-84.4	-4.8	-179.2	64.4	0	0	0	0	114.1	F207 L244 Y245 D248	F207-T301 HydrophobicContact CD1-CG2 4.05Å; F207-T301 WeakPolarHBondContact CD1-O 3.31Å; F207-T301 HydrophobicContact CE1-CG2 3.78Å; F207-T301 HydrophobicContact CZ-CG2 4.28Å; L244-T301 HydrophobicContact CB-CG2 3.67Å; Y245-T301 HydrophobicContact CD1-CG2 3.85Å; Y245-T301 HydrophobicContact CD2-CG2 4.24Å; Y245-T301 HydrophobicContact CE1-CG2 3.75Å; Y245-T301 HydrophobicContact CE2-CG2 4.15Å; Y245-T301 HydrophobicContact CG-CG2 4.1Å; D248-T301 VanDerWaalsContact OD2-CB 3.31Å; D248-T301 WeakPolarHBondContact OD2-CB 3.33Å; D248-T301 WeakPolarHBondContact OD2-CG2 3.21Å; D248-T301 PolarHBondContact OD2-N 3.2Å; D248-T301 PolarHBondContact OD2-OG1 2.88Å
302	G	85.4	Confident	86.6	Confident	5 Å²	5	40.5 Å²	40.5	5%	0.052	22%	0.217	C	C	.	.	S	Bend	trans	109	-144.6	-172.3	0	0	0	0	0	111.1	G299 L300 L304	G299-G302 PolarHBondContact N-O 3.16Å; L300-G302 VanDerWaalsContact C-N 3.34Å; G302-L304 PolarHBondContact O-N 2.95Å
303	E	87.1	Confident	86.4	Confident	102 Å²	102	43 Å²	43	48%	0.477	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	110.1	176.6	-57.3	-50.4	129.2	0	0	110.9	S298 N314	S298-E303 WeakPolarHBondContact CA-OE2 3.44Å; S298-E303 WeakPolarHBondContact CB-OE1 3.3Å; S298-E303 WeakPolarHBondContact CB-OE2 3.39Å; S298-E303 PolarHBondContact OG-OE1 3.34Å; E303-N314 PolarHBondContact O-ND2 2.71Å
304	L	90.7	Very high	86.3	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	105.2	173.1	176.7	60	0	0	0	109.9	V65 D248 L252 G296 V297 G302 N312	V65-L304 HydrophobicContact CG1-CD1 4.07Å; V65-L304 HydrophobicContact CG1-CD2 4.23Å; D248-L304 HydrophobicContact CB-CD2 3.79Å; L252-L304 HydrophobicContact CB-CD2 4.33Å; L252-L304 HydrophobicContact CD2-CD2 4.03Å; L252-L304 HydrophobicContact CD2-CG 4.28Å; G296-L304 WeakPolarHBondContact CA-O 3.21Å; V297-L304 HydrophobicContact CG2-CB 4.19Å; V297-L304 HydrophobicContact CG2-CD2 4.49Å; V297-L304 PolarHBondContact N-O 2.94Å; V297-L304 VanDerWaalsContact N-O 3.11Å; V297-L304 PolarHBondContact O-N 3.18Å; G302-L304 PolarHBondContact O-N 2.95Å; L304-N312 HydrophobicContact CD1-CB 4.36Å; L304-N312 WeakPolarHBondContact CD1-ND2 3.07Å
305	E	90.4	Very high	86.3	Confident	96 Å²	96	36.8 Å²	36.8	45%	0.449	21%	0.21	S	C	.	.			trans	-132.8	174.2	173.7	73	-170.4	137.2	0	0	111.1	N312 P313 N314	E305-N312 WeakPolarHBondContact O-CA 3.27Å; E305-P313 HydrophobicContact CG-CG 4.17Å; E305-N314 PolarHBondContact OE1-ND2 3.26Å
306	F	90.5	Very high	86.6	Confident	15 Å²	15	39.5 Å²	39.5	7%	0.066	22%	0.221	C	C	.	.			trans	-130.7	123.1	-179.6	-67.7	-66	0	0	0	111.3	L36 L63 V65 L252 I292 K293	L36-F306 HydrophobicContact CD2-CZ 4.49Å; L63-F306 HydrophobicContact CB-CD1 4.22Å; L63-F306 HydrophobicContact CB-CE1 3.83Å; L63-F306 HydrophobicContact CB-CE2 4.26Å; L63-F306 HydrophobicContact CB-CZ 3.85Å; L63-F306 HydrophobicContact CD1-CD2 3.89Å; L63-F306 HydrophobicContact CD1-CE2 3.75Å; L63-F306 HydrophobicContact CD1-CG 4.41Å; L63-F306 HydrophobicContact CD1-CZ 4.2Å; L63-F306 HydrophobicContact CD2-CG 4.43Å; V65-F306 HydrophobicContact CG2-CZ 4.21Å; L252-F306 HydrophobicContact CD2-CD2 4.45Å; L252-F306 HydrophobicContact CD2-CE2 3.61Å; L252-F306 HydrophobicContact CD2-CZ 4.32Å; I292-F306 HydrophobicContact CG2-CE2 4.27Å; K293-F306 HydrophobicContact CG-CB 4Å
307	G	84.2	Confident	86.9	Confident	26 Å²	26	37.5 Å²	37.5	27%	0.268	20%	0.2	S	C	.	.			trans	-65.9	176.7	173.8	0	0	0	0	0	112.9	K293 N309 G310 G311	K293-G307 WeakPolarHBondContact CE-O 3.33Å; K293-G307 PolarHBondContact NZ-O 3.2Å; G307-N309 PolarHBondContact O-N 3.35Å; G307-G310 PolarHBondContact O-N 3.47Å; G307-G311 PolarHBondContact N-O 2.91Å
308	E	80.6	Confident	87	Confident	191 Å²	191	37.8 Å²	37.8	89%	0.893	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-37.8	178.9	-64	-160	131.4	0	0	112.3	K293 G310	K293-E308 PolarHBondContact NZ-O 3.27Å; E308-G310 PolarHBondContact O-N 3.42Å
309	N	77.8	Confident	87.3	Confident	100 Å²	100	36.6 Å²	36.6	54%	0.535	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-0.4	175.8	70.9	8.7	0	0	0	115.3	R54 G307 G311	R54-N309 PolarHBondContact NE-O 3.24Å; R54-N309 PolarHBondContact NH1-O 3.42Å; R54-N309 VanDerWaalsContact NH1-O 3.09Å; R54-N309 PolarHBondContact NH2-O 3Å; G307-N309 PolarHBondContact O-N 3.35Å; N309-G311 VanDerWaalsContact C-N 3.28Å; N309-G311 PolarHBondContact O-N 2.99Å; N309-G311 PolarHBondContact OD1-N 3Å
310	G	82.5	Confident	87.6	Confident	5 Å²	5	37.1 Å²	37.1	5%	0.052	20%	0.195	C	C	.	.	S	Bend	trans	72	13.4	179.7	0	0	0	0	0	115.3	L63 S64 G307 E308	L63-G310 CarbonylContact C-O 3.5Å; L63-G310 WeakPolarHBondContact CA-O 3.29Å; S64-G310 PolarHBondContact N-O 3.14Å; G307-G310 PolarHBondContact O-N 3.47Å; E308-G310 PolarHBondContact O-N 3.42Å
311	G	87.1	Confident	87.8	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.031	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-100.2	151.8	167.5	0	0	0	0	0	112.1	G307 N309 P313	G307-G311 PolarHBondContact N-O 2.91Å; N309-G311 VanDerWaalsContact C-N 3.28Å; N309-G311 PolarHBondContact O-N 2.99Å; N309-G311 PolarHBondContact OD1-N 3Å; G311-P313 WeakPolarHBondContact O-CD 3.46Å
312	N	89.3	Confident	87.5	Confident	2 Å²	2	36 Å²	36	1%	0.011	19%	0.19	C	C	.	.			trans	-71.5	120.6	168.1	180	-1.3	0	0	0	110.4	S64 V65 P67 P68 L304 E305 N314	S64-N312 PolarHBondContact O-N 3.14Å; V65-N312 WeakPolarHBondContact O-CB 3.22Å; V65-N312 PolarHBondContact O-ND2 2.95Å; P67-N312 WeakPolarHBondContact CA-O 3.4Å; P67-N312 HydrophobicContact CG-CB 4.31Å; P68-N312 VanDerWaalsContact CD-O 3.23Å; P68-N312 WeakPolarHBondContact CD-O 3.41Å; L304-N312 HydrophobicContact CD1-CB 4.36Å; L304-N312 WeakPolarHBondContact CD1-ND2 3.07Å; E305-N312 WeakPolarHBondContact O-CA 3.27Å; N312-N314 PolarHBondContact OD1-N 3.31Å
313	P	87.1	Confident	86.5	Confident	53 Å²	53	39 Å²	39	34%	0.344	21%	0.205	S	C	.	.			trans	-82.1	-18.2	178.9	33.7	-34.7	0	0	0	113.4	E305 G311 V315	E305-P313 HydrophobicContact CG-CG 4.17Å; G311-P313 WeakPolarHBondContact O-CD 3.46Å; P313-V315 PolarHBondContact O-N 2.9Å
314	N	87.7	Confident	85	Confident	53 Å²	53	40.9 Å²	40.9	28%	0.283	21%	0.209	S	C	.	.			trans	-85.9	98	-165.4	-67.1	-27.3	0	0	0	111.1	P67 E303 E305 N312	P67-N314 WeakPolarHBondContact CG-O 3.31Å; E303-N314 PolarHBondContact O-ND2 2.71Å; E305-N314 PolarHBondContact OE1-ND2 3.26Å; N312-N314 PolarHBondContact OD1-N 3.31Å
315	V	89	Confident	82.8	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.024	23%	0.226	C	C	.	.			trans	-133.8	139.4	172.5	70.3	0	0	0	0	110.6	P67 Y70 Q205 P313 F317 N339 P340	P67-V315 HydrophobicContact CB-CB 3.85Å; P67-V315 HydrophobicContact CB-CG1 4.45Å; P67-V315 HydrophobicContact CB-CG2 4.36Å; P67-V315 HydrophobicContact CG-CB 3.98Å; P67-V315 HydrophobicContact CG-CG2 4.46Å; Y70-V315 HydrophobicContact CD2-CG1 3.7Å; Y70-V315 HydrophobicContact CE2-CG1 4.07Å; Q205-V315 HydrophobicContact CG-CG2 4.34Å; P313-V315 PolarHBondContact O-N 2.9Å; V315-F317 HydrophobicContact CG1-CE2 4.2Å; V315-F317 HydrophobicContact CG2-CD2 4.14Å; V315-F317 HydrophobicContact CG2-CE2 3.55Å; V315-F317 HydrophobicContact CG2-CZ 4.1Å; V315-N339 WeakPolarHBondContact O-CB 3.29Å; V315-P340 HydrophobicContact CG1-CG 3.72Å
316	H	90.7	Very high	80.5	Confident	61 Å²	61	44.7 Å²	44.7	28%	0.282	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.7	170.8	-60.1	-85.4	0	0	0	109	T206	T206-H316 HydrophobicContact CG2-CB 3.88Å; T206-H316 PolarHBondContact N-O 2.76Å
317	F	92.5	Very high	78.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	147.9	168.1	-69.8	-93.8	0	0	0	109.1	L71 V74 E182 I203 R204 V315 C337 W338	L71-F317 HydrophobicContact CD2-CE1 3.51Å; L71-F317 HydrophobicContact CD2-CZ 3.75Å; V74-F317 HydrophobicContact CG2-CD2 3.84Å; V74-F317 HydrophobicContact CG2-CE2 4.14Å; V74-F317 HydrophobicContact CG2-CG 4.07Å; E182-F317 HydrophobicContact CG-CE1 4.11Å; E182-F317 HydrophobicContact CG-CZ 4.5Å; I203-F317 HydrophobicContact CG2-CD1 4.14Å; R204-F317 CarbonylContact O-C 3.57Å; R204-F317 VanDerWaalsContact O-CA 3.24Å; R204-F317 WeakPolarHBondContact O-CA 3.36Å; R204-F317 WeakPolarHBondContact O-CD1 3.5Å; V315-F317 HydrophobicContact CG1-CE2 4.2Å; V315-F317 HydrophobicContact CG2-CD2 4.14Å; V315-F317 HydrophobicContact CG2-CE2 3.55Å; V315-F317 HydrophobicContact CG2-CZ 4.1Å; F317-C337 CarbonylContact O-C 3.59Å; F317-C337 VanDerWaalsContact O-CA 3.24Å; F317-C337 WeakPolarHBondContact O-CA 3.46Å; F317-C337 PolarHBondContact O-SG 2.87Å; F317-W338 HydrophobicContact CB-CB 4.38Å; F317-W338 AromaticContact CD2-CE3 3.87Å; F317-W338 HydrophobicContact CD2-CE3 3.87Å; F317-W338 HydrophobicContact CD2-CZ3 4.24Å; F317-W338 HydrophobicContact CE2-CZ3 4.46Å; F317-W338 PolarHBondContact N-O 3.25Å; F317-W338 PolarHBondContact O-N 3.33Å
318	E	91.7	Very high	76	Confident	18 Å²	18	59.2 Å²	59.2	8%	0.084	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.7	162	65.6	-177.2	-161.8	0	0	110.7	R204 T206 L320 K334	R204-E318 HydrophobicContact CG-CG 3.81Å; R204-E318 IonicContact CZ-OE1 2.71Å; R204-E318 VanDerWaalsContact CZ-OE1 3.26Å; R204-E318 PolarHBondContact N-O 2.87Å; R204-E318 VanDerWaalsContact N-O 3.15Å; R204-E318 IonicContact NE-OE1 2.72Å; R204-E318 PolarHBondContact NE-OE1 2.81Å; R204-E318 IonicContact NH2-OE1 2.66Å; R204-E318 PolarHBondContact NH2-OE1 3.5Å; R204-E318 PolarHBondContact O-N 2.88Å; T206-E318 HydrophobicContact CG2-CB 4Å; T206-E318 HydrophobicContact CG2-CG 4.24Å; T206-E318 PolarHBondContact OG1-OE2 3.25Å; E318-L320 HydrophobicContact CG-CD2 4.17Å; E318-L320 HydrophobicContact CG-CG 4.33Å; E318-K334 HydrophobicContact CB-CD 4.38Å; E318-K334 IonicContact OE2-NZ 3Å; E318-K334 PolarHBondContact OE2-NZ 3.05Å
319	I	93	Very high	74.6	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	112.5	-179.7	-55.7	160.9	0	0	0	106.2	V78 T201 I202 I203 L335 G336 W338 L344 L348	V78-I319 HydrophobicContact CG2-CD1 3.78Å; V78-I319 HydrophobicContact CG2-CG1 4.41Å; T201-I319 HydrophobicContact CG2-CG2 3.64Å; I202-I319 WeakPolarHBondContact O-CA 3.42Å; I203-I319 HydrophobicContact CG1-CG1 4.44Å; I203-I319 HydrophobicContact CG1-CG2 4.43Å; I319-L335 HydrophobicContact CG2-CD1 4.48Å; I319-L335 WeakPolarHBondContact O-CB 3.34Å; I319-L335 PolarHBondContact O-N 2.97Å; I319-G336 PolarHBondContact N-O 2.79Å; I319-G336 PolarHBondContact O-N 3.14Å; I319-W338 HydrophobicContact CD1-CB 4.45Å; I319-L344 HydrophobicContact CD1-CD1 3.61Å; I319-L348 HydrophobicContact CB-CD2 4.01Å; I319-L348 HydrophobicContact CD1-CD1 4.34Å; I319-L348 HydrophobicContact CD1-CD2 4.06Å; I319-L348 HydrophobicContact CG2-CD2 3.57Å
320	L	91.2	Very high	73.8	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.063	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	151.6	-178	-55.3	-178.6	0	0	0	109.4	V189 T201 I202 E318 V332 R333 K334	V189-L320 HydrophobicContact CG2-CD1 4.5Å; T201-L320 CarbonylContact C-O 3.59Å; T201-L320 VanDerWaalsContact CA-O 3.29Å; T201-L320 WeakPolarHBondContact CA-O 3.38Å; I202-L320 HydrophobicContact CB-CB 4.33Å; I202-L320 PolarHBondContact N-O 2.9Å; I202-L320 PolarHBondContact O-N 3.01Å; E318-L320 HydrophobicContact CG-CD2 4.17Å; E318-L320 HydrophobicContact CG-CG 4.33Å; L320-V332 HydrophobicContact CB-CG1 3.66Å; L320-V332 HydrophobicContact CD1-CG1 4.16Å; L320-V332 HydrophobicContact CG-CG1 4.35Å; L320-R333 WeakPolarHBondContact CA-O 3.39Å; L320-K334 HydrophobicContact CD2-CB 4.06Å; L320-K334 HydrophobicContact CD2-CG 4.21Å
321	G	88.1	Confident	73.1	Confident	3 Å²	3	53.5 Å²	53.5	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	149.8	177.5	0	0	0	0	0	112.4	L200 N323 V332 R333	L200-G321 WeakPolarHBondContact O-CA 3.5Å; G321-N323 PolarHBondContact O-N 3.28Å; G321-V332 WeakPolarHBondContact O-CA 3.32Å; G321-R333 PolarHBondContact N-O 3.24Å; G321-R333 PolarHBondContact O-N 3.46Å
322	T	80.8	Confident	72.8	Confident	7 Å²	7	56 Å²	56	4%	0.043	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	129.7	172.2	43.6	0	0	0	0	111.8	V193 L200 G331	V193-T322 HydrophobicContact CG1-CG2 4.28Å; V193-T322 HydrophobicContact CG2-CG2 4.43Å; L200-T322 HydrophobicContact CB-CG2 3.77Å; L200-T322 PolarHBondContact N-OG1 3.47Å; L200-T322 PolarHBondContact O-N 3.26Å; T322-G331 WeakPolarHBondContact CA-O 3.49Å
323	N	65.2	Low	72.5	Confident	68 Å²	68	59.7 Å²	59.7	36%	0.364	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.6	173.4	-171.5	51.1	0	0	0	110.6	G321 G325 G331 R333	G321-N323 PolarHBondContact O-N 3.28Å; N323-G325 PolarHBondContact O-N 2.64Å; N323-G331 PolarHBondContact N-O 3.15Å; N323-R333 HydrophobicContact CB-CB 4.38Å; N323-R333 HydrophobicContact CB-CG 4.31Å
324	Y	55.3	Low	72.5	Confident	141 Å²	141	62 Å²	62	55%	0.553	32%	0.321	S	S	*	.			trans	-98.4	73.6	171.2	-68.4	-81.2	0	0	0	109.2	G198 R330	G198-Y324 PolarHBondContact O-OH 3.35Å; Y324-R330 PolarHBondContact OH-NH2 2.96Å; Y324-R330 VanDerWaalsContact OH-NH2 3.15Å
325	G	44.6	Very low	72.5	Confident	35 Å²	35	60 Å²	60	36%	0.361	31%	0.311	S	S	.	.			trans	-99.1	147.2	171.9	0	0	0	0	0	110.9	N323 E327	N323-G325 PolarHBondContact O-N 2.64Å; G325-E327 VanDerWaalsContact C-N 3.27Å; G325-E327 PolarHBondContact O-N 2.95Å
326	E	42.7	Very low	72.5	Confident	141 Å²	141	60.2 Å²	60.2	66%	0.659	31%	0.313	S	S	*	.	S	Bend	trans	-71.9	-19.4	-176.3	-64.5	-179.8	129.3	0	0	113.3
327	E	39	Very low	72.5	Confident	174 Å²	174	59 Å²	59	81%	0.813	31%	0.311	S	S	*	.	S	Bend	trans	-108.3	124.9	179.9	-63.8	-168.9	150.2	0	0	112.7	G325	G325-E327 VanDerWaalsContact C-N 3.27Å; G325-E327 PolarHBondContact O-N 2.95Å
328	L	40.6	Very low	72.5	Confident	172 Å²	172	59.8 Å²	59.8	90%	0.901	31%	0.314	S	S	*	.	S	Bend	trans	62.8	47.3	172.1	-69.9	86.3	0	0	0	117.5
329	G	50	Low	72.4	Confident	53 Å²	53	60.2 Å²	60.2	55%	0.546	32%	0.317	S	S	.	.	S	Bend	trans	81.9	-172.9	151.7	0	0	0	0	0	116.5	G331	G329-G331 VanDerWaalsContact C-N 3.33Å; G329-G331 PolarHBondContact O-N 2.68Å
330	R	61.8	Low	72.1	Confident	94 Å²	94	62.5 Å²	62.5	36%	0.355	33%	0.332	S	S	.	.	S	Bend	trans	-67	90.3	176.8	-77.8	-174	160.7	-121.4	-20.4	109.9	V193 S196 G198 Y324	V193-R330 HydrophobicContact CG1-CB 3.65Å; V193-R330 WeakPolarHBondContact CG1-O 3.39Å; V193-R330 WeakPolarHBondContact O-CD 3.47Å; S196-R330 PolarHBondContact O-NH1 3.36Å; G198-R330 VanDerWaalsContact O-CZ 3.28Å; G198-R330 PolarHBondContact O-NH1 2.86Å; G198-R330 PolarHBondContact O-NH2 2.8Å; Y324-R330 PolarHBondContact OH-NH2 2.96Å; Y324-R330 VanDerWaalsContact OH-NH2 3.15Å
331	G	68.3	Low	71.9	Confident	29 Å²	29	68.3 Å²	68.3	30%	0.299	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	175.4	173.2	0	0	0	0	0	112.7	T322 N323 G329	T322-G331 WeakPolarHBondContact CA-O 3.49Å; N323-G331 PolarHBondContact N-O 3.15Å; G329-G331 VanDerWaalsContact C-N 3.33Å; G329-G331 PolarHBondContact O-N 2.68Å
332	V	80.7	Confident	71.7	Confident	56 Å²	56	72.7 Å²	72.7	34%	0.339	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131.6	174.4	179.8	0	0	0	0	109.6	V189 V193 L320 G321	V189-V332 HydrophobicContact CG1-CB 4.39Å; V189-V332 HydrophobicContact CG1-CG1 4.29Å; V189-V332 HydrophobicContact CG1-CG2 3.84Å; V193-V332 HydrophobicContact CB-CG2 4.27Å; V193-V332 HydrophobicContact CG1-CG2 4.19Å; V193-V332 HydrophobicContact CG2-CG2 3.44Å; V193-V332 VanDerWaalsContact CG2-CG2 3.44Å; L320-V332 HydrophobicContact CB-CG1 3.66Å; L320-V332 HydrophobicContact CD1-CG1 4.16Å; L320-V332 HydrophobicContact CG-CG1 4.35Å; G321-V332 WeakPolarHBondContact O-CA 3.32Å
333	R	83.6	Confident	72.1	Confident	78 Å²	78	73.5 Å²	73.5	29%	0.294	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	150.1	173.2	71.4	-178.3	-165.3	83.3	-1.7	110.8	L320 G321 N323 L335 D350	L320-R333 WeakPolarHBondContact CA-O 3.39Å; G321-R333 PolarHBondContact N-O 3.24Å; G321-R333 PolarHBondContact O-N 3.46Å; N323-R333 HydrophobicContact CB-CB 4.38Å; N323-R333 HydrophobicContact CB-CG 4.31Å; R333-L335 HydrophobicContact CG-CD2 4.06Å; R333-D350 IonicContact CZ-OD1 3.2Å; R333-D350 IonicContact NE-OD1 2.69Å; R333-D350 IonicContact NH2-OD1 2.77Å; R333-D350 PolarHBondContact NH2-OD1 3.17Å
334	K	87.1	Confident	73.2	Confident	101 Å²	101	71.5 Å²	71.5	44%	0.439	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.9	171.5	-170.6	159.8	179.2	158.3	0	109.4	E318 L320 C337	E318-K334 HydrophobicContact CB-CD 4.38Å; E318-K334 IonicContact OE2-NZ 3Å; E318-K334 PolarHBondContact OE2-NZ 3.05Å; L320-K334 HydrophobicContact CD2-CB 4.06Å; L320-K334 HydrophobicContact CD2-CG 4.21Å; K334-C337 WeakPolarHBondContact CE-SG 3.27Å; K334-C337 PolarHBondContact NZ-SG 3.06Å
335	L	86.7	Confident	74.7	Confident	13 Å²	13	70.3 Å²	70.3	7%	0.068	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-36.2	176.9	-54.4	-176.9	0	0	0	111.3	Y82 I319 R333 S347 L348	Y82-L335 WeakPolarHBondContact OH-CD1 3.28Å; I319-L335 HydrophobicContact CG2-CD1 4.48Å; I319-L335 WeakPolarHBondContact O-CB 3.34Å; I319-L335 PolarHBondContact O-N 2.97Å; R333-L335 HydrophobicContact CG-CD2 4.06Å; L335-S347 PolarHBondContact O-N 3.31Å; L335-L348 HydrophobicContact CB-CD2 3.68Å; L335-L348 HydrophobicContact CD1-CD2 4.12Å
336	G	88.9	Confident	76.4	Confident	7 Å²	7	70.8 Å²	70.8	7%	0.072	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.4	-176.2	178.1	0	0	0	0	0	113.6	I319 N345	I319-G336 PolarHBondContact N-O 2.79Å; I319-G336 PolarHBondContact O-N 3.14Å; G336-N345 CarbonylContact C-O 3.58Å; G336-N345 VanDerWaalsContact CA-O 3.31Å; G336-N345 WeakPolarHBondContact CA-O 3.26Å
337	C	90.9	Very high	78	Confident	36 Å²	36	66.6 Å²	66.6	24%	0.243	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	156.8	167.9	-95.9	0	0	0	0	110.3	F317 K334 N345	F317-C337 CarbonylContact O-C 3.59Å; F317-C337 VanDerWaalsContact O-CA 3.24Å; F317-C337 WeakPolarHBondContact O-CA 3.46Å; F317-C337 PolarHBondContact O-SG 2.87Å; K334-C337 WeakPolarHBondContact CE-SG 3.27Å; K334-C337 PolarHBondContact NZ-SG 3.06Å; C337-N345 PolarHBondContact N-O 2.88Å; C337-N345 PolarHBondContact O-N 2.89Å
338	W	92.3	Very high	79.6	Confident	17 Å²	17	58.3 Å²	58.3	6%	0.064	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	142.4	171.9	-175.2	105.3	0	0	0	110.9	Y70 D73 V74 F317 I319 P340 G343	Y70-W338 AromaticContact CD1-CH2 3.84Å; Y70-W338 HydrophobicContact CD1-CH2 3.84Å; Y70-W338 HydrophobicContact CD1-CZ3 4.41Å; Y70-W338 HydrophobicContact CG-CH2 4.02Å; Y70-W338 HydrophobicContact CG-CZ3 4.14Å; D73-W338 HydrophobicContact CB-CH2 4.29Å; D73-W338 HydrophobicContact CB-CZ2 3.88Å; V74-W338 HydrophobicContact CG1-CB 4.49Å; V74-W338 HydrophobicContact CG1-CG 4.47Å; V74-W338 HydrophobicContact CG2-CD2 3.67Å; V74-W338 HydrophobicContact CG2-CE3 3.53Å; V74-W338 HydrophobicContact CG2-CG 4.2Å; V74-W338 HydrophobicContact CG2-CH2 4.27Å; V74-W338 HydrophobicContact CG2-CZ2 4.38Å; V74-W338 HydrophobicContact CG2-CZ3 3.85Å; F317-W338 HydrophobicContact CB-CB 4.38Å; F317-W338 AromaticContact CD2-CE3 3.87Å; F317-W338 HydrophobicContact CD2-CE3 3.87Å; F317-W338 HydrophobicContact CD2-CZ3 4.24Å; F317-W338 HydrophobicContact CE2-CZ3 4.46Å; F317-W338 PolarHBondContact N-O 3.25Å; F317-W338 PolarHBondContact O-N 3.33Å; I319-W338 HydrophobicContact CD1-CB 4.45Å; W338-P340 HydrophobicContact CH2-CB 4.27Å; W338-P340 HydrophobicContact CH2-CG 4.03Å; W338-P340 HydrophobicContact CZ3-CG 3.85Å; W338-G343 VanDerWaalsContact CA-O 3.27Å; W338-G343 WeakPolarHBondContact CA-O 3.5Å; W338-G343 VanDerWaalsContact CD1-C 3.49Å
339	N	89.9	Confident	80.6	Confident	26 Å²	26	53.6 Å²	53.6	14%	0.139	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	164.4	166.4	71.6	-4.6	0	0	0	111.1	V315 V341 T342 G343	V315-N339 WeakPolarHBondContact O-CB 3.29Å; N339-V341 PolarHBondContact O-N 3.34Å; N339-T342 WeakPolarHBondContact OD1-CA 3.24Å; N339-T342 WeakPolarHBondContact OD1-CB 3.12Å; N339-T342 PolarHBondContact OD1-N 3.2Å; N339-T342 PolarHBondContact OD1-OG1 3.33Å; N339-G343 PolarHBondContact N-O 3.27Å; N339-G343 VanDerWaalsContact N-O 3.15Å; N339-G343 VanDerWaalsContact O-CA 3.29Å; N339-G343 WeakPolarHBondContact O-CA 3.44Å; N339-G343 PolarHBondContact O-N 3.41Å; N339-G343 PolarHBondContact OD1-N 3.13Å
340	P	86.8	Confident	80.8	Confident	49 Å²	49	53.7 Å²	53.7	32%	0.318	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20	-177.4	-23.7	34.8	0	0	0	115.1	Y70 V315 W338	Y70-P340 HydrophobicContact CD1-CB 4.47Å; Y70-P340 HydrophobicContact CD1-CG 4.15Å; Y70-P340 HydrophobicContact CD2-CG 3.99Å; Y70-P340 HydrophobicContact CE1-CB 3.97Å; Y70-P340 HydrophobicContact CE1-CG 3.91Å; Y70-P340 HydrophobicContact CE2-CG 3.72Å; Y70-P340 HydrophobicContact CG-CG 4.17Å; V315-P340 HydrophobicContact CG1-CG 3.72Å; W338-P340 HydrophobicContact CH2-CB 4.27Å; W338-P340 HydrophobicContact CH2-CG 4.03Å; W338-P340 HydrophobicContact CZ3-CG 3.85Å
341	V	86.3	Confident	80	Confident	134 Å²	134	58.6 Å²	58.6	81%	0.812	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-39.8	-171.1	-178.2	0	0	0	0	113.1	N339	N339-V341 PolarHBondContact O-N 3.34Å
342	T	85.6	Confident	78.8	Confident	96 Å²	96	63.8 Å²	63.8	59%	0.589	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-4.8	-179.5	67.2	0	0	0	0	113.1	N339	N339-T342 WeakPolarHBondContact OD1-CA 3.24Å; N339-T342 WeakPolarHBondContact OD1-CB 3.12Å; N339-T342 PolarHBondContact OD1-N 3.2Å; N339-T342 PolarHBondContact OD1-OG1 3.33Å
343	G	88.1	Confident	77.2	Confident	23 Å²	23	66.5 Å²	66.5	24%	0.237	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	67.7	-141	-178	0	0	0	0	0	111.6	W338 N339	W338-G343 VanDerWaalsContact CA-O 3.27Å; W338-G343 WeakPolarHBondContact CA-O 3.5Å; W338-G343 VanDerWaalsContact CD1-C 3.49Å; N339-G343 PolarHBondContact N-O 3.27Å; N339-G343 VanDerWaalsContact N-O 3.15Å; N339-G343 VanDerWaalsContact O-CA 3.29Å; N339-G343 WeakPolarHBondContact O-CA 3.44Å; N339-G343 PolarHBondContact O-N 3.41Å; N339-G343 PolarHBondContact OD1-N 3.13Å
344	L	88.9	Confident	75.4	Confident	27 Å²	27	68 Å²	68	14%	0.141	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	117.1	178	176	66.4	0	0	0	110.9	R77 E81 I319 L348	R77-L344 HydrophobicContact CG-CB 3.93Å; R77-L344 HydrophobicContact CG-CD2 4.33Å; E81-L344 HydrophobicContact CG-CD2 3.65Å; I319-L344 HydrophobicContact CD1-CD1 3.61Å; L344-L348 HydrophobicContact CD1-CD1 4.37Å; L344-L348 HydrophobicContact CD1-CD2 4.27Å; L344-L348 HydrophobicContact CD1-CG 4.31Å; L344-L348 HydrophobicContact CD2-CD1 3.89Å; L344-L348 HydrophobicContact CD2-CG 3.96Å
345	N	86.6	Confident	73.5	Confident	115 Å²	115	65.9 Å²	65.9	62%	0.615	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	105.4	170.4	-175.3	-2.8	0	0	0	109.6	G336 C337	G336-N345 CarbonylContact C-O 3.58Å; G336-N345 VanDerWaalsContact CA-O 3.31Å; G336-N345 WeakPolarHBondContact CA-O 3.26Å; C337-N345 PolarHBondContact N-O 2.88Å; C337-N345 PolarHBondContact O-N 2.89Å
346	G	80.5	Confident	72.2	Confident	45 Å²	45	71 Å²	71	46%	0.464	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	143.8	-163.3	-173.5	0	0	0	0	0	110.8
347	S	75.4	Confident	71.2	Confident	54 Å²	54	71.4 Å²	71.4	38%	0.378	40%	0.396	S	S	.	.			trans	-145.5	130	171.4	-165.7	0	0	0	0	109.3	L335 T349	L335-S347 PolarHBondContact O-N 3.31Å; S347-T349 PolarHBondContact OG-OG1 2.91Å
348	L	73.9	Confident	70.2	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.417	C	S	.	.	S	Bend	trans	-92.1	-22.2	-172.8	-59.9	-178	0	0	0	112.9	V78 E81 Y82 R199 I319 L335 L344	V78-L348 HydrophobicContact CB-CD1 4.12Å; V78-L348 HydrophobicContact CG1-CD1 4.18Å; V78-L348 HydrophobicContact CG2-CD1 3.72Å; E81-L348 HydrophobicContact CB-CB 4.35Å; E81-L348 HydrophobicContact CB-CD1 4Å; E81-L348 HydrophobicContact CG-CD1 4.2Å; Y82-L348 HydrophobicContact CE1-CB 4.16Å; Y82-L348 WeakPolarHBondContact CE1-O 3.41Å; Y82-L348 HydrophobicContact CE2-CB 4.32Å; Y82-L348 PolarHBondContact OH-O 3.08Å; R199-L348 PolarHBondContact NH2-O 3.01Å; I319-L348 HydrophobicContact CB-CD2 4.01Å; I319-L348 HydrophobicContact CD1-CD1 4.34Å; I319-L348 HydrophobicContact CD1-CD2 4.06Å; I319-L348 HydrophobicContact CG2-CD2 3.57Å; L335-L348 HydrophobicContact CB-CD2 3.68Å; L335-L348 HydrophobicContact CD1-CD2 4.12Å; L344-L348 HydrophobicContact CD1-CD1 4.37Å; L344-L348 HydrophobicContact CD1-CD2 4.27Å; L344-L348 HydrophobicContact CD1-CG 4.31Å; L344-L348 HydrophobicContact CD2-CD1 3.89Å; L344-L348 HydrophobicContact CD2-CG 3.96Å
349	T	61.3	Low	69.3	Low	72 Å²	72	80.4 Å²	80.4	44%	0.442	45%	0.445	S	S	.	.	S	Bend	trans	-61.2	139.8	159.2	52	0	0	0	0	108.5	S347 K351	S347-T349 PolarHBondContact OG-OG1 2.91Å; T349-K351 PolarHBondContact O-N 3.09Å
350	D	54.4	Low	69	Low	56 Å²	56	80.4 Å²	80.4	30%	0.299	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-61.6	128.4	154.6	-62.2	-83	0	0	0	106.2	R199 R333 K352	R199-D350 IonicContact CZ-OD2 3.11Å; R199-D350 IonicContact NH1-OD2 2.71Å; R199-D350 PolarHBondContact NH1-OD2 3.4Å; R199-D350 IonicContact NH2-OD2 2.72Å; R199-D350 PolarHBondContact NH2-OD2 2.59Å; R333-D350 IonicContact CZ-OD1 3.2Å; R333-D350 IonicContact NE-OD1 2.69Å; R333-D350 IonicContact NH2-OD1 2.77Å; R333-D350 PolarHBondContact NH2-OD1 3.17Å; D350-K352 PolarHBondContact O-N 3.25Å; D350-K352 VanDerWaalsContact O-N 3.07Å
351	K	45	Very low	69.1	Low	196 Å²	196	81.7 Å²	81.7	85%	0.852	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-46.9	124.5	153.2	-77.7	-173.1	173.6	-174.4	0	104.9	T349	T349-K351 PolarHBondContact O-N 3.09Å
352	K	43	Very low	69.4	Low	138 Å²	138	75.5 Å²	75.5	60%	0.6	41%	0.414	S	S	*	.			trans	-40.3	158.7	-163.7	-63.4	160.4	176.9	178.6	0	111.8	D350 E354	D350-K352 PolarHBondContact O-N 3.25Å; D350-K352 VanDerWaalsContact O-N 3.07Å; K352-E354 HydrophobicContact CB-CB 4.22Å; K352-E354 HydrophobicContact CB-CG 3.89Å; K352-E354 HydrophobicContact CD-CG 3.69Å; K352-E354 WeakPolarHBondContact CD-OE1 3.34Å; K352-E354 WeakPolarHBondContact CE-OE1 3.44Å; K352-E354 IonicContact NZ-OE1 3.84Å; K352-E354 PolarHBondContact NZ-OE1 3.42Å; K352-E354 PolarHBondContact O-N 2.69Å
353	L	46.8	Very low	69.8	Low	113 Å²	113	75.8 Å²	75.8	59%	0.592	41%	0.405	S	S	*	.			trans	-70.6	52.9	157.5	-145.5	75.4	0	0	0	111.2	N355 V702 R706	L353-N355 PolarHBondContact O-N 3.36Å; L353-N355 VanDerWaalsContact O-N 3.13Å; L353-V702 HydrophobicContact CD2-CB 4.32Å; L353-V702 HydrophobicContact CD2-CG1 3.95Å; L353-V702 HydrophobicContact CD2-CG2 3.41Å; L353-V702 VanDerWaalsContact CD2-CG2 3.41Å; L353-R706 PolarHBondContact O-NH2 2.04Å
354	E	45.1	Very low	70.2	Confident	110 Å²	110	74.7 Å²	74.7	51%	0.514	39%	0.393	S	S	.	.			trans	-67.1	96.8	161.8	-91	169.1	172.3	0	0	107.9	K352	K352-E354 HydrophobicContact CB-CB 4.22Å; K352-E354 HydrophobicContact CB-CG 3.89Å; K352-E354 HydrophobicContact CD-CG 3.69Å; K352-E354 WeakPolarHBondContact CD-OE1 3.34Å; K352-E354 WeakPolarHBondContact CE-OE1 3.44Å; K352-E354 IonicContact NZ-OE1 3.84Å; K352-E354 PolarHBondContact NZ-OE1 3.42Å; K352-E354 PolarHBondContact O-N 2.69Å
355	N	47.7	Very low	70.5	Confident	56 Å²	56	73.4 Å²	73.4	30%	0.299	39%	0.387	S	S	.	.	S	Bend	trans	62.3	71.3	137.9	-49.8	8.3	0	0	0	115	L353 Y400 R706	L353-N355 PolarHBondContact O-N 3.36Å; L353-N355 VanDerWaalsContact O-N 3.13Å; N355-Y400 PolarHBondContact ND2-O 3.45Å; N355-Y400 PolarHBondContact OD1-O 3.25Å; N355-R706 PolarHBondContact OD1-NH2 2.96Å
356	N	59.2	Low	70.9	Confident	122 Å²	122	67.9 Å²	67.9	65%	0.652	36%	0.357	S	S	*	.			trans	-150.8	47.7	160.6	-97.8	-25.8	0	0	0	113.9	R358	N356-R358 PolarHBondContact O-N 3.39Å; N356-R358 WeakPolarHBondContact OD1-CD 3.29Å
357	M	68.1	Low	71.6	Confident	14 Å²	14	66 Å²	66	7%	0.069	34%	0.337	C	S	.	.			trans	-81	25.4	153	-69.8	-166.3	-66.6	0	0	111.4	G359 V360 L401 F403 Y699 F703	M357-G359 PolarHBondContact O-N 3.47Å; M357-G359 VanDerWaalsContact O-N 3.16Å; M357-V360 HydrophobicContact CB-CB 4.22Å; M357-V360 HydrophobicContact CB-CG2 4.01Å; M357-V360 HydrophobicContact CG-CG2 4.43Å; M357-V360 WeakPolarHBondContact O-CB 3.25Å; M357-V360 PolarHBondContact O-N 3.04Å; M357-L401 HydrophobicContact CE-CB 3.54Å; M357-L401 HydrophobicContact CE-CD1 3.64Å; M357-L401 HydrophobicContact CE-CD2 4.4Å; M357-L401 HydrophobicContact CE-CG 4.05Å; M357-F403 HydrophobicContact CB-CB 3.91Å; M357-F403 HydrophobicContact CE-CB 4.3Å; M357-F403 HydrophobicContact CE-CD1 3.55Å; M357-F403 HydrophobicContact CE-CE1 4.19Å; M357-F403 HydrophobicContact CE-CG 4.23Å; M357-F403 WeakPolarHBondContact O-CA 3.25Å; M357-Y699 HydrophobicContact CG-CE1 4.46Å; M357-Y699 HydrophobicContact SD-CD1 3.51Å; M357-Y699 VanDerWaalsContact SD-CD1 3.51Å; M357-Y699 HydrophobicContact SD-CE1 3.66Å; M357-Y699 HydrophobicContact SD-CG 4.35Å; M357-F703 HydrophobicContact CE-CE2 3.76Å; M357-F703 HydrophobicContact CE-CZ 4.43Å; M357-F703 HydrophobicContact SD-CE2 4.43Å
358	R	70.6	Confident	72.3	Confident	181 Å²	181	66.7 Å²	66.7	68%	0.683	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	106.1	-173.9	-71.5	-176.3	176	-174.5	-2.2	110.2	N356 G402	N356-R358 PolarHBondContact O-N 3.39Å; N356-R358 WeakPolarHBondContact OD1-CD 3.29Å; R358-G402 WeakPolarHBondContact CA-O 3.5Å
359	G	73.2	Confident	73.1	Confident	62 Å²	62	67.6 Å²	67.6	64%	0.639	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.6	-9.8	-173.9	0	0	0	0	0	113.7	M357	M357-G359 PolarHBondContact O-N 3.47Å; M357-G359 VanDerWaalsContact O-N 3.16Å
360	V	82.2	Confident	74.5	Confident	25 Å²	25	68.6 Å²	68.6	15%	0.152	34%	0.34	C	S	.	.			trans	-70.6	133	168.2	-175.4	0	0	0	0	108.6	M357 L362 N404	M357-V360 HydrophobicContact CB-CB 4.22Å; M357-V360 HydrophobicContact CB-CG2 4.01Å; M357-V360 HydrophobicContact CG-CG2 4.43Å; M357-V360 WeakPolarHBondContact O-CB 3.25Å; M357-V360 PolarHBondContact O-N 3.04Å; V360-L362 HydrophobicContact CG1-CD2 3.6Å; V360-L362 HydrophobicContact CG1-CG 3.97Å; V360-N404 PolarHBondContact O-N 2.92Å
361	V	89.6	Confident	76.3	Confident	76 Å²	76	65.9 Å²	65.9	46%	0.461	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	117.6	171.8	-174.1	0	0	0	0	107.9	N404 E406	V361-N404 CarbonylContact C-O 3.55Å; V361-N404 WeakPolarHBondContact CA-O 3.37Å; V361-N404 HydrophobicContact CG2-CB 4.19Å; V361-E406 HydrophobicContact CG1-CG 4.15Å
362	L	92	Very high	78.7	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	130.2	-177.6	-60.9	177.8	0	0	0	111.2	V360 V364 F403 N404 Y405 E406 D437 I438 Y699 F703	V360-L362 HydrophobicContact CG1-CD2 3.6Å; V360-L362 HydrophobicContact CG1-CG 3.97Å; L362-V364 PolarHBondContact O-N 3.46Å; L362-F403 HydrophobicContact CD1-CB 4.49Å; L362-F403 HydrophobicContact CD1-CD2 3.74Å; L362-F403 HydrophobicContact CD1-CE2 4.08Å; L362-F403 HydrophobicContact CD1-CG 4.12Å; L362-F403 HydrophobicContact CG-CD2 4.28Å; L362-N404 PolarHBondContact N-O 2.92Å; L362-Y405 VanDerWaalsContact O-CA 3.23Å; L362-Y405 WeakPolarHBondContact O-CA 3.42Å; L362-Y405 WeakPolarHBondContact O-CB 3.47Å; L362-E406 PolarHBondContact O-N 2.91Å; L362-D437 HydrophobicContact CD2-CB 4.35Å; L362-I438 HydrophobicContact CD1-CD1 3.72Å; L362-Y699 HydrophobicContact CD2-CD2 4.36Å; L362-Y699 HydrophobicContact CD2-CE2 3.88Å; L362-F703 HydrophobicContact CD1-CE2 4.43Å; L362-F703 HydrophobicContact CD1-CZ 4.04Å
363	R	93.9	Very high	81.1	Confident	101 Å²	101	50 Å²	50	38%	0.381	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	116.5	174.3	-58.2	167.4	-65.1	158.8	6.6	108.7	K434 R435 D437 I438	R363-K434 PolarHBondContact NH1-O 3.47Å; R363-K434 PolarHBondContact NH2-O 3.35Å; R363-R435 PolarHBondContact NH1-O 2.84Å; R363-D437 VanDerWaalsContact CB-OD2 3.26Å; R363-D437 WeakPolarHBondContact CB-OD2 3.46Å; R363-D437 WeakPolarHBondContact CG-OD2 3.49Å; R363-D437 IonicContact CZ-OD1 2.65Å; R363-D437 IonicContact CZ-OD2 2.7Å; R363-D437 PolarHBondContact N-OD2 3.33Å; R363-D437 IonicContact NE-OD1 2.78Å; R363-D437 IonicContact NE-OD2 2.68Å; R363-D437 PolarHBondContact NE-OD2 2.94Å; R363-D437 IonicContact NH2-OD1 3.6Å; R363-D437 PolarHBondContact NH2-OD1 3.19Å; R363-D437 IonicContact NH2-OD2 3.85Å; R363-D437 PolarHBondContact O-N 3.39Å; R363-I438 PolarHBondContact O-N 3.2Å
364	V	96.3	Very high	83.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112.9	-174.5	177.5	0	0	0	0	109.8	L362 L394 Y405 E406 I407 Y408 I438 I440	L362-V364 PolarHBondContact O-N 3.46Å; V364-L394 HydrophobicContact CG1-CD2 4.09Å; V364-L394 HydrophobicContact CG2-CD1 4.48Å; V364-L394 HydrophobicContact CG2-CD2 4.25Å; V364-Y405 HydrophobicContact CG2-CG 4.43Å; V364-E406 PolarHBondContact N-O 2.69Å; V364-I407 HydrophobicContact CB-CG1 4.2Å; V364-I407 HydrophobicContact CG1-CG1 4.26Å; V364-I407 WeakPolarHBondContact O-CA 3.39Å; V364-Y408 PolarHBondContact O-N 3.28Å; V364-I438 CarbonylContact C-O 3.48Å; V364-I438 VanDerWaalsContact CA-O 3.3Å; V364-I438 WeakPolarHBondContact CA-O 3.36Å; V364-I438 HydrophobicContact CG2-CB 4.35Å; V364-I440 HydrophobicContact CG1-CG2 3.56Å
365	V	96.6	Very high	85.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.2	170.8	57.9	0	0	0	0	110.6	Y408 A410 L427 E430 L431 A436 I438 G439 I440	V365-Y408 CarbonylContact C-O 3.54Å; V365-Y408 WeakPolarHBondContact CA-O 3.33Å; V365-Y408 HydrophobicContact CB-CE1 4.2Å; V365-Y408 HydrophobicContact CB-CE2 4.37Å; V365-Y408 HydrophobicContact CG2-CE2 4.24Å; V365-A410 HydrophobicContact CG2-CB 4Å; V365-L427 HydrophobicContact CG1-CD2 4.22Å; V365-L427 HydrophobicContact CG1-CG 3.89Å; V365-L427 HydrophobicContact CG2-CB 4.36Å; V365-L427 HydrophobicContact CG2-CG 4.16Å; V365-E430 HydrophobicContact CB-CB 4.32Å; V365-E430 HydrophobicContact CG1-CB 4.21Å; V365-E430 HydrophobicContact CG2-CB 4.03Å; V365-E430 HydrophobicContact CG2-CG 4.08Å; V365-L431 HydrophobicContact CG1-CD2 4.43Å; V365-L431 HydrophobicContact CG1-CG 4.29Å; V365-A436 HydrophobicContact CB-CB 3.63Å; V365-A436 HydrophobicContact CG1-CB 3.38Å; V365-I438 WeakPolarHBondContact CG1-O 3.33Å; V365-I438 PolarHBondContact N-O 3.2Å; V365-G439 WeakPolarHBondContact O-CA 3.43Å; V365-I440 PolarHBondContact O-N 3.31Å
366	T	95.2	Very high	86.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	166.2	179.1	-161.5	0	0	0	0	113.4	V373 I407 Y408 V409 A410 I440	T366-V373 HydrophobicContact CG2-CG1 4.02Å; T366-V373 WeakPolarHBondContact OG1-CG2 3.27Å; T366-I407 HydrophobicContact CG2-CG2 3.61Å; T366-Y408 PolarHBondContact N-O 3.12Å; T366-V409 HydrophobicContact CG2-CG2 3.94Å; T366-V409 CarbonylContact O-C 3.51Å; T366-V409 WeakPolarHBondContact O-CA 3.46Å; T366-A410 PolarHBondContact O-N 2.94Å; T366-I440 WeakPolarHBondContact CA-O 3.47Å; T366-I440 VanDerWaalsContact CB-O 3.27Å; T366-I440 WeakPolarHBondContact CB-O 3.45Å; T366-I440 PolarHBondContact OG1-O 2.64Å
367	V	93.3	Very high	87.1	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.03	23%	0.23	C	C	.	.			trans	-125.2	139.5	170	172.3	0	0	0	0	106.9	A410 K414 Y415 L427 S441	V367-A410 HydrophobicContact CG2-CB 4.21Å; V367-K414 WeakPolarHBondContact CG2-O 3.28Å; V367-Y415 HydrophobicContact CB-CD1 4.23Å; V367-Y415 HydrophobicContact CB-CE1 4.02Å; V367-Y415 HydrophobicContact CG1-CD1 4.41Å; V367-Y415 HydrophobicContact CG1-CD2 4.4Å; V367-Y415 HydrophobicContact CG1-CE1 4.06Å; V367-Y415 HydrophobicContact CG1-CE2 4.05Å; V367-Y415 HydrophobicContact CG2-CD1 4.29Å; V367-L427 HydrophobicContact CG2-CB 4.08Å; V367-L427 HydrophobicContact CG2-CD1 4.11Å; V367-S441 PolarHBondContact O-OG 2.89Å
368	L	91.6	Very high	86.6	Confident	69 Å²	69	47.9 Å²	47.9	36%	0.361	25%	0.246	S	C	.	.			trans	-79.4	121.3	180	-58.9	178.7	0	0	0	109.7	V373 V375 Y386 V409	L368-V373 WeakPolarHBondContact CA-O 3.31Å; L368-V373 HydrophobicContact CD2-CG1 4.08Å; L368-V375 HydrophobicContact CD1-CG2 4.04Å; L368-V375 HydrophobicContact CD2-CG2 3.95Å; L368-Y386 HydrophobicContact CD2-CD1 4.25Å; L368-Y386 HydrophobicContact CD2-CE1 4.14Å; L368-V409 HydrophobicContact CD2-CG2 4.02Å; L368-V409 HydrophobicContact CG-CG1 4.25Å; L368-V409 HydrophobicContact CG-CG2 4.17Å
369	E	90.6	Very high	86.1	Confident	18 Å²	18	44.4 Å²	44.4	8%	0.084	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-155.9	128.7	174.7	-169.7	97.4	-124.9	0	0	108.1	F372 V373 Y415 S644 V664	E369-F372 PolarHBondContact O-N 3.48Å; E369-V373 PolarHBondContact N-O 3.38Å; E369-V373 PolarHBondContact O-N 3.17Å; E369-Y415 WeakPolarHBondContact CB-OH 3.46Å; E369-Y415 WeakPolarHBondContact CG-OH 3.29Å; E369-Y415 PolarHBondContact OE2-OH 3.18Å; E369-S644 WeakPolarHBondContact OE1-CB 3.45Å; E369-S644 PolarHBondContact OE1-OG 3.17Å; E369-V664 HydrophobicContact CG-CG2 4Å
370	E	91.1	Very high	85.1	Confident	93 Å²	93	49.9 Å²	49.9	44%	0.435	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	133	-175	-44.5	-164.9	144.5	0	0	109.9	M374 Y667	E370-M374 HydrophobicContact CB-CG 4.14Å; E370-M374 HydrophobicContact CB-SD 3.78Å; E370-M374 HydrophobicContact CG-CG 3.94Å; E370-M374 HydrophobicContact CG-SD 3.9Å; E370-Y667 HydrophobicContact CB-CD1 4.44Å; E370-Y667 HydrophobicContact CB-CE1 4.12Å
371	P	92.4	Very high	84	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	cis	-97.9	12.6	3.7	39.5	-36.1	0	0	0	114.2	M374 G388 F389 Y667 W723 W724	P371-M374 HydrophobicContact CB-CE 4.13Å; P371-G388 CarbonylContact O-C 3.55Å; P371-G388 WeakPolarHBondContact O-CA 3.43Å; P371-F389 PolarHBondContact O-N 3.24Å; P371-Y667 HydrophobicContact CB-CD1 3.96Å; P371-Y667 HydrophobicContact CB-CD2 3.63Å; P371-Y667 HydrophobicContact CB-CE1 3.93Å; P371-Y667 HydrophobicContact CB-CE2 3.61Å; P371-Y667 HydrophobicContact CB-CG 3.82Å; P371-Y667 HydrophobicContact CG-CD1 4.11Å; P371-Y667 HydrophobicContact CG-CD2 3.67Å; P371-Y667 HydrophobicContact CG-CE2 4.19Å; P371-Y667 HydrophobicContact CG-CG 3.63Å; P371-W723 HydrophobicContact CB-CE3 4.05Å; P371-W723 HydrophobicContact CG-CB 4.5Å; P371-W724 HydrophobicContact CG-CH2 3.65Å; P371-W724 HydrophobicContact CG-CZ2 3.34Å; P371-W724 HydrophobicContact CG-CZ3 4.4Å
372	F	94.1	Very high	82.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-48.2	-173.1	-70.1	-89.5	0	0	0	112.4	E369 G388 F389 S390 A442 M460 A663 V664 Y689 W724	E369-F372 PolarHBondContact O-N 3.48Å; F372-G388 CarbonylContact O-C 3.54Å; F372-G388 VanDerWaalsContact O-C 3.26Å; F372-G388 WeakPolarHBondContact O-CA 3.5Å; F372-F389 HydrophobicContact CD1-CD1 4.01Å; F372-F389 AromaticContact CE1-CD1 3.95Å; F372-F389 HydrophobicContact CE1-CD1 3.95Å; F372-F389 PolarHBondContact O-N 3.11Å; F372-S390 WeakPolarHBondContact O-CB 3.48Å; F372-S390 PolarHBondContact O-N 2.92Å; F372-A442 HydrophobicContact CB-CB 4.22Å; F372-A442 HydrophobicContact CD1-CB 4.18Å; F372-A442 HydrophobicContact CD2-CB 3.65Å; F372-A442 HydrophobicContact CE1-CB 4.46Å; F372-A442 HydrophobicContact CE2-CB 3.97Å; F372-A442 HydrophobicContact CG-CB 3.76Å; F372-A442 HydrophobicContact CZ-CB 4.36Å; F372-M460 HydrophobicContact CE1-SD 4.29Å; F372-M460 HydrophobicContact CZ-CE 4.49Å; F372-A663 HydrophobicContact CE2-CB 4.17Å; F372-A663 HydrophobicContact CZ-CB 3.92Å; F372-V664 HydrophobicContact CD2-CG2 4.29Å; F372-V664 HydrophobicContact CE2-CG2 3.96Å; F372-Y689 HydrophobicContact CE1-CD2 4.37Å; F372-Y689 HydrophobicContact CE1-CE1 4.38Å; F372-Y689 HydrophobicContact CE1-CE2 4.19Å; F372-Y689 HydrophobicContact CZ-CE1 4.04Å; F372-Y689 HydrophobicContact CZ-CE2 4Å; F372-Y689 AromaticContact CZ-CZ 3.69Å; F372-W724 HydrophobicContact CE1-CH2 4.05Å; F372-W724 HydrophobicContact CE2-CH2 4.2Å; F372-W724 HydrophobicContact CE2-CZ2 4.16Å; F372-W724 AromaticContact CZ-CH2 3.87Å; F372-W724 HydrophobicContact CZ-CH2 3.87Å; F372-W724 HydrophobicContact CZ-CZ2 4.12Å
373	V	94.3	Very high	81.3	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-146.4	117.5	177.7	-175.6	0	0	0	0	110.5	T366 L368 E369 Y386 I391	T366-V373 HydrophobicContact CG2-CG1 4.02Å; T366-V373 WeakPolarHBondContact OG1-CG2 3.27Å; L368-V373 WeakPolarHBondContact CA-O 3.31Å; L368-V373 HydrophobicContact CD2-CG1 4.08Å; E369-V373 PolarHBondContact N-O 3.38Å; E369-V373 PolarHBondContact O-N 3.17Å; V373-Y386 HydrophobicContact CG1-CD1 4.27Å; V373-I391 HydrophobicContact CB-CD1 4.42Å; V373-I391 HydrophobicContact CB-CG1 4.49Å; V373-I391 HydrophobicContact CG1-CD1 3.92Å; V373-I391 HydrophobicContact CG1-CG1 4.15Å; V373-I391 HydrophobicContact CG2-CD1 3.79Å; V373-I391 HydrophobicContact CG2-CG1 4.13Å
374	M	90.8	Very high	80.1	Confident	17 Å²	17	63 Å²	63	8%	0.084	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	156.5	-176	-55.5	-174.3	-79.9	0	0	110.2	E370 P371 Y386 Q387 W723	E370-M374 HydrophobicContact CB-CG 4.14Å; E370-M374 HydrophobicContact CB-SD 3.78Å; E370-M374 HydrophobicContact CG-CG 3.94Å; E370-M374 HydrophobicContact CG-SD 3.9Å; P371-M374 HydrophobicContact CB-CE 4.13Å; M374-Y386 CarbonylContact O-C 3.59Å; M374-Y386 VanDerWaalsContact O-CA 3.31Å; M374-Y386 WeakPolarHBondContact O-CA 3.21Å; M374-Q387 WeakPolarHBondContact CA-O 3.46Å; M374-Q387 HydrophobicContact CB-CG 4.22Å; M374-Q387 WeakPolarHBondContact CB-O 3.25Å; M374-Q387 PolarHBondContact N-O 3.42Å; M374-Q387 PolarHBondContact O-N 2.87Å; M374-W723 HydrophobicContact CE-CE3 4.01Å; M374-W723 HydrophobicContact CE-CH2 3.93Å; M374-W723 HydrophobicContact CE-CZ3 3.34Å
375	V	87.4	Confident	79.4	Confident	62 Å²	62	69.7 Å²	69.7	38%	0.376	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.5	173.5	-176.5	0	0	0	0	108.4	L368 Y386	L368-V375 HydrophobicContact CD1-CG2 4.04Å; L368-V375 HydrophobicContact CD2-CG2 3.95Å; V375-Y386 HydrophobicContact CG2-CD1 4.29Å; V375-Y386 HydrophobicContact CG2-CE1 4.09Å
376	S	78.3	Confident	79	Confident	20 Å²	20	71.2 Å²	71.2	14%	0.14	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-74	151.5	172	65.3	0	0	0	0	111.1	N378 K385	S376-N378 PolarHBondContact O-N 2.91Å; S376-N378 VanDerWaalsContact O-N 3.14Å; S376-K385 WeakPolarHBondContact CB-O 3.32Å; S376-K385 PolarHBondContact N-O 3.48Å; S376-K385 WeakPolarHBondContact OG-CB 3.17Å; S376-K385 PolarHBondContact OG-O 3.04Å
377	E	68.3	Low	78.9	Confident	195 Å²	195	75.1 Å²	75.1	91%	0.911	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-61.4	117.3	-174.5	-66.2	-168.4	143.5	0	0	112.2	V379	E377-V379 PolarHBondContact O-N 3Å; E377-V379 VanDerWaalsContact O-N 3.14Å
378	N	56.4	Low	78.9	Confident	76 Å²	76	74.9 Å²	74.9	41%	0.406	40%	0.397	S	S	.	.			trans	-74.5	105.4	-177.3	-96.8	12.7	0	0	0	111.5	S376 L380 K384	S376-N378 PolarHBondContact O-N 2.91Å; S376-N378 VanDerWaalsContact O-N 3.14Å; N378-L380 PolarHBondContact O-N 2.82Å; N378-K384 WeakPolarHBondContact ND2-CG 3.44Å; N378-K384 WeakPolarHBondContact OD1-CA 3.33Å
379	V	59.6	Low	79.1	Confident	109 Å²	109	71.7 Å²	71.7	66%	0.661	38%	0.38	S	S	*	.			trans	-60.5	120.8	156.6	-174.9	0	0	0	0	108	E377 G381 K382	E377-V379 PolarHBondContact O-N 3Å; E377-V379 VanDerWaalsContact O-N 3.14Å; V379-G381 PolarHBondContact O-N 3.38Å; V379-K382 PolarHBondContact O-N 2.98Å
380	L	53.6	Low	79.3	Confident	177 Å²	177	70.8 Å²	70.8	93%	0.927	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	125.6	-167.1	-161.5	74.8	0	0	0	112.3	N378	N378-L380 PolarHBondContact O-N 2.82Å
381	G	57.6	Low	79.5	Confident	82 Å²	82	66.6 Å²	66.6	85%	0.845	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.3	-2.1	178.3	0	0	0	0	0	116.3	V379	V379-G381 PolarHBondContact O-N 3.38Å
382	K	59.4	Low	79.6	Confident	150 Å²	150	67.9 Å²	67.9	65%	0.652	36%	0.363	S	S	*	.	S	Bend	trans	-95.4	152.8	169.2	-71.1	-176.5	179.1	179.4	0	112	V379	V379-K382 PolarHBondContact O-N 2.98Å
383	P	67.1	Low	79.7	Confident	115 Å²	115	67.9 Å²	67.9	75%	0.747	36%	0.363	S	S	*	.			trans	-60.8	149.8	171.8	27	-35.1	0	0	0	110.8	K385	P383-K385 PolarHBondContact O-N 3.32Å; P383-K385 VanDerWaalsContact O-N 3.08Å
384	K	67.4	Low	79.7	Confident	135 Å²	135	67.9 Å²	67.9	59%	0.587	36%	0.363	S	S	*	.			trans	-57.8	113.1	176.4	-76	-177.7	176.5	-177.1	0	109.9	N378	N378-K384 WeakPolarHBondContact ND2-CG 3.44Å; N378-K384 WeakPolarHBondContact OD1-CA 3.33Å
385	K	81.6	Confident	79.9	Confident	140 Å²	140	69.9 Å²	69.9	61%	0.609	37%	0.374	S	S	*	.			trans	-90	125.4	170.7	176.3	173.6	-178.4	-179.8	0	109.5	S376 P383	S376-K385 WeakPolarHBondContact CB-O 3.32Å; S376-K385 PolarHBondContact N-O 3.48Å; S376-K385 WeakPolarHBondContact OG-CB 3.17Å; S376-K385 PolarHBondContact OG-O 3.04Å; P383-K385 PolarHBondContact O-N 3.32Å; P383-K385 VanDerWaalsContact O-N 3.08Å
386	Y	89.6	Confident	80.1	Confident	32 Å²	32	68.1 Å²	68.1	13%	0.125	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	153.1	171.9	-57.4	-83.3	0	0	0	110.7	L368 V373 M374 V375 I407 V409	L368-Y386 HydrophobicContact CD2-CD1 4.25Å; L368-Y386 HydrophobicContact CD2-CE1 4.14Å; V373-Y386 HydrophobicContact CG1-CD1 4.27Å; M374-Y386 CarbonylContact O-C 3.59Å; M374-Y386 VanDerWaalsContact O-CA 3.31Å; M374-Y386 WeakPolarHBondContact O-CA 3.21Å; V375-Y386 HydrophobicContact CG2-CD1 4.29Å; V375-Y386 HydrophobicContact CG2-CE1 4.09Å; Y386-I407 HydrophobicContact CD2-CB 3.79Å; Y386-I407 HydrophobicContact CD2-CD1 4.18Å; Y386-I407 HydrophobicContact CD2-CG2 3.65Å; Y386-I407 HydrophobicContact CE2-CB 3.93Å; Y386-I407 HydrophobicContact CE2-CG2 3.73Å; Y386-I407 HydrophobicContact CG-CG2 4.15Å; Y386-V409 HydrophobicContact CE1-CG2 3.76Å
387	Q	91.6	Very high	80.8	Confident	82 Å²	82	67.2 Å²	67.2	38%	0.383	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	154	175.9	66.1	-177.6	12	0	0	109.9	M374	M374-Q387 WeakPolarHBondContact CA-O 3.46Å; M374-Q387 HydrophobicContact CB-CG 4.22Å; M374-Q387 WeakPolarHBondContact CB-O 3.25Å; M374-Q387 PolarHBondContact N-O 3.42Å; M374-Q387 PolarHBondContact O-N 2.87Å
388	G	93.5	Very high	82	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	145.8	173.8	179.2	0	0	0	0	0	112	P371 F372 S390 I391 D392	P371-G388 CarbonylContact O-C 3.55Å; P371-G388 WeakPolarHBondContact O-CA 3.43Å; F372-G388 CarbonylContact O-C 3.54Å; F372-G388 VanDerWaalsContact O-C 3.26Å; F372-G388 WeakPolarHBondContact O-CA 3.5Å; G388-S390 PolarHBondContact O-N 3.37Å; G388-I391 PolarHBondContact O-N 3.45Å; G388-I391 VanDerWaalsContact O-N 3.1Å; G388-D392 PolarHBondContact O-N 3.31Å
389	F	95.4	Very high	83.6	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.009	34%	0.335	C	S	.	.	H	α-helix	trans	-60.4	-45.1	-176.7	177.3	-119.9	0	0	0	113	P371 F372 I391 D392 V393 Y459 M460 M716 L719 K720 W723 W724	P371-F389 PolarHBondContact O-N 3.24Å; F372-F389 HydrophobicContact CD1-CD1 4.01Å; F372-F389 AromaticContact CE1-CD1 3.95Å; F372-F389 HydrophobicContact CE1-CD1 3.95Å; F372-F389 PolarHBondContact O-N 3.11Å; F389-I391 PolarHBondContact O-N 3.03Å; F389-D392 PolarHBondContact O-N 2.83Å; F389-V393 HydrophobicContact CD2-CG2 4.38Å; F389-V393 HydrophobicContact CE2-CG2 4.04Å; F389-V393 HydrophobicContact CZ-CG2 4.16Å; F389-V393 WeakPolarHBondContact O-CG2 3.36Å; F389-V393 PolarHBondContact O-N 3.48Å; F389-V393 VanDerWaalsContact O-N 3.11Å; F389-Y459 HydrophobicContact CD1-CE2 4.14Å; F389-Y459 AromaticContact CE1-CD2 3.92Å; F389-Y459 HydrophobicContact CE1-CD2 3.92Å; F389-Y459 AromaticContact CE1-CE2 3.68Å; F389-Y459 HydrophobicContact CE1-CE2 3.68Å; F389-Y459 HydrophobicContact CZ-CD2 4.4Å; F389-M460 HydrophobicContact CD1-SD 4.05Å; F389-M460 HydrophobicContact CE1-CB 4.03Å; F389-M460 HydrophobicContact CE1-CG 4.39Å; F389-M460 HydrophobicContact CE1-SD 3.43Å; F389-M460 WeakPolarHBondContact CE1-SD 3.25Å; F389-M460 HydrophobicContact CZ-CB 4.49Å; F389-M460 HydrophobicContact CZ-SD 4.12Å; F389-M716 HydrophobicContact CZ-CE 3.97Å; F389-L719 HydrophobicContact CD2-CB 4.26Å; F389-L719 HydrophobicContact CE2-CB 3.84Å; F389-K720 HydrophobicContact CE2-CB 4.18Å; F389-K720 HydrophobicContact CZ-CB 4.43Å; F389-W723 HydrophobicContact CB-CG 4.05Å; F389-W723 AromaticContact CD2-CD1 3.9Å; F389-W724 HydrophobicContact CB-CH2 4.14Å; F389-W724 HydrophobicContact CB-CZ3 3.87Å; F389-W724 HydrophobicContact CD1-CH2 4.04Å; F389-W724 AromaticContact CD1-CZ3 3.79Å; F389-W724 HydrophobicContact CD1-CZ3 3.79Å; F389-W724 HydrophobicContact CD2-CZ3 4.2Å; F389-W724 HydrophobicContact CE1-CZ3 4.37Å; F389-W724 HydrophobicContact CG-CH2 4.21Å; F389-W724 AromaticContact CG-CZ3 3.69Å; F389-W724 HydrophobicContact CG-CZ3 3.69Å
390	S	95.4	Very high	84.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-30.6	176.3	-65.5	0	0	0	0	112.1	F372 G388 L394 I440 S441 Y459	F372-S390 WeakPolarHBondContact O-CB 3.48Å; F372-S390 PolarHBondContact O-N 2.92Å; G388-S390 PolarHBondContact O-N 3.37Å; S390-L394 PolarHBondContact O-N 3.05Å; S390-I440 WeakPolarHBondContact O-CD1 3.29Å; S390-S441 PolarHBondContact OG-O 2.85Å; S390-Y459 PolarHBondContact OG-OH 2.84Å
391	I	95.1	Very high	86.4	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-73.1	-43.4	177.4	-53.8	-49.7	0	0	0	111	V373 G388 F389 V393 L394 D395 I407	V373-I391 HydrophobicContact CB-CD1 4.42Å; V373-I391 HydrophobicContact CB-CG1 4.49Å; V373-I391 HydrophobicContact CG1-CD1 3.92Å; V373-I391 HydrophobicContact CG1-CG1 4.15Å; V373-I391 HydrophobicContact CG2-CD1 3.79Å; V373-I391 HydrophobicContact CG2-CG1 4.13Å; G388-I391 PolarHBondContact O-N 3.45Å; G388-I391 VanDerWaalsContact O-N 3.1Å; F389-I391 PolarHBondContact O-N 3.03Å; I391-V393 VanDerWaalsContact C-N 3.27Å; I391-V393 PolarHBondContact O-N 2.85Å; I391-L394 WeakPolarHBondContact O-CB 3.25Å; I391-L394 PolarHBondContact O-N 3.39Å; I391-L394 VanDerWaalsContact O-N 3.15Å; I391-D395 WeakPolarHBondContact O-CB 3.02Å; I391-D395 PolarHBondContact O-N 3.27Å; I391-I407 HydrophobicContact CD1-CD1 3.8Å
392	D	95.1	Very high	87.8	Confident	27 Å²	27	49.7 Å²	49.7	14%	0.144	25%	0.25	C	S	.	.	H	α-helix	trans	-60.7	-36.7	174.3	-72.6	-28.7	0	0	0	112.2	G388 F389 D395 A396 L719 K722 W723	G388-D392 PolarHBondContact O-N 3.31Å; F389-D392 PolarHBondContact O-N 2.83Å; D392-D395 PolarHBondContact O-N 3.28Å; D392-A396 WeakPolarHBondContact O-CB 3.12Å; D392-A396 PolarHBondContact O-N 3.16Å; D392-L719 HydrophobicContact CB-CD1 4.33Å; D392-L719 HydrophobicContact CB-CD2 4.01Å; D392-K722 IonicContact OD1-NZ 2.68Å; D392-K722 PolarHBondContact OD1-NZ 3.04Å; D392-K722 WeakPolarHBondContact OD2-CD 3.47Å; D392-K722 WeakPolarHBondContact OD2-CE 3.47Å; D392-K722 IonicContact OD2-NZ 2.69Å; D392-K722 PolarHBondContact OD2-NZ 3.09Å; D392-W723 PolarHBondContact OD2-NE1 2.95Å
393	V	95.3	Very high	89.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.7	-40	175.5	172.7	0	0	0	0	111.1	F389 I391 A396 L397 M716 L719	F389-V393 HydrophobicContact CD2-CG2 4.38Å; F389-V393 HydrophobicContact CE2-CG2 4.04Å; F389-V393 HydrophobicContact CZ-CG2 4.16Å; F389-V393 WeakPolarHBondContact O-CG2 3.36Å; F389-V393 PolarHBondContact O-N 3.48Å; F389-V393 VanDerWaalsContact O-N 3.11Å; I391-V393 VanDerWaalsContact C-N 3.27Å; I391-V393 PolarHBondContact O-N 2.85Å; V393-A396 PolarHBondContact O-N 3.39Å; V393-L397 HydrophobicContact CG1-CD1 4.16Å; V393-L397 VanDerWaalsContact O-CG 3.3Å; V393-L397 WeakPolarHBondContact O-CG 3.26Å; V393-L397 PolarHBondContact O-N 3.33Å; V393-M716 HydrophobicContact CG1-CE 4.34Å; V393-M716 HydrophobicContact CG1-SD 4.47Å; V393-M716 HydrophobicContact CG2-CE 3.63Å; V393-M716 HydrophobicContact CG2-SD 4.07Å; V393-L719 HydrophobicContact CG2-CD1 3.96Å
394	L	95.1	Very high	90.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-44.2	173.2	-175.1	69.5	0	0	0	111.6	V364 S390 I391 L397 S398 F403 Y405 I407 I440	V364-L394 HydrophobicContact CG1-CD2 4.09Å; V364-L394 HydrophobicContact CG2-CD1 4.48Å; V364-L394 HydrophobicContact CG2-CD2 4.25Å; S390-L394 PolarHBondContact O-N 3.05Å; I391-L394 WeakPolarHBondContact O-CB 3.25Å; I391-L394 PolarHBondContact O-N 3.39Å; I391-L394 VanDerWaalsContact O-N 3.15Å; L394-L397 PolarHBondContact O-N 3.36Å; L394-S398 WeakPolarHBondContact O-CB 3.32Å; L394-S398 PolarHBondContact O-N 2.77Å; L394-F403 HydrophobicContact CD1-CE2 4.2Å; L394-F403 HydrophobicContact CD1-CZ 4.11Å; L394-Y405 HydrophobicContact CD2-CD1 4.09Å; L394-Y405 HydrophobicContact CD2-CD2 3.78Å; L394-Y405 HydrophobicContact CD2-CE1 3.92Å; L394-Y405 HydrophobicContact CD2-CE2 3.63Å; L394-Y405 HydrophobicContact CD2-CG 4.01Å; L394-Y405 HydrophobicContact CG-CD1 4.04Å; L394-Y405 HydrophobicContact CG-CE1 3.8Å; L394-Y405 HydrophobicContact CG-CE2 4.42Å; L394-Y405 HydrophobicContact CG-CG 4.42Å; L394-I407 HydrophobicContact CD2-CD1 4.06Å; L394-I407 HydrophobicContact CD2-CG1 4.29Å; L394-I440 HydrophobicContact CB-CD1 4.2Å; L394-I440 HydrophobicContact CD2-CG2 4.4Å
395	D	94.4	Very high	91.6	Very high	59 Å²	59	38 Å²	38	32%	0.316	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-43	174.1	-98.4	-47.6	0	0	0	111.1	I391 D392 S398 N399 Y405	I391-D395 WeakPolarHBondContact O-CB 3.02Å; I391-D395 PolarHBondContact O-N 3.27Å; D392-D395 PolarHBondContact O-N 3.28Å; D395-S398 WeakPolarHBondContact O-CB 3.19Å; D395-S398 PolarHBondContact O-N 2.91Å; D395-N399 WeakPolarHBondContact O-CB 3.37Å; D395-N399 PolarHBondContact O-N 3.1Å; D395-N399 PolarHBondContact O-ND2 3.38Å; D395-Y405 PolarHBondContact OD1-OH 3.14Å
396	A	93.5	Very high	92.1	Very high	25 Å²	25	37.5 Å²	37.5	21%	0.207	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-48.7	176.3	0	0	0	0	0	111.7	D392 V393 S398 N399 Y400 L710 L719	D392-A396 WeakPolarHBondContact O-CB 3.12Å; D392-A396 PolarHBondContact O-N 3.16Å; V393-A396 PolarHBondContact O-N 3.39Å; A396-S398 PolarHBondContact O-N 3.49Å; A396-N399 PolarHBondContact O-N 3.06Å; A396-Y400 WeakPolarHBondContact O-CB 3.26Å; A396-Y400 PolarHBondContact O-N 3.42Å; A396-L710 HydrophobicContact CB-CD1 4.26Å; A396-L719 HydrophobicContact CB-CD1 4.29Å
397	L	92.3	Very high	92.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-40.7	176.7	-69	168	0	0	0	112.1	V393 L394 Y400 L401 F403 I691 F703 R706 I707 L710	V393-L397 HydrophobicContact CG1-CD1 4.16Å; V393-L397 VanDerWaalsContact O-CG 3.3Å; V393-L397 WeakPolarHBondContact O-CG 3.26Å; V393-L397 PolarHBondContact O-N 3.33Å; L394-L397 PolarHBondContact O-N 3.36Å; L397-Y400 PolarHBondContact O-N 3.31Å; L397-L401 WeakPolarHBondContact O-CB 3.43Å; L397-L401 PolarHBondContact O-N 2.87Å; L397-F403 HydrophobicContact CB-CE1 4.19Å; L397-F403 HydrophobicContact CB-CZ 4.31Å; L397-F403 WeakPolarHBondContact O-CE1 3.38Å; L397-I691 HydrophobicContact CD1-CD1 3.57Å; L397-F703 HydrophobicContact CD1-CD1 3.9Å; L397-F703 HydrophobicContact CD1-CE1 4.25Å; L397-R706 HydrophobicContact CD2-CB 3.56Å; L397-I707 HydrophobicContact CD1-CG1 4.25Å; L397-I707 HydrophobicContact CD2-CG1 4.26Å; L397-L710 HydrophobicContact CD2-CD1 3.98Å; L397-L710 HydrophobicContact CG-CD1 4.33Å
398	S	92.9	Very high	92.4	Very high	15 Å²	15	36.8 Å²	36.8	11%	0.105	19%	0.188	C	C	.	.	H	α-helix	trans	-57.5	-52.5	175.6	-178.7	0	0	0	0	111.3	L394 D395 A396 Y400 G402 F403	L394-S398 WeakPolarHBondContact O-CB 3.32Å; L394-S398 PolarHBondContact O-N 2.77Å; D395-S398 WeakPolarHBondContact O-CB 3.19Å; D395-S398 PolarHBondContact O-N 2.91Å; A396-S398 PolarHBondContact O-N 3.49Å; S398-Y400 VanDerWaalsContact C-N 3.33Å; S398-Y400 PolarHBondContact O-N 2.86Å; S398-G402 VanDerWaalsContact O-CA 3.3Å; S398-G402 WeakPolarHBondContact O-CA 3.33Å; S398-G402 PolarHBondContact O-N 3.42Å; S398-F403 VanDerWaalsContact CA-CE1 3.43Å; S398-F403 PolarHBondContact OG-O 3.04Å
399	N	90.9	Very high	92.4	Very high	131 Å²	131	38.1 Å²	38.1	70%	0.701	20%	0.196	S	C	*	.	H	α-helix	trans	-64.1	-34.9	178	-76.7	-73.5	0	0	0	112.9	D395 A396	D395-N399 WeakPolarHBondContact O-CB 3.37Å; D395-N399 PolarHBondContact O-N 3.1Å; D395-N399 PolarHBondContact O-ND2 3.38Å; A396-N399 PolarHBondContact O-N 3.06Å
400	Y	85.8	Confident	92.3	Very high	97 Å²	97	38 Å²	38	38%	0.38	20%	0.195	S	C	.	.	H	α-helix	trans	-75	-42.4	-178.4	-138.3	-85.3	0	0	0	113.1	N355 A396 L397 S398	N355-Y400 PolarHBondContact ND2-O 3.45Å; N355-Y400 PolarHBondContact OD1-O 3.25Å; A396-Y400 WeakPolarHBondContact O-CB 3.26Å; A396-Y400 PolarHBondContact O-N 3.42Å; L397-Y400 PolarHBondContact O-N 3.31Å; S398-Y400 VanDerWaalsContact C-N 3.33Å; S398-Y400 PolarHBondContact O-N 2.86Å
401	L	86.6	Confident	92.1	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-95.2	-21.3	-174.2	-68.8	165.3	0	0	0	113.4	M357 L397 F403 V702 F703 R706	M357-L401 HydrophobicContact CE-CB 3.54Å; M357-L401 HydrophobicContact CE-CD1 3.64Å; M357-L401 HydrophobicContact CE-CD2 4.4Å; M357-L401 HydrophobicContact CE-CG 4.05Å; L397-L401 WeakPolarHBondContact O-CB 3.43Å; L397-L401 PolarHBondContact O-N 2.87Å; L401-F403 HydrophobicContact CB-CD1 3.93Å; L401-F403 HydrophobicContact CB-CE1 4.29Å; L401-F403 HydrophobicContact CD1-CE1 4.28Å; L401-V702 HydrophobicContact CD1-CG1 4.23Å; L401-V702 HydrophobicContact CD2-CG1 3.67Å; L401-F703 HydrophobicContact CD1-CD2 4.32Å; L401-F703 HydrophobicContact CD1-CE2 4.36Å; L401-R706 HydrophobicContact CD1-CG 3.89Å; L401-R706 HydrophobicContact CD2-CG 3.71Å; L401-R706 HydrophobicContact CG-CG 3.89Å
402	G	85.4	Confident	91.8	Very high	24 Å²	24	45.8 Å²	45.8	25%	0.247	24%	0.242	C	C	.	.			trans	84.6	20	175	0	0	0	0	0	115.7	R358 S398	R358-G402 WeakPolarHBondContact CA-O 3.5Å; S398-G402 VanDerWaalsContact O-CA 3.3Å; S398-G402 WeakPolarHBondContact O-CA 3.33Å; S398-G402 PolarHBondContact O-N 3.42Å
403	F	89.9	Confident	91.4	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.009	26%	0.261	C	S	.	.			trans	-82.9	158.2	174.7	67.1	-87.7	0	0	0	111.8	M357 L362 L394 L397 S398 L401 Y405 F703	M357-F403 HydrophobicContact CB-CB 3.91Å; M357-F403 HydrophobicContact CE-CB 4.3Å; M357-F403 HydrophobicContact CE-CD1 3.55Å; M357-F403 HydrophobicContact CE-CE1 4.19Å; M357-F403 HydrophobicContact CE-CG 4.23Å; M357-F403 WeakPolarHBondContact O-CA 3.25Å; L362-F403 HydrophobicContact CD1-CB 4.49Å; L362-F403 HydrophobicContact CD1-CD2 3.74Å; L362-F403 HydrophobicContact CD1-CE2 4.08Å; L362-F403 HydrophobicContact CD1-CG 4.12Å; L362-F403 HydrophobicContact CG-CD2 4.28Å; L394-F403 HydrophobicContact CD1-CE2 4.2Å; L394-F403 HydrophobicContact CD1-CZ 4.11Å; L397-F403 HydrophobicContact CB-CE1 4.19Å; L397-F403 HydrophobicContact CB-CZ 4.31Å; L397-F403 WeakPolarHBondContact O-CE1 3.38Å; S398-F403 VanDerWaalsContact CA-CE1 3.43Å; S398-F403 PolarHBondContact OG-O 3.04Å; L401-F403 HydrophobicContact CB-CD1 3.93Å; L401-F403 HydrophobicContact CB-CE1 4.29Å; L401-F403 HydrophobicContact CD1-CE1 4.28Å; F403-Y405 HydrophobicContact CD2-CD1 4.26Å; F403-Y405 AromaticContact CE2-CD1 3.79Å; F403-Y405 HydrophobicContact CE2-CD1 3.79Å; F403-Y405 HydrophobicContact CE2-CG 4.4Å; F403-F703 HydrophobicContact CD1-CZ 4.32Å; F403-F703 HydrophobicContact CE1-CE1 4.13Å; F403-F703 HydrophobicContact CE1-CE2 4.34Å; F403-F703 AromaticContact CE1-CZ 3.6Å; F403-F703 HydrophobicContact CE1-CZ 3.6Å; F403-F703 HydrophobicContact CE2-CZ 4.28Å; F403-F703 AromaticContact CZ-CE1 3.88Å; F403-F703 HydrophobicContact CZ-CE1 3.88Å; F403-F703 AromaticContact CZ-CZ 3.59Å; F403-F703 HydrophobicContact CZ-CZ 3.59Å
404	N	91.4	Very high	91.1	Very high	98 Å²	98	54.2 Å²	54.2	52%	0.524	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	158.6	164.9	-67.9	-43.5	0	0	0	109.3	V360 V361 L362	V360-N404 PolarHBondContact O-N 2.92Å; V361-N404 CarbonylContact C-O 3.55Å; V361-N404 WeakPolarHBondContact CA-O 3.37Å; V361-N404 HydrophobicContact CG2-CB 4.19Å; L362-N404 PolarHBondContact N-O 2.92Å
405	Y	93.3	Very high	90.8	Very high	54 Å²	54	56.4 Å²	56.4	21%	0.212	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	157.3	177.3	64.2	-101.9	0	0	0	112.9	L362 V364 L394 D395 F403 I407	L362-Y405 VanDerWaalsContact O-CA 3.23Å; L362-Y405 WeakPolarHBondContact O-CA 3.42Å; L362-Y405 WeakPolarHBondContact O-CB 3.47Å; V364-Y405 HydrophobicContact CG2-CG 4.43Å; L394-Y405 HydrophobicContact CD2-CD1 4.09Å; L394-Y405 HydrophobicContact CD2-CD2 3.78Å; L394-Y405 HydrophobicContact CD2-CE1 3.92Å; L394-Y405 HydrophobicContact CD2-CE2 3.63Å; L394-Y405 HydrophobicContact CD2-CG 4.01Å; L394-Y405 HydrophobicContact CG-CD1 4.04Å; L394-Y405 HydrophobicContact CG-CE1 3.8Å; L394-Y405 HydrophobicContact CG-CE2 4.42Å; L394-Y405 HydrophobicContact CG-CG 4.42Å; D395-Y405 PolarHBondContact OD1-OH 3.14Å; F403-Y405 HydrophobicContact CD2-CD1 4.26Å; F403-Y405 AromaticContact CE2-CD1 3.79Å; F403-Y405 HydrophobicContact CE2-CD1 3.79Å; F403-Y405 HydrophobicContact CE2-CG 4.4Å; Y405-I407 HydrophobicContact CD2-CD1 4.19Å; Y405-I407 HydrophobicContact CD2-CG1 3.71Å; Y405-I407 HydrophobicContact CE2-CD1 3.61Å; Y405-I407 HydrophobicContact CE2-CG1 3.66Å
406	E	92.8	Very high	90.5	Very high	131 Å²	131	53.9 Å²	53.9	61%	0.612	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	120	172.7	-65	-172.6	167.9	0	0	109.3	V361 L362 V364	V361-E406 HydrophobicContact CG1-CG 4.15Å; L362-E406 PolarHBondContact O-N 2.91Å; V364-E406 PolarHBondContact N-O 2.69Å
407	I	92.9	Very high	90.2	Very high	33 Å²	33	53.9 Å²	53.9	17%	0.169	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	131	-179.5	-58.4	175.9	0	0	0	110.5	V364 T366 Y386 I391 L394 Y405	V364-I407 HydrophobicContact CB-CG1 4.2Å; V364-I407 HydrophobicContact CG1-CG1 4.26Å; V364-I407 WeakPolarHBondContact O-CA 3.39Å; T366-I407 HydrophobicContact CG2-CG2 3.61Å; Y386-I407 HydrophobicContact CD2-CB 3.79Å; Y386-I407 HydrophobicContact CD2-CD1 4.18Å; Y386-I407 HydrophobicContact CD2-CG2 3.65Å; Y386-I407 HydrophobicContact CE2-CB 3.93Å; Y386-I407 HydrophobicContact CE2-CG2 3.73Å; Y386-I407 HydrophobicContact CG-CG2 4.15Å; I391-I407 HydrophobicContact CD1-CD1 3.8Å; L394-I407 HydrophobicContact CD2-CD1 4.06Å; L394-I407 HydrophobicContact CD2-CG1 4.29Å; Y405-I407 HydrophobicContact CD2-CD1 4.19Å; Y405-I407 HydrophobicContact CD2-CG1 3.71Å; Y405-I407 HydrophobicContact CE2-CD1 3.61Å; Y405-I407 HydrophobicContact CE2-CG1 3.66Å
408	Y	93.2	Very high	89.9	Confident	66 Å²	66	57.7 Å²	57.7	26%	0.259	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	153.4	164	75.1	-83.2	0	0	0	111.7	V364 V365 T366 E430 R435 A436	V364-Y408 PolarHBondContact O-N 3.28Å; V365-Y408 CarbonylContact C-O 3.54Å; V365-Y408 WeakPolarHBondContact CA-O 3.33Å; V365-Y408 HydrophobicContact CB-CE1 4.2Å; V365-Y408 HydrophobicContact CB-CE2 4.37Å; V365-Y408 HydrophobicContact CG2-CE2 4.24Å; T366-Y408 PolarHBondContact N-O 3.12Å; Y408-E430 WeakPolarHBondContact CE2-OE2 3.07Å; Y408-E430 PolarHBondContact OH-OE2 3.23Å; Y408-R435 VanDerWaalsContact OH-C 3.31Å; Y408-R435 PolarHBondContact OH-O 3.1Å; Y408-A436 HydrophobicContact CE1-CB 4Å; Y408-A436 WeakPolarHBondContact OH-CB 3.44Å; Y408-A436 PolarHBondContact OH-N 3.38Å
409	V	93.4	Very high	89.6	Confident	28 Å²	28	61.1 Å²	61.1	17%	0.17	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	140.1	178.4	-176.9	0	0	0	0	109.4	T366 L368 Y386 H413	T366-V409 HydrophobicContact CG2-CG2 3.94Å; T366-V409 CarbonylContact O-C 3.51Å; T366-V409 WeakPolarHBondContact O-CA 3.46Å; L368-V409 HydrophobicContact CD2-CG2 4.02Å; L368-V409 HydrophobicContact CG-CG1 4.25Å; L368-V409 HydrophobicContact CG-CG2 4.17Å; Y386-V409 HydrophobicContact CE1-CG2 3.76Å; V409-H413 WeakPolarHBondContact CG1-ND1 3.22Å
410	A	93.2	Very high	89.3	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.327	C	S	.	.			trans	-53	129.6	175.1	0	0	0	0	0	110.9	V365 T366 V367 D412 H413	V365-A410 HydrophobicContact CG2-CB 4Å; T366-A410 PolarHBondContact O-N 2.94Å; V367-A410 HydrophobicContact CG2-CB 4.21Å; A410-D412 PolarHBondContact O-N 3.14Å; A410-D412 VanDerWaalsContact O-N 3.12Å; A410-H413 PolarHBondContact O-N 3.32Å
411	P	91.2	Very high	89.1	Confident	98 Å²	98	66 Å²	66	64%	0.636	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.4	-170.7	-26.7	35.4	0	0	0	116.2
412	D	88.4	Confident	88.9	Confident	70 Å²	70	68.7 Å²	68.7	37%	0.374	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	1.5	177.4	64.6	-1.3	0	0	0	113.1	A410 K414 G426	A410-D412 PolarHBondContact O-N 3.14Å; A410-D412 VanDerWaalsContact O-N 3.12Å; D412-K414 PolarHBondContact O-N 3.34Å; D412-K414 VanDerWaalsContact O-N 3.12Å; D412-K414 PolarHBondContact OD1-N 2.71Å; D412-G426 WeakPolarHBondContact OD1-CA 3.45Å; D412-G426 WeakPolarHBondContact OD2-CA 3.47Å; D412-G426 PolarHBondContact OD2-N 3.17Å
413	H	88.7	Confident	89	Confident	118 Å²	118	70.1 Å²	70.1	55%	0.546	37%	0.372	S	S	.	.			trans	55.8	15.6	-174	-61.3	-80.7	0	0	0	115.7	V409 A410	V409-H413 WeakPolarHBondContact CG1-ND1 3.22Å; A410-H413 PolarHBondContact O-N 3.32Å
414	K	88.4	Confident	89.1	Confident	85 Å²	85	71.2 Å²	71.2	37%	0.37	38%	0.376	S	S	.	.			trans	-96.6	150	-179.9	-69.8	-164.3	173.2	-163.6	0	112.8	V367 D412 G416 G426 L427 D603	V367-K414 WeakPolarHBondContact CG2-O 3.28Å; D412-K414 PolarHBondContact O-N 3.34Å; D412-K414 VanDerWaalsContact O-N 3.12Å; D412-K414 PolarHBondContact OD1-N 2.71Å; K414-G416 VanDerWaalsContact C-N 3.32Å; K414-G426 CarbonylContact O-C 3.55Å; K414-G426 WeakPolarHBondContact O-CA 3.43Å; K414-L427 PolarHBondContact O-N 2.9Å; K414-D603 IonicContact NZ-OD2 3.74Å; K414-D603 PolarHBondContact NZ-OD2 3.18Å
415	Y	88.8	Confident	89	Confident	47 Å²	47	67.7 Å²	67.7	18%	0.184	36%	0.357	C	S	.	.			trans	-68.3	-29.5	172.2	-70.7	-80.1	0	0	0	113.5	V367 E369 V428 A442 L443	V367-Y415 HydrophobicContact CB-CD1 4.23Å; V367-Y415 HydrophobicContact CB-CE1 4.02Å; V367-Y415 HydrophobicContact CG1-CD1 4.41Å; V367-Y415 HydrophobicContact CG1-CD2 4.4Å; V367-Y415 HydrophobicContact CG1-CE1 4.06Å; V367-Y415 HydrophobicContact CG1-CE2 4.05Å; V367-Y415 HydrophobicContact CG2-CD1 4.29Å; E369-Y415 WeakPolarHBondContact CB-OH 3.46Å; E369-Y415 WeakPolarHBondContact CG-OH 3.29Å; E369-Y415 PolarHBondContact OE2-OH 3.18Å; Y415-V428 WeakPolarHBondContact O-CG2 3.49Å; Y415-V428 PolarHBondContact O-N 2.77Å; Y415-A442 HydrophobicContact CE1-CB 4.39Å; Y415-L443 HydrophobicContact CD1-CD1 4.1Å
416	G	88.4	Confident	89	Confident	6 Å²	6	65.3 Å²	65.3	6%	0.062	35%	0.349	C	S	.	.			trans	115.7	121.8	-177.9	0	0	0	0	0	113.3	K414 N425 R449	K414-G416 VanDerWaalsContact C-N 3.32Å; G416-N425 WeakPolarHBondContact CA-O 3.13Å; G416-N425 VanDerWaalsContact CA-OD1 3.27Å; G416-N425 WeakPolarHBondContact CA-OD1 3.19Å; G416-R449 PolarHBondContact O-NE 2.94Å; G416-R449 PolarHBondContact O-NH2 3.24Å
417	S	85.7	Confident	89.1	Confident	25 Å²	25	59.1 Å²	59.1	18%	0.175	32%	0.32	C	S	.	.			trans	-124.7	153.8	169.9	65.5	0	0	0	0	110.2	N425	S417-N425 PolarHBondContact N-OD1 2.69Å; S417-N425 PolarHBondContact O-N 3.3Å; S417-N425 PolarHBondContact OG-ND2 2.71Å; S417-N425 PolarHBondContact OG-OD1 3.47Å
418	P	86.4	Confident	89.1	Confident	79 Å²	79	57.5 Å²	57.5	51%	0.513	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-69.6	142.6	167.4	30.9	-33	0	0	0	109.7	W424	P418-W424 HydrophobicContact CB-CD2 4.43Å; P418-W424 HydrophobicContact CB-CH2 4.27Å; P418-W424 HydrophobicContact CB-CZ2 3.88Å; P418-W424 HydrophobicContact CG-CH2 4.22Å; P418-W424 HydrophobicContact CG-CZ2 4.26Å
419	Q	86	Confident	89.1	Confident	87 Å²	87	54.5 Å²	54.5	41%	0.407	30%	0.3	S	S	.	.			trans	-104.8	163.4	179.6	-59	-73.2	82.2	0	0	110.5	D421 G422 T423 N425	Q419-D421 VanDerWaalsContact CB-OD1 3.28Å; Q419-D421 WeakPolarHBondContact CB-OD1 3.15Å; Q419-D421 PolarHBondContact O-N 3.42Å; Q419-G422 PolarHBondContact O-N 3.11Å; Q419-T423 WeakPolarHBondContact CB-O 3.4Å; Q419-T423 PolarHBondContact N-O 2.71Å; Q419-N425 VanDerWaalsContact CD-ND2 3.29Å; Q419-N425 HydrophobicContact CG-CB 4.5Å; Q419-N425 PolarHBondContact OE1-ND2 3.23Å
420	E	84.6	Confident	89.2	Confident	212 Å²	212	53.8 Å²	53.8	99%	0.991	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.4	-178.4	-62.8	-172	163	0	0	114	G422	E420-G422 VanDerWaalsContact C-N 3.29Å
421	D	82.9	Confident	89.3	Confident	118 Å²	118	53.8 Å²	53.8	63%	0.631	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	2	174.7	65.1	1.4	0	0	0	113.7	Q419 T423	Q419-D421 VanDerWaalsContact CB-OD1 3.28Å; Q419-D421 WeakPolarHBondContact CB-OD1 3.15Å; Q419-D421 PolarHBondContact O-N 3.42Å; D421-T423 VanDerWaalsContact C-N 3.28Å; D421-T423 PolarHBondContact O-N 3.07Å; D421-T423 VanDerWaalsContact OD1-CB 3.27Å; D421-T423 WeakPolarHBondContact OD1-CB 3.38Å; D421-T423 WeakPolarHBondContact OD1-CG2 3.17Å; D421-T423 PolarHBondContact OD1-N 2.88Å; D421-T423 PolarHBondContact OD1-OG1 3.31Å; D421-T423 PolarHBondContact OD2-OG1 3.34Å
422	G	81.6	Confident	89.3	Confident	61 Å²	61	51.9 Å²	51.9	63%	0.629	28%	0.282	S	S	*	.	S	Bend	trans	79.6	2.1	-176.1	0	0	0	0	0	114.7	Q419 E420	Q419-G422 PolarHBondContact O-N 3.11Å; E420-G422 VanDerWaalsContact C-N 3.29Å
423	T	88.6	Confident	89.4	Confident	54 Å²	54	53.3 Å²	53.3	33%	0.331	29%	0.285	S	S	.	.			trans	-80.7	169.9	173.7	71.3	0	0	0	0	111.9	Q419 D421	Q419-T423 WeakPolarHBondContact CB-O 3.4Å; Q419-T423 PolarHBondContact N-O 2.71Å; D421-T423 VanDerWaalsContact C-N 3.28Å; D421-T423 PolarHBondContact O-N 3.07Å; D421-T423 VanDerWaalsContact OD1-CB 3.27Å; D421-T423 WeakPolarHBondContact OD1-CB 3.38Å; D421-T423 WeakPolarHBondContact OD1-CG2 3.17Å; D421-T423 PolarHBondContact OD1-N 2.88Å; D421-T423 PolarHBondContact OD1-OG1 3.31Å; D421-T423 PolarHBondContact OD2-OG1 3.34Å
424	W	90.5	Very high	89.4	Confident	26 Å²	26	54 Å²	54	10%	0.098	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-119.4	134.5	175.1	-76.7	77.1	0	0	0	110.4	P418 V428 G429 D448 R449 V452	P418-W424 HydrophobicContact CB-CD2 4.43Å; P418-W424 HydrophobicContact CB-CH2 4.27Å; P418-W424 HydrophobicContact CB-CZ2 3.88Å; P418-W424 HydrophobicContact CG-CH2 4.22Å; P418-W424 HydrophobicContact CG-CZ2 4.26Å; W424-V428 HydrophobicContact CB-CG1 4.31Å; W424-V428 HydrophobicContact CD2-CG1 3.87Å; W424-V428 HydrophobicContact CE3-CB 4.01Å; W424-V428 HydrophobicContact CE3-CG1 3.55Å; W424-V428 HydrophobicContact CG-CG1 4.21Å; W424-V428 HydrophobicContact CZ3-CG1 4.14Å; W424-G429 VanDerWaalsContact O-CA 3.27Å; W424-G429 WeakPolarHBondContact O-CA 3.47Å; W424-D448 HydrophobicContact CH2-CB 4.03Å; W424-D448 WeakPolarHBondContact CH2-O 3.45Å; W424-D448 HydrophobicContact CZ2-CB 4.35Å; W424-D448 WeakPolarHBondContact CZ2-O 3.47Å; W424-R449 HydrophobicContact CH2-CG 3.84Å; W424-R449 HydrophobicContact CZ3-CG 3.74Å; W424-V452 HydrophobicContact CD2-CG2 4.14Å; W424-V452 HydrophobicContact CG-CG2 4.49Å; W424-V452 HydrophobicContact CZ2-CG2 3.96Å
425	N	90.9	Very high	89.4	Confident	24 Å²	24	55.9 Å²	55.9	13%	0.128	29%	0.291	C	S	.	.			trans	-91.2	-176.9	170.7	66.8	35.8	0	0	0	111.2	G416 S417 Q419 G429	G416-N425 WeakPolarHBondContact CA-O 3.13Å; G416-N425 VanDerWaalsContact CA-OD1 3.27Å; G416-N425 WeakPolarHBondContact CA-OD1 3.19Å; S417-N425 PolarHBondContact N-OD1 2.69Å; S417-N425 PolarHBondContact O-N 3.3Å; S417-N425 PolarHBondContact OG-ND2 2.71Å; S417-N425 PolarHBondContact OG-OD1 3.47Å; Q419-N425 VanDerWaalsContact CD-ND2 3.29Å; Q419-N425 HydrophobicContact CG-CB 4.5Å; Q419-N425 PolarHBondContact OE1-ND2 3.23Å; N425-G429 WeakPolarHBondContact O-CA 3.34Å; N425-G429 PolarHBondContact O-N 2.74Å
426	G	91.9	Very high	89.6	Confident	4 Å²	4	53.7 Å²	53.7	4%	0.041	28%	0.282	C	S	.	.	H	α-helix	trans	65.8	-163.4	170.8	0	0	0	0	0	116.6	D412 K414 V428 G429 E430	D412-G426 WeakPolarHBondContact OD1-CA 3.45Å; D412-G426 WeakPolarHBondContact OD2-CA 3.47Å; D412-G426 PolarHBondContact OD2-N 3.17Å; K414-G426 CarbonylContact O-C 3.55Å; K414-G426 WeakPolarHBondContact O-CA 3.43Å; G426-V428 VanDerWaalsContact C-N 3.27Å; G426-V428 PolarHBondContact O-N 2.9Å; G426-G429 WeakPolarHBondContact O-CA 3.37Å; G426-G429 PolarHBondContact O-N 2.83Å; G426-E430 PolarHBondContact O-N 2.86Å
427	L	94.7	Very high	89.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-50.9	-43.2	174.8	-176.9	166.8	0	0	0	112.3	V365 V367 K414 E430 L431 L443	V365-L427 HydrophobicContact CG1-CD2 4.22Å; V365-L427 HydrophobicContact CG1-CG 3.89Å; V365-L427 HydrophobicContact CG2-CB 4.36Å; V365-L427 HydrophobicContact CG2-CG 4.16Å; V367-L427 HydrophobicContact CG2-CB 4.08Å; V367-L427 HydrophobicContact CG2-CD1 4.11Å; K414-L427 PolarHBondContact O-N 2.9Å; L427-E430 PolarHBondContact O-N 3.42Å; L427-L431 HydrophobicContact CD2-CD1 4.2Å; L427-L431 PolarHBondContact O-N 3.01Å; L427-L443 HydrophobicContact CD2-CD2 3.75Å
428	V	94.4	Very high	90.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.3	-42.2	174.9	175.4	0	0	0	0	111.5	Y415 W424 G426 E430 L431 V432 R449 V452 V453	Y415-V428 WeakPolarHBondContact O-CG2 3.49Å; Y415-V428 PolarHBondContact O-N 2.77Å; W424-V428 HydrophobicContact CB-CG1 4.31Å; W424-V428 HydrophobicContact CD2-CG1 3.87Å; W424-V428 HydrophobicContact CE3-CB 4.01Å; W424-V428 HydrophobicContact CE3-CG1 3.55Å; W424-V428 HydrophobicContact CG-CG1 4.21Å; W424-V428 HydrophobicContact CZ3-CG1 4.14Å; G426-V428 VanDerWaalsContact C-N 3.27Å; G426-V428 PolarHBondContact O-N 2.9Å; V428-E430 PolarHBondContact O-N 2.94Å; V428-L431 PolarHBondContact O-N 3.25Å; V428-V432 HydrophobicContact CG1-CG2 4.24Å; V428-V432 WeakPolarHBondContact O-CG2 3.32Å; V428-V432 PolarHBondContact O-N 2.95Å; V428-R449 HydrophobicContact CG2-CG 4.12Å; V428-V452 HydrophobicContact CG1-CG2 3.85Å; V428-V453 HydrophobicContact CG1-CG1 4.06Å; V428-V453 HydrophobicContact CG1-CG2 4.14Å; V428-V453 HydrophobicContact CG2-CG2 4.42Å
429	G	93.3	Very high	90.7	Very high	2 Å²	2	50 Å²	50	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-58.2	-44.7	174.6	0	0	0	0	0	113.1	W424 N425 G426 L431 V432 F433	W424-G429 VanDerWaalsContact O-CA 3.27Å; W424-G429 WeakPolarHBondContact O-CA 3.47Å; N425-G429 WeakPolarHBondContact O-CA 3.34Å; N425-G429 PolarHBondContact O-N 2.74Å; G426-G429 WeakPolarHBondContact O-CA 3.37Å; G426-G429 PolarHBondContact O-N 2.83Å; G429-L431 PolarHBondContact O-N 3.18Å; G429-V432 PolarHBondContact O-N 3.22Å; G429-F433 WeakPolarHBondContact O-CB 3.4Å; G429-F433 WeakPolarHBondContact O-CD2 3.41Å; G429-F433 PolarHBondContact O-N 2.73Å
430	E	95.4	Very high	91.1	Very high	13 Å²	13	45.9 Å²	45.9	6%	0.061	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-32.5	176.9	-71.3	-69.5	117.4	0	0	113.1	V365 Y408 G426 L427 V428 K434 R435 A436	V365-E430 HydrophobicContact CB-CB 4.32Å; V365-E430 HydrophobicContact CG1-CB 4.21Å; V365-E430 HydrophobicContact CG2-CB 4.03Å; V365-E430 HydrophobicContact CG2-CG 4.08Å; Y408-E430 WeakPolarHBondContact CE2-OE2 3.07Å; Y408-E430 PolarHBondContact OH-OE2 3.23Å; G426-E430 PolarHBondContact O-N 2.86Å; L427-E430 PolarHBondContact O-N 3.42Å; V428-E430 PolarHBondContact O-N 2.94Å; E430-K434 PolarHBondContact O-N 3.23Å; E430-R435 PolarHBondContact O-N 3.41Å; E430-R435 VanDerWaalsContact OE1-CD 3.29Å; E430-R435 WeakPolarHBondContact OE1-CD 3.42Å; E430-R435 IonicContact OE1-CZ 2.68Å; E430-R435 IonicContact OE1-NE 3.59Å; E430-R435 IonicContact OE1-NH1 3.97Å; E430-R435 PolarHBondContact OE1-NH1 3.42Å; E430-R435 VanDerWaalsContact OE2-CB 3.3Å; E430-R435 WeakPolarHBondContact OE2-CB 3.12Å; E430-R435 WeakPolarHBondContact OE2-CD 3.26Å; E430-A436 PolarHBondContact O-N 3.08Å
431	L	94.2	Very high	91.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-75.6	-45.8	172.5	-69.9	174.8	0	0	0	112.5	V365 L427 V428 G429 F433 K434 A436 V453 A692 Q694	V365-L431 HydrophobicContact CG1-CD2 4.43Å; V365-L431 HydrophobicContact CG1-CG 4.29Å; L427-L431 HydrophobicContact CD2-CD1 4.2Å; L427-L431 PolarHBondContact O-N 3.01Å; V428-L431 PolarHBondContact O-N 3.25Å; G429-L431 PolarHBondContact O-N 3.18Å; L431-F433 VanDerWaalsContact C-N 3.29Å; L431-F433 PolarHBondContact O-N 3.31Å; L431-K434 WeakPolarHBondContact O-CA 3.37Å; L431-K434 PolarHBondContact O-N 3.11Å; L431-A436 HydrophobicContact CD2-CB 4.08Å; L431-V453 HydrophobicContact CB-CG1 3.7Å; L431-V453 HydrophobicContact CD1-CB 4.45Å; L431-V453 HydrophobicContact CD1-CG1 4.05Å; L431-A692 HydrophobicContact CD1-CB 3.52Å; L431-Q694 HydrophobicContact CD2-CG 4.41Å
432	V	91	Very high	92	Very high	58 Å²	58	30.4 Å²	30.4	35%	0.352	16%	0.161	S	C	.	.	H	α-helix	trans	-60.7	-39.2	177.8	171.6	0	0	0	0	111.2	V428 G429 K434 V452 V453	V428-V432 HydrophobicContact CG1-CG2 4.24Å; V428-V432 WeakPolarHBondContact O-CG2 3.32Å; V428-V432 PolarHBondContact O-N 2.95Å; G429-V432 PolarHBondContact O-N 3.22Å; V432-K434 VanDerWaalsContact C-N 3.27Å; V432-K434 PolarHBondContact O-N 2.93Å; V432-V452 HydrophobicContact CG2-CB 4.09Å; V432-V452 HydrophobicContact CG2-CG2 4.17Å; V432-V453 HydrophobicContact CG2-CG1 4.01Å
433	F	90.9	Very high	92.5	Very high	100 Å²	100	27.5 Å²	27.5	44%	0.439	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	5	173.5	-63.2	-57	0	0	0	114.3	G429 L431 R435	G429-F433 WeakPolarHBondContact O-CB 3.4Å; G429-F433 WeakPolarHBondContact O-CD2 3.41Å; G429-F433 PolarHBondContact O-N 2.73Å; L431-F433 VanDerWaalsContact C-N 3.29Å; L431-F433 PolarHBondContact O-N 3.31Å; F433-R435 HydrophobicContact CB-CG 4.05Å; F433-R435 PolarHBondContact O-N 3.06Å; F433-R435 VanDerWaalsContact O-N 3.17Å
434	K	89.1	Confident	92.7	Very high	132 Å²	132	25.2 Å²	25.2	57%	0.574	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	26	176.7	-51.3	-168.3	174.7	-168.3	0	115.4	R363 E430 L431 V432	R363-K434 PolarHBondContact NH1-O 3.47Å; R363-K434 PolarHBondContact NH2-O 3.35Å; E430-K434 PolarHBondContact O-N 3.23Å; L431-K434 WeakPolarHBondContact O-CA 3.37Å; L431-K434 PolarHBondContact O-N 3.11Å; V432-K434 VanDerWaalsContact C-N 3.27Å; V432-K434 PolarHBondContact O-N 2.93Å
435	R	88.6	Confident	92.7	Very high	125 Å²	125	25.5 Å²	25.5	47%	0.472	12%	0.12	S	C	.	.	S	Bend	trans	-80.1	-32.4	177.3	-57.7	-178.6	-164.7	157.8	4.2	111.5	R363 Y408 E430 F433	R363-R435 PolarHBondContact NH1-O 2.84Å; Y408-R435 VanDerWaalsContact OH-C 3.31Å; Y408-R435 PolarHBondContact OH-O 3.1Å; E430-R435 PolarHBondContact O-N 3.41Å; E430-R435 VanDerWaalsContact OE1-CD 3.29Å; E430-R435 WeakPolarHBondContact OE1-CD 3.42Å; E430-R435 IonicContact OE1-CZ 2.68Å; E430-R435 IonicContact OE1-NE 3.59Å; E430-R435 IonicContact OE1-NH1 3.97Å; E430-R435 PolarHBondContact OE1-NH1 3.42Å; E430-R435 VanDerWaalsContact OE2-CB 3.3Å; E430-R435 WeakPolarHBondContact OE2-CB 3.12Å; E430-R435 WeakPolarHBondContact OE2-CD 3.26Å; F433-R435 HydrophobicContact CB-CG 4.05Å; F433-R435 PolarHBondContact O-N 3.06Å; F433-R435 VanDerWaalsContact O-N 3.17Å
436	A	93.5	Very high	92.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.			trans	-111.9	161	164.6	0	0	0	0	0	111.5	V365 Y408 E430 L431 Q694	V365-A436 HydrophobicContact CB-CB 3.63Å; V365-A436 HydrophobicContact CG1-CB 3.38Å; Y408-A436 HydrophobicContact CE1-CB 4Å; Y408-A436 WeakPolarHBondContact OH-CB 3.44Å; Y408-A436 PolarHBondContact OH-N 3.38Å; E430-A436 PolarHBondContact O-N 3.08Å; L431-A436 HydrophobicContact CD2-CB 4.08Å; A436-Q694 PolarHBondContact O-NE2 2.85Å
437	D	90.9	Very high	92.2	Very high	33 Å²	33	28.3 Å²	28.3	18%	0.176	14%	0.139	C	C	.	.	S	Bend	trans	-101.9	-33.3	178.2	-52.2	-55.8	0	0	0	111.1	L362 R363 Q694	L362-D437 HydrophobicContact CD2-CB 4.35Å; R363-D437 VanDerWaalsContact CB-OD2 3.26Å; R363-D437 WeakPolarHBondContact CB-OD2 3.46Å; R363-D437 WeakPolarHBondContact CG-OD2 3.49Å; R363-D437 IonicContact CZ-OD1 2.65Å; R363-D437 IonicContact CZ-OD2 2.7Å; R363-D437 PolarHBondContact N-OD2 3.33Å; R363-D437 IonicContact NE-OD1 2.78Å; R363-D437 IonicContact NE-OD2 2.68Å; R363-D437 PolarHBondContact NE-OD2 2.94Å; R363-D437 IonicContact NH2-OD1 3.6Å; R363-D437 PolarHBondContact NH2-OD1 3.19Å; R363-D437 IonicContact NH2-OD2 3.85Å; R363-D437 PolarHBondContact O-N 3.39Å; D437-Q694 PolarHBondContact OD1-NE2 3.16Å
438	I	95.2	Very high	91.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.3	177.6	-66.7	-168.7	0	0	0	109.7	L362 R363 V364 V365 I691 A692 L693 F703	L362-I438 HydrophobicContact CD1-CD1 3.72Å; R363-I438 PolarHBondContact O-N 3.2Å; V364-I438 CarbonylContact C-O 3.48Å; V364-I438 VanDerWaalsContact CA-O 3.3Å; V364-I438 WeakPolarHBondContact CA-O 3.36Å; V364-I438 HydrophobicContact CG2-CB 4.35Å; V365-I438 WeakPolarHBondContact CG1-O 3.33Å; V365-I438 PolarHBondContact N-O 3.2Å; I438-I691 HydrophobicContact CG2-CG2 3.44Å; I438-I691 VanDerWaalsContact CG2-CG2 3.44Å; I438-A692 CarbonylContact C-O 3.55Å; I438-A692 WeakPolarHBondContact CA-O 3.38Å; I438-L693 HydrophobicContact CD1-CD2 4.1Å; I438-L693 HydrophobicContact CG1-CD2 4.01Å; I438-L693 HydrophobicContact CG1-CG 4.15Å; I438-F703 HydrophobicContact CD1-CD1 4.28Å; I438-F703 HydrophobicContact CD1-CE1 3.5Å; I438-F703 HydrophobicContact CD1-CE2 3.92Å; I438-F703 HydrophobicContact CD1-CZ 3.28Å
439	G	96.2	Very high	91.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.7	172.8	0	0	0	0	0	111.4	V365 A692	V365-G439 WeakPolarHBondContact O-CA 3.43Å; G439-A692 PolarHBondContact N-O 3.09Å; G439-A692 PolarHBondContact O-N 3.44Å
440	I	95.6	Very high	91.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.			trans	-140.5	128.4	-178.3	-159.8	178.2	0	0	0	112.1	V364 V365 T366 S390 L394 I691	V364-I440 HydrophobicContact CG1-CG2 3.56Å; V365-I440 PolarHBondContact O-N 3.31Å; T366-I440 WeakPolarHBondContact CA-O 3.47Å; T366-I440 VanDerWaalsContact CB-O 3.27Å; T366-I440 WeakPolarHBondContact CB-O 3.45Å; T366-I440 PolarHBondContact OG1-O 2.64Å; S390-I440 WeakPolarHBondContact O-CD1 3.29Å; L394-I440 HydrophobicContact CB-CD1 4.2Å; L394-I440 HydrophobicContact CD2-CG2 4.4Å; I440-I691 HydrophobicContact CD1-CD1 3.8Å; I440-I691 HydrophobicContact CD1-CG1 3.87Å; I440-I691 HydrophobicContact CG1-CG1 4.08Å
441	S	93.8	Very high	91	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-171.9	-158.2	173.9	-175.7	0	0	0	0	106.8	V367 S390 L443 Y459	V367-S441 PolarHBondContact O-OG 2.89Å; S390-S441 PolarHBondContact OG-O 2.85Å; S441-L443 PolarHBondContact O-N 3.48Å; S441-Y459 PolarHBondContact O-OH 2.68Å
442	A	92.4	Very high	90.6	Very high	6 Å²	6	45.9 Å²	45.9	5%	0.05	23%	0.229	C	C	.	.	S	Bend	trans	-69.2	44.5	168.2	0	0	0	0	0	113	F372 Y415 T444 Y689	F372-A442 HydrophobicContact CB-CB 4.22Å; F372-A442 HydrophobicContact CD1-CB 4.18Å; F372-A442 HydrophobicContact CD2-CB 3.65Å; F372-A442 HydrophobicContact CE1-CB 4.46Å; F372-A442 HydrophobicContact CE2-CB 3.97Å; F372-A442 HydrophobicContact CG-CB 3.76Å; F372-A442 HydrophobicContact CZ-CB 4.36Å; Y415-A442 HydrophobicContact CE1-CB 4.39Å; A442-T444 PolarHBondContact O-N 3.07Å; A442-T444 VanDerWaalsContact O-N 3.15Å; A442-Y689 HydrophobicContact CB-CD1 4.36Å; A442-Y689 HydrophobicContact CB-CE1 4.19Å
443	L	92.4	Very high	90.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.			trans	-81.2	99.5	-170.6	-173.8	67.3	0	0	0	111.5	Y415 L427 S441 I445 F455 Y689 G690 A692	Y415-L443 HydrophobicContact CD1-CD1 4.1Å; L427-L443 HydrophobicContact CD2-CD2 3.75Å; S441-L443 PolarHBondContact O-N 3.48Å; L443-I445 PolarHBondContact O-N 3.2Å; L443-F455 HydrophobicContact CD2-CE1 3.72Å; L443-F455 HydrophobicContact CD2-CZ 4.14Å; L443-F455 HydrophobicContact CG-CE1 4.01Å; L443-F455 HydrophobicContact CG-CZ 4.34Å; L443-Y689 WeakPolarHBondContact O-CA 3.33Å; L443-G690 PolarHBondContact O-N 3.49Å; L443-A692 HydrophobicContact CD2-CB 3.55Å
444	T	91.2	Very high	90.5	Very high	6 Å²	6	39 Å²	39	4%	0.037	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-62.3	130.9	172.2	-28.1	0	0	0	0	111.2	A442 T446 R449 Y462 R687	A442-T444 PolarHBondContact O-N 3.07Å; A442-T444 VanDerWaalsContact O-N 3.15Å; T444-T446 PolarHBondContact O-N 3.22Å; T444-R449 PolarHBondContact O-NH1 2.83Å; T444-R449 VanDerWaalsContact O-NH1 3.14Å; T444-Y462 HydrophobicContact CG2-CD1 3.73Å; T444-Y462 HydrophobicContact CG2-CD2 3.89Å; T444-Y462 HydrophobicContact CG2-CE1 3.97Å; T444-Y462 HydrophobicContact CG2-CE2 4.11Å; T444-Y462 HydrophobicContact CG2-CG 3.68Å; T444-R687 HydrophobicContact CG2-CB 4Å
445	I	91.1	Very high	90.8	Very high	32 Å²	32	33.5 Å²	33.5	16%	0.164	17%	0.171	C	C	.	.			trans	-67.1	127.6	169.6	-55.3	167.5	0	0	0	108.6	L443 F455 R458 G688	L443-I445 PolarHBondContact O-N 3.2Å; I445-F455 HydrophobicContact CD1-CB 4.48Å; I445-F455 HydrophobicContact CG1-CB 4.31Å; I445-F455 HydrophobicContact CG1-CD1 3.72Å; I445-F455 HydrophobicContact CG1-CE1 4.08Å; I445-F455 HydrophobicContact CG1-CG 3.95Å; I445-F455 HydrophobicContact CG2-CD2 4.02Å; I445-F455 HydrophobicContact CG2-CE2 4.37Å; I445-F455 HydrophobicContact CG2-CG 4.16Å; I445-R458 HydrophobicContact CD1-CB 4.2Å; I445-G688 WeakPolarHBondContact CG1-O 3.31Å; I445-G688 PolarHBondContact N-O 3.02Å
446	T	87.3	Confident	90.9	Very high	13 Å²	13	27.9 Å²	27.9	8%	0.08	15%	0.15	C	C	.	.			trans	-139.1	149.6	174.1	68.3	0	0	0	0	110.5	T444 D448 R449 E450	T444-T446 PolarHBondContact O-N 3.22Å; T446-D448 VanDerWaalsContact C-N 3.27Å; T446-D448 PolarHBondContact O-N 3.3Å; T446-R449 PolarHBondContact O-N 3.07Å; T446-R449 WeakPolarHBondContact OG1-CG 3.44Å; T446-E450 PolarHBondContact O-N 3.15Å
447	P	85.3	Confident	90.8	Very high	74 Å²	74	30.1 Å²	30.1	48%	0.481	16%	0.164	S	C	.	.	H	α-helix	trans	-56.1	-40	-176.8	-26.9	35.8	0	0	0	113.4	R449 E450 N451	P447-R449 VanDerWaalsContact C-N 3.25Å; P447-R449 PolarHBondContact O-N 2.86Å; P447-E450 PolarHBondContact O-N 2.8Å; P447-N451 PolarHBondContact O-N 3.44Å; P447-N451 PolarHBondContact O-ND2 2.76Å; P447-N451 VanDerWaalsContact O-ND2 3.11Å
448	D	86.2	Confident	90.8	Very high	86 Å²	86	33.2 Å²	33.2	46%	0.46	17%	0.173	S	C	.	.	H	α-helix	trans	-63.7	-32.9	-178.9	-41.1	-75.6	0	0	0	112.2	W424 T446	W424-D448 HydrophobicContact CH2-CB 4.03Å; W424-D448 WeakPolarHBondContact CH2-O 3.45Å; W424-D448 HydrophobicContact CZ2-CB 4.35Å; W424-D448 WeakPolarHBondContact CZ2-O 3.47Å; T446-D448 VanDerWaalsContact C-N 3.27Å; T446-D448 PolarHBondContact O-N 3.3Å
449	R	88.6	Confident	90.7	Very high	21 Å²	21	33.5 Å²	33.5	8%	0.079	17%	0.174	C	C	.	.	H	α-helix	trans	-80.3	-41.5	175.3	-67.6	175.9	174.3	158.6	-1.7	111.4	G416 W424 V428 T444 T446 P447 N451 V452 V453 F455	G416-R449 PolarHBondContact O-NE 2.94Å; G416-R449 PolarHBondContact O-NH2 3.24Å; W424-R449 HydrophobicContact CH2-CG 3.84Å; W424-R449 HydrophobicContact CZ3-CG 3.74Å; V428-R449 HydrophobicContact CG2-CG 4.12Å; T444-R449 PolarHBondContact O-NH1 2.83Å; T444-R449 VanDerWaalsContact O-NH1 3.14Å; T446-R449 PolarHBondContact O-N 3.07Å; T446-R449 WeakPolarHBondContact OG1-CG 3.44Å; P447-R449 VanDerWaalsContact C-N 3.25Å; P447-R449 PolarHBondContact O-N 2.86Å; R449-N451 PolarHBondContact O-N 3.24Å; R449-V452 WeakPolarHBondContact O-CG2 3.45Å; R449-V452 PolarHBondContact O-N 3.14Å; R449-V453 HydrophobicContact CB-CG2 4.37Å; R449-V453 VanDerWaalsContact O-CG2 3.26Å; R449-V453 WeakPolarHBondContact O-CG2 3.24Å; R449-V453 PolarHBondContact O-N 3.44Å; R449-F455 HydrophobicContact CB-CE2 3.69Å; R449-F455 HydrophobicContact CB-CZ 3.94Å
450	E	88.4	Confident	90.4	Very high	111 Å²	111	34.4 Å²	34.4	52%	0.519	18%	0.179	S	C	.	.	H	α-helix	trans	-61.7	-25.2	178.1	-168.8	171.7	-164.3	0	0	112.4	T446 P447 V452 V453 F455	T446-E450 PolarHBondContact O-N 3.15Å; P447-E450 PolarHBondContact O-N 2.8Å; E450-V452 VanDerWaalsContact C-N 3.28Å; E450-V452 PolarHBondContact O-N 2.86Å; E450-V453 WeakPolarHBondContact CA-O 3.31Å; E450-F455 HydrophobicContact CB-CD2 4.22Å; E450-F455 HydrophobicContact CB-CE2 4.48Å
451	N	88.2	Confident	90.2	Very high	125 Å²	125	38.7 Å²	38.7	67%	0.668	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.6	170.9	-71.2	-33.8	0	0	0	114.8	P447 R449	P447-N451 PolarHBondContact O-N 3.44Å; P447-N451 PolarHBondContact O-ND2 2.76Å; P447-N451 VanDerWaalsContact O-ND2 3.11Å; R449-N451 PolarHBondContact O-N 3.24Å
452	V	87.5	Confident	89.9	Confident	42 Å²	42	39.1 Å²	39.1	26%	0.255	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-19.3	-175.4	-60.8	0	0	0	0	115.1	W424 V428 V432 R449 E450	W424-V452 HydrophobicContact CD2-CG2 4.14Å; W424-V452 HydrophobicContact CG-CG2 4.49Å; W424-V452 HydrophobicContact CZ2-CG2 3.96Å; V428-V452 HydrophobicContact CG1-CG2 3.85Å; V432-V452 HydrophobicContact CG2-CB 4.09Å; V432-V452 HydrophobicContact CG2-CG2 4.17Å; R449-V452 WeakPolarHBondContact O-CG2 3.45Å; R449-V452 PolarHBondContact O-N 3.14Å; E450-V452 VanDerWaalsContact C-N 3.28Å; E450-V452 PolarHBondContact O-N 2.86Å
453	V	90.4	Very high	89.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144.2	174.3	-70.2	0	0	0	0	110.5	V428 L431 V432 R449 E450 F455 A692 L693	V428-V453 HydrophobicContact CG1-CG1 4.06Å; V428-V453 HydrophobicContact CG1-CG2 4.14Å; V428-V453 HydrophobicContact CG2-CG2 4.42Å; L431-V453 HydrophobicContact CB-CG1 3.7Å; L431-V453 HydrophobicContact CD1-CB 4.45Å; L431-V453 HydrophobicContact CD1-CG1 4.05Å; V432-V453 HydrophobicContact CG2-CG1 4.01Å; R449-V453 HydrophobicContact CB-CG2 4.37Å; R449-V453 VanDerWaalsContact O-CG2 3.26Å; R449-V453 WeakPolarHBondContact O-CG2 3.24Å; R449-V453 PolarHBondContact O-N 3.44Å; E450-V453 WeakPolarHBondContact CA-O 3.31Å; V453-F455 HydrophobicContact CG2-CE2 4Å; V453-F455 HydrophobicContact CG2-CZ 4.28Å; V453-A692 HydrophobicContact CG2-CB 4.29Å; V453-L693 WeakPolarHBondContact CB-O 3.34Å
454	D	89.4	Confident	89.4	Confident	14 Å²	14	41 Å²	41	8%	0.075	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.5	-178.8	-88	34	0	0	0	110.2	A692 L693 H695 G696 R700	D454-A692 CarbonylContact O-C 3.6Å; D454-A692 WeakPolarHBondContact O-CA 3.24Å; D454-L693 PolarHBondContact N-O 2.95Å; D454-L693 PolarHBondContact O-N 3.47Å; D454-H695 WeakPolarHBondContact OD1-CA 2.99Å; D454-H695 IonicContact OD1-CE1 3.58Å; D454-H695 IonicContact OD1-CG 3.59Å; D454-H695 IonicContact OD1-ND1 3.57Å; D454-H695 PolarHBondContact OD1-ND1 3.22Å; D454-G696 VanDerWaalsContact CG-N 3.31Å; D454-G696 PolarHBondContact OD1-N 3Å; D454-G696 PolarHBondContact OD2-N 3.08Å; D454-R700 HydrophobicContact CB-CG 4.38Å; D454-R700 IonicContact OD2-CZ 3.73Å; D454-R700 IonicContact OD2-NH1 2.69Å; D454-R700 PolarHBondContact OD2-NH1 2.97Å
455	F	93.9	Very high	89.4	Confident	16 Å²	16	40.9 Å²	40.9	7%	0.07	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	149.8	174.4	-76.2	-82.5	0	0	0	112.7	L443 I445 R449 E450 V453 I691 A692 R700	L443-F455 HydrophobicContact CD2-CE1 3.72Å; L443-F455 HydrophobicContact CD2-CZ 4.14Å; L443-F455 HydrophobicContact CG-CE1 4.01Å; L443-F455 HydrophobicContact CG-CZ 4.34Å; I445-F455 HydrophobicContact CD1-CB 4.48Å; I445-F455 HydrophobicContact CG1-CB 4.31Å; I445-F455 HydrophobicContact CG1-CD1 3.72Å; I445-F455 HydrophobicContact CG1-CE1 4.08Å; I445-F455 HydrophobicContact CG1-CG 3.95Å; I445-F455 HydrophobicContact CG2-CD2 4.02Å; I445-F455 HydrophobicContact CG2-CE2 4.37Å; I445-F455 HydrophobicContact CG2-CG 4.16Å; R449-F455 HydrophobicContact CB-CE2 3.69Å; R449-F455 HydrophobicContact CB-CZ 3.94Å; E450-F455 HydrophobicContact CB-CD2 4.22Å; E450-F455 HydrophobicContact CB-CE2 4.48Å; V453-F455 HydrophobicContact CG2-CE2 4Å; V453-F455 HydrophobicContact CG2-CZ 4.28Å; F455-I691 WeakPolarHBondContact CA-O 3.05Å; F455-A692 HydrophobicContact CD1-CB 4.12Å; F455-A692 HydrophobicContact CE1-CB 3.86Å; F455-A692 HydrophobicContact CZ-CB 4.34Å; F455-R700 WeakPolarHBondContact O-CD 3.4Å; F455-R700 WeakPolarHBondContact O-CG 3.37Å
456	T	92.3	Very high	89.3	Confident	7 Å²	7	39.4 Å²	39.4	4%	0.043	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-72.6	172.4	163	63.1	0	0	0	0	111.9	I691 L693 F703 S704 I707	T456-I691 HydrophobicContact CG2-CB 3.82Å; T456-I691 PolarHBondContact N-O 3.35Å; T456-I691 PolarHBondContact OG1-N 3.26Å; T456-L693 HydrophobicContact CG2-CD1 3.72Å; T456-F703 HydrophobicContact CG2-CB 3.76Å; T456-S704 VanDerWaalsContact CA-OG 3.25Å; T456-S704 WeakPolarHBondContact CA-OG 3.33Å; T456-S704 WeakPolarHBondContact CB-OG 3.09Å; T456-I707 HydrophobicContact CG2-CD1 4.06Å; T456-I707 WeakPolarHBondContact OG1-CD1 3.31Å
457	T	90.1	Very high	89.5	Confident	46 Å²	46	38.8 Å²	38.8	28%	0.282	20%	0.204	S	C	.	.	S	Bend	trans	-47.8	144.8	154.1	44.5	0	0	0	0	111.2	Y459 S704 L708	T457-Y459 PolarHBondContact O-N 3.34Å; T457-S704 PolarHBondContact N-OG 2.89Å; T457-S704 VanDerWaalsContact N-OG 3.12Å; T457-S704 VanDerWaalsContact OG1-CA 3.25Å; T457-S704 WeakPolarHBondContact OG1-CA 3.48Å; T457-S704 WeakPolarHBondContact OG1-CB 3.44Å; T457-S704 PolarHBondContact OG1-O 3.5Å; T457-S704 VanDerWaalsContact OG1-O 3.07Å; T457-L708 HydrophobicContact CG2-CD1 4.13Å; T457-L708 HydrophobicContact CG2-CD2 4.36Å; T457-L708 HydrophobicContact CG2-CG 4.19Å
458	R	91.6	Very high	89.7	Confident	98 Å²	98	35.5 Å²	35.5	37%	0.37	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-63.3	129.6	179	67.2	175.5	74.7	178.4	1.7	109.9	I445 D461 R687 Y689 Q711	I445-R458 HydrophobicContact CD1-CB 4.2Å; R458-D461 WeakPolarHBondContact CD-OD1 3.21Å; R458-D461 IonicContact CZ-OD1 2.7Å; R458-D461 IonicContact NE-OD1 3.65Å; R458-D461 IonicContact NH1-OD1 2.65Å; R458-D461 PolarHBondContact NH1-OD1 2.68Å; R458-R687 PolarHBondContact NH1-O 3.44Å; R458-Y689 CarbonylContact C-O 3.48Å; R458-Y689 WeakPolarHBondContact CA-O 3.39Å; R458-Q711 PolarHBondContact O-NE2 3.1Å
459	Y	92.1	Very high	89.8	Confident	6 Å²	6	36.4 Å²	36.4	2%	0.024	18%	0.18	C	C	.	.	S	Bend	trans	-89.3	-25.2	178.3	67.3	-98	0	0	0	112.3	F389 S390 S441 T457 Y689 I691 Q711 M716	F389-Y459 HydrophobicContact CD1-CE2 4.14Å; F389-Y459 AromaticContact CE1-CD2 3.92Å; F389-Y459 HydrophobicContact CE1-CD2 3.92Å; F389-Y459 AromaticContact CE1-CE2 3.68Å; F389-Y459 HydrophobicContact CE1-CE2 3.68Å; F389-Y459 HydrophobicContact CZ-CD2 4.4Å; S390-Y459 PolarHBondContact OG-OH 2.84Å; S441-Y459 PolarHBondContact O-OH 2.68Å; T457-Y459 PolarHBondContact O-N 3.34Å; Y459-Y689 WeakPolarHBondContact CD1-O 3.39Å; Y459-Y689 PolarHBondContact N-O 2.92Å; Y459-I691 HydrophobicContact CD1-CG1 4.1Å; Y459-I691 HydrophobicContact CE1-CG1 4.25Å; Y459-Q711 PolarHBondContact O-NE2 3.32Å; Y459-Q711 VanDerWaalsContact O-NE2 3.17Å; Y459-M716 HydrophobicContact CD2-CE 4.08Å; Y459-M716 HydrophobicContact CG-CE 4.48Å; Y459-M716 WeakPolarHBondContact O-CE 3.42Å
460	M	91.4	Very high	89.3	Confident	19 Å²	19	39.5 Å²	39.5	9%	0.094	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	149.1	173.5	171.2	175.8	168.9	0	0	109.7	F372 F389 A663 G688 Y689 W724	F372-M460 HydrophobicContact CE1-SD 4.29Å; F372-M460 HydrophobicContact CZ-CE 4.49Å; F389-M460 HydrophobicContact CD1-SD 4.05Å; F389-M460 HydrophobicContact CE1-CB 4.03Å; F389-M460 HydrophobicContact CE1-CG 4.39Å; F389-M460 HydrophobicContact CE1-SD 3.43Å; F389-M460 WeakPolarHBondContact CE1-SD 3.25Å; F389-M460 HydrophobicContact CZ-CB 4.49Å; F389-M460 HydrophobicContact CZ-SD 4.12Å; M460-A663 HydrophobicContact CE-CB 3.57Å; M460-G688 CarbonylContact O-C 3.51Å; M460-G688 WeakPolarHBondContact O-CA 3.44Å; M460-Y689 HydrophobicContact CB-CD2 3.8Å; M460-Y689 HydrophobicContact CB-CE2 4.3Å; M460-Y689 HydrophobicContact CE-CE2 4.15Å; M460-Y689 HydrophobicContact CG-CD2 3.84Å; M460-Y689 HydrophobicContact CG-CE2 3.82Å; M460-Y689 WeakPolarHBondContact O-CD2 3.29Å; M460-Y689 PolarHBondContact O-N 3.41Å; M460-Y689 HydrophobicContact SD-CD2 4.4Å; M460-Y689 HydrophobicContact SD-CE2 4.12Å; M460-W724 HydrophobicContact CE-CH2 4.16Å; M460-W724 HydrophobicContact CE-CZ2 4.37Å; M460-W724 HydrophobicContact CE-CZ3 4.37Å; M460-W724 HydrophobicContact SD-CH2 4.29Å; M460-W724 HydrophobicContact SD-CZ3 4.28Å
461	D	90.1	Very high	88.4	Confident	91 Å²	91	37.6 Å²	37.6	49%	0.487	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	147.4	176.4	-73.1	-53.2	0	0	0	112.8	R458 A685 Y689	R458-D461 WeakPolarHBondContact CD-OD1 3.21Å; R458-D461 IonicContact CZ-OD1 2.7Å; R458-D461 IonicContact NE-OD1 3.65Å; R458-D461 IonicContact NH1-OD1 2.65Å; R458-D461 PolarHBondContact NH1-OD1 2.68Å; D461-A685 HydrophobicContact CB-CB 4Å; D461-Y689 VanDerWaalsContact O-CE2 3.27Å; D461-Y689 WeakPolarHBondContact O-CE2 3.4Å
462	Y	88.1	Confident	87.2	Confident	8 Å²	8	38.3 Å²	38.3	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.9	-178.5	166.4	-84.1	0	0	0	110.3	T444 V464 V606 D661 R687 Y689	T444-Y462 HydrophobicContact CG2-CD1 3.73Å; T444-Y462 HydrophobicContact CG2-CD2 3.89Å; T444-Y462 HydrophobicContact CG2-CE1 3.97Å; T444-Y462 HydrophobicContact CG2-CE2 4.11Å; T444-Y462 HydrophobicContact CG2-CG 3.68Å; Y462-V464 HydrophobicContact CE1-CG2 4.06Å; Y462-V606 VanDerWaalsContact OH-CG2 3.31Å; Y462-V606 WeakPolarHBondContact OH-CG2 3.45Å; Y462-D661 WeakPolarHBondContact CD2-OD2 3.35Å; Y462-D661 HydrophobicContact CE2-CB 4.44Å; Y462-D661 WeakPolarHBondContact CE2-OD2 3.47Å; Y462-R687 HydrophobicContact CD1-CB 3.99Å; Y462-R687 PolarHBondContact N-O 2.95Å; Y462-Y689 HydrophobicContact CD2-CD1 4.49Å; Y462-Y689 AromaticContact CD2-CE1 3.67Å; Y462-Y689 HydrophobicContact CD2-CE1 3.67Å; Y462-Y689 AromaticContact CD2-CZ 3.81Å; Y462-Y689 HydrophobicContact CG-CE1 4.47Å
463	S	87.3	Confident	85.9	Confident	33 Å²	33	43.4 Å²	43.4	23%	0.231	21%	0.212	C	C	.	.			trans	-139.6	154.7	171.6	58.5	0	0	0	0	110.4	A662	S463-A662 VanDerWaalsContact O-CB 3.29Å; S463-A662 WeakPolarHBondContact O-CB 3.23Å; S463-A662 PolarHBondContact O-N 2.88Å; S463-A662 WeakPolarHBondContact OG-CB 3.49Å
464	V	87.6	Confident	84.3	Confident	14 Å²	14	49.4 Å²	49.4	9%	0.085	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.1	172.9	-179.8	0	0	0	0	108.5	Y462 V606 V659 N682	Y462-V464 HydrophobicContact CE1-CG2 4.06Å; V464-V606 HydrophobicContact CG1-CG1 4.09Å; V464-V606 HydrophobicContact CG2-CG1 4.48Å; V464-V659 HydrophobicContact CG1-CG1 3.56Å; V464-N682 PolarHBondContact O-N 2.8Å
465	G	89.4	Confident	82.9	Confident	3 Å²	3	52 Å²	52	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	176	175.7	0	0	0	0	0	112.1	V659 W660 I680	G465-V659 WeakPolarHBondContact O-CA 3.34Å; G465-W660 PolarHBondContact N-O 3.07Å; G465-W660 PolarHBondContact O-N 2.66Å; G465-W660 VanDerWaalsContact O-O 3.14Å; G465-I680 CarbonylContact C-O 3.58Å; G465-I680 VanDerWaalsContact CA-O 3.22Å; G465-I680 WeakPolarHBondContact CA-O 3.44Å
466	V	90.6	Very high	81.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.8	175.9	-165.7	0	0	0	0	109.9	L468 L587 L590 A657 F658 V659 T679 I680	V466-L468 HydrophobicContact CB-CD1 4.04Å; V466-L468 HydrophobicContact CG1-CD1 3.67Å; V466-L468 HydrophobicContact CG1-CG 4.3Å; V466-L587 HydrophobicContact CG2-CD1 3.45Å; V466-L587 VanDerWaalsContact CG2-CD1 3.45Å; V466-L590 HydrophobicContact CB-CD2 4.38Å; V466-L590 HydrophobicContact CG1-CD2 3.79Å; V466-L590 HydrophobicContact CG2-CD2 3.84Å; V466-A657 HydrophobicContact CG1-CB 3.86Å; V466-F658 CarbonylContact C-O 3.56Å; V466-F658 VanDerWaalsContact CA-O 3.31Å; V466-F658 WeakPolarHBondContact CA-O 3.35Å; V466-V659 HydrophobicContact CG1-CG2 4.36Å; V466-V659 HydrophobicContact CG2-CG2 4.23Å; V466-T679 CarbonylContact O-C 3.56Å; V466-T679 WeakPolarHBondContact O-CA 3.41Å; V466-I680 HydrophobicContact CB-CB 4.47Å; V466-I680 PolarHBondContact N-O 2.65Å; V466-I680 PolarHBondContact O-N 3.27Å
467	L	91.2	Very high	80.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.6	171.8	-168.7	74.5	0	0	0	109.3	I648 V651 A657 F658 L665 V668 A669 F677 T679	L467-I648 HydrophobicContact CD2-CG1 4.24Å; L467-I648 HydrophobicContact CD2-CG2 4.3Å; L467-V651 HydrophobicContact CD2-CB 4.43Å; L467-V651 HydrophobicContact CD2-CG1 4.44Å; L467-V651 HydrophobicContact CD2-CG2 4.47Å; L467-V651 HydrophobicContact CG-CG1 4.33Å; L467-A657 WeakPolarHBondContact O-CA 3.31Å; L467-F658 HydrophobicContact CB-CB 4.49Å; L467-F658 PolarHBondContact N-O 2.93Å; L467-F658 PolarHBondContact O-N 2.67Å; L467-L665 HydrophobicContact CB-CD1 4.03Å; L467-L665 HydrophobicContact CB-CD2 3.78Å; L467-L665 HydrophobicContact CB-CG 4.33Å; L467-L665 HydrophobicContact CD2-CD2 4.18Å; L467-L665 HydrophobicContact CG-CD2 4.41Å; L467-V668 HydrophobicContact CD2-CG1 4.3Å; L467-A669 HydrophobicContact CD1-CB 4.21Å; L467-F677 HydrophobicContact CD1-CB 3.75Å; L467-F677 HydrophobicContact CD1-CD1 4.21Å; L467-F677 HydrophobicContact CD1-CG 3.97Å; L467-F677 HydrophobicContact CD2-CD1 3.95Å; L467-F677 HydrophobicContact CD2-CE1 4.02Å; L467-F677 HydrophobicContact CD2-CG 4.3Å; L467-F677 HydrophobicContact CD2-CZ 4.42Å; L467-F677 HydrophobicContact CG-CB 4.37Å; L467-F677 HydrophobicContact CG-CD1 3.95Å; L467-F677 HydrophobicContact CG-CE1 4.49Å; L467-F677 HydrophobicContact CG-CG 4.23Å; L467-T679 HydrophobicContact CD1-CG2 3.78Å
468	L	89.6	Confident	79.6	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	150.2	173.7	-63.8	99	0	0	0	110.2	V466 I584 I596 A657 F677 Y678 I680	V466-L468 HydrophobicContact CB-CD1 4.04Å; V466-L468 HydrophobicContact CG1-CD1 3.67Å; V466-L468 HydrophobicContact CG1-CG 4.3Å; L468-I584 HydrophobicContact CD2-CD1 4.01Å; L468-I596 HydrophobicContact CD2-CD1 4.5Å; L468-A657 HydrophobicContact CD2-CB 3.8Å; L468-A657 HydrophobicContact CG-CB 3.76Å; L468-F677 CarbonylContact O-C 3.57Å; L468-F677 WeakPolarHBondContact O-CA 3.45Å; L468-Y678 HydrophobicContact CB-CD1 4.11Å; L468-Y678 HydrophobicContact CB-CE1 3.53Å; L468-Y678 HydrophobicContact CB-CE2 4.46Å; L468-Y678 HydrophobicContact CD1-CE2 4.4Å; L468-Y678 PolarHBondContact N-O 3.18Å; L468-Y678 PolarHBondContact O-N 3.27Å; L468-I680 HydrophobicContact CD1-CD1 3.67Å; L468-I680 HydrophobicContact CD1-CG1 4Å
469	R	86.9	Confident	78.7	Confident	106 Å²	106	59.1 Å²	59.1	40%	0.4	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	131.5	167.6	178.8	169	168.9	171.7	-8.7	109.5	E472 V651 K652 Y678	R469-E472 IonicContact CZ-OE1 3.66Å; R469-E472 IonicContact NH2-OE1 3.65Å; R469-E472 PolarHBondContact NH2-OE1 3.2Å; R469-V651 HydrophobicContact CB-CG1 4.32Å; R469-K652 PolarHBondContact NH1-O 2.98Å; R469-Y678 WeakPolarHBondContact O-CE1 3.35Å
470	R	79.5	Confident	78	Confident	85 Å²	85	60 Å²	60	32%	0.321	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-65.2	130.8	174.5	-176.8	176.4	-75	168.7	-13	108.9	E472 C675 S676 Y678	R470-E472 PolarHBondContact O-N 3.22Å; R470-C675 PolarHBondContact NH1-O 3.38Å; R470-S676 WeakPolarHBondContact CB-O 3.19Å; R470-S676 PolarHBondContact N-O 2.96Å; R470-Y678 HydrophobicContact CB-CD1 4.21Å
471	A	68.6	Low	77.5	Confident	72 Å²	72	62.9 Å²	62.9	60%	0.595	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-60.9	135.4	178.4	0	0	0	0	0	110.9
472	E	63	Low	77	Confident	139 Å²	139	61.1 Å²	61.1	65%	0.65	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-69.8	144.1	174.1	-76.9	173.6	-146.1	0	0	110.6	R469 R470 T474	R469-E472 IonicContact CZ-OE1 3.66Å; R469-E472 IonicContact NH2-OE1 3.65Å; R469-E472 PolarHBondContact NH2-OE1 3.2Å; R470-E472 PolarHBondContact O-N 3.22Å; E472-T474 PolarHBondContact O-N 3.03Å
473	K	60.5	Low	76.8	Confident	149 Å²	149	61.3 Å²	61.3	65%	0.648	33%	0.327	S	S	*	.			trans	-72.8	90.9	179.1	-66.8	-176.5	178.8	-176.6	0	109.9	V475	K473-V475 PolarHBondContact O-N 3.37Å
474	T	56.9	Low	76.8	Confident	126 Å²	126	60.8 Å²	60.8	77%	0.773	32%	0.32	S	S	*	.			trans	-63.9	101.9	168.9	49.3	0	0	0	0	109.5	E472 D476	E472-T474 PolarHBondContact O-N 3.03Å; T474-D476 PolarHBondContact O-N 2.8Å
475	V	60.9	Low	76.8	Confident	69 Å²	69	66.3 Å²	66.3	42%	0.418	35%	0.349	S	S	.	.			trans	-82.6	105.2	175.5	-177.3	0	0	0	0	108.4	K473 M477 K748	K473-V475 PolarHBondContact O-N 3.37Å; V475-M477 PolarHBondContact O-N 2.92Å; V475-M477 VanDerWaalsContact O-N 3.13Å; V475-K748 HydrophobicContact CG1-CB 3.96Å
476	D	65.5	Low	76.7	Confident	107 Å²	107	73 Å²	73	57%	0.572	38%	0.384	S	S	*	.			trans	-62.8	113.6	175.9	-79.9	-41.6	0	0	0	110.9	T474 F478 A479	T474-D476 PolarHBondContact O-N 2.8Å; D476-F478 PolarHBondContact O-N 3.25Å; D476-A479 WeakPolarHBondContact O-CB 3.5Å; D476-A479 PolarHBondContact O-N 2.82Å
477	M	66.9	Low	76.7	Confident	98 Å²	98	77.4 Å²	77.4	48%	0.483	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.8	-178.9	-171.4	171.3	65.7	0	0	113.1	V475 A751 G752	V475-M477 PolarHBondContact O-N 2.92Å; V475-M477 VanDerWaalsContact O-N 3.13Å; M477-A751 HydrophobicContact CG-CB 4.08Å; M477-G752 WeakPolarHBondContact O-CA 3.37Å; M477-G752 PolarHBondContact O-N 2.67Å
478	F	73.4	Confident	76.7	Confident	102 Å²	102	81.1 Å²	81.1	45%	0.447	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	29.7	177.4	-64.6	-72.1	0	0	0	113.6	D476 C480 L481	D476-F478 PolarHBondContact O-N 3.25Å; F478-C480 PolarHBondContact O-N 3.32Å; F478-L481 HydrophobicContact CB-CD1 4.45Å; F478-L481 HydrophobicContact CD1-CD1 4.47Å; F478-L481 PolarHBondContact O-N 3.09Å
479	A	73	Confident	76.8	Confident	9 Å²	9	84.6 Å²	84.6	7%	0.074	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-26.5	178	0	0	0	0	0	114.7	D476 L481 A482 P483 F574	D476-A479 WeakPolarHBondContact O-CB 3.5Å; D476-A479 PolarHBondContact O-N 2.82Å; A479-L481 VanDerWaalsContact C-N 3.3Å; A479-L481 PolarHBondContact O-N 3.35Å; A479-A482 PolarHBondContact O-N 3.03Å; A479-P483 WeakPolarHBondContact O-CD 3.44Å; A479-F574 HydrophobicContact CB-CE1 4.25Å
480	C	76.6	Confident	76.8	Confident	24 Å²	24	82.7 Å²	82.7	16%	0.162	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-18.2	175.5	-54.7	0	0	0	0	114.9	F478 P483 Y567 V753	F478-C480 PolarHBondContact O-N 3.32Å; C480-P483 WeakPolarHBondContact O-CD 3.39Å; C480-Y567 WeakPolarHBondContact O-CE2 3.49Å; C480-Y567 PolarHBondContact O-OH 3.4Å; C480-V753 HydrophobicContact CB-CG2 4.27Å; C480-V753 WeakPolarHBondContact SG-CG2 3.17Å
481	L	81.4	Confident	77.4	Confident	80 Å²	80	82.5 Å²	82.5	42%	0.419	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-23.3	175.7	-67.5	176.6	0	0	0	112.9	F478 A479 F484 W489	F478-L481 HydrophobicContact CB-CD1 4.45Å; F478-L481 HydrophobicContact CD1-CD1 4.47Å; F478-L481 PolarHBondContact O-N 3.09Å; A479-L481 VanDerWaalsContact C-N 3.3Å; A479-L481 PolarHBondContact O-N 3.35Å; L481-F484 VanDerWaalsContact O-O 3.13Å; L481-W489 HydrophobicContact CD2-CZ2 4.12Å; L481-W489 PolarHBondContact O-NE1 3.21Å; L481-W489 VanDerWaalsContact O-NE1 3.13Å
482	A	79.6	Confident	78.4	Confident	54 Å²	54	79.5 Å²	79.5	45%	0.446	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-23	-179.8	0	0	0	0	0	117.5	A479 F484 F574	A479-A482 PolarHBondContact O-N 3.03Å; A482-F484 PolarHBondContact O-N 3.12Å; A482-F484 VanDerWaalsContact O-N 3.08Å; A482-F574 HydrophobicContact CB-CE1 4.39Å; A482-F574 HydrophobicContact CB-CE2 4.47Å; A482-F574 HydrophobicContact CB-CZ 4.16Å
483	P	84.7	Confident	79.6	Confident	12 Å²	12	75.5 Å²	75.5	8%	0.078	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.5	180	-27.3	36.9	0	0	0	115.8	A479 C480 Y567 N570 L571	A479-P483 WeakPolarHBondContact O-CD 3.44Å; C480-P483 WeakPolarHBondContact O-CD 3.39Å; P483-Y567 HydrophobicContact CB-CD2 4.02Å; P483-Y567 HydrophobicContact CB-CE2 4.1Å; P483-Y567 HydrophobicContact CG-CD2 4.34Å; P483-Y567 HydrophobicContact CG-CE2 3.93Å; P483-N570 HydrophobicContact CB-CB 3.82Å; P483-N570 PolarHBondContact O-ND2 3.22Å; P483-L571 HydrophobicContact CG-CB 3.91Å; P483-L571 HydrophobicContact CG-CD1 3.83Å; P483-L571 HydrophobicContact CG-CG 4.45Å
484	F	87.2	Confident	81	Confident	23 Å²	23	70.1 Å²	70.1	10%	0.101	42%	0.416	C	S	.	.	S	Bend	trans	-139.4	140.9	176.9	-68.9	-30.6	0	0	0	111.1	L481 A482 L488 W489 I492 V563 Y567	L481-F484 VanDerWaalsContact O-O 3.13Å; A482-F484 PolarHBondContact O-N 3.12Å; A482-F484 VanDerWaalsContact O-N 3.08Å; F484-L488 HydrophobicContact CB-CB 4.46Å; F484-L488 HydrophobicContact CB-CD2 4.01Å; F484-L488 HydrophobicContact CB-CG 4.44Å; F484-L488 HydrophobicContact CD1-CD2 3.56Å; F484-L488 HydrophobicContact CD2-CD2 4.32Å; F484-L488 HydrophobicContact CE1-CD2 4.06Å; F484-L488 HydrophobicContact CG-CD2 3.73Å; F484-L488 HydrophobicContact CG-CG 4.41Å; F484-W489 HydrophobicContact CD2-CZ2 4.19Å; F484-W489 PolarHBondContact O-NE1 3.47Å; F484-I492 HydrophobicContact CD2-CD1 4.17Å; F484-I492 HydrophobicContact CE2-CD1 4.21Å; F484-V563 HydrophobicContact CE2-CG1 4.03Å; F484-V563 HydrophobicContact CZ-CG1 4.4Å; F484-V563 WeakPolarHBondContact CZ-O 3.38Å; F484-Y567 HydrophobicContact CD2-CD2 4.17Å; F484-Y567 HydrophobicContact CE2-CD2 4.07Å; F484-Y567 HydrophobicContact CE2-CG 4.34Å
485	D	87.9	Confident	82.6	Confident	129 Å²	129	66.1 Å²	66.1	69%	0.69	39%	0.392	S	S	*	.			trans	-59.8	149.6	172.7	-72	-53.8	0	0	0	112.7	S487 L488 W489	D485-S487 PolarHBondContact O-N 3.39Å; D485-S487 VanDerWaalsContact O-N 3.14Å; D485-L488 WeakPolarHBondContact O-CA 3.4Å; D485-L488 WeakPolarHBondContact O-CB 3.23Å; D485-L488 PolarHBondContact O-N 3.2Å; D485-W489 PolarHBondContact O-N 3.08Å
486	L	87.3	Confident	83.9	Confident	145 Å²	145	64 Å²	64	76%	0.759	38%	0.378	S	S	*	.	H	α-helix	trans	-54.4	-33.2	173.6	-66.2	174	0	0	0	112.6	W489 A490	L486-W489 PolarHBondContact O-N 3.35Å; L486-A490 WeakPolarHBondContact O-CB 3.28Å; L486-A490 PolarHBondContact O-N 2.87Å
487	S	90.8	Very high	85	Confident	92 Å²	92	63.6 Å²	63.6	64%	0.643	38%	0.376	S	S	*	.	H	α-helix	trans	-62.3	-40	173.3	-55.2	0	0	0	0	112.5	D485 A490 C491	D485-S487 PolarHBondContact O-N 3.39Å; D485-S487 VanDerWaalsContact O-N 3.14Å; S487-A490 PolarHBondContact O-N 2.84Å; S487-C491 PolarHBondContact O-N 3.49Å; S487-C491 PolarHBondContact O-SG 2.86Å; S487-C491 VanDerWaalsContact O-SG 3.33Å
488	L	90.9	Very high	86	Confident	78 Å²	78	63.8 Å²	63.8	41%	0.408	38%	0.378	S	S	.	.	H	α-helix	trans	-73.9	-38.9	178.1	-178.4	57.9	0	0	0	111	F484 D485 A490 C491 I492	F484-L488 HydrophobicContact CB-CB 4.46Å; F484-L488 HydrophobicContact CB-CD2 4.01Å; F484-L488 HydrophobicContact CB-CG 4.44Å; F484-L488 HydrophobicContact CD1-CD2 3.56Å; F484-L488 HydrophobicContact CD2-CD2 4.32Å; F484-L488 HydrophobicContact CE1-CD2 4.06Å; F484-L488 HydrophobicContact CG-CD2 3.73Å; F484-L488 HydrophobicContact CG-CG 4.41Å; D485-L488 WeakPolarHBondContact O-CA 3.4Å; D485-L488 WeakPolarHBondContact O-CB 3.23Å; D485-L488 PolarHBondContact O-N 3.2Å; L488-A490 VanDerWaalsContact C-N 3.33Å; L488-A490 PolarHBondContact O-N 2.82Å; L488-C491 WeakPolarHBondContact O-CB 3.31Å; L488-C491 PolarHBondContact O-N 2.7Å; L488-I492 HydrophobicContact CG-CD1 4.15Å; L488-I492 VanDerWaalsContact O-CG1 3.31Å; L488-I492 WeakPolarHBondContact O-CG1 3.31Å; L488-I492 PolarHBondContact O-N 2.77Å
489	W	90.6	Very high	86.7	Confident	78 Å²	78	60 Å²	60	30%	0.295	36%	0.363	S	S	.	.	H	α-helix	trans	-57.7	-43.3	170.1	-76.5	112.7	0	0	0	112.4	L481 F484 D485 L486 I492 A493 Y567	L481-W489 HydrophobicContact CD2-CZ2 4.12Å; L481-W489 PolarHBondContact O-NE1 3.21Å; L481-W489 VanDerWaalsContact O-NE1 3.13Å; F484-W489 HydrophobicContact CD2-CZ2 4.19Å; F484-W489 PolarHBondContact O-NE1 3.47Å; D485-W489 PolarHBondContact O-N 3.08Å; L486-W489 PolarHBondContact O-N 3.35Å; W489-I492 PolarHBondContact O-N 3.04Å; W489-A493 PolarHBondContact O-N 2.84Å; W489-Y567 HydrophobicContact CH2-CD2 4.49Å; W489-Y567 HydrophobicContact CH2-CE2 4.33Å; W489-Y567 HydrophobicContact CZ2-CD2 4.37Å; W489-Y567 HydrophobicContact CZ2-CE2 4.1Å
490	A	88.6	Confident	87.3	Confident	66 Å²	66	59.6 Å²	59.6	55%	0.545	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-41	175	0	0	0	0	0	112.3	L486 S487 L488 A493 G494	L486-A490 WeakPolarHBondContact O-CB 3.28Å; L486-A490 PolarHBondContact O-N 2.87Å; S487-A490 PolarHBondContact O-N 2.84Å; L488-A490 VanDerWaalsContact C-N 3.33Å; L488-A490 PolarHBondContact O-N 2.82Å; A490-A493 PolarHBondContact O-N 3.29Å; A490-G494 PolarHBondContact O-N 2.83Å
491	C	91.2	Very high	87.6	Confident	80 Å²	80	62.6 Å²	62.6	54%	0.541	37%	0.374	S	S	.	.	H	α-helix	trans	-62.2	-42.7	173.1	-73.7	0	0	0	0	112.5	S487 L488 G494 T495	S487-C491 PolarHBondContact O-N 3.49Å; S487-C491 PolarHBondContact O-SG 2.86Å; S487-C491 VanDerWaalsContact O-SG 3.33Å; L488-C491 WeakPolarHBondContact O-CB 3.31Å; L488-C491 PolarHBondContact O-N 2.7Å; C491-G494 PolarHBondContact O-N 3.34Å; C491-T495 WeakPolarHBondContact O-CG2 3.04Å; C491-T495 PolarHBondContact O-N 3.19Å; C491-T495 PolarHBondContact O-OG1 3.2Å
492	I	90.6	Very high	87.8	Confident	9 Å²	9	61.9 Å²	61.9	5%	0.046	37%	0.37	C	S	.	.	H	α-helix	trans	-61.9	-47	176.5	-69.6	162.5	0	0	0	110.7	F484 L488 W489 G494 T495 V496 F535 V563	F484-I492 HydrophobicContact CD2-CD1 4.17Å; F484-I492 HydrophobicContact CE2-CD1 4.21Å; L488-I492 HydrophobicContact CG-CD1 4.15Å; L488-I492 VanDerWaalsContact O-CG1 3.31Å; L488-I492 WeakPolarHBondContact O-CG1 3.31Å; L488-I492 PolarHBondContact O-N 2.77Å; W489-I492 PolarHBondContact O-N 3.04Å; I492-G494 VanDerWaalsContact C-N 3.29Å; I492-G494 PolarHBondContact O-N 2.91Å; I492-T495 PolarHBondContact O-N 2.96Å; I492-T495 PolarHBondContact O-OG1 3.44Å; I492-V496 WeakPolarHBondContact O-CG2 3.37Å; I492-V496 PolarHBondContact O-N 2.69Å; I492-F535 HydrophobicContact CG2-CE1 4.23Å; I492-F535 HydrophobicContact CG2-CE2 4.01Å; I492-F535 HydrophobicContact CG2-CZ 3.56Å; I492-V563 HydrophobicContact CD1-CG1 3.81Å; I492-V563 HydrophobicContact CG1-CG1 4.38Å
493	A	88.3	Confident	87.8	Confident	55 Å²	55	59.5 Å²	59.5	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-59.9	-40.3	175	0	0	0	0	0	111.9	W489 A490 L497	W489-A493 PolarHBondContact O-N 2.84Å; A490-A493 PolarHBondContact O-N 3.29Å; A493-L497 WeakPolarHBondContact O-CG 3.28Å; A493-L497 PolarHBondContact O-N 2.83Å; A493-L497 VanDerWaalsContact O-N 3.15Å
494	G	89.8	Confident	87.5	Confident	37 Å²	37	62.4 Å²	62.4	38%	0.381	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-42.6	173.8	0	0	0	0	0	113.6	A490 C491 I492 L497 L498	A490-G494 PolarHBondContact O-N 2.83Å; C491-G494 PolarHBondContact O-N 3.34Å; I492-G494 VanDerWaalsContact C-N 3.29Å; I492-G494 PolarHBondContact O-N 2.91Å; G494-L497 PolarHBondContact O-N 3.31Å; G494-L498 WeakPolarHBondContact O-CB 3.34Å; G494-L498 PolarHBondContact O-N 3.18Å
495	T	89.1	Confident	87.1	Confident	42 Å²	42	64.5 Å²	64.5	26%	0.258	37%	0.372	S	S	.	.	H	α-helix	trans	-71.2	-36.9	178.5	57.5	0	0	0	0	112.6	C491 I492 L497 L498 V499 F559	C491-T495 WeakPolarHBondContact O-CG2 3.04Å; C491-T495 PolarHBondContact O-N 3.19Å; C491-T495 PolarHBondContact O-OG1 3.2Å; I492-T495 PolarHBondContact O-N 2.96Å; I492-T495 PolarHBondContact O-OG1 3.44Å; T495-L497 VanDerWaalsContact C-N 3.35Å; T495-L497 PolarHBondContact O-N 2.88Å; T495-L498 PolarHBondContact O-N 3.09Å; T495-V499 WeakPolarHBondContact O-CB 3.38Å; T495-V499 WeakPolarHBondContact O-CG2 3.24Å; T495-V499 PolarHBondContact O-N 3.44Å; T495-F559 HydrophobicContact CG2-CZ 4.44Å
496	V	88.6	Confident	86.6	Confident	23 Å²	23	60.4 Å²	60.4	14%	0.139	35%	0.35	C	S	.	.	H	α-helix	trans	-57.1	-47.7	171.6	173	0	0	0	0	110.7	I492 G500 V531 F535 W556	I492-V496 WeakPolarHBondContact O-CG2 3.37Å; I492-V496 PolarHBondContact O-N 2.69Å; V496-G500 PolarHBondContact O-N 3.49Å; V496-V531 HydrophobicContact CG1-CG1 4.33Å; V496-F535 HydrophobicContact CG2-CG 4.49Å; V496-W556 HydrophobicContact CB-CH2 4.3Å; V496-W556 HydrophobicContact CG2-CH2 3.68Å; V496-W556 HydrophobicContact CG2-CZ2 4.01Å
497	L	87.8	Confident	85.9	Confident	100 Å²	100	54.9 Å²	54.9	52%	0.524	32%	0.321	S	S	.	.	H	α-helix	trans	-66.8	-42.5	179	-69.9	172.1	0	0	0	112.4	A493 G494 T495 G500 L501 M528	A493-L497 WeakPolarHBondContact O-CG 3.28Å; A493-L497 PolarHBondContact O-N 2.83Å; A493-L497 VanDerWaalsContact O-N 3.15Å; G494-L497 PolarHBondContact O-N 3.31Å; T495-L497 VanDerWaalsContact C-N 3.35Å; T495-L497 PolarHBondContact O-N 2.88Å; L497-G500 PolarHBondContact O-N 3.15Å; L497-L501 WeakPolarHBondContact O-CB 3.41Å; L497-L501 PolarHBondContact O-N 2.82Å; L497-M528 HydrophobicContact CD2-CE 4.31Å; L497-M528 HydrophobicContact CD2-SD 4.28Å
498	L	88.9	Confident	84.9	Confident	102 Å²	102	58.6 Å²	58.6	53%	0.534	32%	0.321	S	S	.	.	H	α-helix	trans	-62.9	-47.6	178.2	179.7	62.8	0	0	0	111.7	G494 T495 L501 L502	G494-L498 WeakPolarHBondContact O-CB 3.34Å; G494-L498 PolarHBondContact O-N 3.18Å; T495-L498 PolarHBondContact O-N 3.09Å; L498-L501 PolarHBondContact O-N 2.71Å; L498-L502 HydrophobicContact CD1-CD1 4.36Å; L498-L502 HydrophobicContact CG-CD1 4.14Å; L498-L502 WeakPolarHBondContact O-CG 3.28Å; L498-L502 PolarHBondContact O-N 3.22Å
499	V	87.4	Confident	83.9	Confident	22 Å²	22	59.9 Å²	59.9	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-69	-37.2	178.7	175.6	0	0	0	0	110.9	T495 L501 L502 V503 V531 W556	T495-V499 WeakPolarHBondContact O-CB 3.38Å; T495-V499 WeakPolarHBondContact O-CG2 3.24Å; T495-V499 PolarHBondContact O-N 3.44Å; V499-L501 VanDerWaalsContact C-N 3.32Å; V499-L501 PolarHBondContact O-N 3.45Å; V499-L502 PolarHBondContact O-N 2.82Å; V499-V503 HydrophobicContact CG1-CG2 4.28Å; V499-V503 WeakPolarHBondContact O-CB 3.43Å; V499-V503 VanDerWaalsContact O-CG2 3.3Å; V499-V503 WeakPolarHBondContact O-CG2 3.29Å; V499-V503 PolarHBondContact O-N 3.4Å; V499-V531 HydrophobicContact CB-CG1 4.05Å; V499-V531 HydrophobicContact CG1-CG1 3.93Å; V499-V531 HydrophobicContact CG1-CG2 4.11Å; V499-W556 HydrophobicContact CB-CD2 4.43Å; V499-W556 HydrophobicContact CB-CE3 4.12Å; V499-W556 HydrophobicContact CB-CZ3 4.26Å; V499-W556 HydrophobicContact CG1-CB 4.41Å; V499-W556 HydrophobicContact CG1-CD2 3.95Å; V499-W556 HydrophobicContact CG1-CE3 4.06Å; V499-W556 HydrophobicContact CG1-CG 4.11Å; V499-W556 HydrophobicContact CG2-CD2 4.48Å; V499-W556 HydrophobicContact CG2-CE3 3.76Å; V499-W556 HydrophobicContact CG2-CZ3 3.93Å
500	G	85.2	Confident	82.7	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-57.5	-42.1	171.2	0	0	0	0	0	113.2	V496 L497 Y504	V496-G500 PolarHBondContact O-N 3.49Å; L497-G500 PolarHBondContact O-N 3.15Å; G500-Y504 WeakPolarHBondContact O-CB 3.03Å; G500-Y504 PolarHBondContact O-N 2.72Å
501	L	84.8	Confident	81.4	Confident	87 Å²	87	61 Å²	61	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-69.8	-39.7	175.9	-169.2	152.9	0	0	0	112.2	L497 L498 V499 Y504 L505	L497-L501 WeakPolarHBondContact O-CB 3.41Å; L497-L501 PolarHBondContact O-N 2.82Å; L498-L501 PolarHBondContact O-N 2.71Å; V499-L501 VanDerWaalsContact C-N 3.32Å; V499-L501 PolarHBondContact O-N 3.45Å; L501-Y504 PolarHBondContact O-N 3.15Å; L501-L505 WeakPolarHBondContact O-CB 3.25Å; L501-L505 PolarHBondContact O-N 3.04Å
502	L	83.9	Confident	79.8	Confident	66 Å²	66	59.8 Å²	59.8	35%	0.346	33%	0.327	S	S	.	.	H	α-helix	trans	-67	-40.4	176.2	-71	168.4	0	0	0	112.6	L498 V499 L505 L506 M552	L498-L502 HydrophobicContact CD1-CD1 4.36Å; L498-L502 HydrophobicContact CG-CD1 4.14Å; L498-L502 WeakPolarHBondContact O-CG 3.28Å; L498-L502 PolarHBondContact O-N 3.22Å; V499-L502 PolarHBondContact O-N 2.82Å; L502-L505 PolarHBondContact O-N 2.96Å; L502-L506 WeakPolarHBondContact O-CB 3.48Å; L502-L506 WeakPolarHBondContact O-CG 3.3Å; L502-L506 PolarHBondContact O-N 3.34Å; L502-M552 HydrophobicContact CB-SD 3.98Å
503	V	80.2	Confident	77.9	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.018	37%	0.37	C	S	.	.	H	α-helix	trans	-60.2	-47.6	171.3	169.2	0	0	0	0	110.6	V499 L505 L506 N507 V531 M552 M553	V499-V503 HydrophobicContact CG1-CG2 4.28Å; V499-V503 WeakPolarHBondContact O-CB 3.43Å; V499-V503 VanDerWaalsContact O-CG2 3.3Å; V499-V503 WeakPolarHBondContact O-CG2 3.29Å; V499-V503 PolarHBondContact O-N 3.4Å; V503-L505 PolarHBondContact O-N 3.36Å; V503-L506 PolarHBondContact O-N 3.01Å; V503-N507 WeakPolarHBondContact O-CB 3.44Å; V503-N507 PolarHBondContact O-N 3.11Å; V503-N507 PolarHBondContact O-ND2 3.45Å; V503-V531 HydrophobicContact CB-CG2 4.26Å; V503-V531 HydrophobicContact CG2-CG2 3.78Å; V503-M552 HydrophobicContact CB-CE 4.24Å; V503-M552 HydrophobicContact CG2-CE 3.37Å; V503-M553 HydrophobicContact CG2-SD 4.11Å
504	Y	78.9	Confident	76.2	Confident	73 Å²	73	75.6 Å²	75.6	29%	0.286	38%	0.384	S	S	.	.	H	α-helix	trans	-58.8	-46.9	175.5	171.9	-106.1	0	0	0	112	G500 L501 L506 N507 W508 T522 L524	G500-Y504 WeakPolarHBondContact O-CB 3.03Å; G500-Y504 PolarHBondContact O-N 2.72Å; L501-Y504 PolarHBondContact O-N 3.15Å; Y504-L506 PolarHBondContact O-N 3.13Å; Y504-N507 PolarHBondContact O-N 3.24Å; Y504-W508 WeakPolarHBondContact O-CB 3.44Å; Y504-W508 PolarHBondContact O-N 2.92Å; Y504-T522 WeakPolarHBondContact CE2-O 3.38Å; Y504-L524 HydrophobicContact CD1-CB 4.46Å; Y504-L524 HydrophobicContact CD1-CD1 4.08Å; Y504-L524 HydrophobicContact CD2-CB 3.86Å; Y504-L524 HydrophobicContact CE1-CD1 4.3Å; Y504-L524 HydrophobicContact CE2-CB 4Å; Y504-L524 HydrophobicContact CG-CB 4.1Å; Y504-L524 HydrophobicContact CG-CD1 4.39Å; Y504-L524 HydrophobicContact CG-CG 4.46Å
505	L	78.4	Confident	74.3	Confident	67 Å²	67	83 Å²	83	35%	0.351	41%	0.408	S	S	.	.	H	α-helix	trans	-61.8	-44.5	179.5	-169.5	76.6	0	0	0	112.1	L501 L502 V503 W508 L509	L501-L505 WeakPolarHBondContact O-CB 3.25Å; L501-L505 PolarHBondContact O-N 3.04Å; L502-L505 PolarHBondContact O-N 2.96Å; V503-L505 PolarHBondContact O-N 3.36Å; L505-W508 HydrophobicContact CD1-CE3 4Å; L505-W508 HydrophobicContact CD1-CZ3 4.27Å; L505-W508 PolarHBondContact O-N 2.94Å; L505-L509 HydrophobicContact CG-CD1 4.05Å; L505-L509 WeakPolarHBondContact O-CB 3.4Å; L505-L509 VanDerWaalsContact O-CG 3.28Å; L505-L509 WeakPolarHBondContact O-CG 3.39Å; L505-L509 PolarHBondContact O-N 3.07Å
506	L	76.8	Confident	72	Confident	44 Å²	44	88.2 Å²	88.2	23%	0.23	43%	0.431	C	S	.	.	H	α-helix	trans	-67.4	-37.9	178.5	-76.4	165.7	0	0	0	112.5	L502 V503 Y504 W508 N510 M552	L502-L506 WeakPolarHBondContact O-CB 3.48Å; L502-L506 WeakPolarHBondContact O-CG 3.3Å; L502-L506 PolarHBondContact O-N 3.34Å; V503-L506 PolarHBondContact O-N 3.01Å; Y504-L506 PolarHBondContact O-N 3.13Å; L506-W508 VanDerWaalsContact C-N 3.35Å; L506-N510 PolarHBondContact O-N 2.8Å; L506-N510 PolarHBondContact O-ND2 2.89Å; L506-M552 HydrophobicContact CD1-CE 3.51Å; L506-M552 HydrophobicContact CD1-SD 3.64Å
507	N	72.9	Confident	69.7	Low	29 Å²	29	90.2 Å²	90.2	16%	0.155	46%	0.457	C	S	.	.	H	α-helix	trans	-70	-29.7	174.5	-70.7	-18.1	0	0	0	112.7	V503 Y504 N510 T522	V503-N507 WeakPolarHBondContact O-CB 3.44Å; V503-N507 PolarHBondContact O-N 3.11Å; V503-N507 PolarHBondContact O-ND2 3.45Å; Y504-N507 PolarHBondContact O-N 3.24Å; N507-N510 CarbonylContact O-C 3.58Å; N507-T522 HydrophobicContact CB-CG2 4.26Å
508	W	70.9	Confident	67.6	Low	170 Å²	170	91 Å²	91	64%	0.644	47%	0.471	S	S	*	.	H	α-helix	trans	-74.8	-41.6	173.8	179.3	52.4	0	0	0	112.2	Y504 L505 L506	Y504-W508 WeakPolarHBondContact O-CB 3.44Å; Y504-W508 PolarHBondContact O-N 2.92Å; L505-W508 HydrophobicContact CD1-CE3 4Å; L505-W508 HydrophobicContact CD1-CZ3 4.27Å; L505-W508 PolarHBondContact O-N 2.94Å; L506-W508 VanDerWaalsContact C-N 3.35Å
509	L	69.5	Low	65.6	Low	105 Å²	105	93.7 Å²	93.7	55%	0.55	48%	0.483	S	S	.	.	H	α-helix	trans	-70.8	-28.1	176.9	-70.6	169.3	0	0	0	113.1	L505	L505-L509 HydrophobicContact CG-CD1 4.05Å; L505-L509 WeakPolarHBondContact O-CB 3.4Å; L505-L509 VanDerWaalsContact O-CG 3.28Å; L505-L509 WeakPolarHBondContact O-CG 3.39Å; L505-L509 PolarHBondContact O-N 3.07Å
510	N	64.5	Low	64	Low	79 Å²	79	96 Å²	96	42%	0.422	50%	0.497	S	S	.	.	S	Bend	trans	-128.9	71.6	-179.3	-63.1	-90.1	0	0	0	111.3	L506 N507 T546	L506-N510 PolarHBondContact O-N 2.8Å; L506-N510 PolarHBondContact O-ND2 2.89Å; N507-N510 CarbonylContact O-C 3.58Å; N510-T546 HydrophobicContact CB-CG2 3.97Å
511	P	61.8	Low	62.5	Low	88 Å²	88	99.3 Å²	99.3	57%	0.571	52%	0.52	S	S	*	.			trans	-61.7	133.6	-179	24.9	-33.9	0	0	0	111.3	R513	P511-R513 PolarHBondContact O-N 3.39Å
512	P	58	Low	61.4	Low	55 Å²	55	98.3 Å²	98.3	36%	0.357	52%	0.517	S	S	.	.			trans	-66	126.8	-178.4	26.9	-34.4	0	0	0	111.1	L514 T545	P512-L514 PolarHBondContact O-N 2.89Å; P512-L514 VanDerWaalsContact O-N 3.13Å; P512-T545 HydrophobicContact CB-CG2 3.85Å
513	R	51.2	Low	60.7	Low	254 Å²	254	97.9 Å²	97.9	96%	0.958	52%	0.518	S	S	*	.	S	Bend	trans	-76.4	7.8	-173.4	-69.5	-172.5	175.3	-175.1	-1.2	115.7	P511	P511-R513 PolarHBondContact O-N 3.39Å
514	L	52.5	Low	60.5	Low	142 Å²	142	101.3 Å²	101.3	74%	0.743	54%	0.536	S	S	*	.			trans	-131.6	112.3	178	-81.7	165.1	0	0	0	109.5	P512	P512-L514 PolarHBondContact O-N 2.89Å; P512-L514 VanDerWaalsContact O-N 3.13Å
515	Q	50.1	Low	60.5	Low	192 Å²	192	105.3 Å²	105.3	90%	0.897	55%	0.551	S	S	*	*			trans	-79	116.1	165.1	-73.8	-177.5	-18.9	0	0	108.8
516	M	39.5	Very low	60.4	Low	151 Å²	151	104.8 Å²	104.8	74%	0.744	55%	0.549	S	S	*	.			trans	-127.7	129.3	162.1	-80.7	-178.3	164	0	0	109.1	T520	M516-T520 PolarHBondContact O-OG1 2.93Å
517	G	40.8	Very low	60.5	Low	66 Å²	66	103 Å²	103	68%	0.68	54%	0.54	S	S	*	.	S	Bend	trans	52.1	74.4	159.7	0	0	0	0	0	118.8	M519	G517-M519 PolarHBondContact O-N 3.41Å
518	S	43.5	Very low	60.9	Low	116 Å²	116	104 Å²	104	81%	0.811	54%	0.544	S	S	*	.	S	Bend	trans	50.5	-12.1	149.9	-157.5	0	0	0	0	122.6
519	M	47	Very low	61.4	Low	159 Å²	159	103.6 Å²	103.6	78%	0.783	54%	0.543	S	S	*	.			trans	-111.7	4.1	-172.9	-63.1	-61.9	153.4	0	0	112.9	G517	G517-M519 PolarHBondContact O-N 3.41Å
520	T	53.3	Low	61.9	Low	70 Å²	70	99.4 Å²	99.4	43%	0.429	52%	0.52	S	S	.	.			trans	-106.7	28.6	-168.6	44.1	0	0	0	0	113.7	M516 T522	M516-T520 PolarHBondContact O-OG1 2.93Å; T520-T522 PolarHBondContact O-N 3.48Å
521	S	53.9	Low	62.9	Low	69 Å²	69	95.7 Å²	95.7	48%	0.483	50%	0.5	S	S	.	.			trans	-70.7	118.9	169.8	58.7	0	0	0	0	110.1	T523 N526	S521-T523 PolarHBondContact O-N 3.34Å; S521-N526 PolarHBondContact O-ND2 3.2Å; S521-N526 PolarHBondContact OG-ND2 3.05Å
522	T	62.4	Low	64	Low	66 Å²	66	97 Å²	97	41%	0.405	50%	0.495	S	S	.	.			trans	-76.7	50	-177.1	45.9	0	0	0	0	112.7	Y504 N507 T520	Y504-T522 WeakPolarHBondContact CE2-O 3.38Å; N507-T522 HydrophobicContact CB-CG2 4.26Å; T520-T522 PolarHBondContact O-N 3.48Å
523	T	68.6	Low	65.2	Low	58 Å²	58	94.9 Å²	94.9	36%	0.356	48%	0.483	S	S	.	.			trans	-72.5	152.8	176.3	68.8	0	0	0	0	111.2	S521 Y525 N526 S527	S521-T523 PolarHBondContact O-N 3.34Å; T523-Y525 PolarHBondContact O-N 3.45Å; T523-N526 PolarHBondContact O-N 2.96Å; T523-N526 WeakPolarHBondContact OG1-CB 3.27Å; T523-N526 PolarHBondContact OG1-N 3.43Å; T523-N526 PolarHBondContact OG1-ND2 3.36Å; T523-S527 WeakPolarHBondContact O-CB 3.5Å; T523-S527 PolarHBondContact O-N 3.16Å; T523-S527 PolarHBondContact O-OG 2.85Å
524	L	75.4	Confident	66.7	Low	75 Å²	75	83.2 Å²	83.2	39%	0.393	44%	0.44	S	S	.	.	H	α-helix	trans	-60.9	-35.5	172.4	177.6	145.3	0	0	0	111.3	Y504 S527 M528	Y504-L524 HydrophobicContact CD1-CB 4.46Å; Y504-L524 HydrophobicContact CD1-CD1 4.08Å; Y504-L524 HydrophobicContact CD2-CB 3.86Å; Y504-L524 HydrophobicContact CE1-CD1 4.3Å; Y504-L524 HydrophobicContact CE2-CB 4Å; Y504-L524 HydrophobicContact CG-CB 4.1Å; Y504-L524 HydrophobicContact CG-CD1 4.39Å; Y504-L524 HydrophobicContact CG-CG 4.46Å; L524-S527 PolarHBondContact O-N 2.76Å; L524-M528 HydrophobicContact CD1-CE 4.25Å; L524-M528 HydrophobicContact CD2-CE 3.8Å; L524-M528 HydrophobicContact CD2-CG 4.43Å; L524-M528 HydrophobicContact CD2-SD 3.58Å; L524-M528 VanDerWaalsContact CD2-SD 3.58Å; L524-M528 HydrophobicContact CG-CE 4.02Å; L524-M528 HydrophobicContact CG-SD 4.22Å; L524-M528 WeakPolarHBondContact O-CB 3.25Å; L524-M528 WeakPolarHBondContact O-CG 3.29Å; L524-M528 PolarHBondContact O-N 3Å
525	Y	79.6	Confident	68.4	Low	156 Å²	156	77.9 Å²	77.9	61%	0.612	41%	0.411	S	S	*	.	H	α-helix	trans	-59.5	-54.4	173.5	176.5	-101.4	0	0	0	112.2	T523 S527 M528 W529	T523-Y525 PolarHBondContact O-N 3.45Å; Y525-S527 VanDerWaalsContact C-N 3.26Å; Y525-S527 PolarHBondContact O-N 3.37Å; Y525-M528 PolarHBondContact O-N 2.86Å; Y525-W529 WeakPolarHBondContact O-CB 3.37Å; Y525-W529 PolarHBondContact O-N 3.3Å
526	N	77.1	Confident	70.1	Confident	56 Å²	56	71.6 Å²	71.6	30%	0.299	39%	0.385	S	S	.	.	H	α-helix	trans	-60.7	-37.5	178.8	-67.5	-12.5	0	0	0	111.6	S521 T523 F530	S521-N526 PolarHBondContact O-ND2 3.2Å; S521-N526 PolarHBondContact OG-ND2 3.05Å; T523-N526 PolarHBondContact O-N 2.96Å; T523-N526 WeakPolarHBondContact OG1-CB 3.27Å; T523-N526 PolarHBondContact OG1-N 3.43Å; T523-N526 PolarHBondContact OG1-ND2 3.36Å; N526-F530 VanDerWaalsContact O-CB 3.23Å; N526-F530 WeakPolarHBondContact O-CB 3.26Å; N526-F530 PolarHBondContact O-N 2.74Å
527	S	77.8	Confident	72.1	Confident	7 Å²	7	70.7 Å²	70.7	5%	0.049	38%	0.38	C	S	.	.	H	α-helix	trans	-66.4	-42.5	178.2	-54.8	0	0	0	0	112.3	T523 L524 Y525 V531	T523-S527 WeakPolarHBondContact O-CB 3.5Å; T523-S527 PolarHBondContact O-N 3.16Å; T523-S527 PolarHBondContact O-OG 2.85Å; L524-S527 PolarHBondContact O-N 2.76Å; Y525-S527 VanDerWaalsContact C-N 3.26Å; Y525-S527 PolarHBondContact O-N 3.37Å; S527-V531 WeakPolarHBondContact O-CG2 3.41Å; S527-V531 PolarHBondContact O-N 3.06Å
528	M	80.6	Confident	73.9	Confident	50 Å²	50	75.6 Å²	75.6	25%	0.246	39%	0.385	C	S	.	.	H	α-helix	trans	-71.6	-42.4	176.4	-73.2	-178	171.8	0	0	112.3	L497 L524 Y525 F530 V531 Y532	L497-M528 HydrophobicContact CD2-CE 4.31Å; L497-M528 HydrophobicContact CD2-SD 4.28Å; L524-M528 HydrophobicContact CD1-CE 4.25Å; L524-M528 HydrophobicContact CD2-CE 3.8Å; L524-M528 HydrophobicContact CD2-CG 4.43Å; L524-M528 HydrophobicContact CD2-SD 3.58Å; L524-M528 VanDerWaalsContact CD2-SD 3.58Å; L524-M528 HydrophobicContact CG-CE 4.02Å; L524-M528 HydrophobicContact CG-SD 4.22Å; L524-M528 WeakPolarHBondContact O-CB 3.25Å; L524-M528 WeakPolarHBondContact O-CG 3.29Å; L524-M528 PolarHBondContact O-N 3Å; Y525-M528 PolarHBondContact O-N 2.86Å; M528-F530 VanDerWaalsContact C-N 3.26Å; M528-F530 PolarHBondContact O-N 3.01Å; M528-V531 PolarHBondContact O-N 3.07Å; M528-Y532 WeakPolarHBondContact O-CB 3.29Å; M528-Y532 PolarHBondContact O-N 3.1Å
529	W	83.2	Confident	75.2	Confident	162 Å²	162	72.1 Å²	72.1	61%	0.614	37%	0.367	S	S	*	.	H	α-helix	trans	-59.5	-38	175.7	-173.4	-104.2	0	0	0	111.8	Y525 Y532 G533	Y525-W529 WeakPolarHBondContact O-CB 3.37Å; Y525-W529 PolarHBondContact O-N 3.3Å; W529-Y532 HydrophobicContact CE3-CD1 4.34Å; W529-Y532 HydrophobicContact CZ3-CD1 4.25Å; W529-Y532 HydrophobicContact CZ3-CE1 4.41Å; W529-Y532 PolarHBondContact O-N 3.09Å; W529-G533 PolarHBondContact O-N 2.74Å
530	F	79.2	Confident	76.1	Confident	17 Å²	17	66.8 Å²	66.8	8%	0.075	35%	0.353	C	S	.	.	H	α-helix	trans	-68.3	-41.8	175.5	179.3	-108	0	0	0	113.8	N526 M528 Y532 G533 S534 G540 V542 Y544 M553	N526-F530 VanDerWaalsContact O-CB 3.23Å; N526-F530 WeakPolarHBondContact O-CB 3.26Å; N526-F530 PolarHBondContact O-N 2.74Å; M528-F530 VanDerWaalsContact C-N 3.26Å; M528-F530 PolarHBondContact O-N 3.01Å; F530-Y532 VanDerWaalsContact C-N 3.29Å; F530-Y532 PolarHBondContact O-N 3.38Å; F530-G533 PolarHBondContact O-N 3.1Å; F530-S534 WeakPolarHBondContact O-CB 3.47Å; F530-S534 PolarHBondContact O-N 2.83Å; F530-S534 PolarHBondContact O-OG 3.16Å; F530-G540 WeakPolarHBondContact CE2-O 3.43Å; F530-V542 HydrophobicContact CD2-CB 4.43Å; F530-V542 HydrophobicContact CD2-CG2 3.6Å; F530-V542 HydrophobicContact CE2-CB 3.93Å; F530-V542 HydrophobicContact CE2-CG2 3.55Å; F530-V542 HydrophobicContact CG-CG2 4.13Å; F530-V542 HydrophobicContact CZ-CB 3.95Å; F530-V542 HydrophobicContact CZ-CG2 4.02Å; F530-Y544 HydrophobicContact CE1-CE1 4.06Å; F530-Y544 AromaticContact CZ-CE1 3.86Å; F530-Y544 HydrophobicContact CZ-CE1 3.86Å; F530-Y544 AromaticContact CZ-CZ 3.98Å; F530-Y544 WeakPolarHBondContact CZ-OH 3.45Å; F530-M553 HydrophobicContact CD1-CE 4.4Å; F530-M553 HydrophobicContact CE1-CE 3.64Å; F530-M553 HydrophobicContact CE1-SD 4.01Å; F530-M553 HydrophobicContact CZ-CE 4.2Å
531	V	84.6	Confident	76.3	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-66.1	-34.7	175	170.8	0	0	0	0	111.1	V496 V499 V503 S527 M528 S534 F535 W556	V496-V531 HydrophobicContact CG1-CG1 4.33Å; V499-V531 HydrophobicContact CB-CG1 4.05Å; V499-V531 HydrophobicContact CG1-CG1 3.93Å; V499-V531 HydrophobicContact CG1-CG2 4.11Å; V503-V531 HydrophobicContact CB-CG2 4.26Å; V503-V531 HydrophobicContact CG2-CG2 3.78Å; S527-V531 WeakPolarHBondContact O-CG2 3.41Å; S527-V531 PolarHBondContact O-N 3.06Å; M528-V531 PolarHBondContact O-N 3.07Å; V531-S534 WeakPolarHBondContact CA-OG 3.32Å; V531-S534 PolarHBondContact O-OG 2.9Å; V531-S534 VanDerWaalsContact O-OG 3.09Å; V531-F535 PolarHBondContact O-N 2.87Å; V531-F535 VanDerWaalsContact O-N 3.16Å; V531-W556 HydrophobicContact CG1-CD2 4.44Å; V531-W556 HydrophobicContact CG1-CH2 4.24Å; V531-W556 HydrophobicContact CG1-CZ2 3.49Å; V531-W556 VanDerWaalsContact CG1-CZ2 3.49Å; V531-W556 PolarHBondContact O-NE1 3.14Å
532	Y	85.5	Confident	76.5	Confident	116 Å²	116	72.8 Å²	72.8	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-68.5	-50.1	171.2	178.4	-105.1	0	0	0	112.9	M528 W529 F530 S534 F535 V536	M528-Y532 WeakPolarHBondContact O-CB 3.29Å; M528-Y532 PolarHBondContact O-N 3.1Å; W529-Y532 HydrophobicContact CE3-CD1 4.34Å; W529-Y532 HydrophobicContact CZ3-CD1 4.25Å; W529-Y532 HydrophobicContact CZ3-CE1 4.41Å; W529-Y532 PolarHBondContact O-N 3.09Å; F530-Y532 VanDerWaalsContact C-N 3.29Å; F530-Y532 PolarHBondContact O-N 3.38Å; Y532-S534 VanDerWaalsContact C-N 3.28Å; Y532-S534 PolarHBondContact O-N 2.03Å; Y532-F535 WeakPolarHBondContact O-CA 3.42Å; Y532-F535 WeakPolarHBondContact O-CB 3.39Å; Y532-F535 PolarHBondContact O-N 2.85Å; Y532-V536 HydrophobicContact CD2-CG2 4.39Å; Y532-V536 HydrophobicContact CE1-CG2 4.14Å; Y532-V536 HydrophobicContact CE2-CG2 3.97Å; Y532-V536 PolarHBondContact O-N 3.22Å
533	G	83.4	Confident	76.2	Confident	10 Å²	10	74 Å²	74	10%	0.103	38%	0.382	C	S	.	.	H	α-helix	trans	-63.4	-30.8	179.6	0	0	0	0	0	113.8	W529 F530 Q537 Q538 G539	W529-G533 PolarHBondContact O-N 2.74Å; F530-G533 PolarHBondContact O-N 3.1Å; G533-Q537 PolarHBondContact O-N 3.11Å; G533-Q538 PolarHBondContact O-N 3.47Å; G533-G539 PolarHBondContact O-N 2.83Å
534	S	83.7	Confident	75.9	Confident	9 Å²	9	73.7 Å²	73.7	6%	0.063	37%	0.374	C	S	.	.	H	α-helix	trans	-75.6	-27.4	170.4	53.2	0	0	0	0	113.6	F530 V531 Y532 Q537 W556	F530-S534 WeakPolarHBondContact O-CB 3.47Å; F530-S534 PolarHBondContact O-N 2.83Å; F530-S534 PolarHBondContact O-OG 3.16Å; V531-S534 WeakPolarHBondContact CA-OG 3.32Å; V531-S534 PolarHBondContact O-OG 2.9Å; V531-S534 VanDerWaalsContact O-OG 3.09Å; Y532-S534 VanDerWaalsContact C-N 3.28Å; Y532-S534 PolarHBondContact O-N 2.03Å; S534-Q537 PolarHBondContact O-N 3.3Å; S534-W556 PolarHBondContact OG-NE1 2.91Å
535	F	86.4	Confident	75.3	Confident	30 Å²	30	73.9 Å²	73.9	13%	0.132	38%	0.379	C	S	.	.	H	α-helix	trans	-69.7	-38.8	168.7	-174.6	-96.1	0	0	0	111.8	I492 V496 V531 Y532 Q537 W556 A560 V563 I564	I492-F535 HydrophobicContact CG2-CE1 4.23Å; I492-F535 HydrophobicContact CG2-CE2 4.01Å; I492-F535 HydrophobicContact CG2-CZ 3.56Å; V496-F535 HydrophobicContact CG2-CG 4.49Å; V531-F535 PolarHBondContact O-N 2.87Å; V531-F535 VanDerWaalsContact O-N 3.16Å; Y532-F535 WeakPolarHBondContact O-CA 3.42Å; Y532-F535 WeakPolarHBondContact O-CB 3.39Å; Y532-F535 PolarHBondContact O-N 2.85Å; F535-Q537 PolarHBondContact O-N 3.33Å; F535-Q537 VanDerWaalsContact O-N 3.17Å; F535-W556 HydrophobicContact CB-CZ2 3.97Å; F535-W556 HydrophobicContact CD2-CH2 4.15Å; F535-W556 AromaticContact CD2-CZ2 3.98Å; F535-W556 HydrophobicContact CD2-CZ2 3.98Å; F535-W556 HydrophobicContact CG-CZ2 4.37Å; F535-A560 HydrophobicContact CD2-CB 3.93Å; F535-V563 HydrophobicContact CE2-CB 4.49Å; F535-V563 HydrophobicContact CE2-CG1 4.2Å; F535-V563 HydrophobicContact CZ-CG1 4.02Å; F535-I564 WeakPolarHBondContact O-CD1 3.37Å
536	V	86.2	Confident	74.9	Confident	60 Å²	60	68 Å²	68	36%	0.364	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	12.2	177.5	-172.5	0	0	0	0	112.4	Y532 Q538	Y532-V536 HydrophobicContact CD2-CG2 4.39Å; Y532-V536 HydrophobicContact CE1-CG2 4.14Å; Y532-V536 HydrophobicContact CE2-CG2 3.97Å; Y532-V536 PolarHBondContact O-N 3.22Å; V536-Q538 HydrophobicContact CG1-CG 4.39Å; V536-Q538 PolarHBondContact O-N 3.1Å
537	Q	81.4	Confident	74.9	Confident	133 Å²	133	71.3 Å²	71.3	62%	0.621	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	5.4	-178.8	-58.4	-177.1	-6.5	0	0	116.2	G533 S534 F535 I564	G533-Q537 PolarHBondContact O-N 3.11Å; S534-Q537 PolarHBondContact O-N 3.3Å; F535-Q537 PolarHBondContact O-N 3.33Å; F535-Q537 VanDerWaalsContact O-N 3.17Å; Q537-I564 HydrophobicContact CG-CD1 3.78Å
538	Q	78.7	Confident	74.9	Confident	169 Å²	169	73.8 Å²	73.8	79%	0.79	40%	0.397	S	S	*	.			trans	-78.4	-23.6	178.1	-69.1	-179.1	-11.2	0	0	112.6	G533 V536	G533-Q538 PolarHBondContact O-N 3.47Å; V536-Q538 HydrophobicContact CG1-CG 4.39Å; V536-Q538 PolarHBondContact O-N 3.1Å
539	G	70.7	Confident	74.6	Confident	42 Å²	42	71.8 Å²	71.8	43%	0.433	39%	0.388	S	S	.	.			trans	73.6	-162.7	173.2	0	0	0	0	0	114.2	G533	G533-G539 PolarHBondContact O-N 2.83Å
540	G	66.2	Low	74.5	Confident	47 Å²	47	71.2 Å²	71.2	49%	0.485	39%	0.385	S	S	.	.			trans	174.2	150.7	178.2	0	0	0	0	0	112.4	F530 V542	F530-G540 WeakPolarHBondContact CE2-O 3.43Å; G540-V542 PolarHBondContact O-N 3.32Å
541	E	57.1	Low	74.7	Confident	201 Å²	201	76.8 Å²	76.8	94%	0.939	41%	0.413	S	S	*	.			trans	-90.8	87.8	-176.4	-63.7	-171.2	171	0	0	111.4
542	V	57.7	Low	74.6	Confident	64 Å²	64	78.8 Å²	78.8	39%	0.388	42%	0.423	S	S	.	.			trans	-119.6	120.9	172.9	-177.5	0	0	0	0	109.6	F530 G540 Y544	F530-V542 HydrophobicContact CD2-CB 4.43Å; F530-V542 HydrophobicContact CD2-CG2 3.6Å; F530-V542 HydrophobicContact CE2-CB 3.93Å; F530-V542 HydrophobicContact CE2-CG2 3.55Å; F530-V542 HydrophobicContact CG-CG2 4.13Å; F530-V542 HydrophobicContact CZ-CB 3.95Å; F530-V542 HydrophobicContact CZ-CG2 4.02Å; G540-V542 PolarHBondContact O-N 3.32Å; V542-Y544 PolarHBondContact O-N 3.37Å; V542-Y544 VanDerWaalsContact O-N 3.1Å
543	P	56.9	Low	74.4	Confident	92 Å²	92	73.3 Å²	73.3	60%	0.597	40%	0.401	S	S	*	.			trans	-72.4	106.2	-176.8	27.7	-33.9	0	0	0	111.4	T545	P543-T545 PolarHBondContact O-N 3.1Å
544	Y	63.4	Low	74.4	Confident	52 Å²	52	74.4 Å²	74.4	20%	0.204	41%	0.413	C	S	.	.			trans	-69	93.7	177.8	-50.6	-65.7	0	0	0	112.1	F530 V542 T549 R550 M553 W557	F530-Y544 HydrophobicContact CE1-CE1 4.06Å; F530-Y544 AromaticContact CZ-CE1 3.86Å; F530-Y544 HydrophobicContact CZ-CE1 3.86Å; F530-Y544 AromaticContact CZ-CZ 3.98Å; F530-Y544 WeakPolarHBondContact CZ-OH 3.45Å; V542-Y544 PolarHBondContact O-N 3.37Å; V542-Y544 VanDerWaalsContact O-N 3.1Å; Y544-T549 HydrophobicContact CD1-CG2 4.14Å; Y544-R550 HydrophobicContact CG-CG 4.18Å; Y544-R550 VanDerWaalsContact O-CZ 3.32Å; Y544-R550 PolarHBondContact O-NE 3.31Å; Y544-R550 PolarHBondContact O-NH2 3.16Å; Y544-M553 HydrophobicContact CD1-CG 4.39Å; Y544-M553 HydrophobicContact CE1-CB 4.32Å; Y544-M553 HydrophobicContact CE1-CG 3.77Å; Y544-W557 HydrophobicContact CE2-CH2 4.03Å; Y544-W557 HydrophobicContact CE2-CZ2 4.39Å; Y544-W557 WeakPolarHBondContact OH-CZ2 3.24Å
545	T	61.4	Low	74.6	Confident	79 Å²	79	76.9 Å²	76.9	49%	0.485	43%	0.434	S	S	.	.			trans	-76.1	-24.5	-176.1	52.7	0	0	0	0	114.8	P512 P543	P512-T545 HydrophobicContact CB-CG2 3.85Å; P543-T545 PolarHBondContact O-N 3.1Å
546	T	70.9	Confident	74.7	Confident	33 Å²	33	76 Å²	76	20%	0.202	43%	0.43	C	S	.	.	S	Bend	trans	-117.9	150.3	-177	79.6	0	0	0	0	113	N510 A548 T549 R550	N510-T546 HydrophobicContact CB-CG2 3.97Å; T546-A548 VanDerWaalsContact C-N 3.32Å; T546-A548 PolarHBondContact O-N 3.48Å; T546-T549 PolarHBondContact O-N 2.94Å; T546-T549 PolarHBondContact OG1-N 2.87Å; T546-T549 PolarHBondContact OG1-OG1 2.91Å; T546-R550 WeakPolarHBondContact O-CG 3.47Å; T546-R550 PolarHBondContact O-N 2.82Å
547	L	77.2	Confident	74.8	Confident	125 Å²	125	79 Å²	79	65%	0.654	44%	0.435	S	S	*	.	H	α-helix	trans	-64.2	-36.1	177.1	-176.7	62.1	0	0	0	112.3	R550 M551	L547-R550 PolarHBondContact O-N 3.42Å; L547-M551 HydrophobicContact CD1-CE 4.15Å; L547-M551 HydrophobicContact CD1-CG 4.49Å; L547-M551 WeakPolarHBondContact O-CG 3.35Å; L547-M551 PolarHBondContact O-N 3.1Å
548	A	77.9	Confident	75.2	Confident	59 Å²	59	77.8 Å²	77.8	49%	0.488	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-47.1	178.3	0	0	0	0	0	111.8	T546 R550 M551 M552	T546-A548 VanDerWaalsContact C-N 3.32Å; T546-A548 PolarHBondContact O-N 3.48Å; A548-R550 VanDerWaalsContact C-N 3.31Å; A548-R550 PolarHBondContact O-N 2.98Å; A548-M551 PolarHBondContact O-N 3.15Å; A548-M552 WeakPolarHBondContact O-CB 3.34Å; A548-M552 PolarHBondContact O-N 3Å
549	T	74.3	Confident	75.7	Confident	8 Å²	8	73.2 Å²	73.2	5%	0.049	41%	0.41	C	S	.	.	H	α-helix	trans	-62.9	-37.7	176.6	-51.8	0	0	0	0	111.5	Y544 T546 M553	Y544-T549 HydrophobicContact CD1-CG2 4.14Å; T546-T549 PolarHBondContact O-N 2.94Å; T546-T549 PolarHBondContact OG1-N 2.87Å; T546-T549 PolarHBondContact OG1-OG1 2.91Å; T549-M553 HydrophobicContact CG2-CG 4.35Å; T549-M553 WeakPolarHBondContact O-CB 3.23Å; T549-M553 VanDerWaalsContact O-CG 3.29Å; T549-M553 WeakPolarHBondContact O-CG 3.34Å; T549-M553 PolarHBondContact O-N 3.4Å
550	R	81.2	Confident	76.6	Confident	150 Å²	150	71.4 Å²	71.4	57%	0.566	39%	0.391	S	S	*	.	H	α-helix	trans	-63.7	-45.6	175.7	-68.2	179.1	-171.5	-159.8	0.3	112.6	Y544 T546 L547 A548 M553 G554	Y544-R550 HydrophobicContact CG-CG 4.18Å; Y544-R550 VanDerWaalsContact O-CZ 3.32Å; Y544-R550 PolarHBondContact O-NE 3.31Å; Y544-R550 PolarHBondContact O-NH2 3.16Å; T546-R550 WeakPolarHBondContact O-CG 3.47Å; T546-R550 PolarHBondContact O-N 2.82Å; L547-R550 PolarHBondContact O-N 3.42Å; A548-R550 VanDerWaalsContact C-N 3.31Å; A548-R550 PolarHBondContact O-N 2.98Å; R550-M553 PolarHBondContact O-N 2.65Å; R550-G554 PolarHBondContact O-N 2.81Å
551	M	83.6	Confident	77.7	Confident	134 Å²	134	73.9 Å²	73.9	66%	0.66	39%	0.392	S	S	*	.	H	α-helix	trans	-65.7	-41.8	178.6	-70.7	-63.6	-178.5	0	0	112	L547 A548 G554 A555	L547-M551 HydrophobicContact CD1-CE 4.15Å; L547-M551 HydrophobicContact CD1-CG 4.49Å; L547-M551 WeakPolarHBondContact O-CG 3.35Å; L547-M551 PolarHBondContact O-N 3.1Å; A548-M551 PolarHBondContact O-N 3.15Å; M551-G554 PolarHBondContact O-N 3.48Å; M551-A555 PolarHBondContact O-N 3.15Å
552	M	82.7	Confident	79.3	Confident	41 Å²	41	68.7 Å²	68.7	20%	0.202	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-42.9	176.1	-174.6	-177.5	62.9	0	0	112.2	L502 V503 L506 A548 A555 W556	L502-M552 HydrophobicContact CB-SD 3.98Å; V503-M552 HydrophobicContact CB-CE 4.24Å; V503-M552 HydrophobicContact CG2-CE 3.37Å; L506-M552 HydrophobicContact CD1-CE 3.51Å; L506-M552 HydrophobicContact CD1-SD 3.64Å; A548-M552 WeakPolarHBondContact O-CB 3.34Å; A548-M552 PolarHBondContact O-N 3Å; M552-A555 PolarHBondContact O-N 3.11Å; M552-W556 PolarHBondContact O-N 2.99Å
553	M	81.1	Confident	80.9	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-67.3	-35.1	175.8	-72.5	-60.4	-53.7	0	0	112.4	V503 F530 Y544 T549 R550 W556 W557	V503-M553 HydrophobicContact CG2-SD 4.11Å; F530-M553 HydrophobicContact CD1-CE 4.4Å; F530-M553 HydrophobicContact CE1-CE 3.64Å; F530-M553 HydrophobicContact CE1-SD 4.01Å; F530-M553 HydrophobicContact CZ-CE 4.2Å; Y544-M553 HydrophobicContact CD1-CG 4.39Å; Y544-M553 HydrophobicContact CE1-CB 4.32Å; Y544-M553 HydrophobicContact CE1-CG 3.77Å; T549-M553 HydrophobicContact CG2-CG 4.35Å; T549-M553 WeakPolarHBondContact O-CB 3.23Å; T549-M553 VanDerWaalsContact O-CG 3.29Å; T549-M553 WeakPolarHBondContact O-CG 3.34Å; T549-M553 PolarHBondContact O-N 3.4Å; R550-M553 PolarHBondContact O-N 2.65Å; M553-W556 PolarHBondContact O-N 3.18Å; M553-W557 WeakPolarHBondContact O-CB 3.43Å; M553-W557 PolarHBondContact O-N 3.02Å
554	G	84.5	Confident	82.4	Confident	33 Å²	33	64 Å²	64	34%	0.34	34%	0.338	S	S	.	.	H	α-helix	trans	-61.4	-42.2	171.7	0	0	0	0	0	112.8	R550 M551 L558	R550-G554 PolarHBondContact O-N 2.81Å; M551-G554 PolarHBondContact O-N 3.48Å; G554-L558 PolarHBondContact O-N 2.96Å
555	A	87.8	Confident	83.7	Confident	62 Å²	62	64.3 Å²	64.3	51%	0.512	35%	0.347	S	S	.	.	H	α-helix	trans	-66.4	-39.2	173.6	0	0	0	0	0	112.5	M551 M552 L558 F559	M551-A555 PolarHBondContact O-N 3.15Å; M552-A555 PolarHBondContact O-N 3.11Å; A555-L558 PolarHBondContact O-N 2.94Å; A555-F559 PolarHBondContact O-N 2.71Å
556	W	88.4	Confident	85	Confident	10 Å²	10	63 Å²	63	4%	0.038	34%	0.342	C	S	.	.	H	α-helix	trans	-62.5	-45.3	174.6	178.5	-119.1	0	0	0	112.5	V496 V499 V531 S534 F535 M552 M553 L558 F559 A560	V496-W556 HydrophobicContact CB-CH2 4.3Å; V496-W556 HydrophobicContact CG2-CH2 3.68Å; V496-W556 HydrophobicContact CG2-CZ2 4.01Å; V499-W556 HydrophobicContact CB-CD2 4.43Å; V499-W556 HydrophobicContact CB-CE3 4.12Å; V499-W556 HydrophobicContact CB-CZ3 4.26Å; V499-W556 HydrophobicContact CG1-CB 4.41Å; V499-W556 HydrophobicContact CG1-CD2 3.95Å; V499-W556 HydrophobicContact CG1-CE3 4.06Å; V499-W556 HydrophobicContact CG1-CG 4.11Å; V499-W556 HydrophobicContact CG2-CD2 4.48Å; V499-W556 HydrophobicContact CG2-CE3 3.76Å; V499-W556 HydrophobicContact CG2-CZ3 3.93Å; V531-W556 HydrophobicContact CG1-CD2 4.44Å; V531-W556 HydrophobicContact CG1-CH2 4.24Å; V531-W556 HydrophobicContact CG1-CZ2 3.49Å; V531-W556 VanDerWaalsContact CG1-CZ2 3.49Å; V531-W556 PolarHBondContact O-NE1 3.14Å; S534-W556 PolarHBondContact OG-NE1 2.91Å; F535-W556 HydrophobicContact CB-CZ2 3.97Å; F535-W556 HydrophobicContact CD2-CH2 4.15Å; F535-W556 AromaticContact CD2-CZ2 3.98Å; F535-W556 HydrophobicContact CD2-CZ2 3.98Å; F535-W556 HydrophobicContact CG-CZ2 4.37Å; M552-W556 PolarHBondContact O-N 2.99Å; M553-W556 PolarHBondContact O-N 3.18Å; W556-L558 PolarHBondContact O-N 3.16Å; W556-F559 AromaticContact CE3-CD1 3.83Å; W556-F559 HydrophobicContact CE3-CD1 3.83Å; W556-F559 HydrophobicContact CH2-CD1 4.27Å; W556-F559 HydrophobicContact CH2-CE1 4.27Å; W556-F559 AromaticContact CZ3-CD1 3.51Å; W556-F559 HydrophobicContact CZ3-CD1 3.51Å; W556-F559 AromaticContact CZ3-CE1 3.75Å; W556-F559 HydrophobicContact CZ3-CE1 3.75Å; W556-F559 PolarHBondContact O-N 2.7Å; W556-A560 WeakPolarHBondContact O-CB 3.25Å; W556-A560 PolarHBondContact O-N 2.81Å
557	W	87.8	Confident	86	Confident	124 Å²	124	64.1 Å²	64.1	47%	0.47	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-39.7	176.5	-68.7	-25.5	0	0	0	112.6	Y544 M553 A560 L561	Y544-W557 HydrophobicContact CE2-CH2 4.03Å; Y544-W557 HydrophobicContact CE2-CZ2 4.39Å; Y544-W557 WeakPolarHBondContact OH-CZ2 3.24Å; M553-W557 WeakPolarHBondContact O-CB 3.43Å; M553-W557 PolarHBondContact O-N 3.02Å; W557-A560 PolarHBondContact O-N 2.77Å; W557-L561 VanDerWaalsContact O-CB 3.25Å; W557-L561 WeakPolarHBondContact O-CB 3.42Å; W557-L561 PolarHBondContact O-N 2.86Å
558	L	89.1	Confident	86.5	Confident	107 Å²	107	61.9 Å²	61.9	56%	0.56	33%	0.334	S	S	*	.	H	α-helix	trans	-62.1	-44.2	174	-178	61.9	0	0	0	111.4	G554 A555 W556 I562	G554-L558 PolarHBondContact O-N 2.96Å; A555-L558 PolarHBondContact O-N 2.94Å; W556-L558 PolarHBondContact O-N 3.16Å; L558-I562 HydrophobicContact CD1-CD1 4.1Å; L558-I562 HydrophobicContact CG-CD1 4.04Å; L558-I562 WeakPolarHBondContact O-CD1 3.18Å; L558-I562 VanDerWaalsContact O-CG1 3.25Å; L558-I562 WeakPolarHBondContact O-CG1 3.45Å; L558-I562 PolarHBondContact O-N 3.33Å; L558-I562 VanDerWaalsContact O-N 3.08Å
559	F	90.2	Very high	87	Confident	74 Å²	74	61.8 Å²	61.8	33%	0.325	33%	0.333	S	S	.	.	H	α-helix	trans	-61.3	-49.6	175.1	173.4	-100.7	0	0	0	112.1	T495 A555 W556 L561 I562 V563	T495-F559 HydrophobicContact CG2-CZ 4.44Å; A555-F559 PolarHBondContact O-N 2.71Å; W556-F559 AromaticContact CE3-CD1 3.83Å; W556-F559 HydrophobicContact CE3-CD1 3.83Å; W556-F559 HydrophobicContact CH2-CD1 4.27Å; W556-F559 HydrophobicContact CH2-CE1 4.27Å; W556-F559 AromaticContact CZ3-CD1 3.51Å; W556-F559 HydrophobicContact CZ3-CD1 3.51Å; W556-F559 AromaticContact CZ3-CE1 3.75Å; W556-F559 HydrophobicContact CZ3-CE1 3.75Å; W556-F559 PolarHBondContact O-N 2.7Å; F559-L561 PolarHBondContact O-N 2.82Å; F559-I562 PolarHBondContact O-N 3.46Å; F559-V563 HydrophobicContact CD1-CG2 4.44Å; F559-V563 HydrophobicContact CD2-CG2 4.25Å; F559-V563 HydrophobicContact CE1-CG2 4.05Å; F559-V563 HydrophobicContact CE2-CG2 3.84Å; F559-V563 HydrophobicContact CZ-CG2 3.74Å; F559-V563 WeakPolarHBondContact O-CG2 3.35Å; F559-V563 PolarHBondContact O-N 3.49Å
560	A	89	Confident	87.6	Confident	4 Å²	4	65 Å²	65	3%	0.033	35%	0.35	C	S	.	.	H	α-helix	trans	-60.6	-44.2	178.8	0	0	0	0	0	112	F535 W556 W557 I562 V563 I564	F535-A560 HydrophobicContact CD2-CB 3.93Å; W556-A560 WeakPolarHBondContact O-CB 3.25Å; W556-A560 PolarHBondContact O-N 2.81Å; W557-A560 PolarHBondContact O-N 2.77Å; A560-I562 PolarHBondContact O-N 2.66Å; A560-V563 PolarHBondContact O-N 2.86Å; A560-I564 HydrophobicContact CB-CD1 4.5Å; A560-I564 WeakPolarHBondContact O-CB 3.2Å; A560-I564 VanDerWaalsContact O-CD1 3.24Å; A560-I564 WeakPolarHBondContact O-CD1 3.39Å; A560-I564 WeakPolarHBondContact O-CG1 3.35Å; A560-I564 PolarHBondContact O-N 2.64Å
561	L	89	Confident	87.7	Confident	98 Å²	98	59.3 Å²	59.3	51%	0.513	33%	0.331	S	S	.	.	H	α-helix	trans	-58.7	-46.2	176.6	-173.1	160.8	0	0	0	111.3	W557 F559 S565	W557-L561 VanDerWaalsContact O-CB 3.25Å; W557-L561 WeakPolarHBondContact O-CB 3.42Å; W557-L561 PolarHBondContact O-N 2.86Å; F559-L561 PolarHBondContact O-N 2.82Å; L561-S565 WeakPolarHBondContact O-CB 3.41Å; L561-S565 PolarHBondContact O-N 3.08Å; L561-S565 PolarHBondContact O-OG 3.46Å
562	I	91.3	Very high	87.4	Confident	92 Å²	92	55.6 Å²	55.6	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-51.9	177.5	-69.7	165.5	0	0	0	110.6	L558 F559 A560 I564 S565 S566	L558-I562 HydrophobicContact CD1-CD1 4.1Å; L558-I562 HydrophobicContact CG-CD1 4.04Å; L558-I562 WeakPolarHBondContact O-CD1 3.18Å; L558-I562 VanDerWaalsContact O-CG1 3.25Å; L558-I562 WeakPolarHBondContact O-CG1 3.45Å; L558-I562 PolarHBondContact O-N 3.33Å; L558-I562 VanDerWaalsContact O-N 3.08Å; F559-I562 PolarHBondContact O-N 3.46Å; A560-I562 PolarHBondContact O-N 2.66Å; I562-I564 VanDerWaalsContact C-N 3.34Å; I562-I564 PolarHBondContact O-N 3.39Å; I562-S565 PolarHBondContact O-N 3.12Å; I562-S566 PolarHBondContact O-N 3.29Å; I562-S566 PolarHBondContact O-OG 2.93Å
563	V	90.5	Very high	87.2	Confident	21 Å²	21	55.8 Å²	55.8	13%	0.127	33%	0.33	C	S	.	.	H	α-helix	trans	-58	-44.6	-178.6	171	0	0	0	0	111.7	F484 I492 F535 F559 A560 S566 Y567	F484-V563 HydrophobicContact CE2-CG1 4.03Å; F484-V563 HydrophobicContact CZ-CG1 4.4Å; F484-V563 WeakPolarHBondContact CZ-O 3.38Å; I492-V563 HydrophobicContact CD1-CG1 3.81Å; I492-V563 HydrophobicContact CG1-CG1 4.38Å; F535-V563 HydrophobicContact CE2-CB 4.49Å; F535-V563 HydrophobicContact CE2-CG1 4.2Å; F535-V563 HydrophobicContact CZ-CG1 4.02Å; F559-V563 HydrophobicContact CD1-CG2 4.44Å; F559-V563 HydrophobicContact CD2-CG2 4.25Å; F559-V563 HydrophobicContact CE1-CG2 4.05Å; F559-V563 HydrophobicContact CE2-CG2 3.84Å; F559-V563 HydrophobicContact CZ-CG2 3.74Å; F559-V563 WeakPolarHBondContact O-CG2 3.35Å; F559-V563 PolarHBondContact O-N 3.49Å; A560-V563 PolarHBondContact O-N 2.86Å; V563-S566 PolarHBondContact O-N 2.72Å; V563-Y567 WeakPolarHBondContact O-CB 3.37Å; V563-Y567 PolarHBondContact O-N 3.42Å
564	I	89.6	Confident	86.9	Confident	37 Å²	37	60.4 Å²	60.4	19%	0.19	35%	0.35	C	S	.	.	H	α-helix	trans	-70.8	-37.8	-178.4	-63.3	159.3	0	0	0	111	F535 Q537 A560 I562 Y567 T568	F535-I564 WeakPolarHBondContact O-CD1 3.37Å; Q537-I564 HydrophobicContact CG-CD1 3.78Å; A560-I564 HydrophobicContact CB-CD1 4.5Å; A560-I564 WeakPolarHBondContact O-CB 3.2Å; A560-I564 VanDerWaalsContact O-CD1 3.24Å; A560-I564 WeakPolarHBondContact O-CD1 3.39Å; A560-I564 WeakPolarHBondContact O-CG1 3.35Å; A560-I564 PolarHBondContact O-N 2.64Å; I562-I564 VanDerWaalsContact C-N 3.34Å; I562-I564 PolarHBondContact O-N 3.39Å; I564-Y567 PolarHBondContact O-N 3.01Å; I564-T568 WeakPolarHBondContact O-CG2 3.47Å; I564-T568 PolarHBondContact O-N 3.36Å; I564-T568 PolarHBondContact O-OG1 3.26Å
565	S	89.4	Confident	86.4	Confident	58 Å²	58	61.2 Å²	61.2	41%	0.406	35%	0.346	S	S	.	.	H	α-helix	trans	-68	-36.8	177.1	-57.5	0	0	0	0	111.9	L561 I562 T568 A569	L561-S565 WeakPolarHBondContact O-CB 3.41Å; L561-S565 PolarHBondContact O-N 3.08Å; L561-S565 PolarHBondContact O-OG 3.46Å; I562-S565 PolarHBondContact O-N 3.12Å; S565-T568 PolarHBondContact O-OG1 2.94Å; S565-A569 VanDerWaalsContact O-CB 3.31Å; S565-A569 WeakPolarHBondContact O-CB 3.44Å; S565-A569 PolarHBondContact O-N 3.06Å; S565-A569 VanDerWaalsContact O-N 3.15Å
566	S	90.7	Very high	85.4	Confident	52 Å²	52	63.6 Å²	63.6	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-67.8	-39.4	170.9	-64.6	0	0	0	0	112.2	I562 V563 N570	I562-S566 PolarHBondContact O-N 3.29Å; I562-S566 PolarHBondContact O-OG 2.93Å; V563-S566 PolarHBondContact O-N 2.72Å; S566-N570 WeakPolarHBondContact O-CB 3.47Å; S566-N570 PolarHBondContact O-N 3.46Å
567	Y	90.5	Very high	84.3	Confident	56 Å²	56	67.6 Å²	67.6	22%	0.22	38%	0.376	C	S	.	.	H	α-helix	trans	-62.7	-48.7	176.5	174.1	-100	0	0	0	112	C480 P483 F484 W489 V563 I564 A569 N570 L571	C480-Y567 WeakPolarHBondContact O-CE2 3.49Å; C480-Y567 PolarHBondContact O-OH 3.4Å; P483-Y567 HydrophobicContact CB-CD2 4.02Å; P483-Y567 HydrophobicContact CB-CE2 4.1Å; P483-Y567 HydrophobicContact CG-CD2 4.34Å; P483-Y567 HydrophobicContact CG-CE2 3.93Å; F484-Y567 HydrophobicContact CD2-CD2 4.17Å; F484-Y567 HydrophobicContact CE2-CD2 4.07Å; F484-Y567 HydrophobicContact CE2-CG 4.34Å; W489-Y567 HydrophobicContact CH2-CD2 4.49Å; W489-Y567 HydrophobicContact CH2-CE2 4.33Å; W489-Y567 HydrophobicContact CZ2-CD2 4.37Å; W489-Y567 HydrophobicContact CZ2-CE2 4.1Å; V563-Y567 WeakPolarHBondContact O-CB 3.37Å; V563-Y567 PolarHBondContact O-N 3.42Å; I564-Y567 PolarHBondContact O-N 3.01Å; Y567-A569 PolarHBondContact O-N 2.85Å; Y567-N570 PolarHBondContact O-N 2.65Å; Y567-L571 HydrophobicContact CE1-CD2 4.04Å; Y567-L571 VanDerWaalsContact O-CB 3.26Å; Y567-L571 WeakPolarHBondContact O-CB 3.19Å; Y567-L571 PolarHBondContact O-N 3.29Å
568	T	89	Confident	82.8	Confident	78 Å²	78	66.7 Å²	66.7	48%	0.479	38%	0.384	S	S	.	.	H	α-helix	trans	-67.1	-36.8	-180	54.6	0	0	0	0	112.3	I564 S565 A572	I564-T568 WeakPolarHBondContact O-CG2 3.47Å; I564-T568 PolarHBondContact O-N 3.36Å; I564-T568 PolarHBondContact O-OG1 3.26Å; S565-T568 PolarHBondContact O-OG1 2.94Å; T568-A572 WeakPolarHBondContact O-CB 3.46Å; T568-A572 PolarHBondContact O-N 3.28Å
569	A	88.1	Confident	81.1	Confident	57 Å²	57	70.4 Å²	70.4	47%	0.471	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-49.2	173.2	0	0	0	0	0	112.3	S565 Y567 L571 A572 A573	S565-A569 VanDerWaalsContact O-CB 3.31Å; S565-A569 WeakPolarHBondContact O-CB 3.44Å; S565-A569 PolarHBondContact O-N 3.06Å; S565-A569 VanDerWaalsContact O-N 3.15Å; Y567-A569 PolarHBondContact O-N 2.85Å; A569-L571 PolarHBondContact O-N 3.11Å; A569-A572 PolarHBondContact O-N 3.47Å; A569-A573 PolarHBondContact O-N 2.74Å
570	N	86.4	Confident	79.4	Confident	76 Å²	76	71.3 Å²	71.3	41%	0.406	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-40.7	178.3	-77.4	7.9	0	0	0	111.9	P483 S566 Y567 A573 F574	P483-N570 HydrophobicContact CB-CB 3.82Å; P483-N570 PolarHBondContact O-ND2 3.22Å; S566-N570 WeakPolarHBondContact O-CB 3.47Å; S566-N570 PolarHBondContact O-N 3.46Å; Y567-N570 PolarHBondContact O-N 2.65Å; N570-A573 PolarHBondContact O-N 3.5Å; N570-F574 WeakPolarHBondContact O-CB 3.3Å; N570-F574 PolarHBondContact O-N 3.13Å
571	L	82.7	Confident	77.7	Confident	30 Å²	30	77.2 Å²	77.2	16%	0.157	43%	0.425	C	S	.	.	H	α-helix	trans	-63.9	-41.9	177.1	-178.1	62.5	0	0	0	111.7	P483 Y567 A569 F574 L575	P483-L571 HydrophobicContact CG-CB 3.91Å; P483-L571 HydrophobicContact CG-CD1 3.83Å; P483-L571 HydrophobicContact CG-CG 4.45Å; Y567-L571 HydrophobicContact CE1-CD2 4.04Å; Y567-L571 VanDerWaalsContact O-CB 3.26Å; Y567-L571 WeakPolarHBondContact O-CB 3.19Å; Y567-L571 PolarHBondContact O-N 3.29Å; A569-L571 PolarHBondContact O-N 3.11Å; L571-F574 PolarHBondContact O-N 3.47Å; L571-L575 HydrophobicContact CD1-CD1 4.04Å; L571-L575 HydrophobicContact CD1-CG 4.16Å; L571-L575 HydrophobicContact CG-CD1 4Å; L571-L575 HydrophobicContact CG-CG 4.49Å; L571-L575 WeakPolarHBondContact O-CB 3.43Å; L571-L575 VanDerWaalsContact O-CG 3.3Å; L571-L575 WeakPolarHBondContact O-CG 3.38Å; L571-L575 PolarHBondContact O-N 2.84Å
572	A	78.1	Confident	76.3	Confident	56 Å²	56	74.5 Å²	74.5	46%	0.463	41%	0.414	S	S	.	.	H	α-helix	trans	-65.2	-39	175.5	0	0	0	0	0	112.4	T568 A569 T576	T568-A572 WeakPolarHBondContact O-CB 3.46Å; T568-A572 PolarHBondContact O-N 3.28Å; A569-A572 PolarHBondContact O-N 3.47Å; A572-T576 WeakPolarHBondContact O-CG2 3.43Å; A572-T576 PolarHBondContact O-N 2.82Å; A572-T576 PolarHBondContact O-OG1 2.9Å
573	A	78.8	Confident	75	Confident	45 Å²	45	75.1 Å²	75.1	37%	0.372	43%	0.426	S	S	.	.	H	α-helix	trans	-65.6	-42.1	173.4	0	0	0	0	0	112.1	A569 N570 T576 I577	A569-A573 PolarHBondContact O-N 2.74Å; N570-A573 PolarHBondContact O-N 3.5Å; A573-T576 PolarHBondContact O-N 3.13Å; A573-T576 PolarHBondContact O-OG1 3.45Å; A573-T576 VanDerWaalsContact O-OG1 3.09Å; A573-I577 WeakPolarHBondContact O-CB 3.43Å; A573-I577 VanDerWaalsContact O-CG1 3.26Å; A573-I577 WeakPolarHBondContact O-CG1 3.36Å; A573-I577 PolarHBondContact O-N 3.42Å; A573-I577 VanDerWaalsContact O-N 3.11Å
574	F	74.5	Confident	74.4	Confident	98 Å²	98	74.4 Å²	74.4	43%	0.43	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-44.8	178.4	-167.8	-98.1	0	0	0	112.1	A479 A482 N570 L571 T576 I577	A479-F574 HydrophobicContact CB-CE1 4.25Å; A482-F574 HydrophobicContact CB-CE1 4.39Å; A482-F574 HydrophobicContact CB-CE2 4.47Å; A482-F574 HydrophobicContact CB-CZ 4.16Å; N570-F574 WeakPolarHBondContact O-CB 3.3Å; N570-F574 PolarHBondContact O-N 3.13Å; L571-F574 PolarHBondContact O-N 3.47Å; F574-T576 VanDerWaalsContact C-N 3.29Å; F574-T576 PolarHBondContact O-N 2.92Å; F574-I577 PolarHBondContact O-N 3.42Å
575	L	73.4	Confident	73.9	Confident	50 Å²	50	79.8 Å²	79.8	26%	0.262	45%	0.446	S	S	.	.	H	α-helix	trans	-68.8	-22.9	178.8	-69.8	173.7	0	0	0	114	L571 L745	L571-L575 HydrophobicContact CD1-CD1 4.04Å; L571-L575 HydrophobicContact CD1-CG 4.16Å; L571-L575 HydrophobicContact CG-CD1 4Å; L571-L575 HydrophobicContact CG-CG 4.49Å; L571-L575 WeakPolarHBondContact O-CB 3.43Å; L571-L575 VanDerWaalsContact O-CG 3.3Å; L571-L575 WeakPolarHBondContact O-CG 3.38Å; L571-L575 PolarHBondContact O-N 2.84Å; L575-L745 HydrophobicContact CB-CD2 4.22Å; L575-L745 HydrophobicContact CD1-CD2 4.21Å; L575-L745 HydrophobicContact CD2-CD2 4.17Å; L575-L745 HydrophobicContact CG-CD2 4.44Å
576	T	67.6	Low	73.6	Confident	112 Å²	112	78.9 Å²	78.9	69%	0.687	44%	0.44	S	S	*	.	H	α-helix	trans	-88.1	-22.6	175	47.2	0	0	0	0	113.1	A572 A573 F574 T578	A572-T576 WeakPolarHBondContact O-CG2 3.43Å; A572-T576 PolarHBondContact O-N 2.82Å; A572-T576 PolarHBondContact O-OG1 2.9Å; A573-T576 PolarHBondContact O-N 3.13Å; A573-T576 PolarHBondContact O-OG1 3.45Å; A573-T576 VanDerWaalsContact O-OG1 3.09Å; F574-T576 VanDerWaalsContact C-N 3.29Å; F574-T576 PolarHBondContact O-N 2.92Å; T576-T578 PolarHBondContact O-N 3.15Å
577	I	64.1	Low	73.2	Confident	95 Å²	95	77 Å²	77	49%	0.487	43%	0.425	S	S	.	.			trans	-98.4	80	179.1	-59.7	169.5	0	0	0	109.4	A573 F574 R579	A573-I577 WeakPolarHBondContact O-CB 3.43Å; A573-I577 VanDerWaalsContact O-CG1 3.26Å; A573-I577 WeakPolarHBondContact O-CG1 3.36Å; A573-I577 PolarHBondContact O-N 3.42Å; A573-I577 VanDerWaalsContact O-N 3.11Å; F574-I577 PolarHBondContact O-N 3.42Å; I577-R579 HydrophobicContact CG2-CB 4.39Å; I577-R579 HydrophobicContact CG2-CG 3.74Å; I577-R579 PolarHBondContact O-N 3.15Å
578	T	57.3	Low	73	Confident	104 Å²	104	78.3 Å²	78.3	64%	0.638	43%	0.434	S	S	*	.			trans	-73.2	77.7	167.1	62.8	0	0	0	0	110.1	T576 I580	T576-T578 PolarHBondContact O-N 3.15Å; T578-I580 PolarHBondContact O-N 2.84Å
579	R	53.5	Low	72.8	Confident	185 Å²	185	77.1 Å²	77.1	70%	0.698	42%	0.424	S	S	*	.			trans	-62	98.3	177.7	-105.6	159.7	-175.5	-123.3	10	110.7	I577 E581	I577-R579 HydrophobicContact CG2-CB 4.39Å; I577-R579 HydrophobicContact CG2-CG 3.74Å; I577-R579 PolarHBondContact O-N 3.15Å; R579-E581 VanDerWaalsContact C-N 3.27Å; R579-E581 HydrophobicContact CB-CG 4.12Å; R579-E581 VanDerWaalsContact CD-OE1 3.23Å; R579-E581 WeakPolarHBondContact CD-OE1 3.43Å; R579-E581 HydrophobicContact CG-CG 4.12Å; R579-E581 IonicContact CZ-OE1 2.76Å; R579-E581 IonicContact NE-OE1 2.68Å; R579-E581 IonicContact NH1-OE1 3.52Å; R579-E581 PolarHBondContact NH1-OE1 2.85Å; R579-E581 PolarHBondContact O-N 2.83Å
580	I	54.2	Low	72.7	Confident	93 Å²	93	74.4 Å²	74.4	48%	0.477	40%	0.402	S	S	.	.			trans	-82.3	82.9	160.6	-54.5	176	0	0	0	106	T578 S582	T578-I580 PolarHBondContact O-N 2.84Å; I580-S582 PolarHBondContact O-N 2.83Å
581	E	53.9	Low	72.7	Confident	128 Å²	128	71.1 Å²	71.1	60%	0.598	39%	0.385	S	S	*	.			trans	-75.8	88.9	176.6	-76.4	-178.3	-170.8	0	0	110.2	R579 S583	R579-E581 VanDerWaalsContact C-N 3.27Å; R579-E581 HydrophobicContact CB-CG 4.12Å; R579-E581 VanDerWaalsContact CD-OE1 3.23Å; R579-E581 WeakPolarHBondContact CD-OE1 3.43Å; R579-E581 HydrophobicContact CG-CG 4.12Å; R579-E581 IonicContact CZ-OE1 2.76Å; R579-E581 IonicContact NE-OE1 2.68Å; R579-E581 IonicContact NH1-OE1 3.52Å; R579-E581 PolarHBondContact NH1-OE1 2.85Å; R579-E581 PolarHBondContact O-N 2.83Å; E581-S583 PolarHBondContact O-N 3.49Å; E581-S583 VanDerWaalsContact O-N 3.1Å
582	S	58.7	Low	72.9	Confident	42 Å²	42	75 Å²	75	29%	0.294	40%	0.4	S	S	.	.			trans	-66.5	102.6	160.2	43.9	0	0	0	0	108.8	I580 I584	I580-S582 PolarHBondContact O-N 2.83Å; S582-I584 PolarHBondContact O-N 2.71Å; S582-I584 VanDerWaalsContact O-N 3.17Å
583	S	64.4	Low	73.3	Confident	104 Å²	104	74 Å²	74	73%	0.727	39%	0.386	S	S	*	.	S	Bend	trans	-64	-15.3	-179.5	54.4	0	0	0	0	114.1	E581	E581-S583 PolarHBondContact O-N 3.49Å; E581-S583 VanDerWaalsContact O-N 3.1Å
584	I	77.7	Confident	73.5	Confident	6 Å²	6	76.7 Å²	76.7	3%	0.031	40%	0.398	C	S	.	.			trans	-122.7	118.8	178	-51.1	-179.4	0	0	0	107.9	L468 S582 D589 L590 Q593 I596 I680	L468-I584 HydrophobicContact CD2-CD1 4.01Å; S582-I584 PolarHBondContact O-N 2.71Å; S582-I584 VanDerWaalsContact O-N 3.17Å; I584-D589 HydrophobicContact CG2-CB 4.34Å; I584-L590 HydrophobicContact CD1-CD1 3.79Å; I584-L590 HydrophobicContact CG2-CB 4Å; I584-Q593 HydrophobicContact CD1-CG 4.09Å; I584-I596 HydrophobicContact CD1-CD1 3.98Å; I584-I680 HydrophobicContact CB-CD1 4.12Å; I584-I680 HydrophobicContact CG2-CD1 3.58Å; I584-I680 WeakPolarHBondContact O-CD1 3.35Å
585	Q	79.6	Confident	74	Confident	150 Å²	150	80.2 Å²	80.2	70%	0.701	42%	0.416	S	S	*	.			trans	-121.1	-15.6	177.4	-61.8	-175.4	5.4	0	0	112.8	I680	Q585-I680 WeakPolarHBondContact O-CG2 3.37Å
586	S	83	Confident	74.7	Confident	39 Å²	39	79.2 Å²	79.2	27%	0.273	41%	0.411	S	S	.	.	S	Bend	trans	-134	158.4	177.1	82.8	0	0	0	0	112.3	Q588 D589 L590	S586-Q588 PolarHBondContact O-N 3.01Å; S586-Q588 PolarHBondContact OG-N 3.19Å; S586-D589 WeakPolarHBondContact CB-OD2 3.48Å; S586-D589 PolarHBondContact N-OD2 2.99Å; S586-D589 PolarHBondContact O-N 2.84Å; S586-D589 VanDerWaalsContact O-N 3.09Å; S586-D589 PolarHBondContact OG-N 3.21Å; S586-D589 PolarHBondContact OG-OD2 2.79Å; S586-L590 PolarHBondContact O-N 3.24Å
587	L	82	Confident	75.8	Confident	12 Å²	12	75.7 Å²	75.7	6%	0.063	39%	0.39	C	S	.	.	H	α-helix	trans	-59.6	-28.6	172.9	-168.7	63.5	0	0	0	112.3	V466 L590 S591 M623 M627	V466-L587 HydrophobicContact CG2-CD1 3.45Å; V466-L587 VanDerWaalsContact CG2-CD1 3.45Å; L587-L590 HydrophobicContact CD1-CD2 4.23Å; L587-S591 PolarHBondContact O-N 3.07Å; L587-S591 VanDerWaalsContact O-N 3.14Å; L587-M623 HydrophobicContact CB-SD 3.94Å; L587-M623 HydrophobicContact CD2-CE 3.73Å; L587-M623 HydrophobicContact CD2-SD 4.01Å; L587-M623 HydrophobicContact CG-CE 4.2Å; L587-M623 HydrophobicContact CG-SD 3.8Å; L587-M627 HydrophobicContact CD1-CE 3.73Å; L587-M627 HydrophobicContact CD1-SD 3.95Å; L587-M627 HydrophobicContact CD2-CE 4.44Å; L587-M627 HydrophobicContact CD2-SD 4.14Å; L587-M627 HydrophobicContact CG-CE 4.25Å; L587-M627 HydrophobicContact CG-SD 3.85Å
588	Q	85	Confident	77.1	Confident	84 Å²	84	71.4 Å²	71.4	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-73.7	-27.1	177.8	-152.4	-159.9	50.6	0	0	112.3	S586 S591 K592 M623	S586-Q588 PolarHBondContact O-N 3.01Å; S586-Q588 PolarHBondContact OG-N 3.19Å; Q588-S591 PolarHBondContact O-OG 2.84Å; Q588-K592 WeakPolarHBondContact O-CD 3.48Å; Q588-K592 WeakPolarHBondContact O-CE 3.47Å; Q588-K592 WeakPolarHBondContact O-CG 3.47Å; Q588-K592 PolarHBondContact O-N 2.82Å; Q588-K592 VanDerWaalsContact OE1-CE 3.24Å; Q588-M623 HydrophobicContact CB-SD 4.08Å; Q588-M623 HydrophobicContact CG-CB 4.34Å; Q588-M623 HydrophobicContact CG-CG 4.37Å; Q588-M623 HydrophobicContact CG-SD 4.35Å
589	D	85.6	Confident	78.7	Confident	53 Å²	53	66.4 Å²	66.4	28%	0.283	34%	0.337	S	S	.	.	H	α-helix	trans	-78.9	-35.4	176.2	-53.8	-46.5	0	0	0	110.7	I584 S586 S591 K592 Q593	I584-D589 HydrophobicContact CG2-CB 4.34Å; S586-D589 WeakPolarHBondContact CB-OD2 3.48Å; S586-D589 PolarHBondContact N-OD2 2.99Å; S586-D589 PolarHBondContact O-N 2.84Å; S586-D589 VanDerWaalsContact O-N 3.09Å; S586-D589 PolarHBondContact OG-N 3.21Å; S586-D589 PolarHBondContact OG-OD2 2.79Å; D589-S591 VanDerWaalsContact C-N 3.3Å; D589-S591 PolarHBondContact O-N 3.47Å; D589-K592 PolarHBondContact O-N 3.28Å; D589-K592 IonicContact OD1-NZ 3.52Å; D589-K592 PolarHBondContact OD1-NZ 2.9Å; D589-Q593 WeakPolarHBondContact O-CG 3.43Å; D589-Q593 PolarHBondContact O-N 3.14Å
590	L	86.7	Confident	80.5	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-60	-36.9	169.2	-173.2	72	0	0	0	112.4	V466 I584 S586 L587 Q593 Y598 A657 V659	V466-L590 HydrophobicContact CB-CD2 4.38Å; V466-L590 HydrophobicContact CG1-CD2 3.79Å; V466-L590 HydrophobicContact CG2-CD2 3.84Å; I584-L590 HydrophobicContact CD1-CD1 3.79Å; I584-L590 HydrophobicContact CG2-CB 4Å; S586-L590 PolarHBondContact O-N 3.24Å; L587-L590 HydrophobicContact CD1-CD2 4.23Å; L590-Q593 PolarHBondContact O-NE2 2.86Å; L590-Y598 HydrophobicContact CD1-CD1 3.9Å; L590-Y598 HydrophobicContact CD1-CE1 4.48Å; L590-Y598 HydrophobicContact CD1-CG 4.48Å; L590-Y598 HydrophobicContact CD2-CD1 4.3Å; L590-Y598 HydrophobicContact CD2-CG 4.22Å; L590-Y598 HydrophobicContact CG-CD1 3.81Å; L590-Y598 HydrophobicContact CG-CE1 4.09Å; L590-Y598 HydrophobicContact CG-CG 4.25Å; L590-Y598 WeakPolarHBondContact O-CE1 3.37Å; L590-A657 HydrophobicContact CD1-CB 3.99Å; L590-V659 HydrophobicContact CD2-CG2 4.44Å
591	S	86.4	Confident	82.2	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-74	-30.6	179.2	86.5	0	0	0	0	113.7	L587 Q588 D589 Q626	L587-S591 PolarHBondContact O-N 3.07Å; L587-S591 VanDerWaalsContact O-N 3.14Å; Q588-S591 PolarHBondContact O-OG 2.84Å; D589-S591 VanDerWaalsContact C-N 3.3Å; D589-S591 PolarHBondContact O-N 3.47Å; S591-Q626 PolarHBondContact O-OE1 2.93Å; S591-Q626 PolarHBondContact OG-OE1 2.27Å
592	K	86.1	Confident	83.6	Confident	111 Å²	111	50.2 Å²	50.2	48%	0.483	27%	0.269	S	S	.	.	H	α-helix	trans	-72.7	-40.4	178.2	-68.8	161	-155.9	158.3	0	112.2	Q588 D589	Q588-K592 WeakPolarHBondContact O-CD 3.48Å; Q588-K592 WeakPolarHBondContact O-CE 3.47Å; Q588-K592 WeakPolarHBondContact O-CG 3.47Å; Q588-K592 PolarHBondContact O-N 2.82Å; Q588-K592 VanDerWaalsContact OE1-CE 3.24Å; D589-K592 PolarHBondContact O-N 3.28Å; D589-K592 IonicContact OD1-NZ 3.52Å; D589-K592 PolarHBondContact OD1-NZ 2.9Å
593	Q	85.7	Confident	84.5	Confident	36 Å²	36	53.4 Å²	53.4	17%	0.168	28%	0.283	C	S	.	.			trans	-79.1	159.2	-179	71.5	75.4	44.6	0	0	112.1	I584 D589 L590 I596	I584-Q593 HydrophobicContact CD1-CG 4.09Å; D589-Q593 WeakPolarHBondContact O-CG 3.43Å; D589-Q593 PolarHBondContact O-N 3.14Å; L590-Q593 PolarHBondContact O-NE2 2.86Å; Q593-I596 PolarHBondContact NE2-O 2.99Å
594	T	84.4	Confident	85.4	Confident	102 Å²	102	49.1 Å²	49.1	63%	0.626	25%	0.253	S	S	*	.			trans	-136.9	10.8	179.8	56.6	0	0	0	0	113.9
595	E	85.6	Confident	85.5	Confident	172 Å²	172	49.9 Å²	49.9	80%	0.804	26%	0.261	S	S	*	.	S	Bend	trans	-84.4	-39.4	-178.1	-62	-176.1	164.9	0	0	111.4	P597	E595-P597 WeakPolarHBondContact O-CD 3.27Å
596	I	88	Confident	85.8	Confident	28 Å²	28	43 Å²	43	14%	0.144	23%	0.228	C	C	.	.	S	Bend	trans	-94.8	111.9	174.4	-52.4	-173.2	0	0	0	108	L468 I584 Q593 A657	L468-I596 HydrophobicContact CD2-CD1 4.5Å; I584-I596 HydrophobicContact CD1-CD1 3.98Å; Q593-I596 PolarHBondContact NE2-O 2.99Å; I596-A657 HydrophobicContact CG2-CB 3.96Å
597	P	89.9	Confident	86	Confident	39 Å²	39	42.6 Å²	42.6	25%	0.253	22%	0.221	S	C	.	.			trans	-66.6	145.3	171.7	28.1	-34.3	0	0	0	110.9	E595 M630 N655 Y656 A657	E595-P597 WeakPolarHBondContact O-CD 3.27Å; P597-M630 HydrophobicContact CB-CE 4Å; P597-N655 WeakPolarHBondContact CD-O 3.41Å; P597-N655 WeakPolarHBondContact CG-O 3.35Å; P597-Y656 HydrophobicContact CB-CD2 4.44Å; P597-Y656 HydrophobicContact CG-CD2 4.36Å; P597-Y656 WeakPolarHBondContact O-CA 3.26Å; P597-Y656 WeakPolarHBondContact O-CD2 3.23Å; P597-A657 PolarHBondContact O-N 3.05Å
598	Y	90.9	Very high	86.1	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.7	178.6	55.5	-97.3	0	0	0	111.9	L590 M627 M630 I631 A657 V659	L590-Y598 HydrophobicContact CD1-CD1 3.9Å; L590-Y598 HydrophobicContact CD1-CE1 4.48Å; L590-Y598 HydrophobicContact CD1-CG 4.48Å; L590-Y598 HydrophobicContact CD2-CD1 4.3Å; L590-Y598 HydrophobicContact CD2-CG 4.22Å; L590-Y598 HydrophobicContact CG-CD1 3.81Å; L590-Y598 HydrophobicContact CG-CE1 4.09Å; L590-Y598 HydrophobicContact CG-CG 4.25Å; L590-Y598 WeakPolarHBondContact O-CE1 3.37Å; Y598-M627 HydrophobicContact CE2-CB 4.09Å; Y598-M627 HydrophobicContact CE2-CG 4.02Å; Y598-M630 HydrophobicContact CD1-CG 4.37Å; Y598-M630 HydrophobicContact CD2-CB 4.42Å; Y598-M630 HydrophobicContact CD2-CG 4.34Å; Y598-M630 HydrophobicContact CE1-CB 4.33Å; Y598-M630 HydrophobicContact CE1-CG 4.02Å; Y598-M630 HydrophobicContact CE2-CB 3.68Å; Y598-M630 HydrophobicContact CE2-CG 3.98Å; Y598-I631 HydrophobicContact CD2-CD1 4.49Å; Y598-I631 HydrophobicContact CD2-CG1 4.25Å; Y598-I631 HydrophobicContact CE2-CG1 4.43Å; Y598-A657 WeakPolarHBondContact CA-O 3.22Å; Y598-A657 WeakPolarHBondContact CB-O 3.28Å; Y598-V659 HydrophobicContact CD2-CG2 4.44Å
599	G	91.7	Very high	86	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	177.7	-172.8	0	0	0	0	0	111.5	Y656 A657 V659	G599-Y656 WeakPolarHBondContact CA-OH 3.26Å; G599-Y656 PolarHBondContact N-OH 3.22Å; G599-Y656 PolarHBondContact O-OH 3.49Å; G599-A657 PolarHBondContact N-O 3.08Å; G599-V659 PolarHBondContact O-N 3.1Å
600	T	91.7	Very high	86	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.202	C	C	.	.			trans	-137.9	-172.4	-178.3	-167	0	0	0	0	110.8	V606 Y607 I631 N640 V641 V659	T600-V606 VanDerWaalsContact OG1-CG1 3.3Å; T600-V606 WeakPolarHBondContact OG1-CG1 3.24Å; T600-Y607 HydrophobicContact CG2-CD2 3.85Å; T600-Y607 HydrophobicContact CG2-CG 4.34Å; T600-I631 HydrophobicContact CG2-CG2 4.46Å; T600-N640 PolarHBondContact N-OD1 2.56Å; T600-N640 CarbonylContact O-C 3.6Å; T600-N640 VanDerWaalsContact O-CA 3.25Å; T600-N640 WeakPolarHBondContact O-CA 3.42Å; T600-N640 WeakPolarHBondContact O-CB 3.32Å; T600-N640 PolarHBondContact O-OD1 3.44Å; T600-V641 PolarHBondContact O-N 2.97Å; T600-V659 WeakPolarHBondContact CB-O 3.47Å; T600-V659 PolarHBondContact OG1-O 3.17Å
601	V	88.6	Confident	86	Confident	11 Å²	11	43.6 Å²	43.6	7%	0.067	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-82.8	135.3	173.2	-169.9	0	0	0	0	109.7	S604 Y607 V641 L642 F658 W660	V601-S604 VanDerWaalsContact O-CB 3.25Å; V601-S604 WeakPolarHBondContact O-CB 3.28Å; V601-S604 PolarHBondContact O-OG 3.48Å; V601-Y607 WeakPolarHBondContact O-CB 3.41Å; V601-V641 CarbonylContact C-O 3.26Å; V601-V641 WeakPolarHBondContact CA-O 3.19Å; V601-V641 HydrophobicContact CG2-CG2 3.98Å; V601-L642 WeakPolarHBondContact CG1-O 3.27Å; V601-F658 HydrophobicContact CG2-CE2 4.03Å; V601-F658 HydrophobicContact CG2-CZ 3.79Å; V601-W660 HydrophobicContact CB-CE3 4.15Å; V601-W660 HydrophobicContact CB-CH2 3.67Å; V601-W660 HydrophobicContact CB-CZ3 3.43Å; V601-W660 VanDerWaalsContact CB-CZ3 3.43Å; V601-W660 HydrophobicContact CG1-CH2 4.46Å; V601-W660 HydrophobicContact CG2-CD2 4.11Å; V601-W660 HydrophobicContact CG2-CE3 3.63Å; V601-W660 HydrophobicContact CG2-CH2 3.51Å; V601-W660 HydrophobicContact CG2-CZ2 3.97Å; V601-W660 HydrophobicContact CG2-CZ3 3.33Å
602	L	84.3	Confident	85.8	Confident	55 Å²	55	48.2 Å²	48.2	29%	0.288	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	156.3	174.6	-65.7	174	0	0	0	111.9	S604 Y607 N640 V641 L642	L602-S604 PolarHBondContact O-N 3.49Å; L602-Y607 HydrophobicContact CD2-CD2 4.4Å; L602-Y607 HydrophobicContact CD2-CE2 3.94Å; L602-N640 HydrophobicContact CD2-CB 3.69Å; L602-N640 HydrophobicContact CG-CB 3.88Å; L602-V641 PolarHBondContact N-O 2.92Å; L602-L642 HydrophobicContact CD1-CD2 4.1Å
603	D	78.1	Confident	85.6	Confident	108 Å²	108	44.7 Å²	44.7	58%	0.578	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	16.6	-177.6	-52.7	-17.8	0	0	0	115.8	K414	K414-D603 IonicContact NZ-OD2 3.74Å; K414-D603 PolarHBondContact NZ-OD2 3.18Å
604	S	81.6	Confident	85.5	Confident	15 Å²	15	43.6 Å²	43.6	11%	0.105	23%	0.225	C	C	.	.	S	Bend	trans	-92.6	162.2	-172.6	72	0	0	0	0	114	V601 L602 V606 Y607 E608	V601-S604 VanDerWaalsContact O-CB 3.25Å; V601-S604 WeakPolarHBondContact O-CB 3.28Å; V601-S604 PolarHBondContact O-OG 3.48Å; L602-S604 PolarHBondContact O-N 3.49Å; S604-V606 PolarHBondContact O-N 3.36Å; S604-V606 PolarHBondContact OG-N 3.34Å; S604-Y607 PolarHBondContact O-N 2.83Å; S604-Y607 WeakPolarHBondContact OG-CB 3.36Å; S604-Y607 PolarHBondContact OG-N 3.47Å; S604-E608 PolarHBondContact O-N 3.36Å
605	A	81.3	Confident	85.4	Confident	22 Å²	22	43.9 Å²	43.9	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-26.6	172.5	0	0	0	0	0	113	H609	A605-H609 VanDerWaalsContact O-CB 3.25Å; A605-H609 WeakPolarHBondContact O-CB 3.35Å; A605-H609 PolarHBondContact O-N 3.23Å; A605-H609 VanDerWaalsContact O-N 3.11Å
606	V	85.8	Confident	85.1	Confident	4 Å²	4	39 Å²	39	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-73.1	-48.5	174.1	-178.3	0	0	0	0	110.4	Y462 V464 T600 S604 E608 H609 V610 V659 W660	Y462-V606 VanDerWaalsContact OH-CG2 3.31Å; Y462-V606 WeakPolarHBondContact OH-CG2 3.45Å; V464-V606 HydrophobicContact CG1-CG1 4.09Å; V464-V606 HydrophobicContact CG2-CG1 4.48Å; T600-V606 VanDerWaalsContact OG1-CG1 3.3Å; T600-V606 WeakPolarHBondContact OG1-CG1 3.24Å; S604-V606 PolarHBondContact O-N 3.36Å; S604-V606 PolarHBondContact OG-N 3.34Å; V606-E608 VanDerWaalsContact C-N 3.34Å; V606-E608 PolarHBondContact O-N 3.48Å; V606-H609 PolarHBondContact O-N 3.03Å; V606-V610 PolarHBondContact O-N 3.09Å; V606-V659 HydrophobicContact CG1-CG1 4.15Å; V606-W660 HydrophobicContact CB-CE3 4.16Å; V606-W660 HydrophobicContact CB-CZ3 4.15Å; V606-W660 HydrophobicContact CG2-CD2 4.45Å; V606-W660 HydrophobicContact CG2-CE3 3.74Å; V606-W660 HydrophobicContact CG2-CZ3 3.89Å
607	Y	86.3	Confident	84.3	Confident	32 Å²	32	43.4 Å²	43.4	13%	0.125	23%	0.232	C	C	.	.	H	α-helix	trans	-56.8	-48	176.5	-176.9	-98.9	0	0	0	111.2	T600 V601 L602 S604 H609 V610 R611 W628 I631	T600-Y607 HydrophobicContact CG2-CD2 3.85Å; T600-Y607 HydrophobicContact CG2-CG 4.34Å; V601-Y607 WeakPolarHBondContact O-CB 3.41Å; L602-Y607 HydrophobicContact CD2-CD2 4.4Å; L602-Y607 HydrophobicContact CD2-CE2 3.94Å; S604-Y607 PolarHBondContact O-N 2.83Å; S604-Y607 WeakPolarHBondContact OG-CB 3.36Å; S604-Y607 PolarHBondContact OG-N 3.47Å; Y607-H609 PolarHBondContact O-N 2.76Å; Y607-V610 PolarHBondContact O-N 2.99Å; Y607-R611 VanDerWaalsContact O-CB 3.29Å; Y607-R611 WeakPolarHBondContact O-CB 3.17Å; Y607-R611 PolarHBondContact O-N 2.86Å; Y607-W628 HydrophobicContact CD2-CZ3 4.2Å; Y607-W628 HydrophobicContact CE1-CH2 4.15Å; Y607-W628 HydrophobicContact CE1-CZ3 4.4Å; Y607-W628 HydrophobicContact CE2-CH2 4.03Å; Y607-W628 AromaticContact CE2-CZ3 3.77Å; Y607-W628 HydrophobicContact CE2-CZ3 3.77Å; Y607-W628 AromaticContact CZ-CH2 3.68Å; Y607-W628 AromaticContact CZ-CZ3 3.89Å; Y607-I631 HydrophobicContact CD2-CG2 4.03Å; Y607-I631 HydrophobicContact CE2-CG2 4Å
608	E	84	Confident	83.3	Confident	57 Å²	57	50.8 Å²	50.8	27%	0.266	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-38.3	178.5	-166.2	56.1	-134.2	0	0	112.6	S604 V606 R611 M612	S604-E608 PolarHBondContact O-N 3.36Å; V606-E608 VanDerWaalsContact C-N 3.34Å; V606-E608 PolarHBondContact O-N 3.48Å; E608-R611 VanDerWaalsContact CD-NE 3.29Å; E608-R611 PolarHBondContact O-N 3.05Å; E608-R611 IonicContact OE1-CZ 2.66Å; E608-R611 IonicContact OE1-NE 2.71Å; E608-R611 PolarHBondContact OE1-NE 3.2Å; E608-R611 IonicContact OE1-NH2 3.7Å; E608-R611 PolarHBondContact OE1-NH2 3.34Å; E608-R611 IonicContact OE2-CZ 3.51Å; E608-R611 IonicContact OE2-NE 2.8Å; E608-R611 PolarHBondContact OE2-NE 3.41Å; E608-R611 IonicContact OE2-NH1 2.83Å; E608-R611 IonicContact OE2-NH2 3.16Å; E608-R611 PolarHBondContact OE2-NH2 3.37Å; E608-M612 HydrophobicContact CG-CG 4.38Å; E608-M612 WeakPolarHBondContact O-CB 3.43Å; E608-M612 WeakPolarHBondContact O-CG 3.11Å; E608-M612 PolarHBondContact O-N 3.23Å; E608-M612 WeakPolarHBondContact OE1-CG 3.44Å
609	H	83.5	Confident	82	Confident	11 Å²	11	53.5 Å²	53.5	5%	0.051	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-44.7	176.7	-170.1	85.5	0	0	0	111.9	A605 V606 Y607 K613 D686 R687	A605-H609 VanDerWaalsContact O-CB 3.25Å; A605-H609 WeakPolarHBondContact O-CB 3.35Å; A605-H609 PolarHBondContact O-N 3.23Å; A605-H609 VanDerWaalsContact O-N 3.11Å; V606-H609 PolarHBondContact O-N 3.03Å; Y607-H609 PolarHBondContact O-N 2.76Å; H609-K613 VanDerWaalsContact CE1-CE 3.46Å; H609-K613 WeakPolarHBondContact CE1-CE 3.47Å; H609-K613 PolarHBondContact CE1-NZ 3.18Å; H609-K613 WeakPolarHBondContact NE2-CE 3.49Å; H609-K613 PolarHBondContact NE2-NZ 3.48Å; H609-K613 WeakPolarHBondContact O-CB 3.46Å; H609-K613 WeakPolarHBondContact O-CG 3.15Å; H609-K613 PolarHBondContact O-N 3.47Å; H609-K613 VanDerWaalsContact O-N 3.1Å; H609-D686 IonicContact CE1-OD2 3.42Å; H609-R687 VanDerWaalsContact ND1-CZ 3.33Å; H609-R687 PolarHBondContact ND1-NH2 3.44Å
610	V	85.8	Confident	80.4	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-73.8	-32.8	177.8	-177.4	0	0	0	0	111.6	V606 Y607 G614 M627 W628 I631	V606-V610 PolarHBondContact O-N 3.09Å; Y607-V610 PolarHBondContact O-N 2.99Å; V610-G614 WeakPolarHBondContact O-CA 3.39Å; V610-G614 PolarHBondContact O-N 3.2Å; V610-M627 HydrophobicContact CG1-CB 4.11Å; V610-W628 HydrophobicContact CG1-CB 4.26Å; V610-W628 HydrophobicContact CG1-CE3 4.49Å; V610-I631 HydrophobicContact CB-CD1 4.42Å; V610-I631 HydrophobicContact CG1-CD1 3.8Å
611	R	86.2	Confident	79	Confident	102 Å²	102	69.2 Å²	69.2	39%	0.385	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-54.7	172.2	-177.1	172.2	85.3	158.7	4.6	111.4	Y607 E608 G614 L615 W628	Y607-R611 VanDerWaalsContact O-CB 3.29Å; Y607-R611 WeakPolarHBondContact O-CB 3.17Å; Y607-R611 PolarHBondContact O-N 2.86Å; E608-R611 VanDerWaalsContact CD-NE 3.29Å; E608-R611 PolarHBondContact O-N 3.05Å; E608-R611 IonicContact OE1-CZ 2.66Å; E608-R611 IonicContact OE1-NE 2.71Å; E608-R611 PolarHBondContact OE1-NE 3.2Å; E608-R611 IonicContact OE1-NH2 3.7Å; E608-R611 PolarHBondContact OE1-NH2 3.34Å; E608-R611 IonicContact OE2-CZ 3.51Å; E608-R611 IonicContact OE2-NE 2.8Å; E608-R611 PolarHBondContact OE2-NE 3.41Å; E608-R611 IonicContact OE2-NH1 2.83Å; E608-R611 IonicContact OE2-NH2 3.16Å; E608-R611 PolarHBondContact OE2-NH2 3.37Å; R611-G614 PolarHBondContact O-N 3.25Å; R611-L615 HydrophobicContact CG-CD1 3.78Å; R611-L615 WeakPolarHBondContact O-CB 3.07Å; R611-L615 VanDerWaalsContact O-CG 3.26Å; R611-L615 WeakPolarHBondContact O-CG 3.31Å; R611-L615 PolarHBondContact O-N 2.78Å; R611-L615 VanDerWaalsContact O-N 3.09Å; R611-W628 HydrophobicContact CB-CD2 4.4Å; R611-W628 HydrophobicContact CB-CE3 4.04Å; R611-W628 HydrophobicContact CB-CH2 3.73Å; R611-W628 HydrophobicContact CB-CZ2 4.09Å; R611-W628 HydrophobicContact CB-CZ3 3.69Å; R611-W628 HydrophobicContact CG-CH2 3.65Å; R611-W628 HydrophobicContact CG-CZ2 3.61Å; R611-W628 HydrophobicContact CG-CZ3 4.14Å
612	M	83	Confident	78.5	Confident	102 Å²	102	71.9 Å²	71.9	50%	0.502	36%	0.358	S	S	.	.	H	α-helix	trans	-61.7	-53.5	-178.6	-71	-72	-83.4	0	0	111.1	E608 G614 L615 N616	E608-M612 HydrophobicContact CG-CG 4.38Å; E608-M612 WeakPolarHBondContact O-CB 3.43Å; E608-M612 WeakPolarHBondContact O-CG 3.11Å; E608-M612 PolarHBondContact O-N 3.23Å; E608-M612 WeakPolarHBondContact OE1-CG 3.44Å; M612-G614 VanDerWaalsContact C-N 3.3Å; M612-G614 PolarHBondContact O-N 3.14Å; M612-L615 PolarHBondContact O-N 3.04Å; M612-N616 PolarHBondContact O-N 3.46Å; M612-N616 VanDerWaalsContact O-N 3.08Å; M612-N616 PolarHBondContact O-ND2 2.95Å; M612-N616 PolarHBondContact O-OD1 3.45Å
613	K	82.4	Confident	78.5	Confident	37 Å²	37	70.1 Å²	70.1	16%	0.161	35%	0.348	C	S	.	.	H	α-helix	trans	-64.7	-32	179.5	-68.1	-169.4	166.4	173.4	0	113.4	H609 E619 Y624 D686	H609-K613 VanDerWaalsContact CE1-CE 3.46Å; H609-K613 WeakPolarHBondContact CE1-CE 3.47Å; H609-K613 PolarHBondContact CE1-NZ 3.18Å; H609-K613 WeakPolarHBondContact NE2-CE 3.49Å; H609-K613 PolarHBondContact NE2-NZ 3.48Å; H609-K613 WeakPolarHBondContact O-CB 3.46Å; H609-K613 WeakPolarHBondContact O-CG 3.15Å; H609-K613 PolarHBondContact O-N 3.47Å; H609-K613 VanDerWaalsContact O-N 3.1Å; K613-E619 WeakPolarHBondContact CA-OE2 3.36Å; K613-E619 WeakPolarHBondContact CB-OE1 3.35Å; K613-E619 WeakPolarHBondContact CD-OE1 3.45Å; K613-E619 VanDerWaalsContact CG-OE1 3.28Å; K613-E619 WeakPolarHBondContact CG-OE1 3.49Å; K613-E619 WeakPolarHBondContact CG-OE2 3.46Å; K613-Y624 HydrophobicContact CB-CD1 4.2Å; K613-Y624 HydrophobicContact CB-CD2 3.96Å; K613-Y624 HydrophobicContact CB-CG 3.75Å; K613-Y624 HydrophobicContact CD-CD2 4.04Å; K613-Y624 HydrophobicContact CD-CE1 4.34Å; K613-Y624 HydrophobicContact CD-CE2 3.83Å; K613-Y624 HydrophobicContact CD-CG 4.39Å; K613-D686 IonicContact NZ-OD2 3.43Å; K613-D686 PolarHBondContact NZ-OD2 3.31Å
614	G	82.6	Confident	78.8	Confident	13 Å²	13	65.9 Å²	65.9	13%	0.134	32%	0.324	C	S	.	.	H	α-helix	trans	-76	-17.4	177.2	0	0	0	0	0	115.1	V610 R611 M612	V610-G614 WeakPolarHBondContact O-CA 3.39Å; V610-G614 PolarHBondContact O-N 3.2Å; R611-G614 PolarHBondContact O-N 3.25Å; M612-G614 VanDerWaalsContact C-N 3.3Å; M612-G614 PolarHBondContact O-N 3.14Å
615	L	82.8	Confident	79	Confident	109 Å²	109	67.9 Å²	67.9	57%	0.571	34%	0.338	S	S	*	.	H	α-helix	trans	-103.6	-17.6	178.6	-69.5	170.9	0	0	0	113.7	R611 M612 P617	R611-L615 HydrophobicContact CG-CD1 3.78Å; R611-L615 WeakPolarHBondContact O-CB 3.07Å; R611-L615 VanDerWaalsContact O-CG 3.26Å; R611-L615 WeakPolarHBondContact O-CG 3.31Å; R611-L615 PolarHBondContact O-N 2.78Å; R611-L615 VanDerWaalsContact O-N 3.09Å; M612-L615 PolarHBondContact O-N 3.04Å; L615-P617 WeakPolarHBondContact O-CD 3.47Å
616	N	79.2	Confident	79.3	Confident	69 Å²	69	69.9 Å²	69.9	37%	0.369	34%	0.344	S	S	.	.			trans	-62	111.2	-179.2	-80.9	-24.7	0	0	0	113.1	M612 F618 E619	M612-N616 PolarHBondContact O-N 3.46Å; M612-N616 VanDerWaalsContact O-N 3.08Å; M612-N616 PolarHBondContact O-ND2 2.95Å; M612-N616 PolarHBondContact O-OD1 3.45Å; N616-F618 PolarHBondContact O-N 3.09Å; N616-F618 VanDerWaalsContact O-N 3.14Å; N616-E619 HydrophobicContact CB-CB 3.71Å; N616-E619 PolarHBondContact ND2-OE2 3.45Å; N616-E619 PolarHBondContact O-N 2.85Å
617	P	71.4	Confident	79.4	Confident	120 Å²	120	69.7 Å²	69.7	78%	0.779	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.6	-178.9	-19.4	34.2	0	0	0	114.5	L615	L615-P617 WeakPolarHBondContact O-CD 3.47Å
618	F	68.8	Low	79.5	Confident	194 Å²	194	69.2 Å²	69.2	85%	0.851	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-11.5	180	-57.8	-74.7	0	0	0	113.2	N616	N616-F618 PolarHBondContact O-N 3.09Å; N616-F618 VanDerWaalsContact O-N 3.14Å
619	E	64	Low	79.7	Confident	61 Å²	61	75.4 Å²	75.4	29%	0.285	36%	0.362	S	S	.	.			trans	-83.8	121.1	-175.7	-162.2	156.5	169.7	0	0	109.7	K613 N616 D621	K613-E619 WeakPolarHBondContact CA-OE2 3.36Å; K613-E619 WeakPolarHBondContact CB-OE1 3.35Å; K613-E619 WeakPolarHBondContact CD-OE1 3.45Å; K613-E619 VanDerWaalsContact CG-OE1 3.28Å; K613-E619 WeakPolarHBondContact CG-OE1 3.49Å; K613-E619 WeakPolarHBondContact CG-OE2 3.46Å; N616-E619 HydrophobicContact CB-CB 3.71Å; N616-E619 PolarHBondContact ND2-OE2 3.45Å; N616-E619 PolarHBondContact O-N 2.85Å; E619-D621 VanDerWaalsContact C-N 3.33Å; E619-D621 PolarHBondContact O-N 3.08Å
620	R	56.2	Low	79.9	Confident	245 Å²	245	76 Å²	76	93%	0.925	37%	0.365	S	S	*	.			trans	-79.5	-13.4	-168.3	-67.8	-177.5	179.6	168.8	0.8	114.2	S622	R620-S622 PolarHBondContact O-N 3.11Å
621	D	63.6	Low	80.1	Confident	86 Å²	86	75.9 Å²	75.9	46%	0.46	36%	0.364	S	S	.	.			trans	-81.6	106.4	-178.2	-86.6	-47	0	0	0	111.7	E619 M623 Y624	E619-D621 VanDerWaalsContact C-N 3.33Å; E619-D621 PolarHBondContact O-N 3.08Å; D621-M623 PolarHBondContact O-N 3.47Å; D621-M623 VanDerWaalsContact O-N 3.07Å; D621-Y624 HydrophobicContact CB-CD2 4.39Å; D621-Y624 PolarHBondContact O-N 2.93Å
622	S	76.8	Confident	80.2	Confident	67 Å²	67	74 Å²	74	47%	0.469	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-13.3	170	54.5	0	0	0	0	113.6	R620 S625 Q626	R620-S622 PolarHBondContact O-N 3.11Å; S622-S625 PolarHBondContact O-OG 3.22Å; S622-Q626 VanDerWaalsContact O-CB 3.29Å; S622-Q626 WeakPolarHBondContact O-CB 3.23Å; S622-Q626 WeakPolarHBondContact O-CG 3.43Å; S622-Q626 PolarHBondContact O-N 3.12Å
623	M	84.4	Confident	80.3	Confident	18 Å²	18	75.9 Å²	75.9	9%	0.089	36%	0.363	C	S	.	.	H	α-helix	trans	-60.1	-55.4	176.1	-174.8	-174.5	74.4	0	0	112.3	L587 Q588 D621 S625 Q626 M627	L587-M623 HydrophobicContact CB-SD 3.94Å; L587-M623 HydrophobicContact CD2-CE 3.73Å; L587-M623 HydrophobicContact CD2-SD 4.01Å; L587-M623 HydrophobicContact CG-CE 4.2Å; L587-M623 HydrophobicContact CG-SD 3.8Å; Q588-M623 HydrophobicContact CB-SD 4.08Å; Q588-M623 HydrophobicContact CG-CB 4.34Å; Q588-M623 HydrophobicContact CG-CG 4.37Å; Q588-M623 HydrophobicContact CG-SD 4.35Å; D621-M623 PolarHBondContact O-N 3.47Å; D621-M623 VanDerWaalsContact O-N 3.07Å; M623-S625 PolarHBondContact O-N 3.45Å; M623-Q626 PolarHBondContact O-N 3.43Å; M623-M627 HydrophobicContact CG-SD 4.06Å; M623-M627 WeakPolarHBondContact O-CB 3.4Å; M623-M627 VanDerWaalsContact O-CG 3.31Å; M623-M627 WeakPolarHBondContact O-CG 3.45Å; M623-M627 PolarHBondContact O-N 2.84Å
624	Y	85.3	Confident	80.3	Confident	19 Å²	19	76.4 Å²	76.4	8%	0.075	37%	0.371	C	S	.	.	H	α-helix	trans	-68.5	-33.8	-174.8	-71.1	-68.1	0	0	0	112.6	K613 D621 M627 W628	K613-Y624 HydrophobicContact CB-CD1 4.2Å; K613-Y624 HydrophobicContact CB-CD2 3.96Å; K613-Y624 HydrophobicContact CB-CG 3.75Å; K613-Y624 HydrophobicContact CD-CD2 4.04Å; K613-Y624 HydrophobicContact CD-CE1 4.34Å; K613-Y624 HydrophobicContact CD-CE2 3.83Å; K613-Y624 HydrophobicContact CD-CG 4.39Å; D621-Y624 HydrophobicContact CB-CD2 4.39Å; D621-Y624 PolarHBondContact O-N 2.93Å; Y624-M627 HydrophobicContact CD1-SD 4.48Å; Y624-M627 PolarHBondContact O-N 3.2Å; Y624-W628 VanDerWaalsContact O-CB 3.25Å; Y624-W628 WeakPolarHBondContact O-CB 3.28Å; Y624-W628 PolarHBondContact O-N 3.15Å
625	S	86.6	Confident	80	Confident	57 Å²	57	82.8 Å²	82.8	40%	0.399	40%	0.402	S	S	.	.	H	α-helix	trans	-72.3	-35.6	175.2	49.9	0	0	0	0	112.7	S622 M623 R629	S622-S625 PolarHBondContact O-OG 3.22Å; M623-S625 PolarHBondContact O-N 3.45Å; S625-R629 WeakPolarHBondContact O-CB 3.43Å; S625-R629 PolarHBondContact O-N 3.43Å; S625-R629 VanDerWaalsContact O-N 3.1Å
626	Q	87	Confident	79.6	Confident	63 Å²	63	77.6 Å²	77.6	29%	0.294	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-47.3	168.2	-76.8	170.6	-1.7	0	0	111.6	S591 S622 M623 R629 M630	S591-Q626 PolarHBondContact O-OE1 2.93Å; S591-Q626 PolarHBondContact OG-OE1 2.27Å; S622-Q626 VanDerWaalsContact O-CB 3.29Å; S622-Q626 WeakPolarHBondContact O-CB 3.23Å; S622-Q626 WeakPolarHBondContact O-CG 3.43Å; S622-Q626 PolarHBondContact O-N 3.12Å; M623-Q626 PolarHBondContact O-N 3.43Å; Q626-R629 PolarHBondContact O-N 3.21Å; Q626-M630 PolarHBondContact O-N 2.83Å
627	M	88	Confident	79.3	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-61.1	-47.8	178.6	-74	178.4	69.9	0	0	111.8	L587 Y598 V610 M623 Y624 R629 M630 I631 V659	L587-M627 HydrophobicContact CD1-CE 3.73Å; L587-M627 HydrophobicContact CD1-SD 3.95Å; L587-M627 HydrophobicContact CD2-CE 4.44Å; L587-M627 HydrophobicContact CD2-SD 4.14Å; L587-M627 HydrophobicContact CG-CE 4.25Å; L587-M627 HydrophobicContact CG-SD 3.85Å; Y598-M627 HydrophobicContact CE2-CB 4.09Å; Y598-M627 HydrophobicContact CE2-CG 4.02Å; V610-M627 HydrophobicContact CG1-CB 4.11Å; M623-M627 HydrophobicContact CG-SD 4.06Å; M623-M627 WeakPolarHBondContact O-CB 3.4Å; M623-M627 VanDerWaalsContact O-CG 3.31Å; M623-M627 WeakPolarHBondContact O-CG 3.45Å; M623-M627 PolarHBondContact O-N 2.84Å; Y624-M627 HydrophobicContact CD1-SD 4.48Å; Y624-M627 PolarHBondContact O-N 3.2Å; M627-R629 VanDerWaalsContact C-N 3.29Å; M627-R629 PolarHBondContact O-N 3.24Å; M627-M630 PolarHBondContact O-N 3.44Å; M627-I631 HydrophobicContact CB-CD1 4.35Å; M627-I631 WeakPolarHBondContact O-CB 3.49Å; M627-I631 WeakPolarHBondContact O-CG1 3.41Å; M627-I631 PolarHBondContact O-N 3.15Å; M627-V659 HydrophobicContact CE-CG1 4.14Å; M627-V659 HydrophobicContact CE-CG2 4.24Å
628	W	88.9	Confident	79.7	Confident	22 Å²	22	79 Å²	79	8%	0.083	38%	0.38	C	S	.	.	H	α-helix	trans	-59.8	-38.5	177.6	-179.2	-121.9	0	0	0	112.1	Y607 V610 R611 Y624 M630 I631 N632	Y607-W628 HydrophobicContact CD2-CZ3 4.2Å; Y607-W628 HydrophobicContact CE1-CH2 4.15Å; Y607-W628 HydrophobicContact CE1-CZ3 4.4Å; Y607-W628 HydrophobicContact CE2-CH2 4.03Å; Y607-W628 AromaticContact CE2-CZ3 3.77Å; Y607-W628 HydrophobicContact CE2-CZ3 3.77Å; Y607-W628 AromaticContact CZ-CH2 3.68Å; Y607-W628 AromaticContact CZ-CZ3 3.89Å; V610-W628 HydrophobicContact CG1-CB 4.26Å; V610-W628 HydrophobicContact CG1-CE3 4.49Å; R611-W628 HydrophobicContact CB-CD2 4.4Å; R611-W628 HydrophobicContact CB-CE3 4.04Å; R611-W628 HydrophobicContact CB-CH2 3.73Å; R611-W628 HydrophobicContact CB-CZ2 4.09Å; R611-W628 HydrophobicContact CB-CZ3 3.69Å; R611-W628 HydrophobicContact CG-CH2 3.65Å; R611-W628 HydrophobicContact CG-CZ2 3.61Å; R611-W628 HydrophobicContact CG-CZ3 4.14Å; Y624-W628 VanDerWaalsContact O-CB 3.25Å; Y624-W628 WeakPolarHBondContact O-CB 3.28Å; Y624-W628 PolarHBondContact O-N 3.15Å; W628-M630 VanDerWaalsContact C-N 3.25Å; W628-M630 PolarHBondContact O-N 3.14Å; W628-I631 HydrophobicContact CE3-CB 4.37Å; W628-I631 HydrophobicContact CE3-CG2 3.96Å; W628-I631 HydrophobicContact CZ3-CG2 3.89Å; W628-I631 PolarHBondContact O-N 2.99Å; W628-N632 HydrophobicContact CD2-CB 4.04Å; W628-N632 HydrophobicContact CE3-CB 4.27Å; W628-N632 HydrophobicContact CH2-CB 3.94Å; W628-N632 HydrophobicContact CZ2-CB 3.69Å; W628-N632 HydrophobicContact CZ3-CB 4.24Å; W628-N632 VanDerWaalsContact O-CB 3.24Å; W628-N632 WeakPolarHBondContact O-CB 3.4Å; W628-N632 PolarHBondContact O-N 2.94Å
629	R	87.9	Confident	80.5	Confident	187 Å²	187	70.3 Å²	70.3	71%	0.706	34%	0.343	S	S	*	.	H	α-helix	trans	-63.4	-28.2	175.2	-168.9	-177.8	67	145.1	2.1	113.4	S625 Q626 M627 R633	S625-R629 WeakPolarHBondContact O-CB 3.43Å; S625-R629 PolarHBondContact O-N 3.43Å; S625-R629 VanDerWaalsContact O-N 3.1Å; Q626-R629 PolarHBondContact O-N 3.21Å; M627-R629 VanDerWaalsContact C-N 3.29Å; M627-R629 PolarHBondContact O-N 3.24Å; R629-R633 PolarHBondContact O-N 3.27Å
630	M	87.7	Confident	81.7	Confident	22 Å²	22	68 Å²	68	11%	0.108	33%	0.332	C	S	.	.	H	α-helix	trans	-85	-42.2	174.3	-167.5	62.2	168.3	0	0	111.8	P597 Y598 Q626 M627 W628 R633 N639	P597-M630 HydrophobicContact CB-CE 4Å; Y598-M630 HydrophobicContact CD1-CG 4.37Å; Y598-M630 HydrophobicContact CD2-CB 4.42Å; Y598-M630 HydrophobicContact CD2-CG 4.34Å; Y598-M630 HydrophobicContact CE1-CB 4.33Å; Y598-M630 HydrophobicContact CE1-CG 4.02Å; Y598-M630 HydrophobicContact CE2-CB 3.68Å; Y598-M630 HydrophobicContact CE2-CG 3.98Å; Q626-M630 PolarHBondContact O-N 2.83Å; M627-M630 PolarHBondContact O-N 3.44Å; W628-M630 VanDerWaalsContact C-N 3.25Å; W628-M630 PolarHBondContact O-N 3.14Å; M630-R633 WeakPolarHBondContact O-CB 3.31Å; M630-R633 PolarHBondContact O-N 2.85Å; M630-N639 PolarHBondContact O-ND2 3.11Å
631	I	89.8	Confident	83.3	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.9	-38.4	178.6	-74.9	162	0	0	0	112	Y598 T600 Y607 V610 M627 W628 G636 N640	Y598-I631 HydrophobicContact CD2-CD1 4.49Å; Y598-I631 HydrophobicContact CD2-CG1 4.25Å; Y598-I631 HydrophobicContact CE2-CG1 4.43Å; T600-I631 HydrophobicContact CG2-CG2 4.46Å; Y607-I631 HydrophobicContact CD2-CG2 4.03Å; Y607-I631 HydrophobicContact CE2-CG2 4Å; V610-I631 HydrophobicContact CB-CD1 4.42Å; V610-I631 HydrophobicContact CG1-CD1 3.8Å; M627-I631 HydrophobicContact CB-CD1 4.35Å; M627-I631 WeakPolarHBondContact O-CB 3.49Å; M627-I631 WeakPolarHBondContact O-CG1 3.41Å; M627-I631 PolarHBondContact O-N 3.15Å; W628-I631 HydrophobicContact CE3-CB 4.37Å; W628-I631 HydrophobicContact CE3-CG2 3.96Å; W628-I631 HydrophobicContact CZ3-CG2 3.89Å; W628-I631 PolarHBondContact O-N 2.99Å; I631-G636 WeakPolarHBondContact O-CA 3.47Å; I631-N640 PolarHBondContact O-ND2 2.92Å
632	N	88.3	Confident	84.3	Confident	62 Å²	62	60 Å²	60	33%	0.332	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	14.1	177.2	-168.4	32.2	0	0	0	113	W628	W628-N632 HydrophobicContact CD2-CB 4.04Å; W628-N632 HydrophobicContact CE3-CB 4.27Å; W628-N632 HydrophobicContact CH2-CB 3.94Å; W628-N632 HydrophobicContact CZ2-CB 3.69Å; W628-N632 HydrophobicContact CZ3-CB 4.24Å; W628-N632 VanDerWaalsContact O-CB 3.24Å; W628-N632 WeakPolarHBondContact O-CB 3.4Å; W628-N632 PolarHBondContact O-N 2.94Å
633	R	85.3	Confident	84.7	Confident	142 Å²	142	63 Å²	63	54%	0.536	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-58.1	141.8	165.3	-174	173	178.2	154.5	-0.6	108.5	R629 M630 N635 G636	R629-R633 PolarHBondContact O-N 3.27Å; M630-R633 WeakPolarHBondContact O-CB 3.31Å; M630-R633 PolarHBondContact O-N 2.85Å; R633-N635 VanDerWaalsContact C-N 3.25Å; R633-N635 PolarHBondContact O-N 2.61Å; R633-G636 WeakPolarHBondContact O-CA 3.38Å; R633-G636 PolarHBondContact O-N 2.98Å
634	S	81.4	Confident	84.9	Confident	47 Å²	47	63.2 Å²	63.2	33%	0.329	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	49	43	179.3	50	0	0	0	0	114	G636 S637 E638	S634-G636 PolarHBondContact O-N 3.14Å; S634-G636 VanDerWaalsContact O-N 3.16Å; S634-S637 PolarHBondContact O-N 3.37Å; S634-S637 VanDerWaalsContact O-N 3.14Å; S634-S637 PolarHBondContact O-OG 2.91Å; S634-E638 VanDerWaalsContact CB-OE2 3.26Å; S634-E638 WeakPolarHBondContact CB-OE2 3.49Å; S634-E638 WeakPolarHBondContact OG-CB 3.47Å; S634-E638 WeakPolarHBondContact OG-CG 3.2Å; S634-E638 PolarHBondContact OG-OE2 2.9Å
635	N	76.4	Confident	85	Confident	147 Å²	147	66.2 Å²	66.2	79%	0.786	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	52.1	30.2	-173.8	-64.5	1.1	0	0	0	113.6	R633 S637	R633-N635 VanDerWaalsContact C-N 3.25Å; R633-N635 PolarHBondContact O-N 2.61Å; N635-S637 VanDerWaalsContact C-N 3.31Å; N635-S637 PolarHBondContact O-N 2.72Å
636	G	74.4	Confident	85.2	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.01	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	79.4	1	179.6	0	0	0	0	0	116	I631 R633 S634 N640	I631-G636 WeakPolarHBondContact O-CA 3.47Å; R633-G636 WeakPolarHBondContact O-CA 3.38Å; R633-G636 PolarHBondContact O-N 2.98Å; S634-G636 PolarHBondContact O-N 3.14Å; S634-G636 VanDerWaalsContact O-N 3.16Å; G636-N640 VanDerWaalsContact CA-ND2 3.27Å; G636-N640 WeakPolarHBondContact CA-ND2 3.31Å; G636-N640 WeakPolarHBondContact O-CB 3.43Å; G636-N640 PolarHBondContact O-N 2.86Å; G636-N640 PolarHBondContact O-ND2 2.72Å
637	S	73.8	Confident	85.4	Confident	95 Å²	95	62.5 Å²	62.5	66%	0.664	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-30.1	-169.7	61.5	0	0	0	0	115.6	S634 N635	S634-S637 PolarHBondContact O-N 3.37Å; S634-S637 VanDerWaalsContact O-N 3.14Å; S634-S637 PolarHBondContact O-OG 2.91Å; N635-S637 VanDerWaalsContact C-N 3.31Å; N635-S637 PolarHBondContact O-N 2.72Å
638	E	79.1	Confident	85.5	Confident	122 Å²	122	63.2 Å²	63.2	57%	0.57	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-40.7	-179.3	-67.3	171.3	143.3	0	0	112.7	S634 K650	S634-E638 VanDerWaalsContact CB-OE2 3.26Å; S634-E638 WeakPolarHBondContact CB-OE2 3.49Å; S634-E638 WeakPolarHBondContact OG-CB 3.47Å; S634-E638 WeakPolarHBondContact OG-CG 3.2Å; S634-E638 PolarHBondContact OG-OE2 2.9Å; E638-K650 PolarHBondContact O-NZ 2.85Å
639	N	85.6	Confident	85.6	Confident	13 Å²	13	67.7 Å²	67.7	7%	0.07	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-43.8	-170	-78.8	-25.7	0	0	0	113.1	M630 K650 Y656	M630-N639 PolarHBondContact O-ND2 3.11Å; N639-K650 PolarHBondContact O-NZ 3.27Å; N639-Y656 WeakPolarHBondContact O-CE2 3.14Å; N639-Y656 PolarHBondContact O-OH 3.01Å
640	N	89.6	Confident	85.8	Confident	11 Å²	11	61.9 Å²	61.9	6%	0.059	32%	0.321	C	S	.	.			trans	-78.2	176.8	-173.1	-57.8	-57.2	0	0	0	113.1	T600 L602 I631 G636	T600-N640 PolarHBondContact N-OD1 2.56Å; T600-N640 CarbonylContact O-C 3.6Å; T600-N640 VanDerWaalsContact O-CA 3.25Å; T600-N640 WeakPolarHBondContact O-CA 3.42Å; T600-N640 WeakPolarHBondContact O-CB 3.32Å; T600-N640 PolarHBondContact O-OD1 3.44Å; L602-N640 HydrophobicContact CD2-CB 3.69Å; L602-N640 HydrophobicContact CG-CB 3.88Å; I631-N640 PolarHBondContact O-ND2 2.92Å; G636-N640 VanDerWaalsContact CA-ND2 3.27Å; G636-N640 WeakPolarHBondContact CA-ND2 3.31Å; G636-N640 WeakPolarHBondContact O-CB 3.43Å; G636-N640 PolarHBondContact O-N 2.86Å; G636-N640 PolarHBondContact O-ND2 2.72Å
641	V	89.6	Confident	86	Confident	16 Å²	16	60.9 Å²	60.9	10%	0.097	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-135.3	166.9	179.1	-66.7	0	0	0	0	111	T600 V601 L602 E643 A646 K650 F658	T600-V641 PolarHBondContact O-N 2.97Å; V601-V641 CarbonylContact C-O 3.26Å; V601-V641 WeakPolarHBondContact CA-O 3.19Å; V601-V641 HydrophobicContact CG2-CG2 3.98Å; L602-V641 PolarHBondContact N-O 2.92Å; V641-E643 WeakPolarHBondContact CG2-O 3.46Å; V641-A646 HydrophobicContact CB-CB 4.35Å; V641-A646 HydrophobicContact CG1-CB 4.48Å; V641-K650 HydrophobicContact CG1-CD 4.07Å; V641-F658 HydrophobicContact CG2-CE2 3.85Å; V641-F658 HydrophobicContact CG2-CZ 4.43Å
642	L	84.8	Confident	85.9	Confident	147 Å²	147	62.9 Å²	62.9	77%	0.77	32%	0.324	S	S	*	.	S	Bend	trans	-93.1	-21	177.5	-66.7	172.2	0	0	0	113.7	V601 L602	V601-L642 WeakPolarHBondContact CG1-O 3.27Å; L602-L642 HydrophobicContact CD1-CD2 4.1Å
643	E	85.3	Confident	85.9	Confident	132 Å²	132	69 Å²	69	62%	0.617	34%	0.344	S	S	*	.	S	Bend	trans	-140.9	151.9	-177.2	-65.7	180	177.2	0	0	110.8	V641 Q645 A646 G647	V641-E643 WeakPolarHBondContact CG2-O 3.46Å; E643-Q645 PolarHBondContact O-N 3.11Å; E643-A646 HydrophobicContact CB-CB 4.47Å; E643-A646 PolarHBondContact O-N 2.92Å; E643-G647 PolarHBondContact O-N 3.15Å
644	S	88.4	Confident	85.9	Confident	22 Å²	22	63.8 Å²	63.8	15%	0.154	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-40.9	179.2	50.9	0	0	0	0	112.5	E369 A646 G647 I648	E369-S644 WeakPolarHBondContact OE1-CB 3.45Å; E369-S644 PolarHBondContact OE1-OG 3.17Å; S644-A646 PolarHBondContact O-N 2.74Å; S644-G647 WeakPolarHBondContact O-CA 3.4Å; S644-G647 PolarHBondContact O-N 3.05Å; S644-G647 VanDerWaalsContact O-N 3.1Å; S644-I648 WeakPolarHBondContact O-CG1 3.18Å; S644-I648 PolarHBondContact O-N 3.42Å
645	Q	88.1	Confident	86.2	Confident	82 Å²	82	66.8 Å²	66.8	38%	0.383	35%	0.347	S	S	.	.	H	α-helix	trans	-57.6	-42.8	174.4	-73.3	-70.6	-6.3	0	0	113	E643 G647 I648 Q649	E643-Q645 PolarHBondContact O-N 3.11Å; Q645-G647 VanDerWaalsContact C-N 3.3Å; Q645-G647 PolarHBondContact O-N 3.09Å; Q645-I648 PolarHBondContact O-N 3.03Å; Q645-Q649 WeakPolarHBondContact O-CG 3.29Å; Q645-Q649 PolarHBondContact O-N 3.17Å
646	A	90	Very high	86.9	Confident	41 Å²	41	60.2 Å²	60.2	34%	0.339	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-34.9	176.1	0	0	0	0	0	112.1	V641 E643 S644 K650	V641-A646 HydrophobicContact CB-CB 4.35Å; V641-A646 HydrophobicContact CG1-CB 4.48Å; E643-A646 HydrophobicContact CB-CB 4.47Å; E643-A646 PolarHBondContact O-N 2.92Å; S644-A646 PolarHBondContact O-N 2.74Å; A646-K650 WeakPolarHBondContact O-CB 3.34Å; A646-K650 PolarHBondContact O-N 3.28Å; A646-K650 VanDerWaalsContact O-N 3.08Å
647	G	90.4	Very high	87.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-47.3	172.1	0	0	0	0	0	112.7	E643 S644 Q645 K650 V651	E643-G647 PolarHBondContact O-N 3.15Å; S644-G647 WeakPolarHBondContact O-CA 3.4Å; S644-G647 PolarHBondContact O-N 3.05Å; S644-G647 VanDerWaalsContact O-N 3.1Å; Q645-G647 VanDerWaalsContact C-N 3.3Å; Q645-G647 PolarHBondContact O-N 3.09Å; G647-K650 WeakPolarHBondContact O-CB 3.47Å; G647-K650 PolarHBondContact O-N 2.86Å; G647-V651 PolarHBondContact O-N 2.66Å
648	I	91.1	Very high	88.6	Confident	16 Å²	16	55.7 Å²	55.7	8%	0.082	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-44.9	178.7	-64.5	156.7	0	0	0	111.2	L467 S644 Q645 K650 V651 K652 F658 V668 F677	L467-I648 HydrophobicContact CD2-CG1 4.24Å; L467-I648 HydrophobicContact CD2-CG2 4.3Å; S644-I648 WeakPolarHBondContact O-CG1 3.18Å; S644-I648 PolarHBondContact O-N 3.42Å; Q645-I648 PolarHBondContact O-N 3.03Å; I648-K650 VanDerWaalsContact C-N 3.33Å; I648-K650 PolarHBondContact O-N 3.08Å; I648-V651 PolarHBondContact O-N 2.87Å; I648-K652 PolarHBondContact O-N 3.41Å; I648-F658 HydrophobicContact CG1-CD1 4.26Å; I648-F658 HydrophobicContact CG1-CE1 4.26Å; I648-V668 HydrophobicContact CD1-CG1 4.25Å; I648-V668 HydrophobicContact CD1-CG2 3.69Å; I648-V668 HydrophobicContact CG1-CG1 4.33Å; I648-V668 HydrophobicContact CG2-CG1 3.78Å; I648-F677 HydrophobicContact CG2-CZ 4.16Å
649	Q	90.8	Very high	89.3	Confident	116 Å²	116	49.9 Å²	49.9	54%	0.542	25%	0.252	S	S	.	.	H	α-helix	trans	-62.7	-37.9	176.6	-68.7	177.9	15.2	0	0	112.3	Q645 V651 K652 Y653	Q645-Q649 WeakPolarHBondContact O-CG 3.29Å; Q645-Q649 PolarHBondContact O-N 3.17Å; Q649-V651 VanDerWaalsContact C-N 3.28Å; Q649-V651 PolarHBondContact O-N 3.25Å; Q649-K652 PolarHBondContact O-N 3.18Å; Q649-Y653 WeakPolarHBondContact O-CD2 3.27Å; Q649-Y653 PolarHBondContact O-N 3.32Å; Q649-Y653 VanDerWaalsContact O-N 3.13Å
650	K	91.3	Very high	89.6	Confident	66 Å²	66	50.1 Å²	50.1	29%	0.287	25%	0.252	S	S	.	.	H	α-helix	trans	-61.9	-33.7	175.5	-163.1	174.7	179.7	177.7	0	112	E638 N639 V641 A646 G647 I648 G654 Y656	E638-K650 PolarHBondContact O-NZ 2.85Å; N639-K650 PolarHBondContact O-NZ 3.27Å; V641-K650 HydrophobicContact CG1-CD 4.07Å; A646-K650 WeakPolarHBondContact O-CB 3.34Å; A646-K650 PolarHBondContact O-N 3.28Å; A646-K650 VanDerWaalsContact O-N 3.08Å; G647-K650 WeakPolarHBondContact O-CB 3.47Å; G647-K650 PolarHBondContact O-N 2.86Å; I648-K650 VanDerWaalsContact C-N 3.33Å; I648-K650 PolarHBondContact O-N 3.08Å; K650-G654 WeakPolarHBondContact O-CA 3.23Å; K650-G654 PolarHBondContact O-N 3.43Å; K650-G654 VanDerWaalsContact O-N 3.11Å; K650-Y656 HydrophobicContact CB-CD1 3.79Å; K650-Y656 HydrophobicContact CB-CE1 4.11Å; K650-Y656 HydrophobicContact CB-CG 4.47Å; K650-Y656 HydrophobicContact CD-CD1 3.81Å; K650-Y656 HydrophobicContact CD-CD2 4.13Å; K650-Y656 HydrophobicContact CD-CE1 3.76Å; K650-Y656 HydrophobicContact CD-CE2 4.08Å; K650-Y656 HydrophobicContact CD-CG 4Å; K650-Y656 HydrophobicContact CG-CD1 3.6Å; K650-Y656 HydrophobicContact CG-CD2 4.39Å; K650-Y656 HydrophobicContact CG-CE1 4.03Å; K650-Y656 HydrophobicContact CG-CG 3.8Å
651	V	91.6	Very high	89.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-74.4	-39.6	171.7	-176.9	0	0	0	0	112.2	L467 R469 G647 I648 Q649 Y656 F658 F677	L467-V651 HydrophobicContact CD2-CB 4.43Å; L467-V651 HydrophobicContact CD2-CG1 4.44Å; L467-V651 HydrophobicContact CD2-CG2 4.47Å; L467-V651 HydrophobicContact CG-CG1 4.33Å; R469-V651 HydrophobicContact CB-CG1 4.32Å; G647-V651 PolarHBondContact O-N 2.66Å; I648-V651 PolarHBondContact O-N 2.87Å; Q649-V651 VanDerWaalsContact C-N 3.28Å; Q649-V651 PolarHBondContact O-N 3.25Å; V651-Y656 HydrophobicContact CG2-CD1 3.78Å; V651-Y656 HydrophobicContact CG2-CE1 4.32Å; V651-F658 HydrophobicContact CG2-CB 3.45Å; V651-F658 VanDerWaalsContact CG2-CB 3.45Å; V651-F677 HydrophobicContact CB-CE1 4.15Å; V651-F677 HydrophobicContact CG1-CD1 3.93Å; V651-F677 HydrophobicContact CG1-CE1 3.83Å
652	K	88.6	Confident	89.6	Confident	43 Å²	43	49.6 Å²	49.6	19%	0.187	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-41.9	-176.5	-161.7	159	-173.9	167.8	0	112.3	R469 I648 Q649 D672 D674 F677	R469-K652 PolarHBondContact NH1-O 2.98Å; I648-K652 PolarHBondContact O-N 3.41Å; Q649-K652 PolarHBondContact O-N 3.18Å; K652-D672 IonicContact NZ-OD1 3.61Å; K652-D672 PolarHBondContact NZ-OD1 3.41Å; K652-D672 IonicContact NZ-OD2 3.03Å; K652-D674 WeakPolarHBondContact CE-OD2 3.44Å; K652-D674 IonicContact NZ-OD2 2.73Å; K652-D674 PolarHBondContact NZ-OD2 3.05Å; K652-F677 HydrophobicContact CB-CE1 4.03Å; K652-F677 HydrophobicContact CB-CZ 3.8Å; K652-F677 HydrophobicContact CD-CE2 4.41Å; K652-F677 HydrophobicContact CD-CZ 3.93Å; K652-F677 HydrophobicContact CG-CE1 4.39Å; K652-F677 HydrophobicContact CG-CZ 3.99Å
653	Y	88.6	Confident	89.9	Confident	190 Å²	190	42.8 Å²	42.8	75%	0.745	22%	0.215	S	C	*	.	H	α-helix	trans	-102.9	-14.5	-174.3	-60.9	-70	0	0	0	115.2	Q649	Q649-Y653 WeakPolarHBondContact O-CD2 3.27Å; Q649-Y653 PolarHBondContact O-N 3.32Å; Q649-Y653 VanDerWaalsContact O-N 3.13Å
654	G	85.5	Confident	90.1	Very high	33 Å²	33	36.7 Å²	36.7	34%	0.34	19%	0.187	S	C	.	.	S	Bend	trans	-123.2	163.1	-177.1	0	0	0	0	0	113.9	K650 Y656	K650-G654 WeakPolarHBondContact O-CA 3.23Å; K650-G654 PolarHBondContact O-N 3.43Å; K650-G654 VanDerWaalsContact O-N 3.11Å; G654-Y656 VanDerWaalsContact C-N 3.34Å; G654-Y656 PolarHBondContact O-N 3.43Å; G654-Y656 VanDerWaalsContact O-N 3.08Å
655	N	87.6	Confident	90.3	Very high	110 Å²	110	35.7 Å²	35.7	59%	0.588	18%	0.179	S	C	*	.	S	Bend	trans	-78.7	86.4	166.8	-175.3	28.5	0	0	0	109.1	P597	P597-N655 WeakPolarHBondContact CD-O 3.41Å; P597-N655 WeakPolarHBondContact CG-O 3.35Å
656	Y	90.8	Very high	90.3	Very high	9 Å²	9	34.3 Å²	34.3	4%	0.035	17%	0.173	C	C	.	.			trans	-150.1	147	-176.3	173.4	-102.7	0	0	0	109.6	P597 G599 N639 K650 V651 G654 F658	P597-Y656 HydrophobicContact CB-CD2 4.44Å; P597-Y656 HydrophobicContact CG-CD2 4.36Å; P597-Y656 WeakPolarHBondContact O-CA 3.26Å; P597-Y656 WeakPolarHBondContact O-CD2 3.23Å; G599-Y656 WeakPolarHBondContact CA-OH 3.26Å; G599-Y656 PolarHBondContact N-OH 3.22Å; G599-Y656 PolarHBondContact O-OH 3.49Å; N639-Y656 WeakPolarHBondContact O-CE2 3.14Å; N639-Y656 PolarHBondContact O-OH 3.01Å; K650-Y656 HydrophobicContact CB-CD1 3.79Å; K650-Y656 HydrophobicContact CB-CE1 4.11Å; K650-Y656 HydrophobicContact CB-CG 4.47Å; K650-Y656 HydrophobicContact CD-CD1 3.81Å; K650-Y656 HydrophobicContact CD-CD2 4.13Å; K650-Y656 HydrophobicContact CD-CE1 3.76Å; K650-Y656 HydrophobicContact CD-CE2 4.08Å; K650-Y656 HydrophobicContact CD-CG 4Å; K650-Y656 HydrophobicContact CG-CD1 3.6Å; K650-Y656 HydrophobicContact CG-CD2 4.39Å; K650-Y656 HydrophobicContact CG-CE1 4.03Å; K650-Y656 HydrophobicContact CG-CG 3.8Å; V651-Y656 HydrophobicContact CG2-CD1 3.78Å; V651-Y656 HydrophobicContact CG2-CE1 4.32Å; G654-Y656 VanDerWaalsContact C-N 3.34Å; G654-Y656 PolarHBondContact O-N 3.43Å; G654-Y656 VanDerWaalsContact O-N 3.08Å; Y656-F658 HydrophobicContact CD1-CB 4.42Å; Y656-F658 HydrophobicContact CE1-CB 3.82Å; Y656-F658 HydrophobicContact CE1-CD2 4.25Å; Y656-F658 HydrophobicContact CE1-CG 4.42Å
657	A	91.6	Very high	90.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.6	175.7	0	0	0	0	0	110.5	V466 L467 L468 L590 I596 P597 Y598 G599	V466-A657 HydrophobicContact CG1-CB 3.86Å; L467-A657 WeakPolarHBondContact O-CA 3.31Å; L468-A657 HydrophobicContact CD2-CB 3.8Å; L468-A657 HydrophobicContact CG-CB 3.76Å; L590-A657 HydrophobicContact CD1-CB 3.99Å; I596-A657 HydrophobicContact CG2-CB 3.96Å; P597-A657 PolarHBondContact O-N 3.05Å; Y598-A657 WeakPolarHBondContact CA-O 3.22Å; Y598-A657 WeakPolarHBondContact CB-O 3.28Å; G599-A657 PolarHBondContact N-O 3.08Å
658	F	93.3	Very high	90.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118	-173.8	-179	-136.5	0	0	0	110.9	V466 L467 V601 V641 I648 V651 Y656 W660 L665	V466-F658 CarbonylContact C-O 3.56Å; V466-F658 VanDerWaalsContact CA-O 3.31Å; V466-F658 WeakPolarHBondContact CA-O 3.35Å; L467-F658 HydrophobicContact CB-CB 4.49Å; L467-F658 PolarHBondContact N-O 2.93Å; L467-F658 PolarHBondContact O-N 2.67Å; V601-F658 HydrophobicContact CG2-CE2 4.03Å; V601-F658 HydrophobicContact CG2-CZ 3.79Å; V641-F658 HydrophobicContact CG2-CE2 3.85Å; V641-F658 HydrophobicContact CG2-CZ 4.43Å; I648-F658 HydrophobicContact CG1-CD1 4.26Å; I648-F658 HydrophobicContact CG1-CE1 4.26Å; V651-F658 HydrophobicContact CG2-CB 3.45Å; V651-F658 VanDerWaalsContact CG2-CB 3.45Å; Y656-F658 HydrophobicContact CD1-CB 4.42Å; Y656-F658 HydrophobicContact CE1-CB 3.82Å; Y656-F658 HydrophobicContact CE1-CD2 4.25Å; Y656-F658 HydrophobicContact CE1-CG 4.42Å; F658-W660 HydrophobicContact CD1-CB 4.04Å; F658-W660 HydrophobicContact CE1-CB 3.62Å; F658-W660 HydrophobicContact CE1-CD2 4.36Å; F658-W660 AromaticContact CE1-CG 3.71Å; F658-W660 HydrophobicContact CE1-CG 3.71Å; F658-W660 HydrophobicContact CE2-CB 4.34Å; F658-W660 HydrophobicContact CZ-CB 3.77Å; F658-W660 AromaticContact CZ-CD2 3.88Å; F658-W660 HydrophobicContact CZ-CD2 3.88Å; F658-W660 HydrophobicContact CZ-CE3 4.18Å; F658-W660 AromaticContact CZ-CG 3.69Å; F658-W660 HydrophobicContact CZ-CG 3.69Å; F658-L665 HydrophobicContact CD1-CD2 3.96Å; F658-L665 HydrophobicContact CE1-CD2 4.26Å
659	V	92.2	Very high	90.2	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.6	179.2	-174.1	0	0	0	0	108.7	V464 G465 V466 L590 Y598 G599 T600 V606 M627	V464-V659 HydrophobicContact CG1-CG1 3.56Å; G465-V659 WeakPolarHBondContact O-CA 3.34Å; V466-V659 HydrophobicContact CG1-CG2 4.36Å; V466-V659 HydrophobicContact CG2-CG2 4.23Å; L590-V659 HydrophobicContact CD2-CG2 4.44Å; Y598-V659 HydrophobicContact CD2-CG2 4.44Å; G599-V659 PolarHBondContact O-N 3.1Å; T600-V659 WeakPolarHBondContact CB-O 3.47Å; T600-V659 PolarHBondContact OG1-O 3.17Å; V606-V659 HydrophobicContact CG1-CG1 4.15Å; M627-V659 HydrophobicContact CE-CG1 4.14Å; M627-V659 HydrophobicContact CE-CG2 4.24Å
660	W	91.6	Very high	90	Very high	19 Å²	19	30.1 Å²	30.1	7%	0.072	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	-173.3	-173.8	-161.7	-124.4	0	0	0	112.6	G465 V601 V606 F658 A662 L665	G465-W660 PolarHBondContact N-O 3.07Å; G465-W660 PolarHBondContact O-N 2.66Å; G465-W660 VanDerWaalsContact O-O 3.14Å; V601-W660 HydrophobicContact CB-CE3 4.15Å; V601-W660 HydrophobicContact CB-CH2 3.67Å; V601-W660 HydrophobicContact CB-CZ3 3.43Å; V601-W660 VanDerWaalsContact CB-CZ3 3.43Å; V601-W660 HydrophobicContact CG1-CH2 4.46Å; V601-W660 HydrophobicContact CG2-CD2 4.11Å; V601-W660 HydrophobicContact CG2-CE3 3.63Å; V601-W660 HydrophobicContact CG2-CH2 3.51Å; V601-W660 HydrophobicContact CG2-CZ2 3.97Å; V601-W660 HydrophobicContact CG2-CZ3 3.33Å; V606-W660 HydrophobicContact CB-CE3 4.16Å; V606-W660 HydrophobicContact CB-CZ3 4.15Å; V606-W660 HydrophobicContact CG2-CD2 4.45Å; V606-W660 HydrophobicContact CG2-CE3 3.74Å; V606-W660 HydrophobicContact CG2-CZ3 3.89Å; F658-W660 HydrophobicContact CD1-CB 4.04Å; F658-W660 HydrophobicContact CE1-CB 3.62Å; F658-W660 HydrophobicContact CE1-CD2 4.36Å; F658-W660 AromaticContact CE1-CG 3.71Å; F658-W660 HydrophobicContact CE1-CG 3.71Å; F658-W660 HydrophobicContact CE2-CB 4.34Å; F658-W660 HydrophobicContact CZ-CB 3.77Å; F658-W660 AromaticContact CZ-CD2 3.88Å; F658-W660 HydrophobicContact CZ-CD2 3.88Å; F658-W660 HydrophobicContact CZ-CE3 4.18Å; F658-W660 AromaticContact CZ-CG 3.69Å; F658-W660 HydrophobicContact CZ-CG 3.69Å; W660-A662 PolarHBondContact O-N 2.97Å; W660-L665 HydrophobicContact CB-CD1 3.88Å; W660-L665 HydrophobicContact CB-CD2 4Å; W660-L665 HydrophobicContact CB-CG 3.96Å
661	D	89.9	Confident	89.7	Confident	9 Å²	9	30.8 Å²	30.8	5%	0.048	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	121	170.7	-174.3	-63	0	0	0	111.1	Y462 A663 V664 L665 Y689	Y462-D661 WeakPolarHBondContact CD2-OD2 3.35Å; Y462-D661 HydrophobicContact CE2-CB 4.44Å; Y462-D661 WeakPolarHBondContact CE2-OD2 3.47Å; D661-A663 VanDerWaalsContact C-N 3.28Å; D661-A663 PolarHBondContact O-N 2.73Å; D661-A663 WeakPolarHBondContact OD1-CA 3.45Å; D661-A663 WeakPolarHBondContact OD1-CB 3.46Å; D661-A663 PolarHBondContact OD1-N 2.88Å; D661-V664 HydrophobicContact CB-CB 4.14Å; D661-V664 HydrophobicContact CB-CG2 3.91Å; D661-V664 PolarHBondContact O-N 2.72Å; D661-V664 PolarHBondContact OD1-N 3.05Å; D661-V664 VanDerWaalsContact OD1-N 3.16Å; D661-L665 VanDerWaalsContact O-CG 3.3Å; D661-L665 WeakPolarHBondContact O-CG 3.36Å; D661-L665 PolarHBondContact O-N 3.06Å; D661-Y689 VanDerWaalsContact CG-OH 3.27Å; D661-Y689 PolarHBondContact OD1-OH 2.67Å; D661-Y689 WeakPolarHBondContact OD2-CE1 3.26Å; D661-Y689 PolarHBondContact OD2-OH 3.06Å
662	A	89.9	Confident	89.3	Confident	6 Å²	6	31.4 Å²	31.4	5%	0.05	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-33.4	-175.3	0	0	0	0	0	113.2	S463 W660 L665 E666	S463-A662 VanDerWaalsContact O-CB 3.29Å; S463-A662 WeakPolarHBondContact O-CB 3.23Å; S463-A662 PolarHBondContact O-N 2.88Å; S463-A662 WeakPolarHBondContact OG-CB 3.49Å; W660-A662 PolarHBondContact O-N 2.97Å; A662-L665 PolarHBondContact O-N 3.26Å; A662-E666 WeakPolarHBondContact O-CB 3.46Å; A662-E666 VanDerWaalsContact O-CG 3.32Å; A662-E666 WeakPolarHBondContact O-CG 3.27Å; A662-E666 PolarHBondContact O-N 3.09Å
663	A	90.4	Very high	89	Confident	5 Å²	5	34.2 Å²	34.2	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-73.2	-38.6	-177.5	0	0	0	0	0	111.5	F372 M460 D661 Y667 W724	F372-A663 HydrophobicContact CE2-CB 4.17Å; F372-A663 HydrophobicContact CZ-CB 3.92Å; M460-A663 HydrophobicContact CE-CB 3.57Å; D661-A663 VanDerWaalsContact C-N 3.28Å; D661-A663 PolarHBondContact O-N 2.73Å; D661-A663 WeakPolarHBondContact OD1-CA 3.45Å; D661-A663 WeakPolarHBondContact OD1-CB 3.46Å; D661-A663 PolarHBondContact OD1-N 2.88Å; A663-Y667 PolarHBondContact O-N 3.28Å; A663-Y667 VanDerWaalsContact O-N 3.11Å; A663-W724 HydrophobicContact CB-CZ2 3.79Å; A663-W724 PolarHBondContact O-NE1 2.75Å
664	V	91.4	Very high	88.5	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-46.3	170.6	177.7	0	0	0	0	110.2	E369 F372 D661 Y667 V668	E369-V664 HydrophobicContact CG-CG2 4Å; F372-V664 HydrophobicContact CD2-CG2 4.29Å; F372-V664 HydrophobicContact CE2-CG2 3.96Å; D661-V664 HydrophobicContact CB-CB 4.14Å; D661-V664 HydrophobicContact CB-CG2 3.91Å; D661-V664 PolarHBondContact O-N 2.72Å; D661-V664 PolarHBondContact OD1-N 3.05Å; D661-V664 VanDerWaalsContact OD1-N 3.16Å; V664-Y667 PolarHBondContact O-N 3.29Å; V664-V668 WeakPolarHBondContact O-CG2 3.21Å; V664-V668 PolarHBondContact O-N 3.24Å
665	L	91.1	Very high	88.4	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-67	-38.7	-178.9	-65.6	-176.7	0	0	0	113.3	L467 F658 W660 D661 A662 V668 A669 T679	L467-L665 HydrophobicContact CB-CD1 4.03Å; L467-L665 HydrophobicContact CB-CD2 3.78Å; L467-L665 HydrophobicContact CB-CG 4.33Å; L467-L665 HydrophobicContact CD2-CD2 4.18Å; L467-L665 HydrophobicContact CG-CD2 4.41Å; F658-L665 HydrophobicContact CD1-CD2 3.96Å; F658-L665 HydrophobicContact CE1-CD2 4.26Å; W660-L665 HydrophobicContact CB-CD1 3.88Å; W660-L665 HydrophobicContact CB-CD2 4Å; W660-L665 HydrophobicContact CB-CG 3.96Å; D661-L665 VanDerWaalsContact O-CG 3.3Å; D661-L665 WeakPolarHBondContact O-CG 3.36Å; D661-L665 PolarHBondContact O-N 3.06Å; A662-L665 PolarHBondContact O-N 3.26Å; L665-V668 PolarHBondContact O-N 2.57Å; L665-A669 WeakPolarHBondContact O-CB 3.37Å; L665-A669 PolarHBondContact O-N 2.8Å; L665-T679 HydrophobicContact CB-CG2 3.98Å; L665-T679 WeakPolarHBondContact O-CG2 3.43Å
666	E	89.1	Confident	88.2	Confident	53 Å²	53	26.3 Å²	26.3	25%	0.248	15%	0.147	C	C	.	.	H	α-helix	trans	-61.5	-43.1	172.5	-78.2	176.8	179.3	0	0	111.4	A662 A669 I670 L732	A662-E666 WeakPolarHBondContact O-CB 3.46Å; A662-E666 VanDerWaalsContact O-CG 3.32Å; A662-E666 WeakPolarHBondContact O-CG 3.27Å; A662-E666 PolarHBondContact O-N 3.09Å; E666-A669 PolarHBondContact O-N 2.72Å; E666-I670 WeakPolarHBondContact O-CB 3.25Å; E666-I670 WeakPolarHBondContact O-CD1 3.31Å; E666-I670 VanDerWaalsContact O-CG1 3.26Å; E666-I670 WeakPolarHBondContact O-CG1 3.33Å; E666-I670 PolarHBondContact O-N 3.25Å; E666-L732 HydrophobicContact CB-CD1 4.42Å; E666-L732 HydrophobicContact CG-CD1 4.35Å
667	Y	89.9	Confident	88	Confident	43 Å²	43	26.2 Å²	26.2	17%	0.169	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-45.5	176.4	179	-103.8	0	0	0	112	E370 P371 A663 V664 A669 I670 N671	E370-Y667 HydrophobicContact CB-CD1 4.44Å; E370-Y667 HydrophobicContact CB-CE1 4.12Å; P371-Y667 HydrophobicContact CB-CD1 3.96Å; P371-Y667 HydrophobicContact CB-CD2 3.63Å; P371-Y667 HydrophobicContact CB-CE1 3.93Å; P371-Y667 HydrophobicContact CB-CE2 3.61Å; P371-Y667 HydrophobicContact CB-CG 3.82Å; P371-Y667 HydrophobicContact CG-CD1 4.11Å; P371-Y667 HydrophobicContact CG-CD2 3.67Å; P371-Y667 HydrophobicContact CG-CE2 4.19Å; P371-Y667 HydrophobicContact CG-CG 3.63Å; A663-Y667 PolarHBondContact O-N 3.28Å; A663-Y667 VanDerWaalsContact O-N 3.11Å; V664-Y667 PolarHBondContact O-N 3.29Å; Y667-A669 VanDerWaalsContact C-N 3.34Å; Y667-A669 PolarHBondContact O-N 3.08Å; Y667-I670 PolarHBondContact O-N 3.2Å; Y667-N671 VanDerWaalsContact CD2-ND2 3.29Å; Y667-N671 WeakPolarHBondContact CD2-ND2 3.38Å; Y667-N671 WeakPolarHBondContact CE2-ND2 3.22Å; Y667-N671 PolarHBondContact O-N 3.34Å; Y667-N671 PolarHBondContact O-ND2 3.38Å
668	V	89.9	Confident	87.8	Confident	26 Å²	26	28.2 Å²	28.2	16%	0.158	15%	0.154	C	C	.	.	H	α-helix	trans	-61	-42.1	177	169.9	0	0	0	0	111.5	L467 I648 V664 L665 N671 D672 F677	L467-V668 HydrophobicContact CD2-CG1 4.3Å; I648-V668 HydrophobicContact CD1-CG1 4.25Å; I648-V668 HydrophobicContact CD1-CG2 3.69Å; I648-V668 HydrophobicContact CG1-CG1 4.33Å; I648-V668 HydrophobicContact CG2-CG1 3.78Å; V664-V668 WeakPolarHBondContact O-CG2 3.21Å; V664-V668 PolarHBondContact O-N 3.24Å; L665-V668 PolarHBondContact O-N 2.57Å; V668-N671 PolarHBondContact O-N 2.93Å; V668-D672 PolarHBondContact O-N 3.02Å; V668-D672 VanDerWaalsContact O-N 3.13Å; V668-F677 HydrophobicContact CG1-CE2 4.3Å
669	A	88.2	Confident	87.5	Confident	3 Å²	3	29.9 Å²	29.9	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-76.4	-23	-178.8	0	0	0	0	0	114.3	L467 L665 E666 Y667 F677 T679 L732	L467-A669 HydrophobicContact CD1-CB 4.21Å; L665-A669 WeakPolarHBondContact O-CB 3.37Å; L665-A669 PolarHBondContact O-N 2.8Å; E666-A669 PolarHBondContact O-N 2.72Å; Y667-A669 VanDerWaalsContact C-N 3.34Å; Y667-A669 PolarHBondContact O-N 3.08Å; A669-F677 HydrophobicContact CB-CB 4.18Å; A669-T679 HydrophobicContact CB-CG2 3.89Å; A669-L732 HydrophobicContact CB-CD2 3.85Å
670	I	86.7	Confident	87.1	Confident	13 Å²	13	30.6 Å²	30.6	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-73.8	-33.5	172.4	-74.3	166	0	0	0	111.9	E666 Y667 P725 L732	E666-I670 WeakPolarHBondContact O-CB 3.25Å; E666-I670 WeakPolarHBondContact O-CD1 3.31Å; E666-I670 VanDerWaalsContact O-CG1 3.26Å; E666-I670 WeakPolarHBondContact O-CG1 3.33Å; E666-I670 PolarHBondContact O-N 3.25Å; Y667-I670 PolarHBondContact O-N 3.2Å; I670-P725 HydrophobicContact CG2-CG 4.32Å; I670-L732 HydrophobicContact CD1-CD1 4.16Å; I670-L732 HydrophobicContact CG1-CD1 3.74Å; I670-L732 HydrophobicContact CG1-CG 4.35Å
671	N	85.3	Confident	86.1	Confident	80 Å²	80	31.8 Å²	31.8	43%	0.428	19%	0.186	S	C	.	.	H	α-helix	trans	-104.9	0.5	-171.2	-64.2	-73.2	0	0	0	114.6	Y667 V668 P673	Y667-N671 VanDerWaalsContact CD2-ND2 3.29Å; Y667-N671 WeakPolarHBondContact CD2-ND2 3.38Å; Y667-N671 WeakPolarHBondContact CE2-ND2 3.22Å; Y667-N671 PolarHBondContact O-N 3.34Å; Y667-N671 PolarHBondContact O-ND2 3.38Å; V668-N671 PolarHBondContact O-N 2.93Å; N671-P673 WeakPolarHBondContact O-CD 3.39Å
672	D	84.3	Confident	85.1	Confident	13 Å²	13	33.7 Å²	33.7	7%	0.07	20%	0.196	C	C	.	.			trans	-68.4	117.2	173.9	-179.6	56.1	0	0	0	110.8	K652 V668 D674 C675 S676 F677 C730	K652-D672 IonicContact NZ-OD1 3.61Å; K652-D672 PolarHBondContact NZ-OD1 3.41Å; K652-D672 IonicContact NZ-OD2 3.03Å; V668-D672 PolarHBondContact O-N 3.02Å; V668-D672 VanDerWaalsContact O-N 3.13Å; D672-D674 PolarHBondContact O-N 2.89Å; D672-D674 VanDerWaalsContact O-N 3.08Å; D672-C675 PolarHBondContact O-N 3.18Å; D672-C675 PolarHBondContact OD2-N 2.97Å; D672-S676 WeakPolarHBondContact OD2-CB 3.43Å; D672-S676 PolarHBondContact OD2-N 3.46Å; D672-S676 PolarHBondContact OD2-OG 2.66Å; D672-F677 HydrophobicContact CB-CD2 3.69Å; D672-F677 HydrophobicContact CB-CE2 3.89Å; D672-C730 PolarHBondContact O-SG 2.95Å
673	P	81.4	Confident	83.5	Confident	102 Å²	102	40.1 Å²	40.1	66%	0.662	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.7	-172.2	26.6	-36.3	0	0	0	113.9	N671	N671-P673 WeakPolarHBondContact O-CD 3.39Å
674	D	78.4	Confident	82	Confident	109 Å²	109	44.6 Å²	44.6	58%	0.583	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-7.9	179.4	-55.4	-60.8	0	0	0	112.8	K652 D672 S676	K652-D674 WeakPolarHBondContact CE-OD2 3.44Å; K652-D674 IonicContact NZ-OD2 2.73Å; K652-D674 PolarHBondContact NZ-OD2 3.05Å; D672-D674 PolarHBondContact O-N 2.89Å; D672-D674 VanDerWaalsContact O-N 3.08Å; D674-S676 PolarHBondContact O-N 3.42Å; D674-S676 VanDerWaalsContact O-N 3.16Å
675	C	83.5	Confident	80.5	Confident	36 Å²	36	46.6 Å²	46.6	24%	0.243	28%	0.279	C	S	.	.			trans	44.5	40.8	-166.8	-57.6	0	0	0	0	113	R470 D672 C730	R470-C675 PolarHBondContact NH1-O 3.38Å; D672-C675 PolarHBondContact O-N 3.18Å; D672-C675 PolarHBondContact OD2-N 2.97Å; C675-C730 WeakPolarHBondContact CA-SG 3.09Å; C675-C730 HydrophobicContact CB-CB 3.83Å; C675-C730 WeakPolarHBondContact CB-SG 3.2Å; C675-C730 WeakPolarHBondContact SG-CA 3.17Å; C675-C730 WeakPolarHBondContact SG-CB 3.42Å; C675-C730 CovalentContact SG-SG 2.04Å; C675-C730 PolarHBondContact SG-SG 3.27Å
676	S	83.3	Confident	79.4	Confident	22 Å²	22	50.9 Å²	50.9	15%	0.154	30%	0.302	C	S	.	.			trans	-84.1	-10.2	-169.2	66.4	0	0	0	0	114.1	R470 D672 D674	R470-S676 WeakPolarHBondContact CB-O 3.19Å; R470-S676 PolarHBondContact N-O 2.96Å; D672-S676 WeakPolarHBondContact OD2-CB 3.43Å; D672-S676 PolarHBondContact OD2-N 3.46Å; D672-S676 PolarHBondContact OD2-OG 2.66Å; D674-S676 PolarHBondContact O-N 3.42Å; D674-S676 VanDerWaalsContact O-N 3.16Å
677	F	87.3	Confident	79	Confident	7 Å²	7	51.1 Å²	51.1	3%	0.031	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	166.4	-179.8	-56.5	-67.5	0	0	0	113.6	L467 L468 I648 V651 K652 V668 A669 D672	L467-F677 HydrophobicContact CD1-CB 3.75Å; L467-F677 HydrophobicContact CD1-CD1 4.21Å; L467-F677 HydrophobicContact CD1-CG 3.97Å; L467-F677 HydrophobicContact CD2-CD1 3.95Å; L467-F677 HydrophobicContact CD2-CE1 4.02Å; L467-F677 HydrophobicContact CD2-CG 4.3Å; L467-F677 HydrophobicContact CD2-CZ 4.42Å; L467-F677 HydrophobicContact CG-CB 4.37Å; L467-F677 HydrophobicContact CG-CD1 3.95Å; L467-F677 HydrophobicContact CG-CE1 4.49Å; L467-F677 HydrophobicContact CG-CG 4.23Å; L468-F677 CarbonylContact O-C 3.57Å; L468-F677 WeakPolarHBondContact O-CA 3.45Å; I648-F677 HydrophobicContact CG2-CZ 4.16Å; V651-F677 HydrophobicContact CB-CE1 4.15Å; V651-F677 HydrophobicContact CG1-CD1 3.93Å; V651-F677 HydrophobicContact CG1-CE1 3.83Å; K652-F677 HydrophobicContact CB-CE1 4.03Å; K652-F677 HydrophobicContact CB-CZ 3.8Å; K652-F677 HydrophobicContact CD-CE2 4.41Å; K652-F677 HydrophobicContact CD-CZ 3.93Å; K652-F677 HydrophobicContact CG-CE1 4.39Å; K652-F677 HydrophobicContact CG-CZ 3.99Å; V668-F677 HydrophobicContact CG1-CE2 4.3Å; A669-F677 HydrophobicContact CB-CB 4.18Å; D672-F677 HydrophobicContact CB-CD2 3.69Å; D672-F677 HydrophobicContact CB-CE2 3.89Å
678	Y	85.8	Confident	79	Confident	41 Å²	41	49.1 Å²	49.1	16%	0.161	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	153.1	155.4	69.7	-74	0	0	0	109.6	L468 R469 R470 I680	L468-Y678 HydrophobicContact CB-CD1 4.11Å; L468-Y678 HydrophobicContact CB-CE1 3.53Å; L468-Y678 HydrophobicContact CB-CE2 4.46Å; L468-Y678 HydrophobicContact CD1-CE2 4.4Å; L468-Y678 PolarHBondContact N-O 3.18Å; L468-Y678 PolarHBondContact O-N 3.27Å; R469-Y678 WeakPolarHBondContact O-CE1 3.35Å; R470-Y678 HydrophobicContact CB-CD1 4.21Å; Y678-I680 HydrophobicContact CD2-CG1 4.25Å; Y678-I680 HydrophobicContact CE2-CD1 4Å; Y678-I680 HydrophobicContact CE2-CG1 4Å
679	T	87.3	Confident	79.2	Confident	36 Å²	36	47.9 Å²	47.9	22%	0.221	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	144.1	-180	48.5	0	0	0	0	111.3	V466 L467 L665 A669	V466-T679 CarbonylContact O-C 3.56Å; V466-T679 WeakPolarHBondContact O-CA 3.41Å; L467-T679 HydrophobicContact CD1-CG2 3.78Å; L665-T679 HydrophobicContact CB-CG2 3.98Å; L665-T679 WeakPolarHBondContact O-CG2 3.43Å; A669-T679 HydrophobicContact CB-CG2 3.89Å
680	I	84.9	Confident	79.4	Confident	15 Å²	15	47.8 Å²	47.8	8%	0.077	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	109.3	170.7	-56.1	-179.8	0	0	0	107.4	G465 V466 L468 I584 Q585 Y678	G465-I680 CarbonylContact C-O 3.58Å; G465-I680 VanDerWaalsContact CA-O 3.22Å; G465-I680 WeakPolarHBondContact CA-O 3.44Å; V466-I680 HydrophobicContact CB-CB 4.47Å; V466-I680 PolarHBondContact N-O 2.65Å; V466-I680 PolarHBondContact O-N 3.27Å; L468-I680 HydrophobicContact CD1-CD1 3.67Å; L468-I680 HydrophobicContact CD1-CG1 4Å; I584-I680 HydrophobicContact CB-CD1 4.12Å; I584-I680 HydrophobicContact CG2-CD1 3.58Å; I584-I680 WeakPolarHBondContact O-CD1 3.35Å; Q585-I680 WeakPolarHBondContact O-CG2 3.37Å; Y678-I680 HydrophobicContact CD2-CG1 4.25Å; Y678-I680 HydrophobicContact CE2-CD1 4Å; Y678-I680 HydrophobicContact CE2-CG1 4Å
681	G	71.3	Confident	79.9	Confident	43 Å²	43	47.1 Å²	47.1	44%	0.443	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	143.1	175.9	0	0	0	0	0	112.4
682	N	68.3	Low	80.4	Confident	49 Å²	49	43.3 Å²	43.3	26%	0.262	26%	0.261	S	S	.	.			trans	-76.3	131.9	161	-171.4	-0.2	0	0	0	109.4	V464 V684	V464-N682 PolarHBondContact O-N 2.8Å; N682-V684 VanDerWaalsContact C-N 3.29Å; N682-V684 PolarHBondContact O-N 2.95Å
683	T	56.7	Low	80.8	Confident	141 Å²	141	42.7 Å²	42.7	87%	0.865	26%	0.257	S	S	*	.	S	Bend	trans	-79	-5.2	-171.9	51.6	0	0	0	0	114.6
684	V	58.1	Low	81	Confident	99 Å²	99	39.5 Å²	39.5	60%	0.6	23%	0.234	S	C	*	.			trans	-110.3	108.8	-179.1	-175.4	0	0	0	0	110.8	N682 D686	N682-V684 VanDerWaalsContact C-N 3.29Å; N682-V684 PolarHBondContact O-N 2.95Å; V684-D686 PolarHBondContact O-N 3.47Å
685	A	60.9	Low	81.2	Confident	46 Å²	46	40.8 Å²	40.8	38%	0.38	24%	0.236	S	C	.	.			trans	-82.8	97.4	174.6	0	0	0	0	0	111.5	D461	D461-A685 HydrophobicContact CB-CB 4Å
686	D	66.1	Low	80.6	Confident	92 Å²	92	41.8 Å²	41.8	49%	0.492	25%	0.252	S	S	.	.			trans	-77.5	-21.1	-179.4	-161.5	17.2	0	0	0	112.4	H609 K613 V684	H609-D686 IonicContact CE1-OD2 3.42Å; K613-D686 IonicContact NZ-OD2 3.43Å; K613-D686 PolarHBondContact NZ-OD2 3.31Å; V684-D686 PolarHBondContact O-N 3.47Å
687	R	81.7	Confident	80.2	Confident	57 Å²	57	41.4 Å²	41.4	22%	0.215	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	178.2	-174	-60.4	-178.8	179.2	173.5	-4.5	111.6	T444 R458 Y462 H609	T444-R687 HydrophobicContact CG2-CB 4Å; R458-R687 PolarHBondContact NH1-O 3.44Å; Y462-R687 HydrophobicContact CD1-CB 3.99Å; Y462-R687 PolarHBondContact N-O 2.95Å; H609-R687 VanDerWaalsContact ND1-CZ 3.33Å; H609-R687 PolarHBondContact ND1-NH2 3.44Å
688	G	89.9	Confident	79.5	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	169.7	172.5	0	0	0	0	0	112.3	I445 M460	I445-G688 WeakPolarHBondContact CG1-O 3.31Å; I445-G688 PolarHBondContact N-O 3.02Å; M460-G688 CarbonylContact O-C 3.51Å; M460-G688 WeakPolarHBondContact O-CA 3.44Å
689	Y	93.3	Very high	79.3	Confident	1 Å²	1	46.3 Å²	46.3	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133.9	168.3	-43.3	-85.3	0	0	0	109.4	F372 A442 L443 R458 Y459 M460 D461 Y462 D661	F372-Y689 HydrophobicContact CE1-CD2 4.37Å; F372-Y689 HydrophobicContact CE1-CE1 4.38Å; F372-Y689 HydrophobicContact CE1-CE2 4.19Å; F372-Y689 HydrophobicContact CZ-CE1 4.04Å; F372-Y689 HydrophobicContact CZ-CE2 4Å; F372-Y689 AromaticContact CZ-CZ 3.69Å; A442-Y689 HydrophobicContact CB-CD1 4.36Å; A442-Y689 HydrophobicContact CB-CE1 4.19Å; L443-Y689 WeakPolarHBondContact O-CA 3.33Å; R458-Y689 CarbonylContact C-O 3.48Å; R458-Y689 WeakPolarHBondContact CA-O 3.39Å; Y459-Y689 WeakPolarHBondContact CD1-O 3.39Å; Y459-Y689 PolarHBondContact N-O 2.92Å; M460-Y689 HydrophobicContact CB-CD2 3.8Å; M460-Y689 HydrophobicContact CB-CE2 4.3Å; M460-Y689 HydrophobicContact CE-CE2 4.15Å; M460-Y689 HydrophobicContact CG-CD2 3.84Å; M460-Y689 HydrophobicContact CG-CE2 3.82Å; M460-Y689 WeakPolarHBondContact O-CD2 3.29Å; M460-Y689 PolarHBondContact O-N 3.41Å; M460-Y689 HydrophobicContact SD-CD2 4.4Å; M460-Y689 HydrophobicContact SD-CE2 4.12Å; D461-Y689 VanDerWaalsContact O-CE2 3.27Å; D461-Y689 WeakPolarHBondContact O-CE2 3.4Å; Y462-Y689 HydrophobicContact CD2-CD1 4.49Å; Y462-Y689 AromaticContact CD2-CE1 3.67Å; Y462-Y689 HydrophobicContact CD2-CE1 3.67Å; Y462-Y689 AromaticContact CD2-CZ 3.81Å; Y462-Y689 HydrophobicContact CG-CE1 4.47Å; D661-Y689 VanDerWaalsContact CG-OH 3.27Å; D661-Y689 PolarHBondContact OD1-OH 2.67Å; D661-Y689 WeakPolarHBondContact OD2-CE1 3.26Å; D661-Y689 PolarHBondContact OD2-OH 3.06Å
690	G	94	Very high	79.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.276	C	S	.	.			trans	-122.7	157.2	174.6	0	0	0	0	0	110.5	L443	L443-G690 PolarHBondContact O-N 3.49Å
691	I	96.1	Very high	78.7	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.291	C	S	.	.			trans	-80	129.7	163.3	-55	-176.9	0	0	0	106.3	L397 I438 I440 F455 T456 Y459 F703 I707	L397-I691 HydrophobicContact CD1-CD1 3.57Å; I438-I691 HydrophobicContact CG2-CG2 3.44Å; I438-I691 VanDerWaalsContact CG2-CG2 3.44Å; I440-I691 HydrophobicContact CD1-CD1 3.8Å; I440-I691 HydrophobicContact CD1-CG1 3.87Å; I440-I691 HydrophobicContact CG1-CG1 4.08Å; F455-I691 WeakPolarHBondContact CA-O 3.05Å; T456-I691 HydrophobicContact CG2-CB 3.82Å; T456-I691 PolarHBondContact N-O 3.35Å; T456-I691 PolarHBondContact OG1-N 3.26Å; Y459-I691 HydrophobicContact CD1-CG1 4.1Å; Y459-I691 HydrophobicContact CE1-CG1 4.25Å; I691-F703 HydrophobicContact CD1-CD1 4.19Å; I691-I707 HydrophobicContact CD1-CD1 4.04Å; I691-I707 HydrophobicContact CG1-CD1 4.38Å
692	A	96.1	Very high	79.2	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	146.6	174.7	0	0	0	0	0	110.5	L431 I438 G439 L443 V453 D454 F455	L431-A692 HydrophobicContact CD1-CB 3.52Å; I438-A692 CarbonylContact C-O 3.55Å; I438-A692 WeakPolarHBondContact CA-O 3.38Å; G439-A692 PolarHBondContact N-O 3.09Å; G439-A692 PolarHBondContact O-N 3.44Å; L443-A692 HydrophobicContact CD2-CB 3.55Å; V453-A692 HydrophobicContact CG2-CB 4.29Å; D454-A692 CarbonylContact O-C 3.6Å; D454-A692 WeakPolarHBondContact O-CA 3.24Å; F455-A692 HydrophobicContact CD1-CB 4.12Å; F455-A692 HydrophobicContact CE1-CB 3.86Å; F455-A692 HydrophobicContact CZ-CB 4.34Å
693	L	93.1	Very high	80.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	164.3	175.8	-59.7	95.4	0	0	0	109.4	I438 V453 D454 T456 H695 S697 R700	I438-L693 HydrophobicContact CD1-CD2 4.1Å; I438-L693 HydrophobicContact CG1-CD2 4.01Å; I438-L693 HydrophobicContact CG1-CG 4.15Å; V453-L693 WeakPolarHBondContact CB-O 3.34Å; D454-L693 PolarHBondContact N-O 2.95Å; D454-L693 PolarHBondContact O-N 3.47Å; T456-L693 HydrophobicContact CG2-CD1 3.72Å; L693-H695 PolarHBondContact O-N 3.48Å; L693-S697 WeakPolarHBondContact CD2-OG 3.4Å; L693-R700 HydrophobicContact CD1-CB 4.24Å; L693-R700 HydrophobicContact CD1-CG 4.38Å
694	Q	86.3	Confident	81.5	Confident	35 Å²	35	39.6 Å²	39.6	16%	0.164	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	141.2	168.1	-63.3	-176.9	22.9	0	0	110.6	L431 A436 D437 G696 S697	L431-Q694 HydrophobicContact CD2-CG 4.41Å; A436-Q694 PolarHBondContact O-NE2 2.85Å; D437-Q694 PolarHBondContact OD1-NE2 3.16Å; Q694-G696 PolarHBondContact O-N 3.05Å; Q694-S697 WeakPolarHBondContact O-CB 3.46Å; Q694-S697 PolarHBondContact O-N 2.96Å
695	H	82.1	Confident	82.7	Confident	135 Å²	135	39.4 Å²	39.4	63%	0.625	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	128.7	179.9	-178.4	55.6	0	0	0	111.9	D454 L693	D454-H695 WeakPolarHBondContact OD1-CA 2.99Å; D454-H695 IonicContact OD1-CE1 3.58Å; D454-H695 IonicContact OD1-CG 3.59Å; D454-H695 IonicContact OD1-ND1 3.57Å; D454-H695 PolarHBondContact OD1-ND1 3.22Å; L693-H695 PolarHBondContact O-N 3.48Å
696	G	70.4	Confident	83.8	Confident	57 Å²	57	37.9 Å²	37.9	59%	0.588	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.6	16.8	-174.8	0	0	0	0	0	115.6	D454 Q694	D454-G696 VanDerWaalsContact CG-N 3.31Å; D454-G696 PolarHBondContact OD1-N 3Å; D454-G696 PolarHBondContact OD2-N 3.08Å; Q694-G696 PolarHBondContact O-N 3.05Å
697	S	75.3	Confident	85	Confident	14 Å²	14	33.5 Å²	33.5	10%	0.098	18%	0.181	C	C	.	.			trans	-61.8	129.9	178.7	175.3	0	0	0	0	112.5	L693 Q694 Y699 R700	L693-S697 WeakPolarHBondContact CD2-OG 3.4Å; Q694-S697 WeakPolarHBondContact O-CB 3.46Å; Q694-S697 PolarHBondContact O-N 2.96Å; S697-Y699 PolarHBondContact O-N 3.22Å; S697-Y699 VanDerWaalsContact O-N 3.16Å; S697-Y699 PolarHBondContact OG-N 3.16Å; S697-R700 PolarHBondContact O-N 3.09Å
698	P	73.1	Confident	85.3	Confident	100 Å²	100	34.2 Å²	34.2	65%	0.649	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-17.8	179.2	29.8	-36.4	0	0	0	112.9
699	Y	80.7	Confident	85	Confident	51 Å²	51	36.2 Å²	36.2	20%	0.2	20%	0.198	C	C	.	.	H	α-helix	trans	-80.6	-18.7	-177.6	-52.2	-54.9	0	0	0	113.4	M357 L362 S697 D701 V702 F703	M357-Y699 HydrophobicContact CG-CE1 4.46Å; M357-Y699 HydrophobicContact SD-CD1 3.51Å; M357-Y699 VanDerWaalsContact SD-CD1 3.51Å; M357-Y699 HydrophobicContact SD-CE1 3.66Å; M357-Y699 HydrophobicContact SD-CG 4.35Å; L362-Y699 HydrophobicContact CD2-CD2 4.36Å; L362-Y699 HydrophobicContact CD2-CE2 3.88Å; S697-Y699 PolarHBondContact O-N 3.22Å; S697-Y699 VanDerWaalsContact O-N 3.16Å; S697-Y699 PolarHBondContact OG-N 3.16Å; Y699-D701 VanDerWaalsContact C-N 3.35Å; Y699-D701 PolarHBondContact O-N 3.12Å; Y699-V702 WeakPolarHBondContact O-CB 3.44Å; Y699-V702 PolarHBondContact O-N 2.91Å; Y699-V702 VanDerWaalsContact O-N 3.14Å; Y699-F703 VanDerWaalsContact O-CD2 3.3Å; Y699-F703 WeakPolarHBondContact O-CD2 3.37Å; Y699-F703 PolarHBondContact O-N 2.94Å
700	R	82.8	Confident	84.8	Confident	32 Å²	32	36.6 Å²	36.6	12%	0.121	20%	0.2	C	C	.	.	H	α-helix	trans	-53.5	-48.5	-173.9	-179.5	-156.8	59.5	-131.9	-11.2	112.4	D454 F455 L693 S697 S704	D454-R700 HydrophobicContact CB-CG 4.38Å; D454-R700 IonicContact OD2-CZ 3.73Å; D454-R700 IonicContact OD2-NH1 2.69Å; D454-R700 PolarHBondContact OD2-NH1 2.97Å; F455-R700 WeakPolarHBondContact O-CD 3.4Å; F455-R700 WeakPolarHBondContact O-CG 3.37Å; L693-R700 HydrophobicContact CD1-CB 4.24Å; L693-R700 HydrophobicContact CD1-CG 4.38Å; S697-R700 PolarHBondContact O-N 3.09Å; R700-S704 VanDerWaalsContact O-CB 3.27Å; R700-S704 WeakPolarHBondContact O-CB 3.1Å; R700-S704 PolarHBondContact O-N 3.44Å; R700-S704 PolarHBondContact O-OG 3.23Å
701	D	76.6	Confident	84.5	Confident	75 Å²	75	40 Å²	40	40%	0.401	22%	0.216	S	C	.	.	H	α-helix	trans	-72.9	-33.3	-176.4	-61.1	-20.5	0	0	0	111.6	F173 Y699 S704 Q705	F173-D701 WeakPolarHBondContact CE2-OD2 3.42Å; Y699-D701 VanDerWaalsContact C-N 3.35Å; Y699-D701 PolarHBondContact O-N 3.12Å; D701-S704 PolarHBondContact O-N 3.31Å; D701-Q705 WeakPolarHBondContact O-CB 3.38Å; D701-Q705 PolarHBondContact O-N 3.33Å
702	V	81.3	Confident	84.1	Confident	23 Å²	23	47.6 Å²	47.6	14%	0.139	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-49.6	176.1	-171.4	0	0	0	0	110.6	L353 L401 Y699 Q705 R706	L353-V702 HydrophobicContact CD2-CB 4.32Å; L353-V702 HydrophobicContact CD2-CG1 3.95Å; L353-V702 HydrophobicContact CD2-CG2 3.41Å; L353-V702 VanDerWaalsContact CD2-CG2 3.41Å; L401-V702 HydrophobicContact CD1-CG1 4.23Å; L401-V702 HydrophobicContact CD2-CG1 3.67Å; Y699-V702 WeakPolarHBondContact O-CB 3.44Å; Y699-V702 PolarHBondContact O-N 2.91Å; Y699-V702 VanDerWaalsContact O-N 3.14Å; V702-Q705 PolarHBondContact O-N 3.17Å; V702-R706 WeakPolarHBondContact O-CG 3.34Å; V702-R706 PolarHBondContact O-N 3.04Å
703	F	88.4	Confident	83.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-43.6	175.4	-83.9	-117.8	0	0	0	110.7	M357 L362 L397 L401 F403 I438 T456 I691 Y699 Q705 R706 I707	M357-F703 HydrophobicContact CE-CE2 3.76Å; M357-F703 HydrophobicContact CE-CZ 4.43Å; M357-F703 HydrophobicContact SD-CE2 4.43Å; L362-F703 HydrophobicContact CD1-CE2 4.43Å; L362-F703 HydrophobicContact CD1-CZ 4.04Å; L397-F703 HydrophobicContact CD1-CD1 3.9Å; L397-F703 HydrophobicContact CD1-CE1 4.25Å; L401-F703 HydrophobicContact CD1-CD2 4.32Å; L401-F703 HydrophobicContact CD1-CE2 4.36Å; F403-F703 HydrophobicContact CD1-CZ 4.32Å; F403-F703 HydrophobicContact CE1-CE1 4.13Å; F403-F703 HydrophobicContact CE1-CE2 4.34Å; F403-F703 AromaticContact CE1-CZ 3.6Å; F403-F703 HydrophobicContact CE1-CZ 3.6Å; F403-F703 HydrophobicContact CE2-CZ 4.28Å; F403-F703 AromaticContact CZ-CE1 3.88Å; F403-F703 HydrophobicContact CZ-CE1 3.88Å; F403-F703 AromaticContact CZ-CZ 3.59Å; F403-F703 HydrophobicContact CZ-CZ 3.59Å; I438-F703 HydrophobicContact CD1-CD1 4.28Å; I438-F703 HydrophobicContact CD1-CE1 3.5Å; I438-F703 HydrophobicContact CD1-CE2 3.92Å; I438-F703 HydrophobicContact CD1-CZ 3.28Å; T456-F703 HydrophobicContact CG2-CB 3.76Å; I691-F703 HydrophobicContact CD1-CD1 4.19Å; Y699-F703 VanDerWaalsContact O-CD2 3.3Å; Y699-F703 WeakPolarHBondContact O-CD2 3.37Å; Y699-F703 PolarHBondContact O-N 2.94Å; F703-Q705 PolarHBondContact O-N 2.68Å; F703-R706 PolarHBondContact O-N 3.01Å; F703-I707 VanDerWaalsContact O-CG1 3.31Å; F703-I707 WeakPolarHBondContact O-CG1 3.44Å; F703-I707 PolarHBondContact O-N 3.47Å
704	S	85.8	Confident	83.5	Confident	13 Å²	13	53.3 Å²	53.3	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-41.4	179.3	-61.9	0	0	0	0	113	T456 T457 R700 D701 L708	T456-S704 VanDerWaalsContact CA-OG 3.25Å; T456-S704 WeakPolarHBondContact CA-OG 3.33Å; T456-S704 WeakPolarHBondContact CB-OG 3.09Å; T457-S704 PolarHBondContact N-OG 2.89Å; T457-S704 VanDerWaalsContact N-OG 3.12Å; T457-S704 VanDerWaalsContact OG1-CA 3.25Å; T457-S704 WeakPolarHBondContact OG1-CA 3.48Å; T457-S704 WeakPolarHBondContact OG1-CB 3.44Å; T457-S704 PolarHBondContact OG1-O 3.5Å; T457-S704 VanDerWaalsContact OG1-O 3.07Å; R700-S704 VanDerWaalsContact O-CB 3.27Å; R700-S704 WeakPolarHBondContact O-CB 3.1Å; R700-S704 PolarHBondContact O-N 3.44Å; R700-S704 PolarHBondContact O-OG 3.23Å; D701-S704 PolarHBondContact O-N 3.31Å; S704-L708 WeakPolarHBondContact O-CG 3.43Å; S704-L708 PolarHBondContact O-N 2.7Å; S704-L708 VanDerWaalsContact O-N 3.11Å
705	Q	82.7	Confident	83.7	Confident	96 Å²	96	54.3 Å²	54.3	45%	0.449	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-45.5	174.3	-174.5	-175	-34.4	0	0	111.2	D701 V702 F703 L708 E709	D701-Q705 WeakPolarHBondContact O-CB 3.38Å; D701-Q705 PolarHBondContact O-N 3.33Å; V702-Q705 PolarHBondContact O-N 3.17Å; F703-Q705 PolarHBondContact O-N 2.68Å; Q705-L708 WeakPolarHBondContact O-CB 3.43Å; Q705-L708 PolarHBondContact O-N 3.15Å; Q705-E709 PolarHBondContact NE2-OE1 3.19Å; Q705-E709 WeakPolarHBondContact O-CG 3.48Å; Q705-E709 PolarHBondContact O-N 3.4Å
706	R	84.9	Confident	84.2	Confident	14 Å²	14	48.4 Å²	48.4	5%	0.053	27%	0.266	C	S	.	.	H	α-helix	trans	-69.3	-33.1	-179.8	-60.4	-46	-179.9	166.7	3.1	113.2	L353 N355 L397 L401 V702 F703 L708 E709 L710	L353-R706 PolarHBondContact O-NH2 2.04Å; N355-R706 PolarHBondContact OD1-NH2 2.96Å; L397-R706 HydrophobicContact CD2-CB 3.56Å; L401-R706 HydrophobicContact CD1-CG 3.89Å; L401-R706 HydrophobicContact CD2-CG 3.71Å; L401-R706 HydrophobicContact CG-CG 3.89Å; V702-R706 WeakPolarHBondContact O-CG 3.34Å; V702-R706 PolarHBondContact O-N 3.04Å; F703-R706 PolarHBondContact O-N 3.01Å; R706-L708 VanDerWaalsContact C-N 3.34Å; R706-E709 WeakPolarHBondContact CD-OE2 3.48Å; R706-E709 IonicContact CZ-OE2 2.98Å; R706-E709 IonicContact NE-OE2 3.53Å; R706-E709 IonicContact NH1-OE1 3.55Å; R706-E709 PolarHBondContact NH1-OE1 3.46Å; R706-E709 IonicContact NH1-OE2 3.62Å; R706-E709 PolarHBondContact NH1-OE2 2.79Å; R706-E709 PolarHBondContact O-N 2.84Å; R706-L710 WeakPolarHBondContact O-CB 3.48Å; R706-L710 VanDerWaalsContact O-CG 3.29Å; R706-L710 WeakPolarHBondContact O-CG 3.39Å; R706-L710 PolarHBondContact O-N 3.47Å
707	I	90.7	Very high	85.2	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-44.2	170.9	-69.6	163.7	0	0	0	110.3	L397 T456 I691 F703 L710 Q711	L397-I707 HydrophobicContact CD1-CG1 4.25Å; L397-I707 HydrophobicContact CD2-CG1 4.26Å; T456-I707 HydrophobicContact CG2-CD1 4.06Å; T456-I707 WeakPolarHBondContact OG1-CD1 3.31Å; I691-I707 HydrophobicContact CD1-CD1 4.04Å; I691-I707 HydrophobicContact CG1-CD1 4.38Å; F703-I707 VanDerWaalsContact O-CG1 3.31Å; F703-I707 WeakPolarHBondContact O-CG1 3.44Å; F703-I707 PolarHBondContact O-N 3.47Å; I707-L710 PolarHBondContact O-N 2.94Å; I707-Q711 VanDerWaalsContact O-CG 3.32Å; I707-Q711 WeakPolarHBondContact O-CG 3.29Å; I707-Q711 PolarHBondContact O-N 3.03Å
708	L	86.9	Confident	86	Confident	71 Å²	71	56.1 Å²	56.1	37%	0.372	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-38.3	175.6	-70.1	171.5	0	0	0	112.5	T457 S704 Q705 R706 Q711 Q712	T457-L708 HydrophobicContact CG2-CD1 4.13Å; T457-L708 HydrophobicContact CG2-CD2 4.36Å; T457-L708 HydrophobicContact CG2-CG 4.19Å; S704-L708 WeakPolarHBondContact O-CG 3.43Å; S704-L708 PolarHBondContact O-N 2.7Å; S704-L708 VanDerWaalsContact O-N 3.11Å; Q705-L708 WeakPolarHBondContact O-CB 3.43Å; Q705-L708 PolarHBondContact O-N 3.15Å; R706-L708 VanDerWaalsContact C-N 3.34Å; L708-Q711 PolarHBondContact O-N 3.31Å; L708-Q712 WeakPolarHBondContact O-CB 3.07Å; L708-Q712 VanDerWaalsContact O-CG 3.26Å; L708-Q712 WeakPolarHBondContact O-CG 3.26Å; L708-Q712 PolarHBondContact O-N 3.23Å
709	E	84.6	Confident	87	Confident	43 Å²	43	53 Å²	53	20%	0.201	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-45.8	174.6	-71.6	171.4	-171.5	0	0	111.6	Q705 R706 Q711 Q712 N713	Q705-E709 PolarHBondContact NE2-OE1 3.19Å; Q705-E709 WeakPolarHBondContact O-CG 3.48Å; Q705-E709 PolarHBondContact O-N 3.4Å; R706-E709 WeakPolarHBondContact CD-OE2 3.48Å; R706-E709 IonicContact CZ-OE2 2.98Å; R706-E709 IonicContact NE-OE2 3.53Å; R706-E709 IonicContact NH1-OE1 3.55Å; R706-E709 PolarHBondContact NH1-OE1 3.46Å; R706-E709 IonicContact NH1-OE2 3.62Å; R706-E709 PolarHBondContact NH1-OE2 2.79Å; R706-E709 PolarHBondContact O-N 2.84Å; E709-Q711 VanDerWaalsContact C-N 3.28Å; E709-Q711 PolarHBondContact O-N 3.19Å; E709-Q712 PolarHBondContact O-N 3.13Å; E709-N713 WeakPolarHBondContact O-CB 3.33Å; E709-N713 PolarHBondContact O-N 2.86Å; E709-N713 PolarHBondContact O-OD1 3.25Å
710	L	89.1	Confident	87.6	Confident	10 Å²	10	54.3 Å²	54.3	5%	0.052	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-31.5	175.5	-68.5	167.6	0	0	0	112.6	A396 L397 R706 I707 G714 D715 M716	A396-L710 HydrophobicContact CB-CD1 4.26Å; L397-L710 HydrophobicContact CD2-CD1 3.98Å; L397-L710 HydrophobicContact CG-CD1 4.33Å; R706-L710 WeakPolarHBondContact O-CB 3.48Å; R706-L710 VanDerWaalsContact O-CG 3.29Å; R706-L710 WeakPolarHBondContact O-CG 3.39Å; R706-L710 PolarHBondContact O-N 3.47Å; I707-L710 PolarHBondContact O-N 2.94Å; L710-G714 PolarHBondContact O-N 2.91Å; L710-D715 HydrophobicContact CB-CB 4.35Å; L710-D715 HydrophobicContact CD2-CB 3.78Å; L710-D715 PolarHBondContact O-N 3.06Å; L710-M716 HydrophobicContact CB-CG 3.73Å; L710-M716 HydrophobicContact CB-SD 4Å; L710-M716 HydrophobicContact CD1-SD 4.36Å; L710-M716 PolarHBondContact O-N 3.43Å; L710-M716 VanDerWaalsContact O-N 3.13Å
711	Q	88.1	Confident	87.9	Confident	70 Å²	70	57.5 Å²	57.5	33%	0.327	29%	0.292	S	S	.	.	H	α-helix	trans	-71.7	-43.8	172.1	-73.8	173.5	-17.2	0	0	111.8	R458 Y459 I707 L708 E709 N713 G714 M716	R458-Q711 PolarHBondContact O-NE2 3.1Å; Y459-Q711 PolarHBondContact O-NE2 3.32Å; Y459-Q711 VanDerWaalsContact O-NE2 3.17Å; I707-Q711 VanDerWaalsContact O-CG 3.32Å; I707-Q711 WeakPolarHBondContact O-CG 3.29Å; I707-Q711 PolarHBondContact O-N 3.03Å; L708-Q711 PolarHBondContact O-N 3.31Å; E709-Q711 VanDerWaalsContact C-N 3.28Å; E709-Q711 PolarHBondContact O-N 3.19Å; Q711-N713 VanDerWaalsContact C-N 3.35Å; Q711-N713 PolarHBondContact O-N 2.87Å; Q711-G714 PolarHBondContact O-N 2.89Å; Q711-M716 HydrophobicContact CG-CB 4.2Å; Q711-M716 HydrophobicContact CG-CG 3.74Å
712	Q	86.4	Confident	88.6	Confident	160 Å²	160	59.7 Å²	59.7	75%	0.748	30%	0.298	S	S	*	.	H	α-helix	trans	-67.1	-32.7	179.6	-74.6	173.2	20.1	0	0	113.2	L708 E709 G714	L708-Q712 WeakPolarHBondContact O-CB 3.07Å; L708-Q712 VanDerWaalsContact O-CG 3.26Å; L708-Q712 WeakPolarHBondContact O-CG 3.26Å; L708-Q712 PolarHBondContact O-N 3.23Å; E709-Q712 PolarHBondContact O-N 3.13Å; Q712-G714 VanDerWaalsContact C-N 3.31Å
713	N	88.1	Confident	89.1	Confident	99 Å²	99	60.3 Å²	60.3	53%	0.529	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-20.7	174.1	-67.5	-11.7	0	0	0	113.5	E709 Q711 D715	E709-N713 WeakPolarHBondContact O-CB 3.33Å; E709-N713 PolarHBondContact O-N 2.86Å; E709-N713 PolarHBondContact O-OD1 3.25Å; Q711-N713 VanDerWaalsContact C-N 3.35Å; Q711-N713 PolarHBondContact O-N 2.87Å; N713-D715 VanDerWaalsContact C-N 3.32Å; N713-D715 HydrophobicContact CB-CB 4.46Å; N713-D715 WeakPolarHBondContact CB-OD2 3.24Å; N713-D715 PolarHBondContact ND2-OD2 2.85Å
714	G	89.6	Confident	89.2	Confident	21 Å²	21	61 Å²	61	22%	0.216	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	2.7	-167.8	0	0	0	0	0	114.8	L710 Q711 Q712 M716 D717 I718	L710-G714 PolarHBondContact O-N 2.91Å; Q711-G714 PolarHBondContact O-N 2.89Å; Q712-G714 VanDerWaalsContact C-N 3.31Å; G714-M716 PolarHBondContact O-N 3.37Å; G714-D717 PolarHBondContact O-N 3.05Å; G714-I718 PolarHBondContact O-N 2.95Å
715	D	90.8	Very high	89.2	Confident	56 Å²	56	62.7 Å²	62.7	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-57.5	-37.9	177.9	-65.1	-46.1	0	0	0	111.4	L710 N713 D717 I718 L719	L710-D715 HydrophobicContact CB-CB 4.35Å; L710-D715 HydrophobicContact CD2-CB 3.78Å; L710-D715 PolarHBondContact O-N 3.06Å; N713-D715 VanDerWaalsContact C-N 3.32Å; N713-D715 HydrophobicContact CB-CB 4.46Å; N713-D715 WeakPolarHBondContact CB-OD2 3.24Å; N713-D715 PolarHBondContact ND2-OD2 2.85Å; D715-D717 VanDerWaalsContact C-N 3.34Å; D715-D717 PolarHBondContact O-N 3.31Å; D715-I718 WeakPolarHBondContact O-CB 3.37Å; D715-I718 PolarHBondContact O-N 2.86Å; D715-L719 WeakPolarHBondContact O-CG 3.3Å; D715-L719 PolarHBondContact O-N 2.78Å
716	M	92.5	Very high	88.6	Confident	11 Å²	11	66.2 Å²	66.2	5%	0.054	33%	0.325	C	S	.	.	H	α-helix	trans	-63.2	-34.8	175.5	-69.3	-58.8	-63.3	0	0	113.6	F389 V393 Y459 L710 Q711 G714 L719 K720	F389-M716 HydrophobicContact CZ-CE 3.97Å; V393-M716 HydrophobicContact CG1-CE 4.34Å; V393-M716 HydrophobicContact CG1-SD 4.47Å; V393-M716 HydrophobicContact CG2-CE 3.63Å; V393-M716 HydrophobicContact CG2-SD 4.07Å; Y459-M716 HydrophobicContact CD2-CE 4.08Å; Y459-M716 HydrophobicContact CG-CE 4.48Å; Y459-M716 WeakPolarHBondContact O-CE 3.42Å; L710-M716 HydrophobicContact CB-CG 3.73Å; L710-M716 HydrophobicContact CB-SD 4Å; L710-M716 HydrophobicContact CD1-SD 4.36Å; L710-M716 PolarHBondContact O-N 3.43Å; L710-M716 VanDerWaalsContact O-N 3.13Å; Q711-M716 HydrophobicContact CG-CB 4.2Å; Q711-M716 HydrophobicContact CG-CG 3.74Å; G714-M716 PolarHBondContact O-N 3.37Å; M716-L719 PolarHBondContact O-N 2.89Å; M716-K720 WeakPolarHBondContact O-CB 3.46Å; M716-K720 PolarHBondContact O-N 2.97Å
717	D	90.7	Very high	87.7	Confident	113 Å²	113	72.9 Å²	72.9	60%	0.604	36%	0.362	S	S	*	.	H	α-helix	trans	-72.4	-33.6	176.5	-81.3	-39.8	0	0	0	111.4	G714 D715 K720 H721	G714-D717 PolarHBondContact O-N 3.05Å; D715-D717 VanDerWaalsContact C-N 3.34Å; D715-D717 PolarHBondContact O-N 3.31Å; D717-K720 PolarHBondContact O-N 3.37Å; D717-H721 VanDerWaalsContact O-CB 3.29Å; D717-H721 WeakPolarHBondContact O-CB 3.41Å; D717-H721 PolarHBondContact O-N 2.89Å
718	I	93.3	Very high	86.5	Confident	120 Å²	120	74.2 Å²	74.2	62%	0.615	38%	0.375	S	S	*	.	H	α-helix	trans	-63.9	-47.1	172.3	-60.6	171.6	0	0	0	109.9	G714 D715 K720 H721 K722	G714-I718 PolarHBondContact O-N 2.95Å; D715-I718 WeakPolarHBondContact O-CB 3.37Å; D715-I718 PolarHBondContact O-N 2.86Å; I718-K720 PolarHBondContact O-N 3.44Å; I718-H721 PolarHBondContact O-N 3.48Å; I718-K722 PolarHBondContact O-N 3.06Å
719	L	93.5	Very high	85.5	Confident	34 Å²	34	78.9 Å²	78.9	18%	0.178	40%	0.395	C	S	.	.	H	α-helix	trans	-62.1	-40.3	174.9	-67.8	-174.5	0	0	0	112.1	F389 D392 V393 A396 D715 M716 K722	F389-L719 HydrophobicContact CD2-CB 4.26Å; F389-L719 HydrophobicContact CE2-CB 3.84Å; D392-L719 HydrophobicContact CB-CD1 4.33Å; D392-L719 HydrophobicContact CB-CD2 4.01Å; V393-L719 HydrophobicContact CG2-CD1 3.96Å; A396-L719 HydrophobicContact CB-CD1 4.29Å; D715-L719 WeakPolarHBondContact O-CG 3.3Å; D715-L719 PolarHBondContact O-N 2.78Å; M716-L719 PolarHBondContact O-N 2.89Å; L719-K722 WeakPolarHBondContact O-CB 3.47Å; L719-K722 PolarHBondContact O-N 3.41Å
720	K	91.9	Very high	84.8	Confident	80 Å²	80	77.2 Å²	77.2	35%	0.348	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-43.7	175.8	-174.3	177.1	178.7	178	0	111.4	F389 M716 D717 I718 K722 W723 W724	F389-K720 HydrophobicContact CE2-CB 4.18Å; F389-K720 HydrophobicContact CZ-CB 4.43Å; M716-K720 WeakPolarHBondContact O-CB 3.46Å; M716-K720 PolarHBondContact O-N 2.97Å; D717-K720 PolarHBondContact O-N 3.37Å; I718-K720 PolarHBondContact O-N 3.44Å; K720-K722 PolarHBondContact O-N 3.26Å; K720-W723 PolarHBondContact O-N 3.49Å; K720-W723 VanDerWaalsContact O-N 3.13Å; K720-W724 HydrophobicContact CG-CE3 3.85Å; K720-W724 HydrophobicContact CG-CZ3 4.42Å; K720-W724 PolarHBondContact O-N 2.98Å
721	H	90.8	Very high	83.7	Confident	98 Å²	98	80.6 Å²	80.6	45%	0.454	41%	0.406	S	S	.	.	H	α-helix	trans	-67	-24.3	-177.2	-164.7	47.8	0	0	0	113.6	D717 I718 W723 W724 K726	D717-H721 VanDerWaalsContact O-CB 3.29Å; D717-H721 WeakPolarHBondContact O-CB 3.41Å; D717-H721 PolarHBondContact O-N 2.89Å; I718-H721 PolarHBondContact O-N 3.48Å; H721-W723 VanDerWaalsContact C-N 3.34Å; H721-W724 CarbonylContact O-C 3.55Å; H721-K726 PolarHBondContact CE1-N 3.28Å
722	K	91.4	Very high	82.4	Confident	122 Å²	122	78.7 Å²	78.7	53%	0.53	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-36.5	171.3	177.6	-174.4	168.4	-171	0	112.9	D392 I718 L719 K720	D392-K722 IonicContact OD1-NZ 2.68Å; D392-K722 PolarHBondContact OD1-NZ 3.04Å; D392-K722 WeakPolarHBondContact OD2-CD 3.47Å; D392-K722 WeakPolarHBondContact OD2-CE 3.47Å; D392-K722 IonicContact OD2-NZ 2.69Å; D392-K722 PolarHBondContact OD2-NZ 3.09Å; I718-K722 PolarHBondContact O-N 3.06Å; L719-K722 WeakPolarHBondContact O-CB 3.47Å; L719-K722 PolarHBondContact O-N 3.41Å; K720-K722 PolarHBondContact O-N 3.26Å
723	W	91.1	Very high	80.9	Confident	35 Å²	35	78.3 Å²	78.3	13%	0.133	39%	0.391	C	S	.	.	H	α-helix	trans	-100.8	-30.3	-177.2	-62.7	100	0	0	0	113.5	P371 M374 F389 D392 K720 H721 P725	P371-W723 HydrophobicContact CB-CE3 4.05Å; P371-W723 HydrophobicContact CG-CB 4.5Å; M374-W723 HydrophobicContact CE-CE3 4.01Å; M374-W723 HydrophobicContact CE-CH2 3.93Å; M374-W723 HydrophobicContact CE-CZ3 3.34Å; F389-W723 HydrophobicContact CB-CG 4.05Å; F389-W723 AromaticContact CD2-CD1 3.9Å; D392-W723 PolarHBondContact OD2-NE1 2.95Å; K720-W723 PolarHBondContact O-N 3.49Å; K720-W723 VanDerWaalsContact O-N 3.13Å; H721-W723 VanDerWaalsContact C-N 3.34Å; W723-P725 VanDerWaalsContact C-CD 3.48Å; W723-P725 VanDerWaalsContact O-CD 3.32Å; W723-P725 WeakPolarHBondContact O-CD 3.33Å
724	W	91.1	Very high	79.1	Confident	16 Å²	16	76.3 Å²	76.3	6%	0.061	38%	0.384	C	S	.	.	S	Bend	trans	-117.1	79	173.2	-65	-91.3	0	0	0	110.2	P371 F372 F389 M460 A663 K720 H721	P371-W724 HydrophobicContact CG-CH2 3.65Å; P371-W724 HydrophobicContact CG-CZ2 3.34Å; P371-W724 HydrophobicContact CG-CZ3 4.4Å; F372-W724 HydrophobicContact CE1-CH2 4.05Å; F372-W724 HydrophobicContact CE2-CH2 4.2Å; F372-W724 HydrophobicContact CE2-CZ2 4.16Å; F372-W724 AromaticContact CZ-CH2 3.87Å; F372-W724 HydrophobicContact CZ-CH2 3.87Å; F372-W724 HydrophobicContact CZ-CZ2 4.12Å; F389-W724 HydrophobicContact CB-CH2 4.14Å; F389-W724 HydrophobicContact CB-CZ3 3.87Å; F389-W724 HydrophobicContact CD1-CH2 4.04Å; F389-W724 AromaticContact CD1-CZ3 3.79Å; F389-W724 HydrophobicContact CD1-CZ3 3.79Å; F389-W724 HydrophobicContact CD2-CZ3 4.2Å; F389-W724 HydrophobicContact CE1-CZ3 4.37Å; F389-W724 HydrophobicContact CG-CH2 4.21Å; F389-W724 AromaticContact CG-CZ3 3.69Å; F389-W724 HydrophobicContact CG-CZ3 3.69Å; M460-W724 HydrophobicContact CE-CH2 4.16Å; M460-W724 HydrophobicContact CE-CZ2 4.37Å; M460-W724 HydrophobicContact CE-CZ3 4.37Å; M460-W724 HydrophobicContact SD-CH2 4.29Å; M460-W724 HydrophobicContact SD-CZ3 4.28Å; A663-W724 HydrophobicContact CB-CZ2 3.79Å; A663-W724 PolarHBondContact O-NE1 2.75Å; K720-W724 HydrophobicContact CG-CE3 3.85Å; K720-W724 HydrophobicContact CG-CZ3 4.42Å; K720-W724 PolarHBondContact O-N 2.98Å; H721-W724 CarbonylContact O-C 3.55Å
725	P	85.1	Confident	77.1	Confident	48 Å²	48	80.2 Å²	80.2	31%	0.312	41%	0.409	S	S	.	.			trans	-71.8	132.9	178.4	29.5	-34.8	0	0	0	111	I670 W723 N727	I670-P725 HydrophobicContact CG2-CG 4.32Å; W723-P725 VanDerWaalsContact C-CD 3.48Å; W723-P725 VanDerWaalsContact O-CD 3.32Å; W723-P725 WeakPolarHBondContact O-CD 3.33Å; P725-N727 PolarHBondContact O-N 2.8Å
726	K	70.7	Confident	74.9	Confident	169 Å²	169	83.4 Å²	83.4	74%	0.735	43%	0.43	S	S	*	.	S	Bend	trans	-65.1	-25.7	175.9	-67.7	179.9	178.8	178.4	0	113.2	H721	H721-K726 PolarHBondContact CE1-N 3.28Å
727	N	66.3	Low	72.2	Confident	155 Å²	155	88.8 Å²	88.8	83%	0.829	46%	0.459	S	S	*	.	S	Bend	trans	-109.2	65.7	177.4	-62.2	-10.4	0	0	0	109	P725	P725-N727 PolarHBondContact O-N 2.8Å
728	G	64.4	Low	69.9	Low	27 Å²	27	88.6 Å²	88.6	28%	0.278	46%	0.462	S	S	.	.			trans	-70.4	179.1	176.1	0	0	0	0	0	113.4	C730	G728-C730 VanDerWaalsContact C-N 3.33Å
729	Q	65.8	Low	67.3	Low	170 Å²	170	91.6 Å²	91.6	79%	0.794	47%	0.471	S	S	*	.	S	Bend	trans	-67.8	-39.5	168.6	-63.7	-172.1	13.9	0	0	110.5
730	C	71.2	Confident	65.1	Low	7 Å²	7	98.8 Å²	98.8	5%	0.047	50%	0.503	C	S	.	.	S	Bend	trans	-98.9	131.4	170.2	-53.8	0	0	0	0	110.6	D672 C675 G728	D672-C730 PolarHBondContact O-SG 2.95Å; C675-C730 WeakPolarHBondContact CA-SG 3.09Å; C675-C730 HydrophobicContact CB-CB 3.83Å; C675-C730 WeakPolarHBondContact CB-SG 3.2Å; C675-C730 WeakPolarHBondContact SG-CA 3.17Å; C675-C730 WeakPolarHBondContact SG-CB 3.42Å; C675-C730 CovalentContact SG-SG 2.04Å; C675-C730 PolarHBondContact SG-SG 3.27Å; G728-C730 VanDerWaalsContact C-N 3.33Å
731	D	65.1	Low	62.8	Low	81 Å²	81	104.4 Å²	104.4	43%	0.433	53%	0.528	S	S	.	.			trans	-86.6	118.3	170.3	-165	-31.4	0	0	0	109.3	Y733 S734	D731-Y733 PolarHBondContact OD1-N 2.77Å; D731-S734 PolarHBondContact OD1-N 3.2Å
732	L	60.5	Low	60.6	Low	31 Å²	31	103.6 Å²	103.6	16%	0.162	55%	0.546	C	S	.	.	S	Bend	trans	-82.7	-22.1	176.6	-83.7	176.3	0	0	0	113	E666 A669 I670	E666-L732 HydrophobicContact CB-CD1 4.42Å; E666-L732 HydrophobicContact CG-CD1 4.35Å; A669-L732 HydrophobicContact CB-CD2 3.85Å; I670-L732 HydrophobicContact CD1-CD1 4.16Å; I670-L732 HydrophobicContact CG1-CD1 3.74Å; I670-L732 HydrophobicContact CG1-CG 4.35Å
733	Y	55.1	Low	59	Low	152 Å²	152	101 Å²	101	60%	0.596	55%	0.553	S	S	*	*	S	Bend	trans	-108.1	-8.8	-170.4	-58.8	-74	0	0	0	113.3	D731 S735 V736	D731-Y733 PolarHBondContact OD1-N 2.77Å; Y733-S735 PolarHBondContact O-N 2.98Å; Y733-V736 PolarHBondContact O-N 2.75Å
734	S	50.8	Low	57.4	Low	56 Å²	56	104.2 Å²	104.2	39%	0.392	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	10.9	174.9	76.3	0	0	0	0	115.5	D731	D731-S734 PolarHBondContact OD1-N 3.2Å
735	S	47.9	Very low	56.2	Low	104 Å²	104	108.4 Å²	108.4	73%	0.727	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-21.4	164.3	53.9	0	0	0	0	112.2	Y733	Y733-S735 PolarHBondContact O-N 2.98Å
736	V	44.2	Very low	55.3	Low	123 Å²	123	109.5 Å²	109.5	75%	0.745	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-48.3	177	-175.1	0	0	0	0	111.3	Y733 T738	Y733-V736 PolarHBondContact O-N 2.75Å; V736-T738 PolarHBondContact O-N 2.84Å
737	D	36.8	Very low	55.5	Low	124 Å²	124	107.5 Å²	107.5	66%	0.663	61%	0.61	S	S	*	*			trans	-85.1	82.8	-171.2	-134.7	-4.3	0	0	0	111.8	K739	D737-K739 VanDerWaalsContact C-N 3.28Å; D737-K739 PolarHBondContact O-N 2.8Å
738	T	41.2	Very low	55.7	Low	109 Å²	109	106 Å²	106	67%	0.669	60%	0.596	S	S	*	*			trans	-68.2	80.3	176.1	42.7	0	0	0	0	111.7	V736 Q740	V736-T738 PolarHBondContact O-N 2.84Å; T738-Q740 VanDerWaalsContact C-N 3.32Å; T738-Q740 PolarHBondContact O-N 3.43Å
739	K	39.7	Very low	56	Low	183 Å²	183	106 Å²	106	80%	0.796	59%	0.591	S	S	*	*			trans	-61	95.3	163.3	-84.6	177.4	-179.5	159.2	0	109.5	D737 K741	D737-K739 VanDerWaalsContact C-N 3.28Å; D737-K739 PolarHBondContact O-N 2.8Å; K739-K741 PolarHBondContact O-N 2.81Å
740	Q	46.3	Very low	56.5	Low	184 Å²	184	101.6 Å²	101.6	86%	0.86	57%	0.57	S	S	*	*			trans	-65.5	71.9	-178.6	-67.1	-178.5	-14.1	0	0	112.6	T738 G742	T738-Q740 VanDerWaalsContact C-N 3.32Å; T738-Q740 PolarHBondContact O-N 3.43Å; Q740-G742 PolarHBondContact O-N 3.24Å
741	K	43.3	Very low	57.1	Low	199 Å²	199	102.7 Å²	102.7	87%	0.865	58%	0.579	S	S	*	*			trans	-69.3	100.9	147	-76.4	-175	175.4	-179.8	0	106.3	K739 G743	K739-K741 PolarHBondContact O-N 2.81Å; K741-G743 PolarHBondContact O-N 3.4Å
742	G	46	Very low	57.9	Low	81 Å²	81	99 Å²	99	84%	0.835	56%	0.561	S	S	*	*			trans	-57.7	102.1	170.1	0	0	0	0	0	109	Q740	Q740-G742 PolarHBondContact O-N 3.24Å
743	G	56.7	Low	59.1	Low	67 Å²	67	100.6 Å²	100.6	69%	0.691	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-67.7	139.4	-178	0	0	0	0	0	110.6	K741	K741-G743 PolarHBondContact O-N 3.4Å
744	A	58.1	Low	60.6	Low	102 Å²	102	99.3 Å²	99.3	84%	0.843	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-59.9	140	163.4	0	0	0	0	0	109	D746	A744-D746 PolarHBondContact O-N 3.15Å
745	L	64.4	Low	62.3	Low	104 Å²	104	99.7 Å²	99.7	55%	0.545	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-65.9	122.9	179.1	-68.6	162.6	0	0	0	109.5	L575 F750	L575-L745 HydrophobicContact CB-CD2 4.22Å; L575-L745 HydrophobicContact CD1-CD2 4.21Å; L575-L745 HydrophobicContact CD2-CD2 4.17Å; L575-L745 HydrophobicContact CG-CD2 4.44Å; L745-F750 HydrophobicContact CB-CE2 4.22Å; L745-F750 HydrophobicContact CD1-CE2 4.12Å
746	D	67.4	Low	64.2	Low	71 Å²	71	99.5 Å²	99.5	38%	0.38	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-67.3	140.2	177.2	-172.6	2.1	0	0	0	110.4	A744 K748 S749	A744-D746 PolarHBondContact O-N 3.15Å; D746-K748 PolarHBondContact O-N 2.98Å; D746-K748 PolarHBondContact OD1-N 3.4Å; D746-K748 VanDerWaalsContact OD2-CD 3.31Å; D746-K748 WeakPolarHBondContact OD2-CD 3.23Å; D746-K748 WeakPolarHBondContact OD2-CG 3.35Å; D746-S749 WeakPolarHBondContact O-CB 3.49Å; D746-S749 PolarHBondContact O-N 3.41Å
747	I	74.4	Confident	66.3	Low	127 Å²	127	98.8 Å²	98.8	65%	0.651	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-58.6	-28.4	176.8	-167.6	168.1	0	0	0	111.8	S749 F750 A751	I747-S749 VanDerWaalsContact C-N 3.26Å; I747-S749 PolarHBondContact O-N 2.78Å; I747-F750 PolarHBondContact O-N 3.21Å; I747-A751 PolarHBondContact O-N 2.99Å
748	K	70.2	Confident	68.9	Low	125 Å²	125	95.4 Å²	95.4	54%	0.543	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-57.8	-36.7	174.4	-62.1	-178.5	-167.4	165.7	0	112.7	V475 D746 F750 A751	V475-K748 HydrophobicContact CG1-CB 3.96Å; D746-K748 PolarHBondContact O-N 2.98Å; D746-K748 PolarHBondContact OD1-N 3.4Å; D746-K748 VanDerWaalsContact OD2-CD 3.31Å; D746-K748 WeakPolarHBondContact OD2-CD 3.23Å; D746-K748 WeakPolarHBondContact OD2-CG 3.35Å; K748-F750 PolarHBondContact O-N 3.02Å; K748-A751 WeakPolarHBondContact O-CB 3.39Å; K748-A751 PolarHBondContact O-N 3.17Å
749	S	70.7	Confident	71.3	Confident	26 Å²	26	93.1 Å²	93.1	18%	0.182	53%	0.534	C	S	.	.	G	3₁₀ helix	trans	-69.3	-18.1	178.5	-55	0	0	0	0	113.4	D746 I747	D746-S749 WeakPolarHBondContact O-CB 3.49Å; D746-S749 PolarHBondContact O-N 3.41Å; I747-S749 VanDerWaalsContact C-N 3.26Å; I747-S749 PolarHBondContact O-N 2.78Å
750	F	77.6	Confident	73.7	Confident	77 Å²	77	86.3 Å²	86.3	34%	0.338	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-103.8	-3.1	176	-80.6	-88.3	0	0	0	113.7	L745 I747 K748 G752 V753 F754	L745-F750 HydrophobicContact CB-CE2 4.22Å; L745-F750 HydrophobicContact CD1-CE2 4.12Å; I747-F750 PolarHBondContact O-N 3.21Å; K748-F750 PolarHBondContact O-N 3.02Å; F750-G752 VanDerWaalsContact C-N 3.31Å; F750-G752 PolarHBondContact O-N 2.94Å; F750-V753 HydrophobicContact CD1-CG2 4.17Å; F750-V753 WeakPolarHBondContact O-CB 3.45Å; F750-V753 PolarHBondContact O-N 3.4Å; F750-F754 HydrophobicContact CB-CD2 4.4Å; F750-F754 HydrophobicContact CB-CE2 4.01Å; F750-F754 WeakPolarHBondContact O-CD2 3.48Å; F750-F754 PolarHBondContact O-N 2.81Å
751	A	81.9	Confident	76	Confident	30 Å²	30	82.1 Å²	82.1	25%	0.248	50%	0.498	C	S	.	.	H	α-helix	trans	-54.6	-42.8	-174.3	0	0	0	0	0	113	M477 I747 K748 V753 F754 C755	M477-A751 HydrophobicContact CG-CB 4.08Å; I747-A751 PolarHBondContact O-N 2.99Å; K748-A751 WeakPolarHBondContact O-CB 3.39Å; K748-A751 PolarHBondContact O-N 3.17Å; A751-V753 VanDerWaalsContact C-N 3.28Å; A751-V753 PolarHBondContact O-N 2.87Å; A751-F754 PolarHBondContact O-N 3.28Å; A751-C755 PolarHBondContact O-N 2.99Å; A751-C755 PolarHBondContact O-SG 3.33Å
752	G	82.4	Confident	78.4	Confident	4 Å²	4	77.6 Å²	77.6	4%	0.041	49%	0.487	C	S	.	.	H	α-helix	trans	-60.4	-31.6	176.4	0	0	0	0	0	114.5	M477 F750 C755 I756	M477-G752 WeakPolarHBondContact O-CA 3.37Å; M477-G752 PolarHBondContact O-N 2.67Å; F750-G752 VanDerWaalsContact C-N 3.31Å; F750-G752 PolarHBondContact O-N 2.94Å; G752-C755 PolarHBondContact O-N 2.9Å; G752-I756 WeakPolarHBondContact O-CD1 3.43Å; G752-I756 VanDerWaalsContact O-CG1 3.25Å; G752-I756 WeakPolarHBondContact O-CG1 3.16Å; G752-I756 PolarHBondContact O-N 2.85Å
753	V	85.6	Confident	80.6	Confident	65 Å²	65	78.5 Å²	78.5	39%	0.394	47%	0.472	S	S	.	.	H	α-helix	trans	-68	-44.4	177.4	-173.7	0	0	0	0	110.4	C480 F750 A751 C755 I756 L757	C480-V753 HydrophobicContact CB-CG2 4.27Å; C480-V753 WeakPolarHBondContact SG-CG2 3.17Å; F750-V753 HydrophobicContact CD1-CG2 4.17Å; F750-V753 WeakPolarHBondContact O-CB 3.45Å; F750-V753 PolarHBondContact O-N 3.4Å; A751-V753 VanDerWaalsContact C-N 3.28Å; A751-V753 PolarHBondContact O-N 2.87Å; V753-C755 VanDerWaalsContact C-N 3.35Å; V753-I756 PolarHBondContact O-N 3.37Å; V753-L757 PolarHBondContact O-N 3.43Å
754	F	86.9	Confident	82.3	Confident	124 Å²	124	78.9 Å²	78.9	54%	0.544	46%	0.464	S	S	.	.	H	α-helix	trans	-64.7	-38.4	174.8	-66.2	-70.6	0	0	0	112	F750 A751 L757 A758	F750-F754 HydrophobicContact CB-CD2 4.4Å; F750-F754 HydrophobicContact CB-CE2 4.01Å; F750-F754 WeakPolarHBondContact O-CD2 3.48Å; F750-F754 PolarHBondContact O-N 2.81Å; A751-F754 PolarHBondContact O-N 3.28Å; F754-L757 PolarHBondContact O-N 2.89Å; F754-A758 WeakPolarHBondContact O-CB 3.03Å; F754-A758 PolarHBondContact O-N 2.99Å
755	C	86.4	Confident	83.9	Confident	65 Å²	65	77.4 Å²	77.4	44%	0.439	45%	0.447	S	S	.	.	H	α-helix	trans	-62.1	-43.3	173.8	-67.9	0	0	0	0	112.5	A751 G752 V753 A758 A759	A751-C755 PolarHBondContact O-N 2.99Å; A751-C755 PolarHBondContact O-SG 3.33Å; G752-C755 PolarHBondContact O-N 2.9Å; V753-C755 VanDerWaalsContact C-N 3.35Å; C755-A758 PolarHBondContact O-N 2.96Å; C755-A759 WeakPolarHBondContact O-CB 3.39Å; C755-A759 PolarHBondContact O-N 3.01Å
756	I	88	Confident	85.1	Confident	99 Å²	99	78.2 Å²	78.2	51%	0.508	45%	0.446	S	S	.	.	H	α-helix	trans	-64.5	-43.1	176.9	-70.4	163.4	0	0	0	110.8	G752 V753 A759 G760	G752-I756 WeakPolarHBondContact O-CD1 3.43Å; G752-I756 VanDerWaalsContact O-CG1 3.25Å; G752-I756 WeakPolarHBondContact O-CG1 3.16Å; G752-I756 PolarHBondContact O-N 2.85Å; V753-I756 PolarHBondContact O-N 3.37Å; I756-A759 PolarHBondContact O-N 2.96Å; I756-G760 PolarHBondContact O-N 3.41Å
757	L	89.2	Confident	86.2	Confident	108 Å²	108	78.5 Å²	78.5	57%	0.565	45%	0.447	S	S	*	.	H	α-helix	trans	-61	-47.4	176.1	178.9	61.5	0	0	0	111.8	V753 F754 A759 G760 I761	V753-L757 PolarHBondContact O-N 3.43Å; F754-L757 PolarHBondContact O-N 2.89Å; L757-A759 PolarHBondContact O-N 2.87Å; L757-G760 PolarHBondContact O-N 3.44Å; L757-I761 HydrophobicContact CD1-CD1 4.21Å; L757-I761 HydrophobicContact CG-CD1 4.12Å; L757-I761 WeakPolarHBondContact O-CG1 3.34Å; L757-I761 PolarHBondContact O-N 2.93Å
758	A	90.3	Very high	87	Confident	54 Å²	54	74.8 Å²	74.8	45%	0.446	44%	0.435	S	S	.	.	H	α-helix	trans	-61.3	-43.7	177.7	0	0	0	0	0	112	F754 C755 G760 I761 V762	F754-A758 WeakPolarHBondContact O-CB 3.03Å; F754-A758 PolarHBondContact O-N 2.99Å; C755-A758 PolarHBondContact O-N 2.96Å; A758-G760 VanDerWaalsContact C-N 3.34Å; A758-G760 PolarHBondContact O-N 3.22Å; A758-I761 PolarHBondContact O-N 3.37Å; A758-V762 WeakPolarHBondContact O-CG2 3.48Å; A758-V762 PolarHBondContact O-N 2.86Å
759	A	91.1	Very high	87.8	Confident	61 Å²	61	75.1 Å²	75.1	50%	0.504	44%	0.44	S	S	.	.	H	α-helix	trans	-61.6	-40.6	175.3	0	0	0	0	0	112.2	C755 I756 L757 V762 L763	C755-A759 WeakPolarHBondContact O-CB 3.39Å; C755-A759 PolarHBondContact O-N 3.01Å; I756-A759 PolarHBondContact O-N 2.96Å; L757-A759 PolarHBondContact O-N 2.87Å; A759-V762 PolarHBondContact O-N 3.26Å; A759-L763 VanDerWaalsContact O-CB 3.29Å; A759-L763 WeakPolarHBondContact O-CB 3.32Å; A759-L763 PolarHBondContact O-N 3.12Å
760	G	91.5	Very high	88.6	Confident	39 Å²	39	77.6 Å²	77.6	40%	0.402	45%	0.451	S	S	.	.	H	α-helix	trans	-62.6	-42.2	175.6	0	0	0	0	0	113.2	I756 L757 A758 S764	I756-G760 PolarHBondContact O-N 3.41Å; L757-G760 PolarHBondContact O-N 3.44Å; A758-G760 VanDerWaalsContact C-N 3.34Å; A758-G760 PolarHBondContact O-N 3.22Å; G760-S764 WeakPolarHBondContact O-CB 3.16Å; G760-S764 PolarHBondContact O-N 3.43Å
761	I	93.8	Very high	89.1	Confident	97 Å²	97	79.5 Å²	79.5	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-64.2	-48.8	176.1	-66.4	164.7	0	0	0	110.6	L757 A758 L763 S764 C765	L757-I761 HydrophobicContact CD1-CD1 4.21Å; L757-I761 HydrophobicContact CG-CD1 4.12Å; L757-I761 WeakPolarHBondContact O-CG1 3.34Å; L757-I761 PolarHBondContact O-N 2.93Å; A758-I761 PolarHBondContact O-N 3.37Å; I761-L763 VanDerWaalsContact C-N 3.34Å; I761-L763 PolarHBondContact O-N 3.22Å; I761-S764 WeakPolarHBondContact O-CB 3.21Å; I761-S764 PolarHBondContact O-N 2.84Å; I761-C765 PolarHBondContact O-N 3.45Å; I761-C765 PolarHBondContact O-SG 3.05Å; I761-C765 VanDerWaalsContact O-SG 3.38Å
762	V	93.4	Very high	89.3	Confident	103 Å²	103	82.4 Å²	82.4	62%	0.624	48%	0.476	S	S	*	.	H	α-helix	trans	-60.8	-42.6	178.6	171.8	0	0	0	0	111.4	A758 A759 C765 F766	A758-V762 WeakPolarHBondContact O-CG2 3.48Å; A758-V762 PolarHBondContact O-N 2.86Å; A759-V762 PolarHBondContact O-N 3.26Å; V762-C765 PolarHBondContact O-N 3.4Å; V762-F766 WeakPolarHBondContact O-CB 3.49Å; V762-F766 PolarHBondContact O-N 3.32Å
763	L	92.7	Very high	89.3	Confident	100 Å²	100	88 Å²	88	52%	0.524	50%	0.496	S	S	.	.	H	α-helix	trans	-64.3	-41.1	176.3	-178.2	60.5	0	0	0	112	A759 I761 F766 I767	A759-L763 VanDerWaalsContact O-CB 3.29Å; A759-L763 WeakPolarHBondContact O-CB 3.32Å; A759-L763 PolarHBondContact O-N 3.12Å; I761-L763 VanDerWaalsContact C-N 3.34Å; I761-L763 PolarHBondContact O-N 3.22Å; L763-F766 PolarHBondContact O-N 2.84Å; L763-I767 HydrophobicContact CD1-CD1 4.1Å; L763-I767 HydrophobicContact CD1-CG1 4.33Å; L763-I767 HydrophobicContact CG-CD1 3.95Å; L763-I767 VanDerWaalsContact O-CG1 3.3Å; L763-I767 WeakPolarHBondContact O-CG1 3.4Å; L763-I767 PolarHBondContact O-N 2.86Å
764	S	91.9	Very high	89.1	Confident	76 Å²	76	92 Å²	92	53%	0.531	50%	0.504	S	S	.	.	H	α-helix	trans	-61.1	-47.9	175.2	-176.1	0	0	0	0	111.8	G760 I761 F766 I767 A768	G760-S764 WeakPolarHBondContact O-CB 3.16Å; G760-S764 PolarHBondContact O-N 3.43Å; I761-S764 WeakPolarHBondContact O-CB 3.21Å; I761-S764 PolarHBondContact O-N 2.84Å; S764-F766 VanDerWaalsContact C-N 3.33Å; S764-F766 PolarHBondContact O-N 3.29Å; S764-I767 PolarHBondContact O-N 3.01Å; S764-A768 WeakPolarHBondContact O-CB 3.44Å; S764-A768 PolarHBondContact O-N 3.41Å
765	C	91.2	Very high	88.6	Confident	71 Å²	71	91 Å²	91	48%	0.48	50%	0.504	S	S	.	.	H	α-helix	trans	-60.4	-40.7	174.9	-66.4	0	0	0	0	112.4	I761 V762 A768 M769	I761-C765 PolarHBondContact O-N 3.45Å; I761-C765 PolarHBondContact O-SG 3.05Å; I761-C765 VanDerWaalsContact O-SG 3.38Å; V762-C765 PolarHBondContact O-N 3.4Å; C765-A768 PolarHBondContact O-N 3.31Å; C765-M769 WeakPolarHBondContact O-CG 3.4Å; C765-M769 PolarHBondContact O-N 2.97Å
766	F	90.9	Very high	87.8	Confident	121 Å²	121	96.4 Å²	96.4	53%	0.531	52%	0.52	S	S	.	.	H	α-helix	trans	-65.4	-42.4	177.2	-178.3	-108.6	0	0	0	112.4	V762 L763 S764 M769 L770	V762-F766 WeakPolarHBondContact O-CB 3.49Å; V762-F766 PolarHBondContact O-N 3.32Å; L763-F766 PolarHBondContact O-N 2.84Å; S764-F766 VanDerWaalsContact C-N 3.33Å; S764-F766 PolarHBondContact O-N 3.29Å; F766-M769 PolarHBondContact O-N 3.47Å; F766-L770 HydrophobicContact CD1-CD1 3.98Å; F766-L770 HydrophobicContact CE1-CD1 3.48Å; F766-L770 VanDerWaalsContact CE1-CD1 3.48Å; F766-L770 HydrophobicContact CE1-CG 4.24Å; F766-L770 HydrophobicContact CZ-CD1 3.83Å; F766-L770 HydrophobicContact CZ-CD2 4.49Å; F766-L770 HydrophobicContact CZ-CG 4.24Å; F766-L770 WeakPolarHBondContact O-CG 3.47Å; F766-L770 PolarHBondContact O-N 3.28Å
767	I	90.4	Very high	86.8	Confident	76 Å²	76	99.4 Å²	99.4	39%	0.39	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-46.1	174.3	-69.6	166.7	0	0	0	110.3	L763 S764 M769 L770 E771	L763-I767 HydrophobicContact CD1-CD1 4.1Å; L763-I767 HydrophobicContact CD1-CG1 4.33Å; L763-I767 HydrophobicContact CG-CD1 3.95Å; L763-I767 VanDerWaalsContact O-CG1 3.3Å; L763-I767 WeakPolarHBondContact O-CG1 3.4Å; L763-I767 PolarHBondContact O-N 2.86Å; S764-I767 PolarHBondContact O-N 3.01Å; I767-M769 VanDerWaalsContact C-N 3.31Å; I767-M769 PolarHBondContact O-N 3.25Å; I767-L770 CarbonylContact O-C 3.54Å; I767-L770 PolarHBondContact O-N 2.93Å; I767-E771 HydrophobicContact CG2-CG 4.26Å; I767-E771 WeakPolarHBondContact O-CG 2.96Å; I767-E771 PolarHBondContact O-N 3.27Å
768	A	90.4	Very high	85.3	Confident	49 Å²	49	101 Å²	101	41%	0.405	53%	0.528	S	S	.	.	H	α-helix	trans	-61.2	-36.2	177.2	0	0	0	0	0	113.1	S764 C765 T772	S764-A768 WeakPolarHBondContact O-CB 3.44Å; S764-A768 PolarHBondContact O-N 3.41Å; C765-A768 PolarHBondContact O-N 3.31Å; A768-T772 WeakPolarHBondContact O-CB 3.14Å; A768-T772 WeakPolarHBondContact O-CG2 3.45Å; A768-T772 PolarHBondContact O-N 2.92Å; A768-T772 PolarHBondContact O-OG1 2.83Å
769	M	87.6	Confident	83.4	Confident	132 Å²	132	101.1 Å²	101.1	65%	0.65	53%	0.534	S	S	*	.	H	α-helix	trans	-66	-42.6	171.2	-73.7	-173.4	-176.5	0	0	112.1	C765 F766 I767 T772 W773	C765-M769 WeakPolarHBondContact O-CG 3.4Å; C765-M769 PolarHBondContact O-N 2.97Å; F766-M769 PolarHBondContact O-N 3.47Å; I767-M769 VanDerWaalsContact C-N 3.31Å; I767-M769 PolarHBondContact O-N 3.25Å; M769-T772 PolarHBondContact O-OG1 3.48Å; M769-W773 WeakPolarHBondContact O-CB 3.15Å; M769-W773 PolarHBondContact O-N 3.18Å
770	L	87.1	Confident	81.4	Confident	79 Å²	79	103.1 Å²	103.1	41%	0.414	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-41.7	176	-73.7	179.2	0	0	0	112.2	F766 I767 W773 W774	F766-L770 HydrophobicContact CD1-CD1 3.98Å; F766-L770 HydrophobicContact CE1-CD1 3.48Å; F766-L770 VanDerWaalsContact CE1-CD1 3.48Å; F766-L770 HydrophobicContact CE1-CG 4.24Å; F766-L770 HydrophobicContact CZ-CD1 3.83Å; F766-L770 HydrophobicContact CZ-CD2 4.49Å; F766-L770 HydrophobicContact CZ-CG 4.24Å; F766-L770 WeakPolarHBondContact O-CG 3.47Å; F766-L770 PolarHBondContact O-N 3.28Å; I767-L770 CarbonylContact O-C 3.54Å; I767-L770 PolarHBondContact O-N 2.93Å; L770-W773 PolarHBondContact O-N 3.33Å; L770-W774 WeakPolarHBondContact O-CB 3.47Å; L770-W774 PolarHBondContact O-N 3.36Å
771	E	89.4	Confident	79.4	Confident	117 Å²	117	112.4 Å²	112.4	55%	0.547	57%	0.567	S	S	.	*	H	α-helix	trans	-65.1	-46.3	177.7	-73.5	-172.5	162.2	0	0	112	I767 W773 W774 N775	I767-E771 HydrophobicContact CG2-CG 4.26Å; I767-E771 WeakPolarHBondContact O-CG 2.96Å; I767-E771 PolarHBondContact O-N 3.27Å; E771-W773 VanDerWaalsContact C-N 3.31Å; E771-W773 PolarHBondContact O-N 3.12Å; E771-W774 PolarHBondContact O-N 2.93Å; E771-N775 VanDerWaalsContact O-CB 3.24Å; E771-N775 WeakPolarHBondContact O-CB 3.46Å; E771-N775 VanDerWaalsContact O-CG 3.3Å; E771-N775 PolarHBondContact O-N 3.31Å; E771-N775 PolarHBondContact O-ND2 3.21Å
772	T	85.1	Confident	76.8	Confident	90 Å²	90	113.6 Å²	113.6	55%	0.552	58%	0.578	S	S	*	*	H	α-helix	trans	-64.8	-34.9	176.3	49	0	0	0	0	112.4	A768 M769 K776	A768-T772 WeakPolarHBondContact O-CB 3.14Å; A768-T772 WeakPolarHBondContact O-CG2 3.45Å; A768-T772 PolarHBondContact O-N 2.92Å; A768-T772 PolarHBondContact O-OG1 2.83Å; M769-T772 PolarHBondContact O-OG1 3.48Å; T772-K776 VanDerWaalsContact O-CB 3.32Å; T772-K776 WeakPolarHBondContact O-CB 3.34Å; T772-K776 WeakPolarHBondContact O-CG 2.96Å; T772-K776 PolarHBondContact O-N 2.9Å
773	W	82.8	Confident	74.4	Confident	121 Å²	121	114.4 Å²	114.4	46%	0.458	59%	0.586	S	S	.	*	H	α-helix	trans	-68.5	-44.1	172.8	-178.2	93.8	0	0	0	112.7	M769 L770 E771 K776 R777	M769-W773 WeakPolarHBondContact O-CB 3.15Å; M769-W773 PolarHBondContact O-N 3.18Å; L770-W773 PolarHBondContact O-N 3.33Å; E771-W773 VanDerWaalsContact C-N 3.31Å; E771-W773 PolarHBondContact O-N 3.12Å; W773-K776 PolarHBondContact O-N 2.03Å; W773-R777 VanDerWaalsContact CH2-NH1 3.29Å; W773-R777 VanDerWaalsContact CZ2-NH1 3.34Å; W773-R777 WeakPolarHBondContact O-CG 3.45Å; W773-R777 PolarHBondContact O-N 3.25Å
774	W	80.4	Confident	72	Confident	149 Å²	149	114.8 Å²	114.8	56%	0.564	60%	0.597	S	S	*	*	H	α-helix	trans	-69.7	-39.1	-179.7	-161.4	-85.4	0	0	0	111.8	L770 E771 R777 K778	L770-W774 WeakPolarHBondContact O-CB 3.47Å; L770-W774 PolarHBondContact O-N 3.36Å; E771-W774 PolarHBondContact O-N 2.93Å; W774-R777 PolarHBondContact O-N 3.17Å; W774-K778 PolarHBondContact O-N 2.97Å
775	N	76.1	Confident	69.3	Low	103 Å²	103	120 Å²	120	55%	0.551	61%	0.61	S	S	*	*	H	α-helix	trans	-70.9	-38.3	174.8	-71.3	-23.6	0	0	0	111.8	E771 R777 K778 G779	E771-N775 VanDerWaalsContact O-CB 3.24Å; E771-N775 WeakPolarHBondContact O-CB 3.46Å; E771-N775 VanDerWaalsContact O-CG 3.3Å; E771-N775 PolarHBondContact O-N 3.31Å; E771-N775 PolarHBondContact O-ND2 3.21Å; N775-R777 VanDerWaalsContact C-N 3.27Å; N775-R777 PolarHBondContact O-N 3.3Å; N775-K778 PolarHBondContact O-N 2.91Å; N775-G779 PolarHBondContact O-N 3.43Å
776	K	71.3	Confident	67.2	Low	179 Å²	179	124.8 Å²	124.8	78%	0.778	63%	0.625	S	S	*	*	H	α-helix	trans	-59.1	-37.3	168.2	-85.2	-176.9	172.8	179.7	0	112.5	T772 W773	T772-K776 VanDerWaalsContact O-CB 3.32Å; T772-K776 WeakPolarHBondContact O-CB 3.34Å; T772-K776 WeakPolarHBondContact O-CG 2.96Å; T772-K776 PolarHBondContact O-N 2.9Å; W773-K776 PolarHBondContact O-N 2.03Å
777	R	65.6	Low	64.8	Low	162 Å²	162	125.2 Å²	125.2	61%	0.611	63%	0.633	S	S	*	*	H	α-helix	trans	-72.1	-39.8	176	-75.4	178.7	169.4	-146.7	-5.7	113.2	W773 W774 N775	W773-R777 VanDerWaalsContact CH2-NH1 3.29Å; W773-R777 VanDerWaalsContact CZ2-NH1 3.34Å; W773-R777 WeakPolarHBondContact O-CG 3.45Å; W773-R777 PolarHBondContact O-N 3.25Å; W774-R777 PolarHBondContact O-N 3.17Å; N775-R777 VanDerWaalsContact C-N 3.27Å; N775-R777 PolarHBondContact O-N 3.3Å
778	K	57.5	Low	62.4	Low	143 Å²	143	128.7 Å²	128.7	62%	0.622	65%	0.653	S	S	*	*	H	α-helix	trans	-70.2	-32.3	174.4	-83.2	-174.5	169.9	179.8	0	113.3	W774 N775 S780 R781	W774-K778 PolarHBondContact O-N 2.97Å; N775-K778 PolarHBondContact O-N 2.91Å; K778-S780 PolarHBondContact O-N 3.33Å; K778-S780 VanDerWaalsContact O-N 3.08Å; K778-R781 PolarHBondContact O-N 3.26Å
779	G	50.7	Low	60.1	Low	56 Å²	56	136.6 Å²	136.6	58%	0.577	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-61.2	-14.5	177.3	0	0	0	0	0	114.7	N775 R781	N775-G779 PolarHBondContact O-N 3.43Å; G779-R781 PolarHBondContact O-N 3.43Å
780	S	49.6	Very low	58	Low	102 Å²	102	138.6 Å²	138.6	71%	0.713	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-79.3	13.5	178.6	-167.2	0	0	0	0	114.8	K778	K778-S780 PolarHBondContact O-N 3.33Å; K778-S780 VanDerWaalsContact O-N 3.08Å
781	R	48.8	Very low	56.1	Low	234 Å²	234	142.6 Å²	142.6	88%	0.883	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-138.1	40.8	179.2	-75.9	-165.5	175.8	-178.2	-0.4	115.1	K778 G779	K778-R781 PolarHBondContact O-N 3.26Å; G779-R781 PolarHBondContact O-N 3.43Å
782	V	40.3	Very low	54	Low	122 Å²	122	142.7 Å²	142.7	74%	0.739	71%	0.71	S	S	*	*	S	Bend	trans	-132.5	134	153.6	-175	0	0	0	0	107.3
783	P	42.2	Very low	52.1	Low	120 Å²	120	145.6 Å²	145.6	78%	0.779	72%	0.721	S	S	*	*			trans	-65.7	152.3	175.7	-17.8	31.4	0	0	0	111.5	K785	P783-K785 PolarHBondContact O-N 3.04Å
784	S	42.3	Very low	50.3	Low	108 Å²	108	146.5 Å²	146.5	76%	0.755	73%	0.73	S	S	*	*			trans	-59.5	129.1	169.2	48.3	0	0	0	0	111
785	K	36.2	Very low	48.7	Very low	187 Å²	187	145.5 Å²	145.5	81%	0.813	73%	0.732	S	S	*	*			trans	-109.4	116.5	144.3	-116.6	-164.9	167.7	-137.8	0	107.4	P783	P783-K785 PolarHBondContact O-N 3.04Å
786	E	46	Very low	47.2	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.794	74%	0.738	S	S	*	*			trans	-73.3	126.1	158	-67.7	162.7	115.8	0	0	106.9
787	D	41.4	Very low	46	Very low	130 Å²	130	145.5 Å²	145.5	70%	0.695	74%	0.735	S	S	*	*			trans	-179.4	-179.7	152	-84.8	-33	0	0	0	105.8	K789	D787-K789 PolarHBondContact O-N 2.63Å
788	D	40.4	Very low	45	Very low	150 Å²	150	146 Å²	146	80%	0.802	74%	0.737	S	S	*	*			trans	58.3	40.7	-178.1	-57.4	-16.2	0	0	0	114.8
789	K	41.3	Very low	44.3	Very low	214 Å²	214	149.2 Å²	149.2	93%	0.93	75%	0.745	S	S	*	*	S	Bend	trans	-100.1	21	157.5	-111.3	-170.5	-178.5	-176.4	0	113.5	D787	D787-K789 PolarHBondContact O-N 2.63Å
790	E	44.3	Very low	44.1	Very low	174 Å²	174	151.6 Å²	151.6	81%	0.813	75%	0.748	S	S	*	*	S	Bend	trans	-129.9	171.5	164.1	-80.2	-177.4	126.6	0	0	108.5
791	I	47.4	Very low	43.7	Very low	164 Å²	164	153.8 Å²	153.8	84%	0.841	75%	0.752	S	S	*	*	S	Bend	trans	69.6	61.3	-178	-36	171.6	0	0	0	115
792	D	43.4	Very low	43.3	Very low	118 Å²	118	146.9 Å²	146.9	63%	0.631	74%	0.739	S	S	*	*	S	Bend	trans	-158.5	-20.4	136.7	-154.8	16.7	0	0	0	113.4	E794 H795	D792-E794 PolarHBondContact O-N 3.25Å; D792-H795 PolarHBondContact O-N 2.64Å
793	L	46.4	Very low	43.2	Very low	151 Å²	151	148.7 Å²	148.7	79%	0.791	74%	0.744	S	S	*	*	H	α-helix	trans	-63.6	-15.1	-175.2	-145.9	72.7	0	0	0	114.8
794	E	45.3	Very low	42.9	Very low	140 Å²	140	148.3 Å²	148.3	65%	0.654	74%	0.743	S	S	*	*	H	α-helix	trans	-78.7	-26.9	173	-73.5	-144.1	140	0	0	114.6	D792 R798	D792-E794 PolarHBondContact O-N 3.25Å; E794-R798 IonicContact OE2-NH2 2.83Å; E794-R798 PolarHBondContact OE2-NH2 3.18Å
795	H	46.1	Very low	42.6	Very low	129 Å²	129	149 Å²	149	60%	0.597	74%	0.743	S	S	*	*	H	α-helix	trans	-78.5	-27.5	-177.7	-92.6	-69.6	0	0	0	112.4	D792	D792-H795 PolarHBondContact O-N 2.64Å
796	L	45.8	Very low	42.5	Very low	130 Å²	130	146.9 Å²	146.9	68%	0.681	74%	0.74	S	S	*	*	H	α-helix	trans	-68.9	-41.2	177.5	-154.1	71.9	0	0	0	112	R798 R799	L796-R798 VanDerWaalsContact C-N 3.33Å; L796-R798 PolarHBondContact O-N 3.34Å; L796-R799 PolarHBondContact O-N 3.32Å
797	H	46	Very low	42	Very low	152 Å²	152	145.9 Å²	145.9	70%	0.704	74%	0.74	S	S	*	*	H	α-helix	trans	-69.8	-25.7	-177.8	-112.5	98.1	0	0	0	114.1	R799	H797-R799 VanDerWaalsContact C-N 3.33Å; H797-R799 PolarHBondContact O-N 3.05Å
798	R	44.4	Very low	41.5	Very low	173 Å²	173	146.1 Å²	146.1	65%	0.653	74%	0.741	S	S	*	*	H	α-helix	trans	-82.9	-1.2	179.4	-97	179.9	-84.5	-177.3	-8.6	114.8	E794 L796	E794-R798 IonicContact OE2-NH2 2.83Å; E794-R798 PolarHBondContact OE2-NH2 3.18Å; L796-R798 VanDerWaalsContact C-N 3.33Å; L796-R798 PolarHBondContact O-N 3.34Å
799	R	42.6	Very low	41.1	Very low	209 Å²	209	143.5 Å²	143.5	79%	0.789	74%	0.735	S	S	*	*	H	α-helix	trans	-112.1	-10.6	-179.4	-120.9	176.2	-176.3	156.3	0.7	115.5	L796 H797	L796-R799 PolarHBondContact O-N 3.32Å; H797-R799 VanDerWaalsContact C-N 3.33Å; H797-R799 PolarHBondContact O-N 3.05Å
800	V	46.8	Very low	41.7	Very low	107 Å²	107	137.9 Å²	137.9	65%	0.648	72%	0.72	S	S	*	*	H	α-helix	trans	-85.2	-27.6	-178.2	177.1	0	0	0	0	112.4	S802	V800-S802 PolarHBondContact O-N 2.95Å
801	N	41.1	Very low	40.9	Very low	148 Å²	148	137.1 Å²	137.1	79%	0.791	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	25.7	-175.4	-73.7	1.4	0	0	0	114.8
802	S	39.2	Very low	40	Very low	89 Å²	89	138.1 Å²	138.1	62%	0.622	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	24.9	176.7	80.3	0	0	0	0	114.3	V800	V800-S802 PolarHBondContact O-N 2.95Å
803	L	38.4	Very low	39.3	Very low	159 Å²	159	140.6 Å²	140.6	83%	0.832	72%	0.723	S	S	*	*			trans	-128.9	63.4	172.7	-90.4	163.1	0	0	0	110.4
804	C	36.3	Very low	38.3	Very low	113 Å²	113	142.4 Å²	142.4	76%	0.764	72%	0.724	S	S	*	*			trans	-123.9	134.3	152.3	-71.3	0	0	0	0	106.1
805	T	36	Very low	37.3	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	72%	0.724	S	S	*	*	S	Bend	trans	52.3	111.5	167.2	55.1	0	0	0	0	117.4
806	D	34.6	Very low	36.5	Very low	142 Å²	142	139.6 Å²	139.6	76%	0.759	73%	0.73	S	S	*	*			cis	-144.1	-154.6	-2.4	-75	-59.3	0	0	0	106.9
807	D	34.3	Very low	35.9	Very low	149 Å²	149	138.2 Å²	138.2	80%	0.797	73%	0.731	S	S	*	*			cis	-161.3	-171.7	12.2	-154.6	-6.9	0	0	0	111.8
808	D	31.8	Very low	35.1	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	73%	0.731	S	S	*	*			trans	-25.6	115.2	179.6	-112.4	-34	0	0	0	120.8
809	S	31.8	Very low	34.5	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	74%	0.738	S	S	*	*				32.5	164.5	124	82.2	0	0	0	0	123.7
810	P	52.5	Low	33.7	Very low	95 Å²	95	131.8 Å²	131.8	62%	0.617	74%	0.737	S	S	*	*			cis	-134	162.4	-31.1	34.3	-17.8	0	0	0	115.1
811	H	29	Very low	32.8	Very low	159 Å²	159	135.1 Å²	135.1	74%	0.736	75%	0.75	S	S	*	*				154.8	143.6	126.3	-83.6	-39.1	0	0	0	115.8
812	K	28.8	Very low	32.3	Very low	184 Å²	184	134 Å²	134	80%	0.8	75%	0.748	S	S	*	*			trans	38.1	128.4	144.6	-56	175.7	-179	173.9	0	118.2
813	Q	27.2	Very low	32.2	Very low	171 Å²	171	135.2 Å²	135.2	80%	0.799	76%	0.755	S	S	*	*				-156.2	177.8	51.3	-78.8	-173.9	-78.9	0	0	114
814	F	25.1	Very low	31.7	Very low	188 Å²	188	136.1 Å²	136.1	83%	0.825	76%	0.759	S	S	*	*			trans	-33.1	162	165.4	-50.1	-84.2	0	0	0	116.4
815	S	25.9	Very low	31.2	Very low	94 Å²	94	137.2 Å²	137.2	66%	0.657	76%	0.757	S	S	*	*			cis	-168.8	161.2	43.3	-174.3	0	0	0	0	115.3
816	T	29	Very low	30.9	Very low	116 Å²	116	137.4 Å²	137.4	71%	0.712	75%	0.753	S	S	*	*			trans	52.8	102.1	152	39.9	0	0	0	0	118.7
817	S	31.8	Very low	30.6	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	75%	0.75	S	S	*	*				74.8	134.8	82.5	72.5	0	0	0	0	114.6
818	S	29.2	Very low	30.4	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	74%	0.743	S	S	*	*				-179	176.4	63.5	51.2	0	0	0	0	113.9
819	I	31.7	Very low	30.5	Very low	156 Å²	156	135.6 Å²	135.6	80%	0.8	75%	0.746	S	S	*	*			trans	84.9	132.2	164.1	-62	164.6	0	0	0	117.1
820	D	26.2	Very low	31	Very low	144 Å²	144	135.9 Å²	135.9	77%	0.77	75%	0.746	S	S	*	*			trans	-88.5	152.1	-170	-47.6	-93.8	0	0	0	114.8
821	L	29	Very low	29.9	Very low	177 Å²	177	138.9 Å²	138.9	93%	0.927	76%	0.763	S	S	*	*			trans	-137	126.4	144.3	-87.6	172.6	0	0	0	108.9
822	T	30.1	Very low	29.9	Very low	124 Å²	124	141.6 Å²	141.6	76%	0.761	77%	0.766	S	S	*	*			trans	-85.8	175	170.9	54.3	0	0	0	0	110.2
823	P	36.4	Very low	29.9	Very low	116 Å²	116	140.9 Å²	140.9	75%	0.753	77%	0.766	S	S	*	*			cis	-126.9	173.3	-2	41.5	-27.7	0	0	0	114.5
824	L	27.7	Very low	30	Very low	177 Å²	177	137.4 Å²	137.4	93%	0.927	77%	0.767	S	S	*	*			trans	-156.6	147.1	151	-113.4	163.5	0	0	0	109.6
825	D	26.3	Very low	30.2	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	76%	0.763	S	S	*	*			trans	-149.3	159.4	-175.4	-168.8	10.5	0	0	0	108.9
826	I	30.1	Very low	30.3	Very low	127 Å²	127	138 Å²	138	65%	0.651	77%	0.766	S	S	*	*			trans	62.9	110.6	173.7	-63.3	162	0	0	0	114.2
827	D	27.9	Very low	30.2	Very low	130 Å²	130	139.5 Å²	139.5	70%	0.695	76%	0.764	S	S	*	*				-154.3	141.2	72	-98.1	-44.9	0	0	0	111
828	T	31.4	Very low	30	Very low	106 Å²	106	141.5 Å²	141.5	65%	0.65	77%	0.766	S	S	*	*				59.4	137.8	69.7	92.2	0	0	0	0	113.8
829	L	33.3	Very low	29.8	Very low	152 Å²	152	141 Å²	141	80%	0.796	76%	0.762	S	S	*	*			cis	-159.2	-167.3	7.9	-105.4	144.4	0	0	0	106.9
830	P	42.5	Very low	29.6	Very low	102 Å²	102	139.8 Å²	139.8	66%	0.662	76%	0.757	S	S	*	*			cis	-125.8	172.4	-40.3	38.7	-25.2	0	0	0	113.4
831	T	28.6	Very low	29.6	Very low	158 Å²	158	142.8 Å²	142.8	97%	0.969	76%	0.764	S	S	*	*			trans	-161	174.5	145.8	-5.1	0	0	0	0	113.2
832	R	29.7	Very low	29.5	Very low	216 Å²	216	144.7 Å²	144.7	82%	0.815	76%	0.758	S	S	*	*			trans	-128.2	135.7	-161.6	-125.8	-179.8	175.9	166.3	-0.7	113.5
833	Q	28.3	Very low	29.3	Very low	168 Å²	168	145.1 Å²	145.1	79%	0.785	76%	0.756	S	S	*	*			trans	30.6	149	143.4	-65.2	177.1	-78.2	0	0	123.8
834	A	29.3	Very low	29	Very low	99 Å²	99	145.5 Å²	145.5	82%	0.818	76%	0.756	S	S	*	*			trans	78.7	151.7	153.8	0	0	0	0	0	118.6
835	L	28.9	Very low	28.9	Very low	142 Å²	142	145.3 Å²	145.3	74%	0.743	75%	0.751	S	S	*	*			cis	-171.9	150.5	-27.1	-168.8	84.2	0	0	0	107.8
836	E	28.3	Very low	28.9	Very low	153 Å²	153	146.6 Å²	146.6	72%	0.715	76%	0.755	S	S	*	*			trans	63.5	165.2	158.2	-88.9	170.8	-174.8	0	0	118.3
837	Q	26.6	Very low	28.6	Very low	146 Å²	146	145.5 Å²	145.5	68%	0.682	76%	0.755	S	S	*	*			cis	-163.2	170.9	-33.8	-133.5	-176.8	14.4	0	0	111.1
838	I	27.9	Very low	28.4	Very low	145 Å²	145	145 Å²	145	74%	0.744	76%	0.757	S	S	*	*			trans	74	178.8	151.1	-73.1	167.4	0	0	0	117.5
839	S	26.1	Very low	28.1	Very low	86 Å²	86	145.3 Å²	145.3	60%	0.601	76%	0.759	S	S	*	*				-141.6	-173.3	-129.9	53.4	0	0	0	0	116.3
840	D	26.4	Very low	27.7	Very low	132 Å²	132	143.4 Å²	143.4	71%	0.706	75%	0.754	S	S	*	*			trans	80.8	129	160.6	-62.2	-73.5	0	0	0	120.1
841	F	26.8	Very low	26.7	Very low	207 Å²	207	147.9 Å²	147.9	91%	0.908	76%	0.763	S	S	*	*				-166.1	177.2	98.2	-119.3	-94.7	0	0	0	113.9
842	R	27.1	Very low	26.6	Very low	216 Å²	216	147.1 Å²	147.1	82%	0.815	75%	0.752	S	S	*	*			trans	-108.5	157.2	-169.5	-106.9	173.8	168.5	171.1	-4.2	114.3
843	N	26.8	Very low	27	Very low	133 Å²	133	142.2 Å²	142.2	71%	0.711	75%	0.747	S	S	*	*			trans	9.5	142.6	150.2	-55.3	-2.2	0	0	0	120.8
844	T	28.5	Very low	27	Very low	124 Å²	124	142.1 Å²	142.1	76%	0.761	75%	0.747	S	S	*	*				-177.1	128.1	104.9	43.5	0	0	0	0	115.9
845	H	26.6	Very low	26.9	Very low	174 Å²	174	145 Å²	145	81%	0.806	74%	0.744	S	S	*	*			trans	50.6	170.5	135.1	-68.4	-73	0	0	0	125.4
846	I	25.3	Very low	26.9	Very low	162 Å²	162	144.1 Å²	144.1	83%	0.831	74%	0.739	S	S	*	*			trans	104	153.5	175	-61.4	179	0	0	0	113.6
847	T	24.7	Very low	26.9	Very low	104 Å²	104	143.4 Å²	143.4	64%	0.638	74%	0.735	S	S	*	*			trans	-164	171.6	-135.2	52.3	0	0	0	0	114.2
848	T	23.6	Very low	26.9	Very low	121 Å²	121	142.5 Å²	142.5	74%	0.742	74%	0.74	S	S	*	*			trans	66.3	149.1	158	45.6	0	0	0	0	116.7
849	T	24.3	Very low	27	Very low	111 Å²	111	141.9 Å²	141.9	68%	0.681	74%	0.737	S	S	*	*			cis	-163.8	157.7	3.9	4.8	0	0	0	0	113.1
850	T	25.1	Very low	27	Very low	113 Å²	113	142.1 Å²	142.1	69%	0.693	74%	0.739	S	S	*	*			trans	58	135.3	148.9	55.8	0	0	0	0	121.2
851	F	22.9	Very low	27.2	Very low	195 Å²	195	146.3 Å²	146.3	86%	0.855	75%	0.745	S	S	*	*				-161.3	-176.2	70.7	-119.7	-89.2	0	0	0	115.1
852	I	24.6	Very low	27.3	Very low	143 Å²	143	141.8 Å²	141.8	73%	0.733	73%	0.734	S	S	*	*			trans	-142.6	141.4	-167.2	-82.9	172.3	0	0	0	108.2
853	P	38.6	Very low	27.2	Very low	112 Å²	112	138.7 Å²	138.7	73%	0.727	73%	0.733	S	S	*	*				-155.1	148.3	91.1	39.1	-18.1	0	0	0	120.1
854	E	28.8	Very low	27.1	Very low	166 Å²	166	137.5 Å²	137.5	78%	0.776	74%	0.735	S	S	*	*			trans	51.1	155.1	136.1	-55.7	-162.8	136	0	0	121.7
855	Q	26.2	Very low	27.2	Very low	161 Å²	161	135.4 Å²	135.4	75%	0.752	73%	0.73	S	S	*	*			cis	-145.5	145.7	31.9	-86.6	-172.7	-19.1	0	0	115.6
856	I	28.7	Very low	27.2	Very low	123 Å²	123	136.6 Å²	136.6	63%	0.631	73%	0.733	S	S	*	*				38.3	121.7	129.1	-58.4	171.4	0	0	0	117.3
857	Q	28.9	Very low	27.3	Very low	138 Å²	138	133.7 Å²	133.7	65%	0.645	73%	0.733	S	S	*	*			cis	-155.8	-153	-0.3	-127.2	-176.1	79.1	0	0	109.5
858	T	27.5	Very low	27.4	Very low	127 Å²	127	133 Å²	133	78%	0.779	74%	0.739	S	S	*	*			cis	-154.3	173.6	23.2	-38.3	0	0	0	0	112.8
859	L	29.2	Very low	27.6	Very low	131 Å²	131	133.4 Å²	133.4	69%	0.686	75%	0.746	S	S	*	*			trans	-64.8	163.3	179.6	-84.3	99.7	0	0	0	117.6
860	S	27	Very low	27.6	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	75%	0.745	S	S	*	*			cis	-159.1	146.3	6.2	51.9	0	0	0	0	116.6
861	R	30.2	Very low	27.7	Very low	220 Å²	220	135.2 Å²	135.2	83%	0.83	75%	0.753	S	S	*	*			trans	67.4	148	134.7	-77.7	178.3	176.8	175.6	-0.6	121.1
862	T	27.7	Very low	27.8	Very low	112 Å²	112	131.4 Å²	131.4	69%	0.687	75%	0.746	S	S	*	*			cis	173.4	149.3	-25	25	0	0	0	0	106.4
863	L	25.3	Very low	27.8	Very low	150 Å²	150	134.6 Å²	134.6	79%	0.785	76%	0.755	S	S	*	*			cis	-134.9	178.6	-5	-65.9	106	0	0	0	107.3
864	S	24.6	Very low	27	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	76%	0.758	S	S	*	*			cis	75.2	139.1	21.3	176.8	0	0	0	0	116
865	A	30.3	Very low	26.8	Very low	79 Å²	79	132.5 Å²	132.5	65%	0.653	76%	0.761	S	S	*	*			cis	-171.8	-172	-21.4	0	0	0	0	0	109.3
866	K	27.3	Very low	26.8	Very low	200 Å²	200	131 Å²	131	87%	0.87	76%	0.763	S	S	*	*			trans	75.3	135.2	170.2	-56.5	179.1	178.7	-179.1	0	115.9
867	A	27.2	Very low	27.5	Very low	100 Å²	100	130.4 Å²	130.4	83%	0.826	77%	0.767	S	S	*	*			cis	75	114.5	3.7	0	0	0	0	0	119.5
868	A	26.9	Very low	27.3	Very low	91 Å²	91	132.3 Å²	132.3	75%	0.752	78%	0.776	S	S	*	*			trans	179.4	141.6	144.6	0	0	0	0	0	112.8
869	S	28.1	Very low	27.2	Very low	128 Å²	128	134.5 Å²	134.5	90%	0.895	78%	0.777	S	S	*	*			trans	53.1	155.5	153.5	52.1	0	0	0	0	121.6
870	G	25.3	Very low	27.2	Very low	64 Å²	64	139.2 Å²	139.2	66%	0.66	79%	0.786	S	S	*	*			cis	156.3	132.9	-10.3	0	0	0	0	0	114.8
871	F	26	Very low	27.2	Very low	199 Å²	199	141.3 Å²	141.3	87%	0.873	79%	0.794	S	S	*	*			trans	72.5	135.4	160.7	-72.6	-83.7	0	0	0	123.9
872	T	24.5	Very low	27.1	Very low	114 Å²	114	134.3 Å²	134.3	70%	0.699	79%	0.791	S	S	*	*			trans	69.1	114.3	142.6	48.5	0	0	0	0	124.6
873	F	24.6	Very low	27.9	Very low	210 Å²	210	134.7 Å²	134.7	92%	0.921	80%	0.796	S	S	*	*			trans	32.9	129.3	130.3	-69.1	-87.7	0	0	0	122.3
874	G	23.7	Very low	27.9	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	80%	0.803	S	S	*	*			trans	175.9	126.7	160.1	0	0	0	0	0	114.7
875	N	24.1	Very low	28	Very low	158 Å²	158	142.5 Å²	142.5	85%	0.845	80%	0.804	S	S	*	*			trans	-74.5	145	-173.5	-70.7	-18.3	0	0	0	115.4
876	V	26	Very low	27.8	Very low	129 Å²	129	145.2 Å²	145.2	78%	0.782	80%	0.803	S	S	*	*				48.5	144.7	122.9	-176.1	0	0	0	0	119.6
877	P	43.1	Very low	27.8	Very low	111 Å²	111	146.3 Å²	146.3	72%	0.721	80%	0.802	S	S	*	*			cis	-130.7	-163.9	1.8	30	-5.8	0	0	0	115.2
878	E	24.8	Very low	27.8	Very low	178 Å²	178	145.6 Å²	145.6	83%	0.832	80%	0.795	S	S	*	*			trans	111.5	151.1	139.4	-96	-167.4	176.3	0	0	122.5
879	H	26.2	Very low	28.2	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.796	80%	0.8	S	S	*	*			trans	-68.6	148	-167.2	-61.8	-85.8	0	0	0	114.9
880	R	27.6	Very low	28.1	Very low	231 Å²	231	149.6 Å²	149.6	87%	0.872	80%	0.801	S	S	*	*				-174.2	139.8	101.9	-104.3	176	179.4	173.5	1.1	116.5
881	T	28.8	Very low	28.2	Very low	135 Å²	135	150.2 Å²	150.2	83%	0.828	81%	0.808	S	S	*	*			trans	18.1	133.3	144.6	58.5	0	0	0	0	121.1
882	G	27.3	Very low	28.3	Very low	74 Å²	74	144 Å²	144	76%	0.763	80%	0.8	S	S	*	*			trans	134.7	136.4	136.6	0	0	0	0	0	115.6
883	P	44.4	Very low	28.5	Very low	120 Å²	120	146.8 Å²	146.8	78%	0.779	80%	0.803	S	S	*	*			trans	-109.4	145.3	-172.3	38.3	-30.4	0	0	0	113.9
884	F	25.9	Very low	28.6	Very low	215 Å²	215	146.6 Å²	146.6	94%	0.943	80%	0.802	S	S	*	*			trans	-136.4	134.7	157.8	-97.9	-80.3	0	0	0	113.3
885	R	25.9	Very low	28.8	Very low	208 Å²	208	152.6 Å²	152.6	79%	0.785	80%	0.8	S	S	*	*			trans	-68.3	153.6	165.6	-62.2	166.7	170.7	167.8	-4.8	108.3
886	H	26.6	Very low	28.9	Very low	136 Å²	136	150.1 Å²	150.1	63%	0.63	80%	0.796	S	S	*	*				-174.9	151.4	70.2	-102.8	-74.2	0	0	0	114.8
887	R	26	Very low	29.3	Very low	223 Å²	223	149.3 Å²	149.3	84%	0.842	79%	0.793	S	S	*	*			trans	53	111.1	144.7	-75.8	174.9	170.9	149.9	-3.8	119.9
888	A	28.9	Very low	28.6	Very low	84 Å²	84	151.8 Å²	151.8	69%	0.694	80%	0.799	S	S	*	*			trans	-72.3	160	133.7	0	0	0	0	0	111.2
889	P	34.1	Very low	28.6	Very low	131 Å²	131	153.1 Å²	153.1	85%	0.851	80%	0.802	S	S	*	*			trans	-79.6	162.9	167.8	33.4	-34.2	0	0	0	112.6
890	N	27.2	Very low	28.7	Very low	172 Å²	172	151.1 Å²	151.1	92%	0.92	80%	0.802	S	S	*	*			trans	-109.2	152.5	-170.7	-77.7	-21.1	0	0	0	114.6
891	G	27.1	Very low	28.5	Very low	78 Å²	78	149 Å²	149	80%	0.804	80%	0.804	S	S	*	*			trans	155.1	122.8	162.4	0	0	0	0	0	110
892	G	27.9	Very low	28.5	Very low	68 Å²	68	147.7 Å²	147.7	70%	0.701	80%	0.801	S	S	*	*			cis	106.4	126.4	14.4	0	0	0	0	0	109.6
893	F	28.3	Very low	28.6	Very low	172 Å²	172	149.7 Å²	149.7	75%	0.754	80%	0.803	S	S	*	*			cis	-149.7	156.7	10.1	-93.9	-99.1	0	0	0	110.6
894	F	27.1	Very low	27.8	Very low	206 Å²	206	151.7 Å²	151.7	90%	0.904	81%	0.805	S	S	*	*				-168	172	112.1	-106.6	-75.7	0	0	0	110.8
895	R	26.8	Very low	28.2	Very low	203 Å²	203	147.1 Å²	147.1	77%	0.766	80%	0.797	S	S	*	*			trans	-109.6	137.5	-162.5	-73.4	174	175.1	170.7	-2.8	111.2
896	S	26.2	Very low	28.2	Very low	107 Å²	107	148.1 Å²	148.1	75%	0.748	80%	0.802	S	S	*	*				71.1	154.5	75.4	108.9	0	0	0	0	113.7
897	P	36.2	Very low	28.3	Very low	112 Å²	112	150.7 Å²	150.7	73%	0.727	82%	0.815	S	S	*	*			cis	-136.4	171.1	26.5	42.6	-25.8	0	0	0	117.9
898	I	26.8	Very low	28.7	Very low	162 Å²	162	145.4 Å²	145.4	83%	0.831	81%	0.809	S	S	*	*			trans	-105.9	149.3	154.8	-68.6	173.7	0	0	0	107.9
899	K	26.6	Very low	28.8	Very low	206 Å²	206	147.9 Å²	147.9	90%	0.896	82%	0.816	S	S	*	*			trans	-114.4	129	-177.3	-129.1	-176.5	-176.1	-176.2	0	111.2
900	T	26.9	Very low	28.8	Very low	130 Å²	130	147.6 Å²	147.6	80%	0.798	81%	0.814	S	S	*	*			trans	-137.2	126.2	172.5	50.9	0	0	0	0	110.7
901	M	24.7	Very low	28.9	Very low	187 Å²	187	146.2 Å²	146.2	92%	0.921	81%	0.812	S	S	*	*			trans	-157.3	151.6	172.6	-97	-175.4	152.2	0	0	107.3
902	S	28.4	Very low	29.2	Very low	108 Å²	108	150.9 Å²	150.9	76%	0.755	82%	0.818	S	S	*	*			cis	-158.1	160.8	-3.4	40.9	0	0	0	0	110.6
903	S	28.6	Very low	29.2	Very low	116 Å²	116	151 Å²	151	81%	0.811	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.6	157.3	179.6	51.2	0	0	0	0	114.5
904	I	28.7	Very low	29.3	Very low	162 Å²	162	150.1 Å²	150.1	83%	0.831	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-74.9	138.2	177.5	-59.6	166.6	0	0	0	111
905	P	32.8	Very low	29.4	Very low	118 Å²	118	146.7 Å²	146.7	77%	0.766	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-89.3	153.3	172.1	35.2	-33.9	0	0	0	113.5
906	Y	26.1	Very low	29.5	Very low	230 Å²	230	144.7 Å²	144.7	90%	0.902	82%	0.816	S	S	*	*			trans	-105.4	135.3	177	-124.8	-90.2	0	0	0	110.4
907	Q	28.6	Very low	29.6	Very low	189 Å²	189	143 Å²	143	88%	0.883	82%	0.816	S	S	*	*			trans	-153.3	167.2	165	-101.1	-158.9	-40.8	0	0	111.5
908	P	34.8	Very low	29.2	Very low	112 Å²	112	145.4 Å²	145.4	73%	0.727	82%	0.823	S	S	*	*			trans	-116.6	175	-133.7	41.6	-33.6	0	0	0	116.9
909	T	32.1	Very low	29.3	Very low	136 Å²	136	145 Å²	145	83%	0.834	82%	0.822	S	S	*	*			trans	-72.8	134.5	178.8	49.8	0	0	0	0	114.4
910	P	33.9	Very low	30.5	Very low	126 Å²	126	140.3 Å²	140.3	82%	0.818	81%	0.813	S	S	*	*			trans	-89.9	165.3	163.9	36	-33	0	0	0	112.8
911	T	29	Very low	30.7	Very low	143 Å²	143	139.5 Å²	139.5	88%	0.877	80%	0.803	S	S	*	*			trans	-106.8	174.1	-176.3	46.6	0	0	0	0	113.8
912	L	32.8	Very low	31.1	Very low	175 Å²	175	141 Å²	141	92%	0.916	80%	0.799	S	S	*	*			trans	-57.9	144.3	-173.8	-132.2	76.7	0	0	0	115
913	G	29	Very low	31	Very low	72 Å²	72	138.8 Å²	138.8	74%	0.742	79%	0.794	S	S	*	*			trans	-152.1	153.6	168.6	0	0	0	0	0	110.7
914	L	30	Very low	31.1	Very low	153 Å²	153	139.3 Å²	139.3	80%	0.801	79%	0.792	S	S	*	*			trans	-118.4	150.8	-164.5	-94.5	160.1	0	0	0	114.8
915	N	27.7	Very low	31.1	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	79%	0.788	S	S	*	*			trans	90.1	135.2	143.4	-79.2	-13.3	0	0	0	124.2
916	L	29.7	Very low	31.3	Very low	161 Å²	161	142.4 Å²	142.4	84%	0.843	81%	0.81	S	S	*	*			trans	72.4	132.7	149.4	-93.6	67.9	0	0	0	120.4
917	G	28.1	Very low	31.6	Very low	72 Å²	72	138.1 Å²	138.1	74%	0.742	81%	0.805	S	S	*	*			trans	172.4	8.2	174	0	0	0	0	0	122.1
918	N	27.9	Very low	31.8	Very low	162 Å²	162	135.4 Å²	135.4	87%	0.866	80%	0.801	S	S	*	*			trans	43.7	125.6	167.5	-66.8	7.7	0	0	0	123
919	D	28.8	Very low	31.6	Very low	155 Å²	155	136.7 Å²	136.7	83%	0.829	81%	0.805	S	S	*	*			trans	-41.5	175.8	145.9	-94.5	-53.7	0	0	0	117.2
920	P	51.2	Low	31.6	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	80%	0.803	S	S	*	*			cis	-134.9	177.2	-3.3	33.7	-13.4	0	0	0	115.6
921	D	31.2	Very low	31.4	Very low	113 Å²	113	137.4 Å²	137.4	60%	0.604	80%	0.803	S	S	*	*				159.6	131.5	101.7	-144.8	-3	0	0	0	113.6
922	R	33.1	Very low	31.6	Very low	218 Å²	218	137 Å²	137	82%	0.823	80%	0.798	S	S	*	*			trans	51.3	138.3	162.4	-67.7	151	-148.7	-146.4	5.2	120.2
923	G	28	Very low	31.5	Very low	63 Å²	63	134.3 Å²	134.3	65%	0.649	79%	0.789	S	S	*	*			cis	92.6	138.7	12.8	0	0	0	0	0	112.8
924	T	30.8	Very low	31.7	Very low	127 Å²	127	139.1 Å²	139.1	78%	0.779	79%	0.793	S	S	*	*			cis	-169	151.6	1.2	37.9	0	0	0	0	109.8
925	S	27.5	Very low	31.9	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	79%	0.792	S	S	*	*			trans	59.5	153.7	143.4	68.5	0	0	0	0	118.9
926	I	38.3	Very low	32.2	Very low	238 Å²	238	138.4 Å²	138.4	100%	1.221	80%	0.799	S	S	*	*			cis	-107	0	32.4	-62.6	177.1	0	0	0	112.4

Retrieved 926 of 926 residues in 1995.5 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).